#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qyg s ILE 2 N 0.00 4.30 -0.20 0.53 1.01 -1.26 -5.02 121.20 120.55 1qyg s ILE 2 Ca 0.00 2.06 -0.08 0.00 0.00 0.00 0.00 60.65 62.63 1qyg s ILE 2 Cb 0.00 -4.32 -0.04 0.00 0.01 0.00 0.00 42.46 38.11 1qyg s ILE 2 CO 0.00 0.41 0.08 -0.69 0.00 0.00 0.00 174.94 174.74 1qyg s VAL 3 N -0.59 4.85 -0.19 2.92 1.01 -1.26 -4.77 120.40 122.36 1qyg s VAL 3 Ca 0.44 -0.01 -0.06 0.00 0.00 0.00 0.00 61.98 62.34 1qyg s VAL 3 Cb -0.25 -3.21 -0.03 0.00 0.00 0.00 0.00 36.38 32.89 1qyg s VAL 3 CO 0.31 0.43 0.04 -0.04 0.00 0.00 0.00 175.10 175.83 1qyg s MET 4 N 0.62 3.82 -0.11 2.72 -1.94 -1.26 -1.37 119.30 121.77 1qyg s MET 4 Ca 0.04 -0.42 0.03 0.00 -1.71 0.00 0.00 55.69 53.63 1qyg s MET 4 Cb -0.13 -3.17 -0.00 0.00 2.01 0.00 0.00 34.83 33.54 1qyg s MET 4 CO 0.01 0.14 -0.22 0.99 -0.01 0.00 0.00 175.02 175.94 1qyg s THR 5 N 0.70 2.24 -0.36 2.05 2.01 0.31 -4.30 115.64 118.30 1qyg s THR 5 Ca 0.02 -0.95 0.03 0.00 0.31 0.00 0.00 61.69 61.10 1qyg s THR 5 Cb -0.14 -1.88 0.10 0.00 0.01 0.00 0.00 72.50 70.60 1qyg s THR 5 CO 0.02 0.55 0.09 -1.10 -0.69 0.00 0.00 174.62 173.49 1qyg s GLN 6 N 0.40 1.35 0.01 4.92 -0.21 -1.26 -0.77 119.66 124.10 1qyg s GLN 6 Ca -0.16 -1.78 -0.05 0.00 0.02 0.00 0.00 55.36 53.38 1qyg s GLN 6 Cb -0.17 -2.90 -0.02 0.00 1.00 0.00 0.00 33.01 30.91 1qyg s GLN 6 CO 0.07 -0.98 1.08 0.00 -2.12 0.00 0.00 175.29 173.34 1qyg h ALA 7 N 7.56 -0.74 -1.98 6.09 0.00 -1.94 -3.41 119.26 124.84 1qyg h ALA 7 Ca -0.06 -0.02 -0.61 0.00 0.00 0.00 0.00 54.91 54.21 1qyg h ALA 7 Cb 1.00 0.39 0.01 0.00 0.00 0.00 0.00 17.79 19.20 1qyg h ALA 7 CO 0.53 -0.75 1.16 0.00 0.00 0.00 0.00 179.25 180.19 1qyg n ALA 8 N -2.40 0.99 0.22 0.00 0.00 -1.26 -4.83 120.51 113.24 1qyg n ALA 8 Ca -0.02 0.22 0.11 0.00 0.00 0.00 0.00 53.44 53.75 1qyg n ALA 8 Cb 0.06 -2.54 0.35 0.00 0.00 0.00 0.00 19.45 17.32 1qyg n ALA 8 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1qyg h PRO 9 N 9.94 0.00 -3.04 0.00 0.13 -1.81 -3.38 132.00 133.83 1qyg h PRO 9 Ca -0.47 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.67 1qyg h PRO 9 Cb 1.27 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.30 1qyg h PRO 9 CO 0.95 0.15 0.19 -1.54 -0.23 0.00 0.00 178.00 177.53 1qyg s SER 10 N -6.13 -0.44 -0.06 1.44 1.04 -1.26 -1.11 113.70 107.19 1qyg s SER 10 Ca 0.03 -0.24 -0.02 0.00 0.48 0.00 0.00 55.95 56.20 1qyg s SER 10 Cb 0.08 0.63 0.04 0.00 0.10 0.00 0.00 66.02 66.87 1qyg s SER 10 CO 0.64 -1.09 0.12 0.54 0.98 0.00 0.00 173.24 174.44 1qyg s VAL 11 N -3.81 -0.10 0.06 5.02 0.11 0.29 -4.85 120.40 117.12 1qyg s VAL 11 Ca 0.05 0.24 -0.22 0.00 -2.93 0.00 0.00 61.98 59.12 1qyg s VAL 11 Cb -0.02 -0.22 -0.06 0.00 -1.53 0.00 0.00 36.38 34.54 1qyg s VAL 11 CO -0.06 0.10 0.65 -2.16 -3.33 0.00 0.00 175.10 170.30 1qyg s PRO 12 N 1.45 4.36 -0.05 1.54 0.04 -1.26 -1.36 135.00 139.72 1qyg s PRO 12 Ca -0.06 0.87 -0.09 0.00 0.04 0.00 0.00 61.00 61.76 1qyg s PRO 12 Cb -0.12 -3.30 0.02 0.00 0.04 0.00 0.00 34.50 31.14 1qyg s PRO 12 CO -0.05 0.48 0.22 0.08 0.04 0.00 0.00 177.00 177.77 1qyg s VAL 13 N -0.65 0.04 -0.14 -0.36 1.01 0.17 -4.94 120.40 115.51 1qyg s VAL 13 Ca 0.32 -0.29 -0.08 0.00 0.00 0.00 0.00 61.98 61.94 1qyg s VAL 13 Cb -0.20 -0.41 -0.04 0.00 0.00 0.00 0.00 36.38 35.73 1qyg s VAL 13 CO 0.20 -0.16 0.13 0.28 0.00 0.00 0.00 175.10 175.55 1qyg s THR 14 N -0.59 5.38 0.36 3.92 -1.32 -1.26 -0.15 115.64 121.98 1qyg s THR 14 Ca -0.07 0.17 -0.26 0.00 -1.21 0.00 0.00 61.69 60.32 1qyg s THR 14 Cb -0.04 -3.37 -0.12 0.00 -1.51 0.00 0.00 72.50 67.45 1qyg s THR 14 CO 0.01 0.56 0.97 -2.65 -2.21 0.00 0.00 174.62 171.31 1qyg n PRO 15 N 2.47 1.30 0.00 7.08 -0.02 -1.26 -1.81 135.00 142.75 1qyg n PRO 15 Ca -0.19 0.46 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 1qyg n PRO 15 Cb 0.54 -1.91 0.00 0.00 -0.02 0.00 0.00 33.50 32.11 1qyg n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1qyg n GLY 16 N 1.25 3.23 3.96 -1.23 0.00 0.09 -4.94 105.19 107.54 1qyg n GLY 16 Ca 0.09 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.89 1qyg n GLY 16 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1qyg s GLU 17 N -0.52 2.83 0.34 1.61 -1.05 -0.75 -4.50 118.70 116.66 1qyg s GLU 17 Ca 0.00 -0.57 -0.08 0.00 -0.15 0.00 0.00 54.97 54.17 1qyg s GLU 17 Cb 0.00 -2.51 -0.06 0.00 -0.44 0.00 0.00 34.13 31.12 1qyg s GLU 17 CO 0.00 -0.49 0.66 -1.54 0.95 0.00 0.00 175.26 174.84 1qyg s SER 18 N -4.31 6.51 0.05 0.83 1.04 -1.23 -0.67 113.70 115.92 1qyg s SER 18 Ca 0.52 0.95 -0.17 0.00 0.48 0.00 0.00 55.95 57.73 1qyg s SER 18 Cb -0.10 -2.24 0.03 0.00 0.10 0.00 0.00 66.02 63.81 1qyg s SER 18 CO 0.39 -0.27 0.40 0.54 0.98 0.00 0.00 173.24 175.27 1qyg s VAL 19 N -2.18 0.06 0.14 5.02 0.11 -0.42 -4.95 120.40 118.18 1qyg s VAL 19 Ca 0.48 -0.49 0.07 0.00 -2.93 0.00 0.00 61.98 59.11 1qyg s VAL 19 Cb -0.11 -0.97 -0.04 0.00 -1.53 0.00 0.00 36.38 33.74 1qyg s VAL 19 CO 0.29 -0.27 -0.17 -0.94 -3.33 0.00 0.00 175.10 170.68 1qyg s SER 20 N -2.07 2.40 -0.05 3.54 1.04 -1.26 -0.16 113.70 117.14 1qyg s SER 20 Ca -0.05 -0.83 0.04 0.00 0.48 0.00 0.00 55.95 55.59 1qyg s SER 20 Cb -0.01 -0.12 0.00 0.00 0.10 0.00 0.00 66.02 65.99 1qyg s SER 20 CO -0.03 -0.07 -0.16 -0.63 0.98 0.00 0.00 173.24 173.33 1qyg s ILE 21 N -2.02 1.36 0.15 -1.02 -1.09 0.48 -4.98 121.20 114.08 1qyg s ILE 21 Ca 0.12 -0.66 0.06 0.00 -2.23 0.00 0.00 60.65 57.95 1qyg s ILE 21 Cb -0.06 -1.18 -0.04 0.00 -1.58 0.00 0.00 42.46 39.60 1qyg s ILE 21 CO 0.05 0.40 0.03 -0.94 -1.23 0.00 0.00 174.94 173.24 1qyg s SER 22 N 0.20 4.99 -0.03 3.58 1.04 -1.26 -0.16 113.70 122.06 1qyg s SER 22 Ca -0.07 -0.28 -0.05 0.00 0.48 0.00 0.00 55.95 56.03 1qyg s SER 22 Cb -0.13 -1.15 0.01 0.00 0.10 0.00 0.00 66.02 64.85 1qyg s SER 22 CO 0.03 0.11 0.12 0.00 0.98 0.00 0.00 173.24 174.48 1qyg s ARG 24 N -0.48 0.75 0.29 0.00 0.52 0.05 -1.26 118.95 118.81 1qyg s ARG 24 Ca -0.06 -0.74 0.08 0.00 -0.52 0.00 0.00 55.73 54.50 1qyg s ARG 24 Cb -0.04 -0.69 -0.04 0.00 0.52 0.00 0.00 34.95 34.71 1qyg s ARG 24 CO 0.01 0.16 0.11 -1.54 0.02 0.00 0.00 175.30 174.05 1qyg s SER 25 N -1.29 4.89 0.00 0.23 1.04 -0.25 -0.53 113.70 117.79 1qyg s SER 25 Ca -0.02 -0.57 0.26 0.00 0.48 0.00 0.00 55.95 56.10 1qyg s SER 25 Cb -0.08 -0.97 0.69 0.00 0.10 0.00 0.00 66.02 65.76 1qyg s SER 25 CO 0.01 -0.12 1.52 -1.54 0.98 0.00 0.00 173.24 174.10 1qyg n SER 26 N -1.07 0.84 -3.95 7.02 3.41 -0.47 -4.79 113.62 114.61 1qyg n SER 26 Ca -0.05 -0.67 -0.10 0.00 -0.26 0.00 0.00 58.87 57.79 1qyg n SER 26 Cb 0.59 0.17 -0.10 0.00 -0.26 0.00 0.00 64.21 64.61 1qyg n SER 26 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1qyg s LYS 27 N -2.66 0.42 0.00 4.33 2.20 -1.26 -4.94 119.74 117.83 1qyg s LYS 27 Ca 0.20 -0.61 0.00 0.00 -0.36 0.00 0.00 55.97 55.20 1qyg s LYS 27 Cb 0.19 0.16 0.00 0.00 -1.51 0.00 0.00 37.83 36.67 1qyg s LYS 27 CO 0.58 -0.09 0.00 0.45 -0.36 0.00 0.00 175.35 175.93 1qyg n SER 27 N 1.33 -0.14 -1.47 1.43 2.88 -1.26 -4.68 113.62 111.70 1qyg n SER 27 Ca -0.22 -0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.32 1qyg n SER 27 Cb 0.56 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.02 1qyg n SER 27 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 1qyg n LEU 27 N 0.00 -4.56 -4.93 2.46 7.94 -1.26 -5.01 117.00 111.64 1qyg n LEU 27 Ca 0.00 2.05 -0.25 0.00 -1.11 0.00 0.00 56.01 56.70 1qyg n LEU 27 Cb 0.00 -2.32 0.00 0.00 0.53 0.00 0.00 43.42 41.63 1qyg n LEU 27 CO 0.00 -1.08 0.36 -2.28 -1.11 0.00 0.00 177.39 173.28 1qyg s HIS 27 N -0.36 3.42 0.48 1.96 5.65 0.10 -4.97 115.29 121.58 1qyg s HIS 27 Ca 0.00 0.55 0.15 0.00 0.25 0.00 0.00 55.06 56.00 1qyg s HIS 27 Cb 0.00 -2.28 1.13 0.00 -1.18 0.00 0.00 32.58 30.26 1qyg s HIS 27 CO 0.00 -0.29 2.08 0.77 -0.65 0.00 0.00 174.74 176.65 1qyg h SER 27 N 0.32 0.04 0.17 9.88 0.02 -2.03 0.58 113.55 122.53 1qyg h SER 27 Ca -0.47 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.48 1qyg h SER 27 Cb 1.23 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.76 1qyg h SER 27 CO 0.60 0.10 0.00 -0.46 -1.14 0.00 0.00 176.83 175.93 1qyg n ASN 28 N -4.45 0.00 0.00 3.07 0.23 -1.26 -4.87 115.26 107.98 1qyg n ASN 28 Ca -0.02 -0.33 0.00 0.00 -0.53 0.00 0.00 54.58 53.70 1qyg n ASN 28 Cb 0.15 -0.13 0.00 0.00 -2.08 0.00 0.00 39.78 37.71 1qyg n ASN 28 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1qyg n GLY 29 N 0.30 0.75 3.90 4.83 0.00 0.20 -5.07 105.19 110.10 1qyg n GLY 29 Ca 0.12 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.86 1qyg n GLY 29 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1qyg s TYR 30 N -2.27 3.49 -0.24 1.61 4.12 -1.26 -4.81 117.35 117.99 1qyg s TYR 30 Ca 0.00 0.70 -0.03 0.00 0.02 0.00 0.00 57.07 57.76 1qyg s TYR 30 Cb 0.00 -2.16 0.01 0.00 -1.52 0.00 0.00 41.96 38.29 1qyg s TYR 30 CO 0.00 0.07 -0.05 0.99 0.02 0.00 0.00 175.55 176.59 1qyg s THR 31 N -2.22 3.15 -1.22 -0.71 2.01 -1.26 0.01 115.64 115.40 1qyg s THR 31 Ca 0.45 -0.77 -0.10 0.00 0.31 0.00 0.00 61.69 61.58 1qyg s THR 31 Cb -0.10 -2.52 0.20 0.00 0.01 0.00 0.00 72.50 70.08 1qyg s THR 31 CO 0.32 0.29 1.63 -1.22 -0.69 0.00 0.00 174.62 174.95 1qyg n TYR 32 N 4.74 3.63 -4.17 4.92 4.02 -1.26 -4.25 117.16 124.79 1qyg n TYR 32 Ca -0.17 -3.02 -0.25 0.00 -0.01 0.00 0.00 57.90 54.45 1qyg n TYR 32 Cb 0.49 -1.90 -0.17 0.00 -0.02 0.00 0.00 39.34 37.74 1qyg n TYR 32 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 1qyg s LEU 33 N -0.12 1.32 0.24 7.72 2.96 -1.26 -1.24 118.68 128.30 1qyg s LEU 33 Ca 0.39 -0.25 0.09 0.00 -0.22 0.00 0.00 54.13 54.13 1qyg s LEU 33 Cb 0.04 -0.74 -0.05 0.00 0.50 0.00 0.00 46.19 45.94 1qyg s LEU 33 CO 0.01 -0.06 -0.14 -1.00 -1.32 0.00 0.00 176.35 173.84 1qyg s HIS 34 N 1.23 1.93 0.02 5.38 3.76 -0.50 -0.82 115.29 126.29 1qyg s HIS 34 Ca -0.05 -0.53 0.08 0.00 -0.15 0.00 0.00 55.06 54.41 1qyg s HIS 34 Cb -0.14 -0.92 -0.02 0.00 1.11 0.00 0.00 32.58 32.60 1qyg s HIS 34 CO -0.02 0.45 -0.23 -1.58 -0.85 0.00 0.00 174.74 172.50 1qyg s TRP 35 N -2.85 2.06 0.08 1.40 0.52 0.83 -1.00 118.94 119.99 1qyg s TRP 35 Ca 0.26 -0.39 0.05 0.00 0.02 0.00 0.00 56.10 56.04 1qyg s TRP 35 Cb -0.01 -1.26 -0.03 0.00 -1.15 0.00 0.00 33.47 31.02 1qyg s TRP 35 CO 0.10 0.06 -0.13 -0.06 0.02 0.00 0.00 176.95 176.95 1qyg s PHE 36 N -0.72 1.18 -0.07 -1.98 0.40 0.64 -0.04 117.98 117.39 1qyg s PHE 36 Ca 0.09 -0.52 0.02 0.00 -0.60 0.00 0.00 56.93 55.92 1qyg s PHE 36 Cb -0.09 -0.65 -0.03 0.00 0.51 0.00 0.00 43.02 42.76 1qyg s PHE 36 CO 0.01 0.05 -0.12 -1.17 0.70 0.00 0.00 175.22 174.70 1qyg s LEU 37 N -2.02 2.87 -0.26 -0.37 2.96 -0.06 0.01 118.68 121.81 1qyg s LEU 37 Ca 0.01 -0.17 -0.00 0.00 -0.22 0.00 0.00 54.13 53.76 1qyg s LEU 37 Cb -0.07 -1.61 0.07 0.00 0.50 0.00 0.00 46.19 45.08 1qyg s LEU 37 CO 0.02 0.32 0.01 -1.58 -1.32 0.00 0.00 176.35 173.80 1qyg s GLN 38 N -0.54 1.19 0.61 1.98 0.74 0.10 -0.71 119.66 123.01 1qyg s GLN 38 Ca 0.08 -0.98 -0.14 0.00 0.05 0.00 0.00 55.36 54.36 1qyg s GLN 38 Cb -0.12 -2.41 -0.03 0.00 1.10 0.00 0.00 33.01 31.56 1qyg s GLN 38 CO 0.02 -0.74 1.05 1.03 -0.55 0.00 0.00 175.29 176.10 1qyg s ARG 39 N 1.49 3.31 0.04 1.67 0.52 -1.26 -1.82 118.95 122.90 1qyg s ARG 39 Ca 0.01 1.10 -0.37 0.00 -0.52 0.00 0.00 55.73 55.95 1qyg s ARG 39 Cb -0.18 -2.04 -0.16 0.00 0.52 0.00 0.00 34.95 33.09 1qyg s ARG 39 CO -0.11 -0.81 1.44 -2.30 0.02 0.00 0.00 175.30 173.53 1qyg n PRO 40 N -2.27 1.31 -0.91 3.54 -0.02 -1.26 -1.86 135.00 133.52 1qyg n PRO 40 Ca 0.08 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 1qyg n PRO 40 Cb 0.53 -2.14 0.00 0.00 -0.02 0.00 0.00 33.50 31.87 1qyg n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1qyg n GLY 41 N 2.91 0.45 3.66 -1.23 0.00 -1.26 -5.01 105.19 104.71 1qyg n GLY 41 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 1qyg n GLY 41 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1qyg s GLN 42 N -0.58 2.03 0.72 1.61 -0.21 -0.78 -5.14 119.66 117.31 1qyg s GLN 42 Ca 0.00 -2.19 -0.11 0.00 0.02 0.00 0.00 55.36 53.08 1qyg s GLN 42 Cb 0.00 -1.61 0.02 0.00 1.00 0.00 0.00 33.01 32.42 1qyg s GLN 42 CO 0.00 -0.14 1.07 -1.12 -2.12 0.00 0.00 175.29 172.99 1qyg s SER 43 N -3.76 5.21 0.82 5.90 0.01 -1.26 -4.58 113.70 116.04 1qyg s SER 43 Ca 0.27 1.42 -0.11 0.00 1.31 0.00 0.00 55.95 58.84 1qyg s SER 43 Cb 0.08 -2.26 0.08 0.00 0.21 0.00 0.00 66.02 64.13 1qyg s SER 43 CO 0.14 -1.53 1.09 -2.84 0.41 0.00 0.00 173.24 170.51 1qyg s PRO 44 N -5.14 1.87 -0.11 12.44 0.02 -1.26 -4.49 135.00 138.33 1qyg s PRO 44 Ca 0.59 1.03 -0.10 0.00 0.02 0.00 0.00 61.00 62.54 1qyg s PRO 44 Cb -0.13 -1.86 0.03 0.00 0.02 0.00 0.00 34.50 32.55 1qyg s PRO 44 CO 0.54 -1.87 0.29 1.14 -0.33 0.00 0.00 177.00 176.77 1qyg s GLN 45 N -4.92 0.34 0.16 5.54 -2.07 0.11 -4.98 119.66 113.85 1qyg s GLN 45 Ca 0.62 0.41 -0.30 0.00 -1.82 0.00 0.00 55.36 54.27 1qyg s GLN 45 Cb -0.17 0.16 -0.08 0.00 -1.09 0.00 0.00 33.01 31.82 1qyg s GLN 45 CO 0.56 -0.04 1.28 -1.17 -1.32 0.00 0.00 175.29 174.60 1qyg s LEU 46 N 0.19 4.41 -0.23 2.60 2.96 -1.26 -0.88 118.68 126.46 1qyg s LEU 46 Ca -0.00 2.29 -0.12 0.00 -0.22 0.00 0.00 54.13 56.08 1qyg s LEU 46 Cb -0.02 -3.60 -0.10 0.00 0.50 0.00 0.00 46.19 42.97 1qyg s LEU 46 CO 0.00 -0.50 -0.30 0.18 -1.32 0.00 0.00 176.35 174.41 1qyg n LEU 47 N 2.97 1.67 -3.82 -0.68 4.77 0.94 -4.76 117.00 118.09 1qyg n LEU 47 Ca 0.07 0.29 -0.17 0.00 -0.03 0.00 0.00 56.01 56.17 1qyg n LEU 47 Cb 0.44 -0.69 -0.16 0.00 -2.33 0.00 0.00 43.42 40.67 1qyg n LEU 47 CO 0.57 0.45 -0.37 -0.63 -1.33 0.00 0.00 177.39 176.08 1qyg s ILE 48 N -2.45 0.17 0.01 -0.08 1.01 -0.83 -1.33 121.20 117.71 1qyg s ILE 48 Ca -0.33 0.09 0.04 0.00 0.00 0.00 0.00 60.65 60.45 1qyg s ILE 48 Cb 0.12 -0.27 -0.03 0.00 0.01 0.00 0.00 42.46 42.29 1qyg s ILE 48 CO 0.41 0.14 -0.07 -0.72 0.00 0.00 0.00 174.94 174.70 1qyg s TYR 49 N 1.02 2.87 -1.21 3.97 1.13 -0.05 -0.12 117.35 124.97 1qyg s TYR 49 Ca -0.10 -0.05 -0.12 0.00 -1.41 0.00 0.00 57.07 55.38 1qyg s TYR 49 Cb -0.14 -1.59 -0.01 0.00 -1.10 0.00 0.00 41.96 39.13 1qyg s TYR 49 CO -0.02 0.38 0.72 0.54 -2.51 0.00 0.00 175.55 174.66 1qyg n ARG 50 N 1.46 -2.33 0.00 -3.49 1.74 -0.81 -1.79 116.66 111.44 1qyg n ARG 50 Ca -0.15 0.51 0.00 0.00 -0.77 0.00 0.00 57.85 57.44 1qyg n ARG 50 Cb 0.52 -4.52 0.00 0.00 -1.02 0.00 0.00 32.46 27.44 1qyg n ARG 50 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1qyg n VAL 51 N -4.16 0.00 -1.21 1.55 0.31 -0.00 -4.11 118.33 110.71 1qyg n VAL 51 Ca -0.17 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 1qyg n VAL 51 Cb 0.63 0.00 0.01 0.00 -0.91 0.00 0.00 33.84 33.56 1qyg n VAL 51 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1qyg n SER 52 N 2.70 0.26 -4.55 4.52 3.41 -1.24 -3.58 113.62 115.14 1qyg n SER 52 Ca 0.00 -1.45 -0.40 0.00 -0.26 0.00 0.00 58.87 56.76 1qyg n SER 52 Cb 0.00 -0.08 -0.11 0.00 -0.26 0.00 0.00 64.21 63.77 1qyg n SER 52 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1qyg s ASN 53 N -0.49 6.05 0.29 4.04 0.01 -0.74 -4.62 114.94 119.48 1qyg s ASN 53 Ca 0.01 -0.28 -0.29 0.00 -0.71 0.00 0.00 52.86 51.59 1qyg s ASN 53 Cb 0.01 -2.13 -0.10 0.00 0.41 0.00 0.00 41.25 39.44 1qyg s ASN 53 CO 0.00 -0.18 1.19 -0.76 -1.51 0.00 0.00 177.10 175.85 1qyg s LEU 54 N 1.74 4.49 0.81 0.60 1.02 -1.26 -0.87 118.68 125.22 1qyg s LEU 54 Ca 0.06 2.43 -0.12 0.00 0.02 0.00 0.00 54.13 56.53 1qyg s LEU 54 Cb -0.17 -3.63 0.08 0.00 0.02 0.00 0.00 46.19 42.49 1qyg s LEU 54 CO 0.11 -0.32 1.10 0.00 0.02 0.00 0.00 176.35 177.26 1qyg s ALA 55 N -1.04 2.17 0.30 4.21 0.00 -0.44 -4.88 121.76 122.08 1qyg s ALA 55 Ca 0.47 -0.23 -0.30 0.00 0.00 0.00 0.00 51.96 51.91 1qyg s ALA 55 Cb -0.35 -3.10 -0.11 0.00 0.00 0.00 0.00 23.12 19.55 1qyg s ALA 55 CO 0.45 -1.81 1.54 0.45 0.00 0.00 0.00 175.76 176.39 1qyg s SER 56 N -3.89 6.43 0.00 0.00 0.15 -1.26 -1.68 113.70 113.45 1qyg s SER 56 Ca 0.61 2.91 0.00 0.00 0.70 0.00 0.00 55.95 60.17 1qyg s SER 56 Cb -0.15 -2.64 0.00 0.00 -1.71 0.00 0.00 66.02 61.53 1qyg s SER 56 CO 0.54 -0.85 0.00 0.61 1.20 0.00 0.00 173.24 174.74 1qyg n GLY 57 N 1.83 1.90 3.77 9.45 0.00 -1.26 -5.01 105.19 115.87 1qyg n GLY 57 Ca 0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 1qyg n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qyg s VAL 58 N -3.48 4.18 0.42 1.61 1.01 -0.67 -4.99 120.40 118.47 1qyg s VAL 58 Ca 0.00 1.91 -0.26 0.00 0.00 0.00 0.00 61.98 63.62 1qyg s VAL 58 Cb 0.00 -4.17 -0.09 0.00 0.00 0.00 0.00 36.38 32.12 1qyg s VAL 58 CO 0.00 0.36 1.45 -2.84 0.00 0.00 0.00 175.10 174.07 1qyg s PRO 59 N -1.53 3.87 0.60 2.72 0.02 -1.26 -4.89 135.00 134.53 1qyg s PRO 59 Ca 0.44 2.47 0.29 0.00 0.02 0.00 0.00 61.00 64.22 1qyg s PRO 59 Cb -0.23 -2.79 1.66 0.00 0.02 0.00 0.00 34.50 33.16 1qyg s PRO 59 CO 0.28 -0.69 2.07 -0.44 -0.33 0.00 0.00 177.00 177.89 1qyg h ASP 60 N 2.62 0.00 0.08 2.53 3.32 -1.99 -2.54 116.42 120.44 1qyg h ASP 60 Ca -0.51 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.54 1qyg h ASP 60 Cb 1.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.80 1qyg h ASP 60 CO 0.62 0.00 0.00 -2.11 -1.72 0.00 0.00 179.24 176.03 1qyg n ARG 61 N -3.71 0.15 -3.27 3.56 1.85 -1.26 -4.71 116.66 109.27 1qyg n ARG 61 Ca 0.02 0.62 -0.33 0.00 -1.00 0.00 0.00 57.85 57.16 1qyg n ARG 61 Cb 0.37 -1.96 -0.06 0.00 -1.05 0.00 0.00 32.46 29.76 1qyg n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1qyg s PHE 62 N -3.54 3.47 0.12 2.89 0.08 -0.96 -0.66 117.98 119.38 1qyg s PHE 62 Ca -0.02 1.10 -0.17 0.00 0.12 0.00 0.00 56.93 57.96 1qyg s PHE 62 Cb 0.07 -2.42 0.04 0.00 -0.57 0.00 0.00 43.02 40.13 1qyg s PHE 62 CO 0.22 0.25 0.43 -1.54 -0.10 0.00 0.00 175.22 174.48 1qyg s SER 63 N -2.11 -0.29 0.10 1.36 1.04 -0.52 -4.97 113.70 108.33 1qyg s SER 63 Ca 0.47 -0.22 0.02 0.00 0.48 0.00 0.00 55.95 56.70 1qyg s SER 63 Cb -0.12 0.48 -0.04 0.00 0.10 0.00 0.00 66.02 66.44 1qyg s SER 63 CO 0.19 -0.84 -0.06 -0.83 0.98 0.00 0.00 173.24 172.69 1qyg s GLY 64 N -2.67 0.80 0.29 7.32 0.00 -1.26 -1.36 107.32 110.44 1qyg s GLY 64 Ca 0.01 -1.37 -0.07 0.00 0.00 0.00 0.00 44.72 43.30 1qyg s GLY 64 CO -0.11 -1.46 0.45 -1.35 0.00 0.00 0.00 173.10 170.63 1qyg s SER 65 N -3.05 0.37 0.00 1.64 1.04 -0.21 -4.31 113.70 109.17 1qyg s SER 65 Ca 0.13 -1.23 0.00 0.00 0.48 0.00 0.00 55.95 55.33 1qyg s SER 65 Cb 0.05 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.78 1qyg s SER 65 CO -0.04 -1.19 0.00 0.61 0.98 0.00 0.00 173.24 173.60 1qyg n GLY 66 N -0.45 2.49 3.52 7.32 0.00 -1.26 -1.22 105.19 115.59 1qyg n GLY 66 Ca -0.00 -1.87 -0.08 0.00 0.00 0.00 0.00 46.02 44.07 1qyg n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1qyg s SER 67 N 0.00 -0.33 0.93 1.61 1.04 -0.34 -4.97 113.70 111.65 1qyg s SER 67 Ca 0.00 -0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.42 1qyg s SER 67 Cb 0.00 0.35 0.00 0.00 0.10 0.00 0.00 66.02 66.47 1qyg s SER 67 CO 0.00 -0.58 0.00 0.61 0.98 0.00 0.00 173.24 174.25 1qyg n GLY 68 N -0.23 0.29 0.00 7.32 0.00 -1.26 -1.58 105.19 109.74 1qyg n GLY 68 Ca -0.07 0.66 0.00 0.00 0.00 0.00 0.00 46.02 46.61 1qyg n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1qyg n THR 69 N 0.00 0.99 -4.07 2.61 -2.24 -1.26 -4.36 114.28 105.94 1qyg n THR 69 Ca 0.00 -1.00 -0.18 0.00 -2.27 0.00 0.00 64.05 60.60 1qyg n THR 69 Cb 0.00 0.49 -0.16 0.00 -2.10 0.00 0.00 70.33 68.57 1qyg n THR 69 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1qyg s ALA 70 N -1.03 0.46 0.04 6.98 0.00 -0.61 -1.09 121.76 126.51 1qyg s ALA 70 Ca 0.01 0.01 -0.02 0.00 0.00 0.00 0.00 51.96 51.96 1qyg s ALA 70 Cb 0.01 -0.30 -0.03 0.00 0.00 0.00 0.00 23.12 22.80 1qyg s ALA 70 CO 0.00 -0.00 0.00 -0.06 0.00 0.00 0.00 175.76 175.70 1qyg s PHE 71 N 0.71 0.37 -0.03 0.00 0.40 -0.39 -1.19 117.98 117.85 1qyg s PHE 71 Ca -0.08 -0.80 -0.01 0.00 -0.60 0.00 0.00 56.93 55.44 1qyg s PHE 71 Cb -0.11 -0.28 0.03 0.00 0.51 0.00 0.00 43.02 43.17 1qyg s PHE 71 CO -0.01 -0.34 0.05 0.99 0.70 0.00 0.00 175.22 176.62 1qyg s THR 72 N -3.04 -0.05 -0.19 0.64 2.01 -0.36 -1.32 115.64 113.34 1qyg s THR 72 Ca -0.01 0.17 -0.09 0.00 0.31 0.00 0.00 61.69 62.07 1qyg s THR 72 Cb 0.01 -0.11 -0.04 0.00 0.01 0.00 0.00 72.50 72.37 1qyg s THR 72 CO -0.07 0.07 0.09 -0.22 -0.69 0.00 0.00 174.62 173.81 1qyg s LEU 73 N 0.88 3.99 0.07 4.42 2.96 0.77 -1.04 118.68 130.73 1qyg s LEU 73 Ca -0.07 0.15 0.08 0.00 -0.22 0.00 0.00 54.13 54.06 1qyg s LEU 73 Cb -0.10 -2.02 -0.03 0.00 0.50 0.00 0.00 46.19 44.54 1qyg s LEU 73 CO -0.03 0.17 -0.21 -0.13 -1.32 0.00 0.00 176.35 174.83 1qyg s ARG 74 N 0.39 1.27 -0.15 1.98 0.52 -0.46 -0.39 118.95 122.11 1qyg s ARG 74 Ca 0.05 -1.05 -0.01 0.00 -0.52 0.00 0.00 55.73 54.20 1qyg s ARG 74 Cb -0.12 -1.47 -0.02 0.00 0.52 0.00 0.00 34.95 33.87 1qyg s ARG 74 CO -0.01 0.36 -0.10 -0.06 0.02 0.00 0.00 175.30 175.51 1qyg s PHE 75 N -0.97 2.88 0.16 -0.53 0.40 0.78 -1.43 117.98 119.27 1qyg s PHE 75 Ca 0.07 -0.62 -0.03 0.00 -0.60 0.00 0.00 56.93 55.75 1qyg s PHE 75 Cb -0.09 -1.90 0.00 0.00 0.51 0.00 0.00 43.02 41.54 1qyg s PHE 75 CO 0.03 -0.22 1.40 0.66 0.70 0.00 0.00 175.22 177.78 1qyg h SER 76 N 6.90 0.56 -2.73 1.36 4.64 -1.19 -1.12 113.55 121.97 1qyg h SER 76 Ca -0.29 -0.38 -0.16 0.00 -0.47 0.00 0.00 61.79 60.49 1qyg h SER 76 Cb 1.20 -0.17 -0.30 0.00 -0.31 0.00 0.00 62.40 62.82 1qyg h SER 76 CO 0.58 1.13 -0.45 -0.13 -0.87 0.00 0.00 176.83 177.09 1qyg s ARG 77 N -3.58 0.23 0.54 4.77 0.52 -1.26 -3.58 118.95 116.59 1qyg s ARG 77 Ca -0.06 0.87 -0.17 0.00 -0.52 0.00 0.00 55.73 55.85 1qyg s ARG 77 Cb 0.10 0.12 -0.06 0.00 0.52 0.00 0.00 34.95 35.63 1qyg s ARG 77 CO 0.85 -0.26 1.02 0.08 0.02 0.00 0.00 175.30 177.00 1qyg s VAL 78 N 2.45 4.19 0.10 3.52 1.01 0.16 -4.81 120.40 127.02 1qyg s VAL 78 Ca -0.01 1.09 0.06 0.00 0.00 0.00 0.00 61.98 63.12 1qyg s VAL 78 Cb -0.12 -3.56 -0.03 0.00 0.00 0.00 0.00 36.38 32.67 1qyg s VAL 78 CO -0.10 -0.56 -0.16 -1.61 0.00 0.00 0.00 175.10 172.67 1qyg s GLU 79 N -3.95 0.98 0.48 2.72 2.02 -1.26 -0.73 118.70 118.96 1qyg s GLU 79 Ca 0.62 -1.11 0.17 0.00 0.02 0.00 0.00 54.97 54.66 1qyg s GLU 79 Cb -0.13 -1.01 1.18 0.00 0.10 0.00 0.00 34.13 34.27 1qyg s GLU 79 CO 0.31 0.22 2.05 0.00 0.02 0.00 0.00 175.26 177.86 1qyg h ALA 80 N 3.95 2.10 0.00 5.21 0.00 -1.94 -0.49 119.26 128.10 1qyg h ALA 80 Ca -0.42 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1qyg h ALA 80 Cb 1.19 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1qyg h ALA 80 CO 0.44 -0.18 0.00 -0.85 0.00 0.00 0.00 179.25 178.65 1qyg n GLU 81 N -4.47 0.77 0.00 0.00 0.28 -1.17 -3.06 120.64 112.98 1qyg n GLU 81 Ca 0.05 0.00 0.15 0.00 -0.16 0.00 0.00 57.16 57.20 1qyg n GLU 81 Cb 0.31 -1.50 0.85 0.00 1.43 0.00 0.00 31.44 32.53 1qyg n GLU 81 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1qyg n ASP 82 N -1.00 0.25 -4.69 -1.84 8.00 -0.19 -4.88 116.55 112.20 1qyg n ASP 82 Ca 0.18 -0.97 -0.43 0.00 0.71 0.00 0.00 54.79 54.28 1qyg n ASP 82 Cb 0.08 -0.03 -0.01 0.00 -0.02 0.00 0.00 41.12 41.14 1qyg n ASP 82 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 1qyg n VAL 83 N -0.85 1.63 -1.80 2.53 0.24 -1.17 -4.83 118.33 114.07 1qyg n VAL 83 Ca 0.22 -0.41 0.00 0.00 -2.04 0.00 0.00 64.34 62.11 1qyg n VAL 83 Cb 0.17 -1.53 0.00 0.00 -1.47 0.00 0.00 33.84 31.01 1qyg n VAL 83 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1qyg n GLY 84 N 1.28 -1.46 3.48 7.63 0.00 -1.25 -4.64 105.19 110.24 1qyg n GLY 84 Ca 0.07 -1.40 -0.33 0.00 0.00 0.00 0.00 46.02 44.35 1qyg n GLY 84 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qyg s VAL 85 N -2.36 3.64 -0.18 1.61 1.01 -0.76 -1.19 120.40 122.17 1qyg s VAL 85 Ca 0.00 -0.46 -0.04 0.00 0.00 0.00 0.00 61.98 61.48 1qyg s VAL 85 Cb 0.00 -2.56 -0.02 0.00 0.00 0.00 0.00 36.38 33.80 1qyg s VAL 85 CO 0.00 0.52 -0.03 -0.31 0.00 0.00 0.00 175.10 175.28 1qyg s TYR 86 N 0.12 3.00 0.05 5.22 1.51 0.28 -0.73 117.35 126.80 1qyg s TYR 86 Ca -0.03 -0.47 0.08 0.00 -1.01 0.00 0.00 57.07 55.65 1qyg s TYR 86 Cb -0.14 -2.02 -0.03 0.00 -0.11 0.00 0.00 41.96 39.66 1qyg s TYR 86 CO 0.03 -0.19 -0.21 0.71 -1.11 0.00 0.00 175.55 174.78 1qyg s TYR 87 N 0.75 2.47 0.18 2.71 1.51 0.10 -0.59 117.35 124.49 1qyg s TYR 87 Ca -0.01 -0.31 0.05 0.00 -1.01 0.00 0.00 57.07 55.79 1qyg s TYR 87 Cb -0.14 -1.43 -0.04 0.00 -0.11 0.00 0.00 41.96 40.24 1qyg s TYR 87 CO 0.02 0.22 0.18 0.00 -1.11 0.00 0.00 175.55 174.85 1qyg s MET 89 N -3.30 0.03 -0.05 0.00 1.75 -0.17 -0.61 119.30 116.95 1qyg s MET 89 Ca 0.32 0.05 -0.14 0.00 -1.25 0.00 0.00 55.69 54.67 1qyg s MET 89 Cb -0.10 -0.00 -0.05 0.00 2.84 0.00 0.00 34.83 37.52 1qyg s MET 89 CO 0.25 -0.01 0.37 1.14 -0.65 0.00 0.00 175.02 176.11 1qyg s GLN 90 N 0.09 3.94 -0.22 4.11 1.03 -0.21 -1.42 119.66 126.98 1qyg s GLN 90 Ca -0.01 0.30 0.14 0.00 0.04 0.00 0.00 55.36 55.83 1qyg s GLN 90 Cb -0.01 -3.26 0.45 0.00 0.03 0.00 0.00 33.01 30.22 1qyg s GLN 90 CO -0.00 0.59 1.18 1.58 -2.54 0.00 0.00 175.29 176.10 1qyg n HIS 91 N 2.25 1.26 -0.08 9.60 -0.00 -0.38 -3.22 115.22 124.65 1qyg n HIS 91 Ca -0.14 -1.74 -0.23 0.00 0.46 0.00 0.00 57.72 56.07 1qyg n HIS 91 Cb 0.53 -0.27 -0.12 0.00 -0.12 0.00 0.00 29.99 30.01 1qyg n HIS 91 CO 0.00 0.00 0.00 -0.11 0.46 0.00 0.00 176.34 176.69 1qyg n LEU 92 N -0.65 2.13 -4.19 0.27 7.94 -1.26 -4.88 117.00 116.36 1qyg n LEU 92 Ca 0.25 0.33 -0.12 0.00 -1.11 0.00 0.00 56.01 55.36 1qyg n LEU 92 Cb 0.88 -0.98 -0.10 0.00 0.53 0.00 0.00 43.42 43.75 1qyg n LEU 92 CO 0.15 0.50 -0.39 -1.61 -1.11 0.00 0.00 177.39 174.93 1qyg s GLU 93 N -2.44 0.89 0.13 1.96 2.02 -1.26 -5.10 118.70 114.89 1qyg s GLU 93 Ca -0.29 -1.35 -0.16 0.00 0.02 0.00 0.00 54.97 53.19 1qyg s GLU 93 Cb 0.08 -0.33 -0.07 0.00 0.10 0.00 0.00 34.13 33.91 1qyg s GLU 93 CO 0.62 0.01 0.55 0.71 0.02 0.00 0.00 175.26 177.17 1qyg s TYR 94 N -3.48 3.66 0.34 1.61 1.51 -1.26 -3.10 117.35 116.63 1qyg s TYR 94 Ca 0.13 1.11 -0.26 0.00 -1.01 0.00 0.00 57.07 57.04 1qyg s TYR 94 Cb 0.04 -2.40 -0.09 0.00 -0.11 0.00 0.00 41.96 39.40 1qyg s TYR 94 CO -0.03 0.47 1.03 -1.25 -1.11 0.00 0.00 175.55 174.66 1qyg s PRO 95 N -1.74 4.42 0.56 -1.71 0.04 -1.26 -4.95 135.00 130.36 1qyg s PRO 95 Ca 0.35 1.54 -0.21 0.00 0.04 0.00 0.00 61.00 62.72 1qyg s PRO 95 Cb -0.16 -2.81 -0.04 0.00 0.04 0.00 0.00 34.50 31.53 1qyg s PRO 95 CO 0.19 0.09 1.36 -0.06 0.04 0.00 0.00 177.00 178.62 1qyg s PHE 96 N -1.49 2.24 0.01 0.56 2.99 -1.18 -4.72 117.98 116.38 1qyg s PHE 96 Ca 0.52 1.37 0.02 0.00 0.00 0.00 0.00 56.93 58.84 1qyg s PHE 96 Cb -0.24 -3.81 -0.01 0.00 0.00 0.00 0.00 43.02 38.96 1qyg s PHE 96 CO 0.30 -2.97 -0.06 0.95 -0.00 0.00 0.00 175.22 173.45 1qyg s THR 97 N -1.30 0.41 0.08 0.64 -4.23 -1.20 -5.00 115.64 105.04 1qyg s THR 97 Ca 0.73 -0.48 0.05 0.00 -1.18 0.00 0.00 61.69 60.81 1qyg s THR 97 Cb -0.41 -0.40 -0.04 0.00 1.34 0.00 0.00 72.50 73.00 1qyg s THR 97 CO 0.48 -0.06 -0.02 -0.36 -0.54 0.00 0.00 174.62 174.12 1qyg s PHE 98 N -0.52 2.94 1.04 3.99 0.08 -1.26 -1.05 117.98 123.19 1qyg s PHE 98 Ca -0.02 -0.05 -0.12 0.00 0.12 0.00 0.00 56.93 56.86 1qyg s PHE 98 Cb -0.04 -1.53 0.21 0.00 -0.57 0.00 0.00 43.02 41.09 1qyg s PHE 98 CO -0.00 0.46 1.08 0.20 -0.10 0.00 0.00 175.22 176.86 1qyg s GLY 99 N -2.20 1.56 0.00 4.36 0.00 0.22 -4.58 107.32 106.69 1qyg s GLY 99 Ca 0.24 -0.31 0.26 0.00 0.00 0.00 0.00 44.72 44.91 1qyg s GLY 99 CO 0.16 0.33 1.86 -1.14 0.00 0.00 0.00 173.10 174.31 1qyg n SER 100 N -4.36 0.00 0.00 1.64 3.41 -1.26 -4.74 113.62 108.31 1qyg n SER 100 Ca 0.05 0.04 0.00 0.00 -0.26 0.00 0.00 58.87 58.69 1qyg n SER 100 Cb 0.57 -0.33 0.00 0.00 -0.26 0.00 0.00 64.21 64.19 1qyg n SER 100 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1qyg n GLY 101 N 0.94 -0.42 2.97 5.00 0.00 -1.26 -5.01 105.19 107.41 1qyg n GLY 101 Ca 0.11 -1.57 -0.26 0.00 0.00 0.00 0.00 46.02 44.29 1qyg n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1qyg s THR 102 N -3.04 1.14 -0.11 2.61 2.01 0.24 -4.61 115.64 113.89 1qyg s THR 102 Ca 0.00 -0.41 -0.24 0.00 0.31 0.00 0.00 61.69 61.35 1qyg s THR 102 Cb 0.00 -1.10 -0.03 0.00 0.01 0.00 0.00 72.50 71.38 1qyg s THR 102 CO 0.00 0.38 0.73 -0.75 -0.69 0.00 0.00 174.62 174.29 1qyg s LYS 103 N 1.24 4.37 -0.13 4.92 2.20 -0.26 -0.56 119.74 131.52 1qyg s LYS 103 Ca -0.03 0.89 -0.25 0.00 -0.36 0.00 0.00 55.97 56.22 1qyg s LYS 103 Cb -0.14 -3.50 -0.02 0.00 -1.51 0.00 0.00 37.83 32.66 1qyg s LYS 103 CO -0.03 -0.09 0.79 -1.17 -0.36 0.00 0.00 175.35 174.48 1qyg s LEU 104 N 1.33 4.23 -0.14 5.43 0.20 -0.33 -0.55 118.68 128.85 1qyg s LEU 104 Ca 0.37 1.19 0.01 0.00 0.69 0.00 0.00 54.13 56.38 1qyg s LEU 104 Cb -0.17 -3.19 -0.00 0.00 -0.43 0.00 0.00 46.19 42.40 1qyg s LEU 104 CO 0.16 -0.30 -0.16 -1.61 -0.29 0.00 0.00 176.35 174.15 1qyg s GLU 105 N 1.66 3.23 -0.06 1.98 2.02 -0.46 -3.87 118.70 123.20 1qyg s GLU 105 Ca 0.38 -0.75 -0.23 0.00 0.02 0.00 0.00 54.97 54.39 1qyg s GLU 105 Cb -0.17 -2.58 -0.04 0.00 0.10 0.00 0.00 34.13 31.44 1qyg s GLU 105 CO 0.15 0.08 0.67 0.42 0.02 0.00 0.00 175.26 176.60 1qyg s ILE 106 N 0.65 5.02 0.10 -1.63 -1.09 -1.26 -0.66 121.20 122.33 1qyg s ILE 106 Ca -0.08 1.38 -0.13 0.00 -2.23 0.00 0.00 60.65 59.58 1qyg s ILE 106 Cb -0.16 -4.01 -0.06 0.00 -1.58 0.00 0.00 42.46 36.65 1qyg s ILE 106 CO 0.02 0.29 0.49 -0.54 -1.23 0.00 0.00 174.94 173.97 1qyg s LYS 107 N 0.59 3.91 0.32 2.79 1.02 0.79 -4.84 119.74 124.32 1qyg s LYS 107 Ca 0.35 0.39 -0.00 0.00 0.02 0.00 0.00 55.97 56.73 1qyg s LYS 107 Cb -0.18 -3.00 0.00 0.00 -0.52 0.00 0.00 37.83 34.14 1qyg s LYS 107 CO 0.17 0.54 0.42 2.89 -0.92 0.00 0.00 175.35 178.45 1qyg n ARG 108 N 0.99 0.61 -2.19 1.68 1.85 -1.26 -4.53 116.66 113.82 1qyg n ARG 108 Ca -0.07 -2.61 -0.35 0.00 -1.00 0.00 0.00 57.85 53.81 1qyg n ARG 108 Cb 0.52 2.46 0.01 0.00 -1.05 0.00 0.00 32.46 34.40 1qyg n ARG 108 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1qyg s ALA 109 N -2.75 2.66 0.57 2.89 0.00 -1.26 -4.96 121.76 118.91 1qyg s ALA 109 Ca 0.28 0.84 -0.20 0.00 0.00 0.00 0.00 51.96 52.87 1qyg s ALA 109 Cb -0.01 -3.37 -0.04 0.00 0.00 0.00 0.00 23.12 19.70 1qyg s ALA 109 CO 0.20 -0.87 1.28 -0.51 0.00 0.00 0.00 175.76 175.86 1qyg s ASP 110 N -1.79 5.24 -0.04 0.00 1.01 -1.26 -4.79 116.67 115.04 1qyg s ASP 110 Ca 0.73 2.57 -0.01 0.00 0.71 0.00 0.00 52.55 56.55 1qyg s ASP 110 Cb -0.25 -2.62 0.03 0.00 1.01 0.00 0.00 42.92 41.10 1qyg s ASP 110 CO 0.29 -1.58 0.08 0.00 0.21 0.00 0.00 175.17 174.17 1qyg s ALA 111 N -1.43 -0.02 0.53 5.23 0.00 0.53 -4.90 121.76 121.69 1qyg s ALA 111 Ca 0.74 0.42 -0.16 0.00 0.00 0.00 0.00 51.96 52.96 1qyg s ALA 111 Cb -0.35 -0.39 -0.07 0.00 0.00 0.00 0.00 23.12 22.31 1qyg s ALA 111 CO 0.40 -0.20 1.01 0.00 0.00 0.00 0.00 175.76 176.97 1qyg s ALA 112 N 1.31 2.98 0.54 0.00 0.00 -1.26 -1.10 121.76 124.23 1qyg s ALA 112 Ca -0.07 0.24 -0.19 0.00 0.00 0.00 0.00 51.96 51.94 1qyg s ALA 112 Cb -0.12 -3.15 -0.06 0.00 0.00 0.00 0.00 23.12 19.79 1qyg s ALA 112 CO -0.04 -0.39 1.13 -1.25 0.00 0.00 0.00 175.76 175.21 1qyg s PRO 113 N -4.06 3.37 -0.38 0.00 0.04 -1.26 -4.55 135.00 128.16 1qyg s PRO 113 Ca 0.60 1.60 -0.15 0.00 0.04 0.00 0.00 61.00 63.09 1qyg s PRO 113 Cb -0.12 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.42 1qyg s PRO 113 CO 0.33 -0.83 0.34 0.99 0.04 0.00 0.00 177.00 177.87 1qyg s THR 114 N -1.78 5.19 -0.18 1.26 2.01 -0.16 -4.84 115.64 117.14 1qyg s THR 114 Ca 0.73 -0.28 -0.07 0.00 0.31 0.00 0.00 61.69 62.37 1qyg s THR 114 Cb -0.24 -3.89 -0.04 0.00 0.01 0.00 0.00 72.50 68.34 1qyg s THR 114 CO 0.27 -0.22 0.06 -0.69 -0.69 0.00 0.00 174.62 173.35 1qyg s VAL 115 N 1.91 4.82 -0.03 3.82 1.01 -1.26 -0.98 120.40 129.70 1qyg s VAL 115 Ca 0.09 -0.02 0.02 0.00 0.00 0.00 0.00 61.98 62.07 1qyg s VAL 115 Cb -0.17 -3.17 0.00 0.00 0.00 0.00 0.00 36.38 33.04 1qyg s VAL 115 CO 0.12 0.47 -0.09 -0.44 0.00 0.00 0.00 175.10 175.16 1qyg s SER 116 N 0.30 1.17 0.12 3.32 0.01 -0.28 -4.97 113.70 113.36 1qyg s SER 116 Ca 0.04 -0.18 0.10 0.00 1.31 0.00 0.00 55.95 57.22 1qyg s SER 116 Cb -0.12 -0.34 -0.04 0.00 0.21 0.00 0.00 66.02 65.73 1qyg s SER 116 CO 0.00 0.05 -0.25 -0.51 0.41 0.00 0.00 173.24 172.94 1qyg s ILE 117 N 0.26 2.10 -0.14 1.44 2.07 -1.26 -1.20 121.20 124.47 1qyg s ILE 117 Ca -0.04 -1.69 -0.01 0.00 -1.41 0.00 0.00 60.65 57.50 1qyg s ILE 117 Cb -0.09 -1.87 0.04 0.00 0.13 0.00 0.00 42.46 40.67 1qyg s ILE 117 CO 0.01 0.05 -0.04 -0.36 -1.91 0.00 0.00 174.94 172.69 1qyg s PHE 118 N -1.08 1.38 0.78 3.50 0.40 0.07 -5.00 117.98 118.02 1qyg s PHE 118 Ca 0.12 -0.80 -0.13 0.00 -0.60 0.00 0.00 56.93 55.52 1qyg s PHE 118 Cb -0.10 -1.17 0.07 0.00 0.51 0.00 0.00 43.02 42.33 1qyg s PHE 118 CO 0.05 -0.53 1.16 -2.14 0.70 0.00 0.00 175.22 174.46 1qyg s PRO 119 N 1.74 1.95 0.29 0.24 0.02 -1.26 -2.56 135.00 135.42 1qyg s PRO 119 Ca 0.02 1.55 -0.29 0.00 0.02 0.00 0.00 61.00 62.30 1qyg s PRO 119 Cb -0.14 -1.83 -0.13 0.00 0.02 0.00 0.00 34.50 32.42 1qyg s PRO 119 CO -0.07 -1.94 1.27 -2.30 -0.33 0.00 0.00 177.00 173.63 1qyg n PRO 120 N -3.23 1.92 -2.11 5.54 -0.02 -1.25 -4.85 135.00 131.00 1qyg n PRO 120 Ca 0.12 0.68 -0.39 0.00 -2.02 0.00 0.00 63.50 61.88 1qyg n PRO 120 Cb 0.51 -2.24 -0.01 0.00 -0.02 0.00 0.00 33.50 31.74 1qyg n PRO 120 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1qyg s SER 121 N -0.14 6.38 0.44 2.55 1.04 -1.26 -4.85 113.70 117.85 1qyg s SER 121 Ca 0.61 2.59 0.18 0.00 0.48 0.00 0.00 55.95 59.81 1qyg s SER 121 Cb -0.63 -2.63 1.11 0.00 0.10 0.00 0.00 66.02 63.97 1qyg s SER 121 CO 0.57 -0.80 1.90 0.77 0.98 0.00 0.00 173.24 176.66 1qyg h SER 122 N 2.71 0.35 -0.64 7.02 4.64 -1.98 0.95 113.55 126.60 1qyg h SER 122 Ca -0.49 0.03 -0.06 0.00 -0.47 0.00 0.00 61.79 60.80 1qyg h SER 122 Cb 1.24 -0.04 -0.03 0.00 -0.31 0.00 0.00 62.40 63.26 1qyg h SER 122 CO 0.63 0.16 0.19 -0.08 -0.87 0.00 0.00 176.83 176.86 1qyg h GLU 123 N 0.36 1.02 -0.50 4.77 4.81 -1.98 -1.99 114.58 121.07 1qyg h GLU 123 Ca 0.41 -0.21 -0.12 0.00 -0.13 0.00 0.00 59.36 59.31 1qyg h GLU 123 Cb 1.04 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 30.26 1qyg h GLU 123 CO -0.13 0.88 -0.14 0.37 -0.73 0.00 0.00 179.01 179.26 1qyg h GLN 124 N 0.98 0.96 -0.80 1.92 4.15 -1.16 -3.16 115.11 118.00 1qyg h GLN 124 Ca 0.22 -0.36 -0.03 0.00 0.77 0.00 0.00 58.65 59.24 1qyg h GLN 124 Cb 0.30 -0.06 -0.04 0.00 0.21 0.00 0.00 27.48 27.89 1qyg h GLN 124 CO -0.01 1.03 0.37 -0.07 -1.93 0.00 0.00 178.83 178.23 1qyg h LEU 125 N 0.85 1.05 -2.02 -2.39 3.38 -0.72 -0.47 115.31 114.99 1qyg h LEU 125 Ca 0.13 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1qyg h LEU 125 Cb 0.70 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.17 1qyg h LEU 125 CO 0.05 0.90 -0.08 0.71 0.09 0.00 0.00 178.44 180.11 1qyg h THR 126 N 1.15 0.39 -0.23 0.22 1.35 -1.35 -0.37 112.91 114.07 1qyg h THR 126 Ca 0.27 -0.44 0.00 0.00 -0.55 0.00 0.00 66.41 65.70 1qyg h THR 126 Cb 0.13 1.31 0.00 0.00 -1.73 0.00 0.00 68.15 67.86 1qyg h THR 126 CO -0.03 0.08 0.00 -1.20 -0.25 0.00 0.00 175.52 174.12 1qyg n SER 127 N -3.47 1.71 0.00 5.36 7.64 -0.23 -4.92 113.62 119.72 1qyg n SER 127 Ca -0.02 -1.80 0.00 0.00 1.01 0.00 0.00 58.87 58.06 1qyg n SER 127 Cb 0.22 -0.15 0.00 0.00 -1.01 0.00 0.00 64.21 63.27 1qyg n SER 127 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1qyg n GLY 128 N 1.10 0.62 3.60 0.23 0.00 -0.15 -5.05 105.19 105.55 1qyg n GLY 128 Ca 0.15 -0.03 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 1qyg n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1qyg s GLY 129 N -2.03 1.81 -0.39 -0.02 0.00 -0.95 -1.30 107.32 104.45 1qyg s GLY 129 Ca 0.00 -1.19 0.10 0.00 0.00 0.00 0.00 44.72 43.64 1qyg s GLY 129 CO 0.00 -1.15 0.72 0.00 0.00 0.00 0.00 173.10 172.67 1qyg n ALA 130 N 0.79 1.72 -2.58 3.20 0.00 -0.73 -2.94 120.51 119.98 1qyg n ALA 130 Ca -0.13 -3.15 -0.42 0.00 0.00 0.00 0.00 53.44 49.74 1qyg n ALA 130 Cb 0.52 -0.94 -0.03 0.00 0.00 0.00 0.00 19.45 19.00 1qyg n ALA 130 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1qyg s SER 131 N -2.01 7.39 -0.26 0.00 0.01 -1.26 -2.85 113.70 114.71 1qyg s SER 131 Ca 0.37 1.71 -0.09 0.00 1.31 0.00 0.00 55.95 59.25 1qyg s SER 131 Cb 0.30 -2.58 -0.04 0.00 0.21 0.00 0.00 66.02 63.91 1qyg s SER 131 CO -0.09 -0.22 0.14 -0.69 0.41 0.00 0.00 173.24 172.79 1qyg s VAL 132 N 0.74 4.89 -0.04 3.43 1.01 -0.43 -3.89 120.40 126.11 1qyg s VAL 132 Ca 0.51 0.03 -0.01 0.00 0.00 0.00 0.00 61.98 62.50 1qyg s VAL 132 Cb -0.22 -3.31 -0.04 0.00 0.00 0.00 0.00 36.38 32.81 1qyg s VAL 132 CO 0.29 0.29 0.04 -0.69 0.00 0.00 0.00 175.10 175.03 1qyg s VAL 133 N 1.65 4.52 -0.08 2.92 1.01 -1.06 -0.83 120.40 128.52 1qyg s VAL 133 Ca 0.07 -0.33 -0.01 0.00 0.00 0.00 0.00 61.98 61.71 1qyg s VAL 133 Cb -0.15 -2.98 0.03 0.00 0.00 0.00 0.00 36.38 33.27 1qyg s VAL 133 CO 0.08 0.48 -0.04 0.00 0.00 0.00 0.00 175.10 175.61 1qyg s PHE 135 N 1.67 3.39 -0.38 0.00 0.08 -0.34 -0.55 117.98 121.85 1qyg s PHE 135 Ca 0.02 0.29 -0.00 0.00 0.12 0.00 0.00 56.93 57.36 1qyg s PHE 135 Cb -0.13 -2.13 0.11 0.00 -0.57 0.00 0.00 43.02 40.29 1qyg s PHE 135 CO -0.05 0.29 0.14 -0.51 -0.10 0.00 0.00 175.22 174.99 1qyg s LEU 136 N 0.30 5.05 0.19 -0.37 1.02 -0.17 -1.13 118.68 123.56 1qyg s LEU 136 Ca 0.07 -2.06 0.08 0.00 0.02 0.00 0.00 54.13 52.25 1qyg s LEU 136 Cb -0.11 -1.76 -0.04 0.00 0.02 0.00 0.00 46.19 44.30 1qyg s LEU 136 CO -0.01 -0.48 -0.06 0.20 0.02 0.00 0.00 176.35 176.02 1qyg s ASN 137 N 1.49 4.44 -1.24 2.29 0.02 -0.15 -0.84 114.94 120.95 1qyg s ASN 137 Ca 0.09 -0.53 -0.08 0.00 -1.02 0.00 0.00 52.86 51.32 1qyg s ASN 137 Cb -0.21 -0.83 -0.01 0.00 0.02 0.00 0.00 41.25 40.22 1qyg s ASN 137 CO -0.05 0.09 0.69 0.59 0.02 0.00 0.00 177.10 178.44 1qyg n ASN 138 N -0.10 -2.96 -4.64 -1.22 4.13 -0.76 -0.98 115.26 108.72 1qyg n ASN 138 Ca -0.10 -0.92 -0.25 0.00 1.68 0.00 0.00 54.58 54.99 1qyg n ASN 138 Cb 0.56 -3.71 -0.09 0.00 -1.54 0.00 0.00 39.78 35.00 1qyg n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1qyg s PHE 139 N -3.63 2.54 -0.24 3.10 -0.12 0.72 -4.68 117.98 115.66 1qyg s PHE 139 Ca 0.21 -0.52 -0.26 0.00 -0.05 0.00 0.00 56.93 56.32 1qyg s PHE 139 Cb -0.07 -1.63 0.08 0.00 -0.63 0.00 0.00 43.02 40.77 1qyg s PHE 139 CO 0.84 0.42 0.75 -0.47 -0.05 0.00 0.00 175.22 176.71 1qyg s TYR 140 N -2.58 -0.74 1.25 3.49 6.14 -0.25 -1.10 117.35 123.55 1qyg s TYR 140 Ca 0.36 1.75 -0.21 0.00 0.64 0.00 0.00 57.07 59.61 1qyg s TYR 140 Cb 0.03 0.30 0.31 0.00 0.42 0.00 0.00 41.96 43.01 1qyg s TYR 140 CO 0.19 -0.39 1.11 -1.25 0.64 0.00 0.00 175.55 175.86 1qyg s PRO 141 N 0.16 -1.61 0.50 4.97 0.04 -1.26 -0.35 135.00 137.45 1qyg s PRO 141 Ca -0.01 -0.20 0.29 0.00 0.04 0.00 0.00 61.00 61.11 1qyg s PRO 141 Cb -0.04 -1.56 0.93 0.00 0.04 0.00 0.00 34.50 33.87 1qyg s PRO 141 CO 0.01 -3.94 1.83 -0.56 0.04 0.00 0.00 177.00 174.38 1qyg h GLN 142 N -2.74 0.00 -6.44 4.56 3.07 -1.97 -3.44 115.11 108.15 1qyg h GLN 142 Ca -0.42 0.00 -0.53 0.00 0.09 0.00 0.00 58.65 57.78 1qyg h GLN 142 Cb 1.28 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.82 1qyg h GLN 142 CO 0.28 0.02 0.33 -0.51 0.09 0.00 0.00 178.83 179.04 1qyg s ASP 143 N -5.93 7.39 0.06 0.06 1.01 -1.26 -5.02 116.67 112.98 1qyg s ASP 143 Ca 0.03 1.67 -0.07 0.00 0.71 0.00 0.00 52.55 54.89 1qyg s ASP 143 Cb 0.07 -2.56 -0.01 0.00 1.01 0.00 0.00 42.92 41.44 1qyg s ASP 143 CO 0.60 -0.15 0.15 -0.51 0.21 0.00 0.00 175.17 175.47 1qyg s ILE 144 N 0.50 0.14 0.00 0.77 2.07 -1.26 -4.62 121.20 118.80 1qyg s ILE 144 Ca 0.48 -1.16 0.06 0.00 -1.41 0.00 0.00 60.65 58.61 1qyg s ILE 144 Cb -0.22 -1.17 -0.02 0.00 0.13 0.00 0.00 42.46 41.19 1qyg s ILE 144 CO 0.28 -0.64 -0.18 -0.89 -1.91 0.00 0.00 174.94 171.60 1qyg s THR 145 N -3.30 1.40 -0.05 4.00 2.01 -0.31 -4.98 115.64 114.40 1qyg s THR 145 Ca 0.01 -0.85 0.04 0.00 0.31 0.00 0.00 61.69 61.20 1qyg s THR 145 Cb 0.03 -1.18 0.00 0.00 0.01 0.00 0.00 72.50 71.36 1qyg s THR 145 CO -0.08 0.32 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.32 1qyg s VAL 146 N -0.52 1.35 -0.03 3.82 1.01 -1.26 -0.68 120.40 124.09 1qyg s VAL 146 Ca 0.06 -0.66 0.06 0.00 0.00 0.00 0.00 61.98 61.45 1qyg s VAL 146 Cb -0.07 -1.17 -0.01 0.00 0.00 0.00 0.00 36.38 35.13 1qyg s VAL 146 CO -0.00 0.39 -0.21 -0.55 0.00 0.00 0.00 175.10 174.73 1qyg s SER 147 N 0.16 2.54 -0.03 3.32 0.15 -0.43 -4.99 113.70 114.43 1qyg s SER 147 Ca -0.06 -0.40 0.04 0.00 0.70 0.00 0.00 55.95 56.23 1qyg s SER 147 Cb -0.12 -0.46 -0.03 0.00 -1.71 0.00 0.00 66.02 63.70 1qyg s SER 147 CO 0.03 0.24 -0.14 0.26 1.20 0.00 0.00 173.24 174.82 1qyg s TRP 148 N -0.32 2.70 -0.03 3.44 0.52 -1.26 -1.18 118.94 122.82 1qyg s TRP 148 Ca 0.03 -0.16 0.03 0.00 0.02 0.00 0.00 56.10 56.02 1qyg s TRP 148 Cb -0.10 -1.60 0.00 0.00 -1.15 0.00 0.00 33.47 30.63 1qyg s TRP 148 CO 0.01 0.23 -0.10 0.15 0.02 0.00 0.00 176.95 177.25 1qyg s LYS 149 N -0.96 1.09 -0.31 4.98 1.02 -0.68 -0.35 119.74 124.52 1qyg s LYS 149 Ca 0.13 -0.34 -0.00 0.00 0.02 0.00 0.00 55.97 55.77 1qyg s LYS 149 Cb -0.11 -1.00 0.07 0.00 -0.52 0.00 0.00 37.83 36.27 1qyg s LYS 149 CO 0.02 0.12 0.01 0.42 -0.92 0.00 0.00 175.35 175.01 1qyg s ILE 150 N 0.22 2.79 -1.12 2.17 1.01 -0.26 -1.02 121.20 124.99 1qyg s ILE 150 Ca -0.04 -1.65 -0.11 0.00 0.00 0.00 0.00 60.65 58.85 1qyg s ILE 150 Cb -0.09 -2.71 -0.04 0.00 0.01 0.00 0.00 42.46 39.63 1qyg s ILE 150 CO 0.01 -0.24 0.85 0.47 0.00 0.00 0.00 174.94 176.03 1qyg n ASP 151 N 4.54 -5.33 0.00 3.58 8.00 -0.10 -1.33 116.55 125.91 1qyg n ASP 151 Ca -0.10 -0.84 0.00 0.00 0.71 0.00 0.00 54.79 54.56 1qyg n ASP 151 Cb 0.43 -4.36 0.00 0.00 -0.02 0.00 0.00 41.12 37.16 1qyg n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1qyg n GLY 152 N -1.44 0.64 3.78 0.44 0.00 -1.26 -4.98 105.19 102.36 1qyg n GLY 152 Ca -0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.52 1qyg n GLY 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qyg s ALA 153 N -0.90 3.51 0.29 4.61 0.00 -0.44 -4.94 121.76 123.89 1qyg s ALA 153 Ca 0.00 0.08 -0.29 0.00 0.00 0.00 0.00 51.96 51.75 1qyg s ALA 153 Cb 0.00 -2.75 -0.10 0.00 0.00 0.00 0.00 23.12 20.27 1qyg s ALA 153 CO 0.00 0.24 1.30 -2.00 0.00 0.00 0.00 175.76 175.30 1qyg s GLU 154 N -0.53 4.38 -0.09 0.00 2.12 -1.26 -1.10 118.70 122.22 1qyg s GLU 154 Ca 0.31 2.16 0.04 0.00 0.36 0.00 0.00 54.97 57.85 1qyg s GLU 154 Cb -0.19 -3.11 -0.00 0.00 0.26 0.00 0.00 34.13 31.09 1qyg s GLU 154 CO 0.19 -0.19 -0.24 0.50 -0.54 0.00 0.00 175.26 174.98 1qyg s ARG 155 N -1.31 2.92 -0.04 4.30 6.06 0.52 -4.91 118.95 126.50 1qyg s ARG 155 Ca 0.51 -0.88 0.03 0.00 -2.50 0.00 0.00 55.73 52.89 1qyg s ARG 155 Cb -0.39 -2.27 -0.04 0.00 0.06 0.00 0.00 34.95 32.31 1qyg s ARG 155 CO 0.48 0.24 0.00 0.43 -2.50 0.00 0.00 175.30 173.95 1qyg n SER 156 N 3.36 3.96 -4.85 -2.12 7.64 -1.26 -4.12 113.62 116.23 1qyg n SER 156 Ca -0.19 -0.01 -0.34 0.00 1.01 0.00 0.00 58.87 59.35 1qyg n SER 156 Cb 0.53 0.45 -0.06 0.00 -1.01 0.00 0.00 64.21 64.12 1qyg n SER 156 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1qyg s SER 157 N -3.68 6.79 0.00 6.43 0.01 -1.26 -3.82 113.70 118.16 1qyg s SER 157 Ca -0.03 1.12 0.00 0.00 1.31 0.00 0.00 55.95 58.35 1qyg s SER 157 Cb 0.01 -2.30 0.00 0.00 0.21 0.00 0.00 66.02 63.94 1qyg s SER 157 CO 0.15 -0.02 0.00 0.61 0.41 0.00 0.00 173.24 174.39 1qyg n GLY 158 N 0.28 0.65 3.55 3.44 0.00 -1.26 -4.85 105.19 106.99 1qyg n GLY 158 Ca -0.01 -0.70 -0.34 0.00 0.00 0.00 0.00 46.02 44.97 1qyg n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qyg s VAL 159 N -2.00 4.17 -0.21 1.61 1.01 -1.25 -0.23 120.40 123.51 1qyg s VAL 159 Ca 0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 61.98 61.71 1qyg s VAL 159 Cb 0.00 -2.84 0.01 0.00 0.00 0.00 0.00 36.38 33.55 1qyg s VAL 159 CO 0.00 0.49 -0.12 -0.76 0.00 0.00 0.00 175.10 174.71 1qyg s LEU 160 N 0.29 2.59 0.00 3.92 1.43 -0.15 -4.95 118.68 121.81 1qyg s LEU 160 Ca -0.01 -0.58 0.06 0.00 -1.03 0.00 0.00 54.13 52.56 1qyg s LEU 160 Cb -0.13 -1.61 -0.03 0.00 0.03 0.00 0.00 46.19 44.45 1qyg s LEU 160 CO 0.02 -0.03 -0.17 0.20 0.23 0.00 0.00 176.35 176.61 1qyg s ASN 161 N 1.37 3.88 -0.02 2.29 0.01 -1.26 -0.14 114.94 121.06 1qyg s ASN 161 Ca 0.05 -0.33 -0.08 0.00 -0.71 0.00 0.00 52.86 51.78 1qyg s ASN 161 Cb -0.14 -0.70 0.01 0.00 0.41 0.00 0.00 41.25 40.83 1qyg s ASN 161 CO -0.08 0.29 0.18 -0.55 -1.51 0.00 0.00 177.10 175.43 1qyg s SER 162 N -1.14 -0.08 0.04 -1.22 0.15 -0.56 -5.00 113.70 105.90 1qyg s SER 162 Ca 0.13 0.03 0.05 0.00 0.70 0.00 0.00 55.95 56.86 1qyg s SER 162 Cb -0.11 0.29 -0.02 0.00 -1.71 0.00 0.00 66.02 64.47 1qyg s SER 162 CO 0.03 -0.29 -0.15 0.26 1.20 0.00 0.00 173.24 174.30 1qyg s TRP 163 N -0.90 1.29 0.35 3.44 0.51 -1.26 -0.91 118.94 121.45 1qyg s TRP 163 Ca -0.10 -0.36 -0.03 0.00 -2.12 0.00 0.00 56.10 53.49 1qyg s TRP 163 Cb -0.05 -0.76 -0.04 0.00 -0.81 0.00 0.00 33.47 31.80 1qyg s TRP 163 CO 0.02 0.04 0.59 0.95 -0.51 0.00 0.00 176.95 178.04 1qyg s THR 164 N -0.88 5.04 0.96 2.01 -4.23 -0.53 -5.02 115.64 113.00 1qyg s THR 164 Ca 0.02 -0.15 -0.12 0.00 -1.18 0.00 0.00 61.69 60.26 1qyg s THR 164 Cb -0.08 -3.81 0.17 0.00 1.34 0.00 0.00 72.50 70.11 1qyg s THR 164 CO 0.01 -0.52 1.09 -1.81 -0.54 0.00 0.00 174.62 172.85 1qyg s ASP 165 N -3.71 2.84 0.31 3.99 1.01 -1.26 -4.57 116.67 115.27 1qyg s ASP 165 Ca 0.43 1.47 -0.29 0.00 0.71 0.00 0.00 52.55 54.86 1qyg s ASP 165 Cb -0.10 -2.14 -0.11 0.00 1.01 0.00 0.00 42.92 41.57 1qyg s ASP 165 CO 0.35 -3.04 1.55 -1.58 0.21 0.00 0.00 175.17 172.66 1qyg s GLN 166 N -4.85 4.14 0.20 8.23 0.74 -1.26 -4.76 119.66 122.09 1qyg s GLN 166 Ca 0.65 2.54 -0.30 0.00 0.05 0.00 0.00 55.36 58.30 1qyg s GLN 166 Cb -0.20 -3.02 -0.09 0.00 1.10 0.00 0.00 33.01 30.80 1qyg s GLN 166 CO 0.58 -0.58 1.42 0.34 -0.55 0.00 0.00 175.29 176.50 1qyg s ASP 167 N 0.30 6.74 0.31 6.67 2.15 0.40 -4.92 116.67 128.31 1qyg s ASP 167 Ca 0.60 2.53 0.26 0.00 0.43 0.00 0.00 52.55 56.37 1qyg s ASP 167 Cb -0.47 -2.61 1.00 0.00 -0.30 0.00 0.00 42.92 40.54 1qyg s ASP 167 CO 0.51 -0.67 1.77 0.77 -0.17 0.00 0.00 175.17 177.39 1qyg h SER 168 N 5.68 0.00 0.00 -0.34 4.64 -1.91 -1.67 113.55 119.94 1qyg h SER 168 Ca -0.44 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 60.50 1qyg h SER 168 Cb 1.21 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.24 1qyg h SER 168 CO 0.81 0.00 -2.31 -1.20 -0.87 0.00 0.00 176.83 173.26 1qyg n SER 169 N -2.42 1.88 -0.69 4.97 7.64 -1.26 -3.05 113.62 120.69 1qyg n SER 169 Ca 0.02 0.15 0.06 0.00 1.01 0.00 0.00 58.87 60.12 1qyg n SER 169 Cb 0.29 -0.58 0.15 0.00 -1.01 0.00 0.00 64.21 63.05 1qyg n SER 169 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1qyg n ASP 170 N -3.76 2.83 -2.05 6.43 5.68 -1.25 -4.94 116.55 119.49 1qyg n ASP 170 Ca -0.44 -1.89 -0.15 0.00 -0.50 0.00 0.00 54.79 51.81 1qyg n ASP 170 Cb 0.86 -0.20 -0.03 0.00 -1.14 0.00 0.00 41.12 40.61 1qyg n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1qyg n SER 171 N 0.69 -4.24 -5.04 -1.12 7.64 -0.63 -4.97 113.62 105.95 1qyg n SER 171 Ca 0.12 0.22 -0.20 0.00 1.01 0.00 0.00 58.87 60.02 1qyg n SER 171 Cb 0.42 -3.70 0.07 0.00 -1.01 0.00 0.00 64.21 60.00 1qyg n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1qyg s THR 172 N -2.55 2.01 0.15 0.44 -4.23 -1.26 -4.65 115.64 105.55 1qyg s THR 172 Ca 0.00 -1.00 0.07 0.00 -1.18 0.00 0.00 61.69 59.58 1qyg s THR 172 Cb 0.00 -2.01 -0.04 0.00 1.34 0.00 0.00 72.50 71.79 1qyg s THR 172 CO 0.00 0.00 -0.15 -0.31 -0.54 0.00 0.00 174.62 173.62 1qyg s TYR 173 N -2.72 1.57 0.05 3.99 2.02 -0.26 -0.45 117.35 121.56 1qyg s TYR 173 Ca 0.63 -0.55 0.00 0.00 -0.37 0.00 0.00 57.07 56.79 1qyg s TYR 173 Cb -0.05 -0.79 -0.03 0.00 -0.40 0.00 0.00 41.96 40.68 1qyg s TYR 173 CO 0.40 0.23 -0.05 -1.12 -1.57 0.00 0.00 175.55 173.45 1qyg s SER 174 N -2.71 0.63 0.03 2.29 0.01 -1.26 -0.20 113.70 112.49 1qyg s SER 174 Ca 0.14 -0.82 0.01 0.00 1.31 0.00 0.00 55.95 56.59 1qyg s SER 174 Cb -0.04 0.13 -0.02 0.00 0.21 0.00 0.00 66.02 66.30 1qyg s SER 174 CO 0.05 -0.44 -0.06 -0.32 0.41 0.00 0.00 173.24 172.88 1qyg s MET 175 N -3.00 0.42 -0.04 12.44 1.75 -0.02 -1.45 119.30 129.40 1qyg s MET 175 Ca 0.00 -0.63 0.06 0.00 -1.25 0.00 0.00 55.69 53.88 1qyg s MET 175 Cb 0.01 -0.16 -0.02 0.00 2.84 0.00 0.00 34.83 37.50 1qyg s MET 175 CO -0.05 0.02 -0.22 0.45 -0.65 0.00 0.00 175.02 174.56 1qyg s SER 176 N -1.35 3.33 -0.07 1.11 0.15 -0.09 -1.00 113.70 115.79 1qyg s SER 176 Ca -0.11 -0.41 -0.01 0.00 0.70 0.00 0.00 55.95 56.13 1qyg s SER 176 Cb -0.09 -0.64 0.03 0.00 -1.71 0.00 0.00 66.02 63.61 1qyg s SER 176 CO -0.00 0.30 -0.01 -0.55 1.20 0.00 0.00 173.24 174.18 1qyg s SER 177 N -0.49 1.43 -0.16 5.45 0.15 0.29 -1.49 113.70 118.88 1qyg s SER 177 Ca 0.06 -0.09 0.01 0.00 0.70 0.00 0.00 55.95 56.63 1qyg s SER 177 Cb -0.11 -0.44 0.01 0.00 -1.71 0.00 0.00 66.02 63.77 1qyg s SER 177 CO 0.01 -0.16 -0.19 -0.89 1.20 0.00 0.00 173.24 173.20 1qyg s THR 178 N 1.74 2.27 -0.25 6.45 2.01 0.80 -1.02 115.64 127.64 1qyg s THR 178 Ca 0.02 -0.90 -0.21 0.00 0.31 0.00 0.00 61.69 60.90 1qyg s THR 178 Cb -0.13 -1.94 -0.02 0.00 0.01 0.00 0.00 72.50 70.43 1qyg s THR 178 CO -0.04 0.53 0.68 -0.22 -0.69 0.00 0.00 174.62 174.88 1qyg s LEU 179 N 0.94 4.07 -0.33 4.42 2.96 -0.01 -0.98 118.68 129.74 1qyg s LEU 179 Ca -0.04 0.80 -0.14 0.00 -0.22 0.00 0.00 54.13 54.53 1qyg s LEU 179 Cb -0.15 -2.94 -0.02 0.00 0.50 0.00 0.00 46.19 43.58 1qyg s LEU 179 CO -0.04 -0.41 0.29 0.42 -1.32 0.00 0.00 176.35 175.29 1qyg s THR 180 N 2.59 5.24 0.17 3.68 -4.23 0.68 -1.31 115.64 122.46 1qyg s THR 180 Ca 0.28 -0.04 0.07 0.00 -1.18 0.00 0.00 61.69 60.82 1qyg s THR 180 Cb -0.15 -3.74 -0.04 0.00 1.34 0.00 0.00 72.50 69.91 1qyg s THR 180 CO 0.08 -0.01 -0.14 -0.76 -0.54 0.00 0.00 174.62 173.26 1qyg s LEU 181 N 1.85 2.52 0.64 4.79 1.43 -1.13 -4.81 118.68 123.97 1qyg s LEU 181 Ca 0.09 -0.98 -0.05 0.00 -1.03 0.00 0.00 54.13 52.16 1qyg s LEU 181 Cb -0.17 -0.58 0.04 0.00 0.03 0.00 0.00 46.19 45.51 1qyg s LEU 181 CO 0.11 -0.20 0.94 0.42 0.23 0.00 0.00 176.35 177.86 1qyg s THR 182 N -2.87 2.84 0.19 5.49 -4.23 -1.26 -1.77 115.64 114.02 1qyg s THR 182 Ca 0.18 -0.22 -0.10 0.00 -1.18 0.00 0.00 61.69 60.37 1qyg s THR 182 Cb -0.01 -3.17 0.11 0.00 1.34 0.00 0.00 72.50 70.77 1qyg s THR 182 CO 0.05 -0.17 1.76 0.50 -0.54 0.00 0.00 174.62 176.21 1qyg h LYS 183 N -0.36 0.99 0.06 3.99 3.64 -1.44 0.53 116.57 123.98 1qyg h LYS 183 Ca -0.45 -0.17 0.03 0.00 -1.27 0.00 0.00 60.65 58.79 1qyg h LYS 183 Cb 1.29 -0.17 -0.04 0.00 -0.41 0.00 0.00 32.23 32.90 1qyg h LYS 183 CO 0.60 0.81 -0.27 -0.44 -2.27 0.00 0.00 179.45 177.87 1qyg h ASP 184 N 0.95 -0.80 -0.95 4.20 3.32 -1.94 -1.17 116.42 120.03 1qyg h ASP 184 Ca 0.23 0.10 0.05 0.00 0.02 0.00 0.00 57.03 57.43 1qyg h ASP 184 Cb 0.17 0.31 -0.06 0.00 0.22 0.00 0.00 39.33 39.97 1qyg h ASP 184 CO -0.02 -0.35 0.61 -0.33 -1.72 0.00 0.00 179.24 177.43 1qyg h GLU 185 N -0.45 1.12 -0.42 3.56 5.08 -1.89 -2.45 114.58 119.14 1qyg h GLU 185 Ca 0.05 -0.07 0.05 0.00 -1.00 0.00 0.00 59.36 58.39 1qyg h GLU 185 Cb 0.51 -0.25 -0.05 0.00 0.50 0.00 0.00 28.75 29.46 1qyg h GLU 185 CO -0.20 0.74 0.14 -0.92 -1.00 0.00 0.00 179.01 177.78 1qyg h TYR 186 N 1.16 0.25 0.00 4.33 3.20 0.04 -2.73 116.97 123.22 1qyg h TYR 186 Ca 0.39 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.28 1qyg h TYR 186 Cb 0.07 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 38.29 1qyg h TYR 186 CO -0.01 0.09 0.00 0.93 -1.64 0.00 0.00 178.16 177.53 1qyg h GLU 187 N 0.31 0.00 0.00 1.82 5.08 -0.76 -2.95 114.58 118.08 1qyg h GLU 187 Ca 0.19 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 1qyg h GLU 187 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1qyg h GLU 187 CO -0.20 0.00 0.00 0.54 -1.00 0.00 0.00 179.01 178.35 1qyg n ARG 188 N -3.06 0.08 -4.19 2.33 1.74 -1.03 -4.79 116.66 107.74 1qyg n ARG 188 Ca -0.00 0.25 -0.16 0.00 -0.77 0.00 0.00 57.85 57.17 1qyg n ARG 188 Cb 0.26 -1.50 -0.07 0.00 -1.02 0.00 0.00 32.46 30.13 1qyg n ARG 188 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1qyg s HIS 189 N -2.72 1.35 0.00 -1.55 3.76 -1.12 -5.10 115.29 109.92 1qyg s HIS 189 Ca 0.07 -1.44 0.00 0.00 -0.15 0.00 0.00 55.06 53.54 1qyg s HIS 189 Cb 0.06 -0.43 0.00 0.00 1.11 0.00 0.00 32.58 33.32 1qyg s HIS 189 CO 0.14 -0.93 0.00 0.45 -0.85 0.00 0.00 174.74 173.56 1qyg n SER 190 N -1.22 2.10 -4.64 1.40 2.88 -1.26 -4.78 113.62 108.10 1qyg n SER 190 Ca 0.04 0.00 -0.39 0.00 -1.33 0.00 0.00 58.87 57.19 1qyg n SER 190 Cb 0.63 0.18 -0.08 0.00 -0.75 0.00 0.00 64.21 64.19 1qyg n SER 190 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1qyg s SER 191 N -2.09 6.37 -0.13 -3.46 0.15 -1.26 -1.08 113.70 112.19 1qyg s SER 191 Ca 0.00 0.43 -0.00 0.00 0.70 0.00 0.00 55.95 57.08 1qyg s SER 191 Cb 0.00 -2.23 0.03 0.00 -1.71 0.00 0.00 66.02 62.11 1qyg s SER 191 CO 0.00 -0.14 -0.08 -0.31 1.20 0.00 0.00 173.24 173.91 1qyg s TYR 192 N 1.69 1.66 0.03 3.44 1.51 -0.71 -0.92 117.35 124.04 1qyg s TYR 192 Ca 0.18 -0.90 0.05 0.00 -1.01 0.00 0.00 57.07 55.38 1qyg s TYR 192 Cb -0.15 -1.32 -0.02 0.00 -0.11 0.00 0.00 41.96 40.36 1qyg s TYR 192 CO 0.09 -0.57 -0.15 0.95 -1.11 0.00 0.00 175.55 174.76 1qyg s THR 193 N 1.65 1.19 -0.22 -0.71 -4.23 -0.19 -1.53 115.64 111.61 1qyg s THR 193 Ca 0.04 -0.95 0.00 0.00 -1.18 0.00 0.00 61.69 59.60 1qyg s THR 193 Cb -0.13 -1.06 0.03 0.00 1.34 0.00 0.00 72.50 72.68 1qyg s THR 193 CO -0.09 0.09 -0.13 0.00 -0.54 0.00 0.00 174.62 173.96 1qyg s GLU 195 N 1.28 3.09 -0.18 0.00 2.12 -0.32 -1.96 118.70 122.72 1qyg s GLU 195 Ca 0.01 -0.82 -0.05 0.00 0.36 0.00 0.00 54.97 54.47 1qyg s GLU 195 Cb -0.15 -2.48 -0.03 0.00 0.26 0.00 0.00 34.13 31.73 1qyg s GLU 195 CO -0.08 0.02 -0.01 0.00 -0.54 0.00 0.00 175.26 174.65 1qyg s ALA 196 N 0.75 3.04 -0.18 6.30 0.00 0.15 -1.31 121.76 130.52 1qyg s ALA 196 Ca -0.08 -0.91 -0.03 0.00 0.00 0.00 0.00 51.96 50.93 1qyg s ALA 196 Cb -0.16 -1.70 -0.02 0.00 0.00 0.00 0.00 23.12 21.24 1qyg s ALA 196 CO -0.00 0.00 -0.05 0.99 0.00 0.00 0.00 175.76 176.70 1qyg s THR 197 N 0.73 3.59 0.03 0.00 2.01 0.14 0.03 115.64 122.18 1qyg s THR 197 Ca -0.00 -0.45 -0.06 0.00 0.31 0.00 0.00 61.69 61.48 1qyg s THR 197 Cb -0.14 -2.59 -0.01 0.00 0.01 0.00 0.00 72.50 69.77 1qyg s THR 197 CO 0.02 0.47 0.12 -2.28 -0.69 0.00 0.00 174.62 172.26 1qyg s HIS 198 N 0.78 0.15 0.33 4.92 2.46 -1.26 -1.16 115.29 121.50 1qyg s HIS 198 Ca -0.02 -0.39 0.21 0.00 0.47 0.00 0.00 55.06 55.32 1qyg s HIS 198 Cb -0.15 -0.11 1.12 0.00 -0.13 0.00 0.00 32.58 33.32 1qyg s HIS 198 CO 0.02 -0.36 1.58 1.57 -2.47 0.00 0.00 174.74 175.08 1qyg h LYS 199 N 3.76 0.00 0.00 2.88 5.09 -1.94 -0.83 116.57 125.53 1qyg h LYS 199 Ca -0.32 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.42 1qyg h LYS 199 Cb 1.19 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.52 1qyg h LYS 199 CO 0.48 0.00 0.00 0.25 -2.09 0.00 0.00 179.45 178.09 1qyg n THR 200 N -2.45 0.49 -3.90 0.07 -2.24 -1.26 -4.76 114.28 100.24 1qyg n THR 200 Ca -0.01 -0.13 -0.11 0.00 -2.27 0.00 0.00 64.05 61.53 1qyg n THR 200 Cb 0.36 -0.65 -0.11 0.00 -2.10 0.00 0.00 70.33 67.82 1qyg n THR 200 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1qyg s SER 201 N -4.04 0.06 0.38 3.42 0.15 -0.32 -5.00 113.70 108.35 1qyg s SER 201 Ca 0.11 -0.18 0.20 0.00 0.70 0.00 0.00 55.95 56.78 1qyg s SER 201 Cb 0.13 0.15 0.27 0.00 -1.71 0.00 0.00 66.02 64.87 1qyg s SER 201 CO 0.54 -0.22 1.56 0.71 1.20 0.00 0.00 173.24 177.03 1qyg h THR 202 N 4.67 0.33 -3.08 6.45 1.35 -1.85 -3.42 112.91 117.36 1qyg h THR 202 Ca -0.29 -1.44 -0.63 0.00 -0.55 0.00 0.00 66.41 63.50 1qyg h THR 202 Cb 1.20 2.14 -0.11 0.00 -1.73 0.00 0.00 68.15 69.65 1qyg h THR 202 CO 0.43 0.18 -0.51 -0.94 -0.25 0.00 0.00 175.52 174.43 1qyg s SER 203 N -6.29 6.10 0.46 5.36 1.04 -1.26 -5.05 113.70 114.06 1qyg s SER 203 Ca 0.06 0.27 -0.22 0.00 0.48 0.00 0.00 55.95 56.54 1qyg s SER 203 Cb 0.06 -2.02 -0.10 0.00 0.10 0.00 0.00 66.02 64.05 1qyg s SER 203 CO 0.69 0.26 0.78 -2.65 0.98 0.00 0.00 173.24 173.31 1qyg n PRO 204 N 2.96 0.91 -3.01 4.02 -0.02 -1.26 -4.91 135.00 133.68 1qyg n PRO 204 Ca -0.18 0.33 -0.41 0.00 -2.02 0.00 0.00 63.50 61.23 1qyg n PRO 204 Cb 0.53 -1.83 -0.05 0.00 -0.02 0.00 0.00 33.50 32.13 1qyg n PRO 204 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1qyg s ILE 205 N -1.43 4.95 -0.15 4.25 -1.09 0.10 -4.87 121.20 122.96 1qyg s ILE 205 Ca 0.66 1.40 -0.01 0.00 -2.23 0.00 0.00 60.65 60.46 1qyg s ILE 205 Cb -0.54 -4.04 -0.02 0.00 -1.58 0.00 0.00 42.46 36.29 1qyg s ILE 205 CO 0.56 0.06 -0.11 -0.89 -1.23 0.00 0.00 174.94 173.33 1qyg s THR 206 N 2.10 3.20 -0.07 2.92 2.01 -1.26 -0.67 115.64 123.86 1qyg s THR 206 Ca 0.33 -0.60 0.03 0.00 0.31 0.00 0.00 61.69 61.76 1qyg s THR 206 Cb -0.16 -2.37 0.01 0.00 0.01 0.00 0.00 72.50 69.99 1qyg s THR 206 CO 0.11 0.51 -0.17 -0.54 -0.69 0.00 0.00 174.62 173.84 1qyg s LYS 207 N 0.50 2.13 0.25 4.92 -0.14 -0.83 -5.01 119.74 121.55 1qyg s LYS 207 Ca -0.08 -0.59 -0.14 0.00 -1.36 0.00 0.00 55.97 53.80 1qyg s LYS 207 Cb -0.15 -1.71 -0.00 0.00 -1.68 0.00 0.00 37.83 34.29 1qyg s LYS 207 CO 0.04 0.12 0.50 -1.54 -0.76 0.00 0.00 175.35 173.71 1qyg s SER 208 N 0.44 -0.11 0.29 2.83 1.04 -1.26 -0.71 113.70 116.22 1qyg s SER 208 Ca -0.14 -0.89 -0.10 0.00 0.48 0.00 0.00 55.95 55.31 1qyg s SER 208 Cb -0.16 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.57 1qyg s SER 208 CO 0.05 -1.16 0.50 0.72 0.98 0.00 0.00 173.24 174.34 1qyg s PHE 209 N -4.01 0.57 -0.10 5.02 -0.12 -0.58 -5.00 117.98 113.77 1qyg s PHE 209 Ca 0.21 -0.93 0.03 0.00 -0.05 0.00 0.00 56.93 56.20 1qyg s PHE 209 Cb -0.01 0.16 0.01 0.00 -0.63 0.00 0.00 43.02 42.54 1qyg s PHE 209 CO 0.09 -1.09 -0.21 -0.80 -0.05 0.00 0.00 175.22 173.16 1qyg s ASN 210 N -3.10 2.80 0.28 1.98 0.01 -1.26 -1.75 114.94 113.92 1qyg s ASN 210 Ca 0.25 -0.51 -0.01 0.00 -0.71 0.00 0.00 52.86 51.88 1qyg s ASN 210 Cb -0.01 -1.28 0.48 0.00 0.41 0.00 0.00 41.25 40.85 1qyg s ASN 210 CO 0.13 0.11 1.89 -0.09 -1.51 0.00 0.00 177.10 177.63 1qyg h ARG 211 N 6.94 1.06 -0.14 -0.60 2.43 -1.41 -1.40 114.38 121.26 1qyg h ARG 211 Ca -0.25 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 58.86 1qyg h ARG 211 Cb 1.22 -0.24 0.00 0.00 -0.42 0.00 0.00 29.97 30.53 1qyg h ARG 211 CO 0.49 0.70 0.00 0.41 -1.51 0.00 0.00 179.97 180.06 1qyg n GLY 212 N -1.38 0.04 0.00 2.80 0.00 -1.26 -5.13 105.19 100.26 1qyg n GLY 212 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1qyg n GLY 212 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50