#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qew s SER 2 N 0.00 5.84 0.13 1.61 0.15 -1.26 -3.64 113.70 116.53 1qew s SER 2 Ca 0.00 1.97 -0.07 0.00 0.70 0.00 0.00 55.95 58.55 1qew s SER 2 Cb 0.00 -2.56 -0.01 0.00 -1.71 0.00 0.00 66.02 61.74 1qew s SER 2 CO 0.00 -1.13 0.21 -1.00 1.20 0.00 0.00 173.24 172.52 1qew s HIS 3 N -2.11 0.40 0.11 3.44 4.02 -0.87 -4.99 115.29 115.29 1qew s HIS 3 Ca 0.68 -0.79 -0.18 0.00 1.02 0.00 0.00 55.06 55.78 1qew s HIS 3 Cb -0.19 -0.13 0.04 0.00 -1.02 0.00 0.00 32.58 31.28 1qew s HIS 3 CO 0.30 -0.62 0.45 -1.54 1.02 0.00 0.00 174.74 174.34 1qew s SER 4 N -2.95 -0.32 -0.10 1.40 1.04 -1.26 -1.04 113.70 110.47 1qew s SER 4 Ca 0.14 -0.15 0.02 0.00 0.48 0.00 0.00 55.95 56.44 1qew s SER 4 Cb 0.05 0.49 0.01 0.00 0.10 0.00 0.00 66.02 66.67 1qew s SER 4 CO -0.03 -0.82 -0.14 -0.32 0.98 0.00 0.00 173.24 172.90 1qew s MET 5 N -3.39 2.08 0.01 4.02 -2.45 -0.87 -0.58 119.30 118.12 1qew s MET 5 Ca 0.00 -0.52 0.01 0.00 -1.25 0.00 0.00 55.69 53.93 1qew s MET 5 Cb 0.01 -1.76 -0.01 0.00 1.25 0.00 0.00 34.83 34.32 1qew s MET 5 CO -0.09 -0.04 -0.03 1.03 1.05 0.00 0.00 175.02 176.94 1qew s ARG 6 N 0.91 0.24 -0.05 4.11 0.52 0.50 -2.26 118.95 122.92 1qew s ARG 6 Ca -0.09 -0.22 0.05 0.00 -0.52 0.00 0.00 55.73 54.95 1qew s ARG 6 Cb -0.15 -0.16 -0.02 0.00 0.52 0.00 0.00 34.95 35.14 1qew s ARG 6 CO 0.00 0.04 -0.20 0.71 0.02 0.00 0.00 175.30 175.87 1qew s TYR 7 N -0.38 2.54 -0.11 -0.53 2.02 -0.60 0.16 117.35 120.45 1qew s TYR 7 Ca -0.02 -0.44 0.02 0.00 -0.37 0.00 0.00 57.07 56.25 1qew s TYR 7 Cb -0.03 -1.61 0.01 0.00 -0.40 0.00 0.00 41.96 39.93 1qew s TYR 7 CO -0.00 -0.03 -0.17 -0.06 -1.57 0.00 0.00 175.55 173.71 1qew s PHE 8 N -0.42 2.13 -0.06 2.71 0.40 -0.46 -2.46 117.98 119.81 1qew s PHE 8 Ca 0.04 -0.97 0.04 0.00 -0.60 0.00 0.00 56.93 55.44 1qew s PHE 8 Cb -0.12 -1.50 0.00 0.00 0.51 0.00 0.00 43.02 41.92 1qew s PHE 8 CO 0.02 -0.47 -0.18 -0.06 0.70 0.00 0.00 175.22 175.22 1qew s PHE 9 N 0.81 1.91 -0.05 0.36 0.08 0.19 -1.55 117.98 119.74 1qew s PHE 9 Ca -0.10 -0.64 0.02 0.00 0.12 0.00 0.00 56.93 56.33 1qew s PHE 9 Cb -0.16 -1.30 0.02 0.00 -0.57 0.00 0.00 43.02 41.01 1qew s PHE 9 CO 0.01 -0.25 -0.09 0.99 -0.10 0.00 0.00 175.22 175.78 1qew s THR 10 N 0.21 0.85 -0.10 0.64 2.01 0.10 -0.98 115.64 118.37 1qew s THR 10 Ca -0.09 -0.32 0.00 0.00 0.31 0.00 0.00 61.69 61.59 1qew s THR 10 Cb -0.14 -0.81 0.02 0.00 0.01 0.00 0.00 72.50 71.58 1qew s THR 10 CO 0.04 0.29 -0.08 -0.44 -0.69 0.00 0.00 174.62 173.74 1qew s SER 11 N 0.73 1.97 -0.17 3.53 0.01 -0.15 -0.88 113.70 118.74 1qew s SER 11 Ca -0.13 -0.27 0.01 0.00 1.31 0.00 0.00 55.95 56.87 1qew s SER 11 Cb -0.15 -0.78 0.03 0.00 0.21 0.00 0.00 66.02 65.33 1qew s SER 11 CO 0.02 -0.09 -0.15 -0.69 0.41 0.00 0.00 173.24 172.74 1qew s VAL 12 N 1.46 1.75 0.46 3.43 1.01 -0.22 -1.10 120.40 127.19 1qew s VAL 12 Ca -0.00 -0.81 -0.23 0.00 0.00 0.00 0.00 61.98 60.94 1qew s VAL 12 Cb -0.13 -1.65 -0.07 0.00 0.00 0.00 0.00 36.38 34.52 1qew s VAL 12 CO -0.05 0.43 1.18 -0.94 0.00 0.00 0.00 175.10 175.71 1qew s SER 13 N 1.40 6.15 -0.48 3.32 1.04 -0.78 -0.85 113.70 123.51 1qew s SER 13 Ca 0.04 2.34 0.07 0.00 0.48 0.00 0.00 55.95 58.87 1qew s SER 13 Cb -0.14 -2.61 0.24 0.00 0.10 0.00 0.00 66.02 63.62 1qew s SER 13 CO -0.11 -0.93 0.56 0.54 0.98 0.00 0.00 173.24 174.28 1qew n ARG 14 N -0.46 1.21 -1.58 4.02 1.74 -1.26 -4.30 116.66 116.02 1qew n ARG 14 Ca 0.07 -3.68 -0.53 0.00 -0.77 0.00 0.00 57.85 52.94 1qew n ARG 14 Cb 0.48 -1.60 -0.06 0.00 -1.02 0.00 0.00 32.46 30.26 1qew n ARG 14 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 1qew n PRO 15 N 1.43 0.97 -0.97 5.56 -0.02 -1.26 -0.42 135.00 140.28 1qew n PRO 15 Ca 0.24 0.35 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 1qew n PRO 15 Cb 0.48 -1.97 0.00 0.00 -0.02 0.00 0.00 33.50 31.99 1qew n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1qew n GLY 16 N 2.41 0.54 2.02 -1.23 0.00 -1.26 -4.85 105.19 102.82 1qew n GLY 16 Ca 0.19 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.22 1qew n GLY 16 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1qew n ARG 17 N -2.21 1.06 0.00 1.61 0.63 0.45 -5.14 116.66 113.05 1qew n ARG 17 Ca 0.00 -2.85 0.00 0.00 -0.92 0.00 0.00 57.85 54.08 1qew n ARG 17 Cb 0.06 -0.92 0.00 0.00 0.45 0.00 0.00 32.46 32.05 1qew n ARG 17 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1qew n GLY 18 N -0.15 -1.93 3.68 5.14 0.00 -1.24 -4.90 105.19 105.80 1qew n GLY 18 Ca 0.10 -1.69 -0.31 0.00 0.00 0.00 0.00 46.02 44.12 1qew n GLY 18 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1qew s GLU 19 N -0.00 1.10 0.53 1.61 0.41 -1.26 -4.43 118.70 116.65 1qew s GLU 19 Ca 0.00 1.45 -0.22 0.00 -0.41 0.00 0.00 54.97 55.79 1qew s GLU 19 Cb 0.00 -1.74 -0.05 0.00 -1.78 0.00 0.00 34.13 30.55 1qew s GLU 19 CO 0.00 -2.54 1.28 -2.14 -0.49 0.00 0.00 175.26 171.37 1qew s PRO 20 N -4.68 3.29 0.05 0.39 0.02 -1.26 -4.61 135.00 128.19 1qew s PRO 20 Ca 0.66 2.04 -0.30 0.00 0.02 0.00 0.00 61.00 63.42 1qew s PRO 20 Cb -0.22 -2.25 -0.05 0.00 0.02 0.00 0.00 34.50 32.00 1qew s PRO 20 CO 0.58 -1.01 1.15 0.50 -0.33 0.00 0.00 177.00 177.90 1qew s ARG 21 N -2.90 4.46 -0.15 5.54 6.06 -0.03 -4.80 118.95 127.11 1qew s ARG 21 Ca 0.70 1.70 0.01 0.00 -2.50 0.00 0.00 55.73 55.64 1qew s ARG 21 Cb -0.36 -3.37 0.02 0.00 0.06 0.00 0.00 34.95 31.30 1qew s ARG 21 CO 0.42 -0.22 -0.18 0.12 -2.50 0.00 0.00 175.30 172.94 1qew s PHE 22 N 1.07 2.43 -0.07 5.12 5.36 -1.26 -1.05 117.98 129.58 1qew s PHE 22 Ca 0.57 -1.35 0.03 0.00 -0.96 0.00 0.00 56.93 55.22 1qew s PHE 22 Cb -0.28 -1.72 0.01 0.00 -0.34 0.00 0.00 43.02 40.69 1qew s PHE 22 CO 0.29 -0.69 -0.15 0.42 -1.46 0.00 0.00 175.22 173.64 1qew s ILE 23 N 1.25 1.31 -0.01 3.12 1.01 -0.06 -0.88 121.20 126.94 1qew s ILE 23 Ca 0.02 -0.59 0.03 0.00 0.00 0.00 0.00 60.65 60.11 1qew s ILE 23 Cb -0.14 -1.18 -0.01 0.00 0.01 0.00 0.00 42.46 41.15 1qew s ILE 23 CO -0.09 0.39 -0.10 0.00 0.00 0.00 0.00 174.94 175.15 1qew s ALA 24 N 0.57 0.83 -0.00 9.38 0.00 -0.56 -0.73 121.76 131.26 1qew s ALA 24 Ca -0.15 -0.41 0.00 0.00 0.00 0.00 0.00 51.96 51.40 1qew s ALA 24 Cb -0.16 -0.23 -0.00 0.00 0.00 0.00 0.00 23.12 22.73 1qew s ALA 24 CO 0.05 0.19 -0.01 0.14 0.00 0.00 0.00 175.76 176.13 1qew s VAL 25 N -0.16 0.10 -0.06 0.00 -7.23 -0.60 -1.31 120.40 111.14 1qew s VAL 25 Ca 0.03 -0.07 0.02 0.00 -1.81 0.00 0.00 61.98 60.15 1qew s VAL 25 Cb -0.05 -0.10 -0.03 0.00 0.56 0.00 0.00 36.38 36.77 1qew s VAL 25 CO -0.00 0.02 -0.11 -0.83 -0.31 0.00 0.00 175.10 173.87 1qew s GLY 26 N -0.06 1.61 0.09 2.32 0.00 -0.63 -1.36 107.32 109.29 1qew s GLY 26 Ca 0.00 -0.93 0.05 0.00 0.00 0.00 0.00 44.72 43.84 1qew s GLY 26 CO -0.00 -0.70 -0.13 -0.19 0.00 0.00 0.00 173.10 172.08 1qew s TYR 27 N -0.72 1.23 -0.21 1.90 1.51 0.12 -0.68 117.35 120.51 1qew s TYR 27 Ca 0.11 -0.52 0.01 0.00 -1.01 0.00 0.00 57.07 55.66 1qew s TYR 27 Cb -0.11 -0.68 0.05 0.00 -0.11 0.00 0.00 41.96 41.11 1qew s TYR 27 CO 0.01 0.07 -0.10 0.08 -1.11 0.00 0.00 175.55 174.50 1qew s VAL 28 N -1.68 1.66 0.00 0.71 1.01 -0.51 -0.37 120.40 121.22 1qew s VAL 28 Ca 0.02 -1.07 0.00 0.00 0.00 0.00 0.00 61.98 60.93 1qew s VAL 28 Cb -0.08 -1.76 0.00 0.00 0.00 0.00 0.00 36.38 34.55 1qew s VAL 28 CO 0.02 0.13 0.00 0.47 0.00 0.00 0.00 175.10 175.72 1qew n ASP 29 N 4.67 0.00 -1.75 3.32 8.00 0.25 -0.91 116.55 130.14 1qew n ASP 29 Ca -0.14 0.00 -0.03 0.00 0.71 0.00 0.00 54.79 55.33 1qew n ASP 29 Cb 0.46 0.00 0.29 0.00 -0.02 0.00 0.00 41.12 41.85 1qew n ASP 29 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1qew n ASP 30 N 5.62 4.50 -4.23 -2.24 8.00 -1.26 -4.90 116.55 122.04 1qew n ASP 30 Ca 0.00 -3.24 -0.35 0.00 0.71 0.00 0.00 54.79 51.91 1qew n ASP 30 Cb 0.00 -0.70 -0.14 0.00 -0.02 0.00 0.00 41.12 40.26 1qew n ASP 30 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1qew s THR 31 N -2.99 3.10 0.19 -3.53 2.01 -0.08 -5.02 115.64 109.32 1qew s THR 31 Ca 0.52 -0.99 -0.30 0.00 0.31 0.00 0.00 61.69 61.23 1qew s THR 31 Cb 0.42 -2.60 -0.08 0.00 0.01 0.00 0.00 72.50 70.25 1qew s THR 31 CO 0.12 0.15 1.19 -1.58 -0.69 0.00 0.00 174.62 173.80 1qew s GLN 32 N 1.35 4.50 0.00 4.92 0.74 -1.26 -1.43 119.66 128.49 1qew s GLN 32 Ca 0.00 1.86 0.00 0.00 0.05 0.00 0.00 55.36 57.28 1qew s GLN 32 Cb -0.17 -3.24 0.00 0.00 1.10 0.00 0.00 33.01 30.70 1qew s GLN 32 CO -0.03 -0.06 0.00 1.97 -0.55 0.00 0.00 175.29 176.62 1qew n PHE 33 N 2.41 0.00 -3.90 1.67 -1.74 0.14 -4.04 117.46 112.00 1qew n PHE 33 Ca 0.04 0.00 -0.09 0.00 -0.56 0.00 0.00 57.45 56.84 1qew n PHE 33 Cb 0.45 0.00 -0.07 0.00 1.52 0.00 0.00 39.48 41.37 1qew n PHE 33 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 1qew s VAL 34 N -1.55 0.12 0.05 1.97 -7.23 -1.22 -0.54 120.40 112.01 1qew s VAL 34 Ca 0.00 -1.27 -0.27 0.00 -1.81 0.00 0.00 61.98 58.64 1qew s VAL 34 Cb 0.00 -1.51 0.07 0.00 0.56 0.00 0.00 36.38 35.50 1qew s VAL 34 CO 0.00 -0.55 0.63 0.00 -0.31 0.00 0.00 175.10 174.87 1qew s ARG 35 N -3.90 1.14 -0.12 4.82 1.04 -0.62 -1.60 118.95 119.72 1qew s ARG 35 Ca 0.09 -0.10 -0.07 0.00 -1.04 0.00 0.00 55.73 54.61 1qew s ARG 35 Cb 0.05 0.53 0.05 0.00 -2.04 0.00 0.00 34.95 33.53 1qew s ARG 35 CO -0.08 -0.43 0.29 0.12 -0.04 0.00 0.00 175.30 175.16 1qew s PHE 36 N -2.38 -0.39 -0.20 5.89 5.36 -0.43 -0.23 117.98 125.60 1qew s PHE 36 Ca -0.05 0.89 -0.01 0.00 -0.96 0.00 0.00 56.93 56.80 1qew s PHE 36 Cb -0.00 0.10 0.05 0.00 -0.34 0.00 0.00 43.02 42.83 1qew s PHE 36 CO -0.01 -0.25 -0.03 0.34 -1.46 0.00 0.00 175.22 173.82 1qew s ASP 37 N 1.15 3.28 0.59 6.13 -1.08 -1.26 -1.50 116.67 123.97 1qew s ASP 37 Ca -0.08 -0.92 0.29 0.00 -0.52 0.00 0.00 52.55 51.31 1qew s ASP 37 Cb -0.09 -0.93 1.46 0.00 -1.46 0.00 0.00 42.92 41.90 1qew s ASP 37 CO -0.08 -0.24 1.88 0.77 0.52 0.00 0.00 175.17 178.02 1qew h SER 38 N 8.09 0.00 0.28 -0.34 4.64 -1.40 0.15 113.55 124.97 1qew h SER 38 Ca -0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.13 1qew h SER 38 Cb 1.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 1qew h SER 38 CO 0.39 0.00 -0.22 0.47 -0.87 0.00 0.00 176.83 176.60 1qew n ASP 39 N -3.73 0.86 -4.90 4.97 9.92 -1.26 -4.92 116.55 117.50 1qew n ASP 39 Ca 0.09 -0.78 -0.29 0.00 -0.53 0.00 0.00 54.79 53.28 1qew n ASP 39 Cb 0.71 0.08 0.05 0.00 -0.64 0.00 0.00 41.12 41.32 1qew n ASP 39 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1qew s ALA 40 N -2.51 3.00 0.12 2.24 0.00 0.54 -5.01 121.76 120.14 1qew s ALA 40 Ca 0.25 -0.54 -0.02 0.00 0.00 0.00 0.00 51.96 51.64 1qew s ALA 40 Cb 0.19 -2.86 -0.12 0.00 0.00 0.00 0.00 23.12 20.34 1qew s ALA 40 CO 0.51 -1.14 1.28 0.00 0.00 0.00 0.00 175.76 176.41 1qew h ALA 41 N -0.57 0.34 -0.55 0.00 0.00 -1.91 -3.35 119.26 113.22 1qew h ALA 41 Ca -0.45 -0.76 0.03 0.00 0.00 0.00 0.00 54.91 53.73 1qew h ALA 41 Cb 1.27 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.99 1qew h ALA 41 CO 0.63 0.88 0.32 0.66 0.00 0.00 0.00 179.25 181.74 1qew h SER 42 N 0.16 0.49 -5.32 0.00 4.64 -1.95 -3.46 113.55 108.11 1qew h SER 42 Ca -0.08 0.01 -0.38 0.00 -0.47 0.00 0.00 61.79 60.87 1qew h SER 42 Cb 1.66 -0.09 0.12 0.00 -0.31 0.00 0.00 62.40 63.78 1qew h SER 42 CO 0.16 0.34 -0.63 0.00 -0.87 0.00 0.00 176.83 175.84 1qew n GLN 43 N -4.80 -7.02 -3.84 4.77 1.13 -1.26 -5.00 117.38 101.37 1qew n GLN 43 Ca 0.05 0.80 -0.10 0.00 -1.94 0.00 0.00 57.00 55.80 1qew n GLN 43 Cb 0.10 -5.68 -0.08 0.00 0.11 0.00 0.00 30.24 24.69 1qew n GLN 43 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1qew s ARG 44 N -6.13 0.72 0.09 -1.09 0.52 -1.26 -5.05 118.95 106.74 1qew s ARG 44 Ca 0.51 -0.65 -0.31 0.00 -0.52 0.00 0.00 55.73 54.75 1qew s ARG 44 Cb -0.22 0.30 -0.08 0.00 0.52 0.00 0.00 34.95 35.47 1qew s ARG 44 CO 0.63 -0.21 1.46 1.41 0.02 0.00 0.00 175.30 178.61 1qew s MET 45 N -2.69 4.28 0.06 3.54 -2.45 -1.26 -4.69 119.30 116.08 1qew s MET 45 Ca -0.04 2.14 0.04 0.00 -1.25 0.00 0.00 55.69 56.57 1qew s MET 45 Cb -0.00 -3.36 -0.04 0.00 1.25 0.00 0.00 34.83 32.68 1qew s MET 45 CO -0.05 -0.54 -0.02 -1.21 1.05 0.00 0.00 175.02 174.25 1qew s GLU 46 N 1.63 2.56 0.48 4.11 2.02 0.67 -4.91 118.70 125.27 1qew s GLU 46 Ca 0.67 -0.79 -0.19 0.00 0.02 0.00 0.00 54.97 54.68 1qew s GLU 46 Cb -0.37 -2.54 -0.09 0.00 0.10 0.00 0.00 34.13 31.23 1qew s GLU 46 CO 0.30 0.57 0.99 -1.25 0.02 0.00 0.00 175.26 175.89 1qew s PRO 47 N -1.97 3.94 0.00 0.39 0.04 -1.26 -1.59 135.00 134.56 1qew s PRO 47 Ca 0.22 1.15 0.00 0.00 0.04 0.00 0.00 61.00 62.41 1qew s PRO 47 Cb -0.11 -2.13 0.00 0.00 0.04 0.00 0.00 34.50 32.30 1qew s PRO 47 CO 0.14 -0.28 0.27 0.54 0.04 0.00 0.00 177.00 177.70 1qew n ARG 48 N -1.13 0.03 -4.00 4.56 5.12 0.30 -4.85 116.66 116.69 1qew n ARG 48 Ca 0.08 -0.28 -0.14 0.00 -1.93 0.00 0.00 57.85 55.58 1qew n ARG 48 Cb 0.53 -0.51 -0.14 0.00 -1.16 0.00 0.00 32.46 31.18 1qew n ARG 48 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1qew s ALA 49 N -0.01 0.20 0.17 7.54 0.00 -1.24 -4.69 121.76 123.72 1qew s ALA 49 Ca 0.00 -0.12 -0.17 0.00 0.00 0.00 0.00 51.96 51.67 1qew s ALA 49 Cb 0.00 -0.05 0.09 0.00 0.00 0.00 0.00 23.12 23.17 1qew s ALA 49 CO 0.00 0.04 1.66 -1.35 0.00 0.00 0.00 175.76 176.12 1qew h PRO 50 N 6.05 -0.02 0.00 0.00 0.11 -1.95 -2.64 132.00 133.56 1qew h PRO 50 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1qew h PRO 50 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1qew h PRO 50 CO 0.50 -0.01 0.00 0.11 -0.21 0.00 0.00 178.00 178.39 1qew h TRP 51 N -0.02 0.00 0.00 0.65 5.08 -1.98 -2.27 115.95 117.42 1qew h TRP 51 Ca 0.19 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.16 1qew h TRP 51 Cb 0.31 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.47 1qew h TRP 51 CO -0.36 0.00 -0.42 0.97 -1.28 0.00 0.00 178.44 177.35 1qew h ILE 52 N 0.00 0.00 0.00 0.12 6.09 -1.82 -3.25 117.51 118.65 1qew h ILE 52 Ca 0.00 -0.67 0.00 0.00 -1.37 0.00 0.00 64.86 62.82 1qew h ILE 52 Cb 0.11 1.42 0.00 0.00 0.47 0.00 0.00 36.82 38.83 1qew h ILE 52 CO 0.00 0.00 0.00 -0.62 -3.07 0.00 0.00 178.15 174.46 1qew n GLU 53 N -2.44 0.06 -0.03 2.19 1.02 -0.85 -2.02 120.64 118.57 1qew n GLU 53 Ca 0.03 0.34 -0.04 0.00 -0.02 0.00 0.00 57.16 57.48 1qew n GLU 53 Cb 0.47 -1.62 0.18 0.00 -0.02 0.00 0.00 31.44 30.45 1qew n GLU 53 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 1qew h GLN 54 N 0.00 0.61 -6.55 3.49 4.20 -1.72 -3.44 115.11 111.70 1qew h GLN 54 Ca 0.00 -0.21 -0.60 0.00 0.06 0.00 0.00 58.65 57.91 1qew h GLN 54 Cb 0.24 -0.05 0.09 0.00 0.30 0.00 0.00 27.48 28.06 1qew h GLN 54 CO 0.00 0.75 0.41 0.39 -0.67 0.00 0.00 178.83 179.71 1qew n GLU 55 N -4.16 1.73 -1.81 1.46 -0.58 -0.86 -4.98 120.64 111.45 1qew n GLU 55 Ca 0.01 0.61 -0.29 0.00 -0.42 0.00 0.00 57.16 57.06 1qew n GLU 55 Cb 0.37 -2.16 0.21 0.00 -0.57 0.00 0.00 31.44 29.29 1qew n GLU 55 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1qew n GLY 56 N 1.63 -1.64 0.37 0.62 0.00 -1.26 -4.85 105.19 100.06 1qew n GLY 56 Ca 0.10 -1.69 0.08 0.00 0.00 0.00 0.00 46.02 44.51 1qew n GLY 56 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1qew h PRO 57 N 0.00 0.91 -0.47 1.61 0.11 -1.98 -1.92 132.00 130.25 1qew h PRO 57 Ca -0.43 -0.05 0.03 0.00 0.11 0.00 0.00 66.00 65.65 1qew h PRO 57 Cb 1.19 -0.20 -0.03 0.00 0.11 0.00 0.00 31.00 32.06 1qew h PRO 57 CO 0.30 0.60 0.27 1.49 -0.21 0.00 0.00 178.00 180.44 1qew h GLU 58 N 0.93 0.52 0.27 1.05 4.81 -1.99 -0.60 114.58 119.56 1qew h GLU 58 Ca 0.47 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.68 1qew h GLU 58 Cb 0.50 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.74 1qew h GLU 58 CO -0.24 0.34 -0.31 -0.92 -0.73 0.00 0.00 179.01 177.15 1qew h TYR 59 N 0.53 -0.85 -0.80 0.92 3.20 -1.71 -0.46 116.97 117.81 1qew h TYR 59 Ca 0.19 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.06 1qew h TYR 59 Cb 0.04 0.34 -0.04 0.00 1.54 0.00 0.00 36.73 38.61 1qew h TYR 59 CO -0.08 -0.44 0.45 -1.49 -1.64 0.00 0.00 178.16 174.97 1qew h TRP 60 N -0.63 1.07 -0.46 -3.82 4.06 -1.27 0.14 115.95 115.05 1qew h TRP 60 Ca -0.00 -0.01 -0.12 0.00 2.06 0.00 0.00 58.89 60.81 1qew h TRP 60 Cb 0.59 -0.35 -0.01 0.00 -1.00 0.00 0.00 29.16 28.39 1qew h TRP 60 CO -0.21 0.73 -0.19 -0.44 -3.56 0.00 0.00 178.44 174.77 1qew h ASP 61 N 1.11 0.92 0.17 -3.49 3.32 -0.99 -0.83 116.42 116.63 1qew h ASP 61 Ca 0.28 -0.33 -0.01 0.00 0.02 0.00 0.00 57.03 57.00 1qew h ASP 61 Cb -0.00 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.30 1qew h ASP 61 CO -0.05 1.09 -0.08 1.23 -1.72 0.00 0.00 179.24 179.71 1qew h GLY 62 N 0.93 -0.24 1.07 2.75 0.00 -0.34 -1.11 103.07 106.13 1qew h GLY 62 Ca 0.11 0.09 -0.01 0.00 0.00 0.00 0.00 47.33 47.52 1qew h GLY 62 CO 0.06 -0.09 0.53 0.83 0.00 0.00 0.00 176.54 177.87 1qew h GLU 63 N -0.46 1.23 -0.01 4.80 4.39 -0.74 -1.53 114.58 122.26 1qew h GLU 63 Ca -0.02 -0.12 -0.00 0.00 0.34 0.00 0.00 59.36 59.56 1qew h GLU 63 Cb 0.35 -0.25 -0.00 0.00 -0.10 0.00 0.00 28.75 28.75 1qew h GLU 63 CO 0.04 0.87 0.01 1.15 -1.16 0.00 0.00 179.01 179.92 1qew h THR 64 N 1.24 1.06 -0.59 1.13 2.02 -1.07 0.16 112.91 116.85 1qew h THR 64 Ca 0.32 -0.17 0.06 0.00 0.77 0.00 0.00 66.41 67.39 1qew h THR 64 Cb -0.03 1.15 -0.05 0.00 -1.74 0.00 0.00 68.15 67.47 1qew h THR 64 CO -0.06 0.05 0.30 -0.09 0.37 0.00 0.00 175.52 176.09 1qew h ARG 65 N -0.05 0.55 -0.28 6.66 2.43 -0.91 -0.90 114.38 121.88 1qew h ARG 65 Ca 0.00 -0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 58.99 1qew h ARG 65 Cb 0.07 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 29.49 1qew h ARG 65 CO -0.00 0.36 -0.41 0.87 -1.51 0.00 0.00 179.97 179.28 1qew h LYS 66 N 0.56 0.77 -0.54 0.20 1.57 -1.04 -1.88 116.57 116.21 1qew h LYS 66 Ca 0.27 -0.45 -0.06 0.00 -1.87 0.00 0.00 60.65 58.53 1qew h LYS 66 Cb 0.19 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.52 1qew h LYS 66 CO -0.19 1.08 0.07 -0.24 -0.57 0.00 0.00 179.45 179.60 1qew h VAL 67 N 0.52 1.24 -0.50 0.50 3.04 -0.46 0.28 116.25 120.87 1qew h VAL 67 Ca 0.03 -0.93 -0.09 0.00 -1.01 0.00 0.00 66.70 64.69 1qew h VAL 67 Cb 1.01 0.75 -0.02 0.00 -2.01 0.00 0.00 31.29 31.02 1qew h VAL 67 CO 0.09 0.34 -0.07 0.11 -1.01 0.00 0.00 177.57 177.04 1qew h LYS 68 N 0.81 0.89 -0.32 4.17 1.57 -1.13 -1.33 116.57 121.23 1qew h LYS 68 Ca 0.17 -0.29 -0.09 0.00 -1.87 0.00 0.00 60.65 58.57 1qew h LYS 68 Cb 0.39 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.60 1qew h LYS 68 CO 0.01 0.93 -0.18 0.00 -0.57 0.00 0.00 179.45 179.64 1qew h ALA 69 N 1.11 1.08 -0.76 3.86 0.00 -0.74 -1.33 119.26 122.48 1qew h ALA 69 Ca 0.14 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 1qew h ALA 69 Cb 0.58 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 1qew h ALA 69 CO 0.04 0.56 0.26 0.45 0.00 0.00 0.00 179.25 180.56 1qew h HIS 70 N 0.53 1.20 0.11 0.00 3.86 -0.53 -1.32 115.15 119.01 1qew h HIS 70 Ca 0.09 -0.11 0.01 0.00 -1.16 0.00 0.00 60.37 59.19 1qew h HIS 70 Cb 0.61 -0.35 -0.01 0.00 1.06 0.00 0.00 27.41 28.72 1qew h HIS 70 CO 0.02 0.93 -0.13 1.03 0.86 0.00 0.00 177.93 180.65 1qew h SER 71 N 1.13 -0.34 -0.77 2.45 0.87 -0.48 -1.60 113.55 114.81 1qew h SER 71 Ca 0.25 0.04 0.04 0.00 -1.23 0.00 0.00 61.79 60.88 1qew h SER 71 Cb 0.28 0.12 -0.05 0.00 -0.44 0.00 0.00 62.40 62.31 1qew h SER 71 CO -0.01 -0.19 0.48 1.56 -0.53 0.00 0.00 176.83 178.14 1qew h GLN 72 N -0.27 0.91 -0.41 2.24 1.08 -1.03 -1.33 115.11 116.30 1qew h GLN 72 Ca 0.01 -0.05 0.02 0.00 -1.45 0.00 0.00 58.65 57.18 1qew h GLN 72 Cb 0.27 -0.21 -0.03 0.00 -0.05 0.00 0.00 27.48 27.46 1qew h GLN 72 CO -0.04 0.60 0.23 1.15 -0.95 0.00 0.00 178.83 179.82 1qew h THR 73 N 0.94 1.02 0.00 -0.54 2.02 -0.95 -2.10 112.91 113.29 1qew h THR 73 Ca 0.31 -0.16 -0.08 0.00 0.77 0.00 0.00 66.41 67.25 1qew h THR 73 Cb 0.04 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 66.95 1qew h THR 73 CO -0.12 0.08 -0.40 0.45 0.37 0.00 0.00 175.52 175.91 1qew h HIS 74 N 0.47 0.00 -0.23 3.16 3.86 -0.81 -0.49 115.15 121.11 1qew h HIS 74 Ca 0.17 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.37 1qew h HIS 74 Cb 0.03 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.49 1qew h HIS 74 CO -0.08 0.40 0.09 0.00 0.86 0.00 0.00 177.93 179.20 1qew h ARG 75 N 0.00 0.34 -0.41 2.45 3.08 -0.64 -1.47 114.38 117.73 1qew h ARG 75 Ca -0.00 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 59.97 1qew h ARG 75 Cb 0.78 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.76 1qew h ARG 75 CO 0.05 0.39 0.19 0.28 -1.07 0.00 0.00 179.97 179.81 1qew h VAL 76 N 0.22 1.18 -0.40 2.04 2.07 -1.15 -2.99 116.25 117.21 1qew h VAL 76 Ca 0.08 -0.53 0.08 0.00 0.82 0.00 0.00 66.70 67.15 1qew h VAL 76 Cb 0.17 0.78 -0.08 0.00 -1.52 0.00 0.00 31.29 30.64 1qew h VAL 76 CO -0.01 0.20 -0.11 0.44 0.02 0.00 0.00 177.57 178.11 1qew h ASP 77 N 0.52 -0.41 -0.66 0.57 3.32 -0.76 -1.45 116.42 117.54 1qew h ASP 77 Ca 0.14 0.13 0.14 0.00 0.02 0.00 0.00 57.03 57.46 1qew h ASP 77 Cb 0.14 0.26 -0.11 0.00 0.22 0.00 0.00 39.33 39.84 1qew h ASP 77 CO -0.02 -0.15 -0.00 -0.07 -1.72 0.00 0.00 179.24 177.28 1qew h LEU 78 N -0.02 -0.31 -0.48 1.55 3.38 -1.12 0.30 115.31 118.61 1qew h LEU 78 Ca 0.20 0.17 -0.11 0.00 0.09 0.00 0.00 57.88 58.23 1qew h LEU 78 Cb 0.31 0.30 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 1qew h LEU 78 CO -0.43 -0.14 -0.11 1.23 0.09 0.00 0.00 178.44 179.09 1qew h GLY 79 N 0.11 1.00 1.00 0.83 0.00 -1.41 -2.51 103.07 102.08 1qew h GLY 79 Ca 0.35 -0.82 0.00 0.00 0.00 0.00 0.00 47.33 46.86 1qew h GLY 79 CO -0.58 0.75 0.28 -0.84 0.00 0.00 0.00 176.54 176.15 1qew h THR 80 N 0.77 1.12 -0.74 4.70 2.02 -0.10 -2.77 112.91 117.91 1qew h THR 80 Ca 0.12 -0.24 -0.02 0.00 0.77 0.00 0.00 66.41 67.04 1qew h THR 80 Cb 0.66 0.50 -0.04 0.00 -1.74 0.00 0.00 68.15 67.54 1qew h THR 80 CO 0.05 0.12 0.38 -0.07 0.37 0.00 0.00 175.52 176.36 1qew h LEU 81 N 0.59 0.94 -0.90 2.58 3.38 -0.38 -1.32 115.31 120.19 1qew h LEU 81 Ca 0.16 -0.09 0.01 0.00 0.09 0.00 0.00 57.88 58.05 1qew h LEU 81 Cb -0.05 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.42 1qew h LEU 81 CO -0.03 0.78 0.59 0.03 0.09 0.00 0.00 178.44 179.90 1qew h ARG 82 N 1.04 1.16 -0.23 1.13 3.08 -1.18 -0.80 114.38 118.58 1qew h ARG 82 Ca 0.26 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 60.22 1qew h ARG 82 Cb 0.07 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 29.85 1qew h ARG 82 CO -0.04 0.77 0.08 0.78 -1.07 0.00 0.00 179.97 180.49 1qew h GLY 83 N 1.20 0.38 0.50 0.04 0.00 -1.17 0.23 103.07 104.25 1qew h GLY 83 Ca 0.34 -0.23 0.11 0.00 0.00 0.00 0.00 47.33 47.55 1qew h GLY 83 CO -0.08 0.21 0.59 -0.97 0.00 0.00 0.00 176.54 176.29 1qew h TYR 84 N 0.21 1.07 -0.45 5.60 -1.99 -0.65 -0.83 116.97 119.93 1qew h TYR 84 Ca 0.08 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.84 1qew h TYR 84 Cb 0.23 -0.34 0.00 0.00 2.00 0.00 0.00 36.73 38.62 1qew h TYR 84 CO 0.00 0.44 0.00 0.66 -0.00 0.00 0.00 178.16 179.26 1qew n TYR 85 N -4.65 0.59 -3.81 4.88 4.01 -0.36 -4.86 117.16 112.96 1qew n TYR 85 Ca 0.17 -0.30 -0.26 0.00 -0.16 0.00 0.00 57.90 57.35 1qew n TYR 85 Cb 0.32 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.36 1qew n TYR 85 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1qew n ASN 86 N 1.05 -2.03 -4.76 7.72 5.03 0.31 -4.97 115.26 117.60 1qew n ASN 86 Ca 0.18 -0.97 -0.25 0.00 0.87 0.00 0.00 54.58 54.41 1qew n ASN 86 Cb 0.47 -3.38 -0.06 0.00 -1.02 0.00 0.00 39.78 35.79 1qew n ASN 86 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 1qew s GLN 87 N -6.24 2.73 0.80 3.52 -0.21 0.56 -5.02 119.66 115.79 1qew s GLN 87 Ca 0.15 -1.03 -0.12 0.00 0.02 0.00 0.00 55.36 54.38 1qew s GLN 87 Cb -0.05 -2.51 0.08 0.00 1.00 0.00 0.00 33.01 31.52 1qew s GLN 87 CO 0.86 0.44 1.17 -1.54 -2.12 0.00 0.00 175.29 174.10 1qew s SER 88 N -3.32 4.56 0.00 5.90 1.04 -1.26 -4.68 113.70 115.94 1qew s SER 88 Ca 0.31 0.78 0.17 0.00 0.48 0.00 0.00 55.95 57.69 1qew s SER 88 Cb -0.09 -1.29 0.61 0.00 0.10 0.00 0.00 66.02 65.35 1qew s SER 88 CO 0.22 -1.86 1.46 -0.62 0.98 0.00 0.00 173.24 173.41 1qew n GLU 89 N -3.28 1.73 0.04 4.02 -0.58 -1.26 -4.33 120.64 116.98 1qew n GLU 89 Ca 0.08 -1.11 -0.20 0.00 -0.42 0.00 0.00 57.16 55.51 1qew n GLU 89 Cb 0.61 -1.35 -0.11 0.00 -0.57 0.00 0.00 31.44 30.02 1qew n GLU 89 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1qew h ALA 90 N 3.90 0.11 -2.20 0.62 0.00 -2.01 -3.46 119.26 116.22 1qew h ALA 90 Ca 0.00 -0.69 -0.46 0.00 0.00 0.00 0.00 54.91 53.75 1qew h ALA 90 Cb 0.46 0.06 0.06 0.00 0.00 0.00 0.00 17.79 18.37 1qew h ALA 90 CO 0.00 0.66 0.13 0.20 0.00 0.00 0.00 179.25 180.24 1qew s GLY 91 N -4.29 1.66 0.05 0.00 0.00 -1.26 -4.85 107.32 98.62 1qew s GLY 91 Ca -0.10 -0.89 -0.17 0.00 0.00 0.00 0.00 44.72 43.56 1qew s GLY 91 CO 0.92 -0.58 0.50 -0.45 0.00 0.00 0.00 173.10 173.48 1qew s SER 92 N -4.37 6.94 0.07 1.64 0.15 -1.26 -4.78 113.70 112.09 1qew s SER 92 Ca 0.56 1.12 0.03 0.00 0.70 0.00 0.00 55.95 58.36 1qew s SER 92 Cb -0.10 -2.31 -0.03 0.00 -1.71 0.00 0.00 66.02 61.87 1qew s SER 92 CO 0.43 0.29 -0.09 -1.00 1.20 0.00 0.00 173.24 174.07 1qew s HIS 93 N -1.12 0.89 -0.04 3.44 4.02 -1.26 -4.97 115.29 116.25 1qew s HIS 93 Ca 0.27 -0.59 0.07 0.00 1.02 0.00 0.00 55.06 55.83 1qew s HIS 93 Cb -0.18 -0.51 -0.02 0.00 -1.02 0.00 0.00 32.58 30.85 1qew s HIS 93 CO 0.17 -0.05 -0.24 0.99 1.02 0.00 0.00 174.74 176.63 1qew s THR 94 N -1.96 2.19 -0.10 1.30 2.01 -1.26 -1.87 115.64 115.95 1qew s THR 94 Ca -0.02 -1.04 0.04 0.00 0.31 0.00 0.00 61.69 60.99 1qew s THR 94 Cb -0.06 -1.78 -0.00 0.00 0.01 0.00 0.00 72.50 70.67 1qew s THR 94 CO -0.00 0.58 -0.24 -0.69 -0.69 0.00 0.00 174.62 173.58 1qew s VAL 95 N -0.44 2.07 0.02 3.82 1.01 -0.26 0.11 120.40 126.73 1qew s VAL 95 Ca 0.05 -1.02 0.04 0.00 0.00 0.00 0.00 61.98 61.05 1qew s VAL 95 Cb -0.12 -1.78 -0.02 0.00 0.00 0.00 0.00 36.38 34.47 1qew s VAL 95 CO 0.01 0.56 -0.14 -1.10 0.00 0.00 0.00 175.10 174.43 1qew s GLN 96 N 0.29 0.99 -0.01 2.72 -0.21 -0.65 -0.98 119.66 121.81 1qew s GLN 96 Ca -0.17 -0.63 0.02 0.00 0.02 0.00 0.00 55.36 54.59 1qew s GLN 96 Cb -0.18 -0.98 -0.00 0.00 1.00 0.00 0.00 33.01 32.85 1qew s GLN 96 CO 0.08 0.25 -0.05 0.50 -2.12 0.00 0.00 175.29 173.96 1qew s ARG 97 N -0.77 0.46 -0.08 2.91 3.52 -0.15 -1.16 118.95 123.69 1qew s ARG 97 Ca 0.03 -0.18 -0.03 0.00 -0.13 0.00 0.00 55.73 55.42 1qew s ARG 97 Cb -0.07 -0.46 0.04 0.00 -1.56 0.00 0.00 34.95 32.91 1qew s ARG 97 CO 0.00 0.09 0.17 1.41 -0.81 0.00 0.00 175.30 176.16 1qew s MET 98 N -0.00 0.11 0.07 5.12 1.75 -0.53 -0.63 119.30 125.18 1qew s MET 98 Ca 0.01 0.42 -0.14 0.00 -1.25 0.00 0.00 55.69 54.72 1qew s MET 98 Cb -0.04 -0.17 0.02 0.00 2.84 0.00 0.00 34.83 37.48 1qew s MET 98 CO -0.00 -0.18 0.34 1.52 -0.65 0.00 0.00 175.02 176.04 1qew s TYR 99 N 1.30 -0.13 -1.80 4.11 -0.85 -1.03 0.39 117.35 119.35 1qew s TYR 99 Ca -0.08 -0.08 0.00 0.00 -0.52 0.00 0.00 57.07 56.39 1qew s TYR 99 Cb -0.11 0.14 0.00 0.00 0.38 0.00 0.00 41.96 42.37 1qew s TYR 99 CO -0.06 -0.58 0.00 0.41 -1.52 0.00 0.00 175.55 173.80 1qew n GLY 100 N 0.25 -1.31 3.05 5.49 0.00 -0.47 -1.56 105.19 110.64 1qew n GLY 100 Ca -0.17 -0.96 -0.08 0.00 0.00 0.00 0.00 46.02 44.81 1qew n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qew s ASP 102 N -2.41 2.56 0.17 0.00 1.01 0.21 -2.04 116.67 116.16 1qew s ASP 102 Ca -0.01 -0.53 0.09 0.00 0.71 0.00 0.00 52.55 52.81 1qew s ASP 102 Cb 0.02 -0.22 -0.04 0.00 1.01 0.00 0.00 42.92 43.69 1qew s ASP 102 CO -0.07 0.17 -0.18 0.68 0.21 0.00 0.00 175.17 175.98 1qew s VAL 103 N -0.80 1.83 0.00 -1.27 -7.23 -0.21 0.17 120.40 112.89 1qew s VAL 103 Ca 0.08 -1.95 0.00 0.00 -1.81 0.00 0.00 61.98 58.30 1qew s VAL 103 Cb -0.09 -1.87 0.00 0.00 0.56 0.00 0.00 36.38 34.98 1qew s VAL 103 CO 0.02 -0.34 0.00 0.61 -0.31 0.00 0.00 175.10 175.08 1qew n GLY 104 N 0.21 -0.49 0.32 2.32 0.00 -0.47 -2.06 105.19 105.02 1qew n GLY 104 Ca -0.13 -1.76 0.21 0.00 0.00 0.00 0.00 46.02 44.35 1qew n GLY 104 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1qew h SER 105 N 0.00 0.00 0.04 1.61 0.02 -1.91 0.29 113.55 113.60 1qew h SER 105 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1qew h SER 105 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1qew h SER 105 CO 0.00 0.00 -0.07 -0.90 -1.14 0.00 0.00 176.83 174.72 1qew n ASP 106 N -3.05 1.56 -1.56 3.07 5.68 -1.26 -4.94 116.55 116.05 1qew n ASP 106 Ca -0.02 -1.41 -0.14 0.00 -0.50 0.00 0.00 54.79 52.72 1qew n ASP 106 Cb 0.13 0.05 -0.01 0.00 -1.14 0.00 0.00 41.12 40.15 1qew n ASP 106 CO 0.00 0.00 0.00 0.79 -1.33 0.00 0.00 177.20 176.66 1qew n TRP 107 N 0.10 -0.63 -4.09 2.11 7.02 0.10 -5.02 117.44 117.02 1qew n TRP 107 Ca 0.17 0.00 -0.28 0.00 -1.02 0.00 0.00 57.50 56.36 1qew n TRP 107 Cb 0.38 -2.95 -0.06 0.00 -2.42 0.00 0.00 31.31 26.25 1qew n TRP 107 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 1qew s ARG 108 N -4.64 2.77 0.10 -0.99 1.81 -1.26 -4.78 118.95 111.97 1qew s ARG 108 Ca 0.00 -0.83 -0.36 0.00 -1.72 0.00 0.00 55.73 52.83 1qew s ARG 108 Cb 0.00 -2.62 -0.17 0.00 -0.45 0.00 0.00 34.95 31.70 1qew s ARG 108 CO 0.00 0.52 1.14 0.34 -0.68 0.00 0.00 175.30 176.62 1qew n PHE 109 N 0.12 1.02 -0.02 -0.53 7.35 -1.26 -1.36 117.46 122.78 1qew n PHE 109 Ca -0.09 0.80 -0.04 0.00 -0.76 0.00 0.00 57.45 57.37 1qew n PHE 109 Cb 0.53 -2.21 -0.01 0.00 0.35 0.00 0.00 39.48 38.14 1qew n PHE 109 CO 0.00 0.00 0.00 -0.11 -0.76 0.00 0.00 176.76 175.89 1qew n LEU 110 N 2.02 0.25 -3.49 -2.13 7.94 0.13 -4.73 117.00 116.98 1qew n LEU 110 Ca 0.18 0.04 -0.09 0.00 -1.11 0.00 0.00 56.01 55.03 1qew n LEU 110 Cb 0.18 -0.10 -0.02 0.00 0.53 0.00 0.00 43.42 44.01 1qew n LEU 110 CO 0.61 0.06 0.60 0.00 -1.11 0.00 0.00 177.39 177.55 1qew s ARG 111 N -2.06 0.98 0.09 1.96 1.70 -1.06 -4.98 118.95 115.58 1qew s ARG 111 Ca -0.05 -0.37 0.05 0.00 -0.47 0.00 0.00 55.73 54.89 1qew s ARG 111 Cb 0.02 0.44 -0.03 0.00 -0.57 0.00 0.00 34.95 34.81 1qew s ARG 111 CO 0.06 -0.43 -0.13 0.20 -1.08 0.00 0.00 175.30 173.92 1qew s GLY 112 N -2.58 0.91 0.04 3.88 0.00 -1.26 -0.62 107.32 107.69 1qew s GLY 112 Ca 0.04 -1.14 -0.01 0.00 0.00 0.00 0.00 44.72 43.62 1qew s GLY 112 CO -0.10 -1.19 -0.03 -0.19 0.00 0.00 0.00 173.10 171.60 1qew s TYR 113 N -1.88 0.43 -0.32 1.90 1.51 -0.04 -4.82 117.35 114.13 1qew s TYR 113 Ca 0.03 -0.85 0.00 0.00 -1.01 0.00 0.00 57.07 55.24 1qew s TYR 113 Cb -0.06 -0.31 0.19 0.00 -0.11 0.00 0.00 41.96 41.66 1qew s TYR 113 CO 0.02 -0.30 0.77 -1.58 -1.11 0.00 0.00 175.55 173.35 1qew s HIS 114 N -2.93 -1.31 0.15 2.71 2.46 -1.25 -1.37 115.29 113.74 1qew s HIS 114 Ca -0.02 0.62 0.08 0.00 0.47 0.00 0.00 55.06 56.21 1qew s HIS 114 Cb 0.01 0.23 -0.04 0.00 -0.13 0.00 0.00 32.58 32.65 1qew s HIS 114 CO -0.06 -0.80 -0.08 -0.65 -2.47 0.00 0.00 174.74 170.68 1qew s GLN 115 N 2.61 2.17 -0.02 2.88 -0.21 0.16 -1.68 119.66 125.58 1qew s GLN 115 Ca 0.16 -1.13 0.01 0.00 0.02 0.00 0.00 55.36 54.43 1qew s GLN 115 Cb -0.05 -2.27 0.01 0.00 1.00 0.00 0.00 33.01 31.70 1qew s GLN 115 CO -0.21 0.47 -0.02 -0.47 -2.12 0.00 0.00 175.29 172.94 1qew s TYR 116 N -1.50 0.38 0.06 0.91 6.14 0.84 -1.46 117.35 122.73 1qew s TYR 116 Ca 0.24 -0.06 0.04 0.00 0.64 0.00 0.00 57.07 57.93 1qew s TYR 116 Cb -0.10 -0.35 -0.03 0.00 0.42 0.00 0.00 41.96 41.90 1qew s TYR 116 CO 0.15 -0.08 -0.12 0.00 0.64 0.00 0.00 175.55 176.15 1qew s ALA 117 N 0.46 0.97 -0.09 3.97 0.00 -0.31 -0.38 121.76 126.38 1qew s ALA 117 Ca -0.05 -0.93 0.03 0.00 0.00 0.00 0.00 51.96 51.02 1qew s ALA 117 Cb -0.08 -0.05 0.00 0.00 0.00 0.00 0.00 23.12 23.00 1qew s ALA 117 CO -0.01 0.10 -0.20 -0.47 0.00 0.00 0.00 175.76 175.18 1qew s TYR 118 N -1.34 2.18 -1.67 0.00 5.04 -0.41 -1.64 117.35 119.50 1qew s TYR 118 Ca -0.04 -0.87 -0.14 0.00 -2.44 0.00 0.00 57.07 53.58 1qew s TYR 118 Cb -0.10 -1.49 0.13 0.00 0.35 0.00 0.00 41.96 40.85 1qew s TYR 118 CO 0.02 -0.37 0.58 -0.25 -1.34 0.00 0.00 175.55 174.18 1qew n ASP 119 N 3.62 -1.90 -0.01 4.32 8.00 0.12 -1.61 116.55 129.08 1qew n ASP 119 Ca -0.20 -1.10 -0.00 0.00 0.71 0.00 0.00 54.79 54.20 1qew n ASP 119 Cb 0.53 -2.42 -0.00 0.00 -0.02 0.00 0.00 41.12 39.21 1qew n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1qew n GLY 120 N -1.59 0.47 3.26 0.44 0.00 -1.26 -4.98 105.19 101.51 1qew n GLY 120 Ca -0.04 -0.34 -0.16 0.00 0.00 0.00 0.00 46.02 45.49 1qew n GLY 120 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qew s LYS 121 N -0.67 1.08 0.24 1.61 1.02 -0.64 -5.11 119.74 117.27 1qew s LYS 121 Ca 0.00 -1.40 -0.31 0.00 0.02 0.00 0.00 55.97 54.28 1qew s LYS 121 Cb 0.00 -0.77 -0.11 0.00 -0.52 0.00 0.00 37.83 36.43 1qew s LYS 121 CO 0.00 0.12 1.58 -0.51 -0.92 0.00 0.00 175.35 175.62 1qew s ASP 122 N -2.96 6.48 -0.03 2.83 1.01 -1.26 -1.29 116.67 121.46 1qew s ASP 122 Ca 0.15 2.80 -0.07 0.00 0.71 0.00 0.00 52.55 56.13 1qew s ASP 122 Cb -0.00 -2.62 -0.02 0.00 1.01 0.00 0.00 42.92 41.29 1qew s ASP 122 CO 0.02 -0.86 -0.14 0.00 0.21 0.00 0.00 175.17 174.40 1qew n TYR 123 N 2.99 0.00 -3.79 4.23 9.36 0.49 -4.64 117.16 125.81 1qew n TYR 123 Ca 0.11 0.00 -0.13 0.00 3.32 0.00 0.00 57.90 61.20 1qew n TYR 123 Cb 0.38 -0.20 -0.10 0.00 -0.63 0.00 0.00 39.34 38.79 1qew n TYR 123 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 1qew s ILE 124 N -2.21 0.05 -0.10 2.97 2.07 -0.83 -2.59 121.20 120.55 1qew s ILE 124 Ca -0.12 -0.39 -0.10 0.00 -1.41 0.00 0.00 60.65 58.64 1qew s ILE 124 Cb 0.02 -0.51 0.03 0.00 0.13 0.00 0.00 42.46 42.12 1qew s ILE 124 CO 0.17 -0.21 0.28 0.00 -1.91 0.00 0.00 174.94 173.27 1qew s ALA 125 N -0.91 -0.68 0.10 1.50 0.00 -0.60 -0.11 121.76 121.05 1qew s ALA 125 Ca -0.10 0.74 -0.30 0.00 0.00 0.00 0.00 51.96 52.30 1qew s ALA 125 Cb -0.05 -0.42 -0.06 0.00 0.00 0.00 0.00 23.12 22.59 1qew s ALA 125 CO 0.03 -0.14 1.12 -1.17 0.00 0.00 0.00 175.76 175.60 1qew s LEU 126 N 0.04 4.42 0.76 0.00 2.96 -0.68 -0.82 118.68 125.36 1qew s LEU 126 Ca -0.01 2.00 -0.12 0.00 -0.22 0.00 0.00 54.13 55.78 1qew s LEU 126 Cb -0.02 -3.59 0.05 0.00 0.50 0.00 0.00 46.19 43.13 1qew s LEU 126 CO 0.01 -0.33 1.10 -0.54 -1.32 0.00 0.00 176.35 175.26 1qew s LYS 127 N 0.44 2.30 0.51 1.98 1.02 0.13 -4.68 119.74 121.45 1qew s LYS 127 Ca 0.54 1.25 0.23 0.00 0.02 0.00 0.00 55.97 58.01 1qew s LYS 127 Cb -0.28 -1.90 1.33 0.00 -0.52 0.00 0.00 37.83 36.46 1qew s LYS 127 CO 0.31 -1.62 2.00 1.49 -0.92 0.00 0.00 175.35 176.61 1qew h GLU 128 N -0.90 0.07 0.00 1.68 4.81 -1.88 0.28 114.58 118.63 1qew h GLU 128 Ca -0.44 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.78 1qew h GLU 128 Cb 1.24 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.60 1qew h GLU 128 CO 0.51 0.04 0.00 -0.40 -0.73 0.00 0.00 179.01 178.44 1qew n ASP 129 N -4.40 0.00 -2.54 1.04 5.68 -1.26 -4.77 116.55 110.29 1qew n ASP 129 Ca 0.09 -0.17 -0.17 0.00 -0.50 0.00 0.00 54.79 54.05 1qew n ASP 129 Cb 0.55 -0.20 -0.00 0.00 -1.14 0.00 0.00 41.12 40.33 1qew n ASP 129 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1qew n LEU 130 N -1.20 -1.63 0.00 -2.12 4.77 0.97 -4.79 117.00 113.01 1qew n LEU 130 Ca 0.10 0.03 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 1qew n LEU 130 Cb 0.12 -2.53 0.00 0.00 -2.33 0.00 0.00 43.42 38.68 1qew n LEU 130 CO 0.13 -0.11 -0.27 0.54 -1.33 0.00 0.00 177.39 176.35 1qew n ARG 131 N -3.06 2.65 -4.34 3.23 1.74 -1.26 -4.58 116.66 111.03 1qew n ARG 131 Ca -0.17 0.00 -0.18 0.00 -0.77 0.00 0.00 57.85 56.73 1qew n ARG 131 Cb 0.64 -0.77 -0.10 0.00 -1.02 0.00 0.00 32.46 31.21 1qew n ARG 131 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1qew s SER 132 N -1.24 1.46 0.14 0.55 1.04 -1.26 -4.90 113.70 109.49 1qew s SER 132 Ca 0.00 -1.45 0.11 0.00 0.48 0.00 0.00 55.95 55.08 1qew s SER 132 Cb 0.00 0.23 -0.04 0.00 0.10 0.00 0.00 66.02 66.31 1qew s SER 132 CO 0.00 -0.78 -0.25 0.26 0.98 0.00 0.00 173.24 173.44 1qew s TRP 133 N -3.65 2.23 -0.25 5.02 0.52 -1.26 0.20 118.94 121.75 1qew s TRP 133 Ca 0.36 -0.38 -0.01 0.00 0.02 0.00 0.00 56.10 56.09 1qew s TRP 133 Cb 0.07 -1.18 0.03 0.00 -1.15 0.00 0.00 33.47 31.23 1qew s TRP 133 CO 0.15 0.35 -0.07 0.99 0.02 0.00 0.00 176.95 178.39 1qew s THR 134 N -1.22 2.78 -0.15 2.01 2.01 -0.00 -4.89 115.64 116.16 1qew s THR 134 Ca 0.14 -1.08 -0.00 0.00 0.31 0.00 0.00 61.69 61.06 1qew s THR 134 Cb -0.09 -2.42 -0.01 0.00 0.01 0.00 0.00 72.50 69.99 1qew s THR 134 CO 0.07 0.19 -0.14 0.00 -0.69 0.00 0.00 174.62 174.05 1qew s ALA 135 N 1.30 2.55 0.00 7.40 0.00 -1.26 -1.56 121.76 130.20 1qew s ALA 135 Ca -0.00 -1.02 0.00 0.00 0.00 0.00 0.00 51.96 50.94 1qew s ALA 135 Cb -0.17 -1.26 0.00 0.00 0.00 0.00 0.00 23.12 21.69 1qew s ALA 135 CO -0.05 -0.00 0.54 0.00 0.00 0.00 0.00 175.76 176.25 1qew n ALA 136 N 4.00 -0.04 -2.01 0.00 0.00 -1.07 -4.92 120.51 116.47 1qew n ALA 136 Ca -0.19 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.04 1qew n ALA 136 Cb 0.52 0.02 0.07 0.00 0.00 0.00 0.00 19.45 20.06 1qew n ALA 136 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1qew s ASP 137 N -2.08 4.88 0.20 0.00 1.47 -1.26 -4.99 116.67 114.89 1qew s ASP 137 Ca 0.00 -0.51 -0.12 0.00 1.18 0.00 0.00 52.55 53.11 1qew s ASP 137 Cb 0.00 -0.07 0.23 0.00 -0.34 0.00 0.00 42.92 42.74 1qew s ASP 137 CO 0.00 -1.47 1.72 0.24 0.68 0.00 0.00 175.17 176.34 1qew h MET 138 N -0.07 0.25 -0.38 2.11 2.86 -2.00 -1.77 114.93 115.93 1qew h MET 138 Ca -0.35 -0.02 0.09 0.00 -2.06 0.00 0.00 59.70 57.36 1qew h MET 138 Cb 1.28 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.86 1qew h MET 138 CO 0.42 0.17 0.27 0.00 1.06 0.00 0.00 176.91 178.83 1qew h ALA 139 N 1.42 2.20 0.00 6.32 0.00 -1.95 0.10 119.26 127.35 1qew h ALA 139 Ca 0.27 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1qew h ALA 139 Cb 0.38 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1qew h ALA 139 CO -0.35 -0.30 0.00 0.00 0.00 0.00 0.00 179.25 178.60 1qew n ALA 140 N -2.58 2.23 -0.26 0.00 0.00 -0.67 -3.60 120.51 115.64 1qew n ALA 140 Ca 0.06 -0.04 -0.06 0.00 0.00 0.00 0.00 53.44 53.40 1qew n ALA 140 Cb 0.37 -1.46 0.05 0.00 0.00 0.00 0.00 19.45 18.42 1qew n ALA 140 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1qew h GLN 141 N 0.00 0.99 -0.40 0.00 1.08 -0.89 -1.66 115.11 114.23 1qew h GLN 141 Ca 0.00 -0.11 0.04 0.00 -1.45 0.00 0.00 58.65 57.13 1qew h GLN 141 Cb 0.63 -0.20 -0.04 0.00 -0.05 0.00 0.00 27.48 27.82 1qew h GLN 141 CO 0.00 0.74 0.16 1.15 -0.95 0.00 0.00 178.83 179.93 1qew h THR 142 N 0.98 0.91 -0.44 -0.54 2.02 -1.70 -0.47 112.91 113.66 1qew h THR 142 Ca 0.25 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 67.32 1qew h THR 142 Cb 0.03 0.55 -0.02 0.00 -1.74 0.00 0.00 68.15 66.97 1qew h THR 142 CO -0.04 0.06 0.28 0.74 0.37 0.00 0.00 175.52 176.93 1qew h THR 143 N 0.33 1.12 -0.39 3.16 2.02 -1.69 -0.39 112.91 117.09 1qew h THR 143 Ca 0.18 -0.25 0.06 0.00 0.77 0.00 0.00 66.41 67.17 1qew h THR 143 Cb 0.14 0.49 -0.05 0.00 -1.74 0.00 0.00 68.15 67.00 1qew h THR 143 CO -0.17 0.12 0.09 0.50 0.37 0.00 0.00 175.52 176.44 1qew h LYS 144 N 0.60 0.22 -0.30 6.66 3.64 -0.58 0.80 116.57 127.61 1qew h LYS 144 Ca 0.16 -0.01 -0.13 0.00 -1.27 0.00 0.00 60.65 59.40 1qew h LYS 144 Cb -0.05 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 1qew h LYS 144 CO -0.03 0.15 -0.35 0.45 -2.27 0.00 0.00 179.45 177.40 1qew h HIS 145 N 0.23 0.79 -0.16 1.91 3.86 -0.82 -0.84 115.15 120.12 1qew h HIS 145 Ca 0.18 -0.21 -0.01 0.00 -1.16 0.00 0.00 60.37 59.17 1qew h HIS 145 Cb 0.20 -0.18 -0.01 0.00 1.06 0.00 0.00 27.41 28.49 1qew h HIS 145 CO -0.18 0.93 0.04 0.87 0.86 0.00 0.00 177.93 180.44 1qew h LYS 146 N 0.56 0.25 -0.11 2.45 1.57 -0.64 -1.43 116.57 119.22 1qew h LYS 146 Ca 0.06 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.72 1qew h LYS 146 Cb 0.86 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.12 1qew h LYS 146 CO 0.07 0.40 -0.22 -1.49 -0.57 0.00 0.00 179.45 177.64 1qew h TRP 147 N 0.06 0.21 -0.24 -1.35 4.06 -0.77 -1.43 115.95 116.49 1qew h TRP 147 Ca 0.05 -0.03 -0.11 0.00 2.06 0.00 0.00 58.89 60.86 1qew h TRP 147 Cb 0.26 -0.06 -0.00 0.00 -1.00 0.00 0.00 29.16 28.36 1qew h TRP 147 CO 0.01 0.41 -0.27 0.93 -3.56 0.00 0.00 178.44 175.95 1qew h GLU 148 N 0.18 0.60 -0.88 0.49 5.08 -1.02 -1.07 114.58 117.96 1qew h GLU 148 Ca 0.03 -0.33 0.01 0.00 -1.00 0.00 0.00 59.36 58.07 1qew h GLU 148 Cb 0.49 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.72 1qew h GLU 148 CO 0.03 0.93 0.58 0.00 -1.00 0.00 0.00 179.01 179.56 1qew h ALA 149 N 0.66 1.12 -0.11 3.43 0.00 -0.75 -2.52 119.26 121.09 1qew h ALA 149 Ca 0.03 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1qew h ALA 149 Cb 0.84 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1qew h ALA 149 CO 0.07 0.50 0.00 0.00 0.00 0.00 0.00 179.25 179.82 1qew n ALA 150 N -2.34 2.54 -3.08 0.00 0.00 -0.59 -4.93 120.51 112.11 1qew n ALA 150 Ca 0.10 -0.35 -0.23 0.00 0.00 0.00 0.00 53.44 52.96 1qew n ALA 150 Cb 0.03 -1.15 0.04 0.00 0.00 0.00 0.00 19.45 18.37 1qew n ALA 150 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1qew n HIS 151 N -0.12 -2.08 -0.14 0.00 -0.00 -0.95 -4.88 115.22 107.05 1qew n HIS 151 Ca 0.14 0.58 0.00 0.00 -0.00 0.00 0.00 57.72 58.44 1qew n HIS 151 Cb 0.21 -4.59 0.26 0.00 -0.00 0.00 0.00 29.99 25.87 1qew n HIS 151 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.34 176.62 1qew h VAL 152 N -1.55 1.19 -0.33 1.59 2.07 -1.47 -1.85 116.25 115.90 1qew h VAL 152 Ca -0.54 -0.49 -0.01 0.00 0.82 0.00 0.00 66.70 66.48 1qew h VAL 152 Cb 1.37 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 31.51 1qew h VAL 152 CO 0.57 0.21 0.15 0.00 0.02 0.00 0.00 177.57 178.53 1qew h ALA 153 N 1.51 0.42 -0.56 1.67 0.00 -1.90 0.29 119.26 120.70 1qew h ALA 153 Ca 0.21 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1qew h ALA 153 Cb 0.04 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 1qew h ALA 153 CO -0.03 -0.01 0.35 0.93 0.00 0.00 0.00 179.25 180.49 1qew h GLU 154 N 0.39 0.74 -0.49 0.00 3.07 -1.72 0.28 114.58 116.86 1qew h GLU 154 Ca 0.11 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.92 1qew h GLU 154 Cb 0.13 -0.16 -0.02 0.00 -0.84 0.00 0.00 28.75 27.85 1qew h GLU 154 CO -0.01 0.51 0.32 1.96 -1.40 0.00 0.00 179.01 180.38 1qew h GLN 155 N 0.75 0.65 -0.56 2.33 4.20 -1.04 -1.91 115.11 119.54 1qew h GLN 155 Ca 0.20 -0.05 -0.10 0.00 0.06 0.00 0.00 58.65 58.76 1qew h GLN 155 Cb -0.06 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.56 1qew h GLN 155 CO -0.04 0.45 -0.05 -0.07 -0.67 0.00 0.00 178.83 178.45 1qew h LEU 156 N 0.66 1.00 -0.86 1.46 3.38 -0.48 -2.67 115.31 117.80 1qew h LEU 156 Ca 0.18 -0.30 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 1qew h LEU 156 Cb -0.05 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.39 1qew h LEU 156 CO -0.04 1.08 0.45 -0.09 0.09 0.00 0.00 178.44 179.93 1qew h ARG 157 N 0.91 1.22 -0.64 1.13 2.43 -0.13 0.21 114.38 119.52 1qew h ARG 157 Ca 0.15 -0.16 -0.04 0.00 -0.81 0.00 0.00 59.98 59.12 1qew h ARG 157 Cb 0.60 -0.23 -0.03 0.00 -0.42 0.00 0.00 29.97 29.89 1qew h ARG 157 CO 0.04 0.91 0.24 0.00 -1.51 0.00 0.00 179.97 179.65 1qew h ALA 158 N 1.24 0.83 0.08 2.80 0.00 -1.22 -1.32 119.26 121.66 1qew h ALA 158 Ca 0.30 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1qew h ALA 158 Cb 0.07 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1qew h ALA 158 CO -0.04 0.46 -0.04 -0.92 0.00 0.00 0.00 179.25 178.71 1qew h TYR 159 N 0.90 -0.10 -0.78 0.00 3.20 -1.09 -1.13 116.97 117.97 1qew h TYR 159 Ca 0.21 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 62.05 1qew h TYR 159 Cb 0.23 0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.50 1qew h TYR 159 CO 0.01 0.27 0.39 -0.07 -1.64 0.00 0.00 178.16 177.12 1qew h LEU 160 N -0.49 1.01 0.00 2.82 3.38 -0.52 0.25 115.31 121.77 1qew h LEU 160 Ca -0.01 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 57.75 1qew h LEU 160 Cb 0.41 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 1qew h LEU 160 CO 0.02 0.84 -0.95 -0.33 0.09 0.00 0.00 178.44 178.11 1qew h GLU 161 N 1.11 0.00 0.00 1.13 5.08 -1.33 -3.36 114.58 117.21 1qew h GLU 161 Ca 0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.63 1qew h GLU 161 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1qew h GLU 161 CO -0.04 0.24 0.00 0.41 -1.00 0.00 0.00 179.01 178.62 1qew n GLY 162 N 1.27 -0.10 0.25 -3.84 0.00 -0.43 -4.53 105.19 97.81 1qew n GLY 162 Ca -0.03 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.94 1qew n GLY 162 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1qew h THR 163 N 0.00 0.42 -0.83 2.61 2.02 -1.46 -0.73 112.91 114.93 1qew h THR 163 Ca 0.00 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.23 1qew h THR 163 Cb 0.00 0.42 -0.06 0.00 -1.74 0.00 0.00 68.15 66.77 1qew h THR 163 CO 0.00 0.00 0.52 0.00 0.37 0.00 0.00 175.52 176.41 1qew h VAL 165 N 0.96 1.31 -0.33 0.00 2.07 -1.52 -1.55 116.25 117.20 1qew h VAL 165 Ca 0.36 -0.95 -0.00 0.00 0.82 0.00 0.00 66.70 66.93 1qew h VAL 165 Cb 0.13 1.88 -0.02 0.00 -1.52 0.00 0.00 31.29 31.76 1qew h VAL 165 CO -0.16 0.25 0.19 -0.33 0.02 0.00 0.00 177.57 177.54 1qew h GLU 166 N -0.30 0.45 -0.52 1.57 4.39 -0.94 0.01 114.58 119.23 1qew h GLU 166 Ca 0.01 -0.05 -0.09 0.00 0.34 0.00 0.00 59.36 59.57 1qew h GLU 166 Cb 0.42 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.95 1qew h GLU 166 CO 0.00 0.36 -0.04 -1.49 -1.16 0.00 0.00 179.01 176.69 1qew h TRP 167 N 0.41 0.98 -0.65 4.33 4.06 -1.34 0.23 115.95 123.98 1qew h TRP 167 Ca 0.12 -0.16 0.03 0.00 2.06 0.00 0.00 58.89 60.93 1qew h TRP 167 Cb 0.03 -0.26 -0.04 0.00 -1.00 0.00 0.00 29.16 27.89 1qew h TRP 167 CO -0.04 0.91 0.40 1.25 -3.56 0.00 0.00 178.44 177.40 1qew h LEU 168 N 0.83 0.66 -0.57 -4.49 5.85 -0.96 0.93 115.31 117.55 1qew h LEU 168 Ca 0.15 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.87 1qew h LEU 168 Cb 0.54 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.40 1qew h LEU 168 CO 0.03 0.46 0.37 0.03 -0.34 0.00 0.00 178.44 178.99 1qew h ARG 169 N 0.79 0.76 -0.34 1.25 3.08 -0.38 -1.29 114.38 118.25 1qew h ARG 169 Ca 0.26 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.26 1qew h ARG 169 Cb 0.02 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 29.88 1qew h ARG 169 CO -0.10 0.51 0.22 -0.09 -1.07 0.00 0.00 179.97 179.44 1qew h ARG 170 N 0.78 0.45 -0.45 0.04 2.43 -0.15 -2.20 114.38 115.27 1qew h ARG 170 Ca 0.21 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.36 1qew h ARG 170 Cb -0.08 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.35 1qew h ARG 170 CO -0.04 0.30 0.30 1.88 -1.51 0.00 0.00 179.97 180.90 1qew h TYR 171 N 0.46 0.56 -0.54 2.20 0.05 -0.49 0.80 116.97 120.01 1qew h TYR 171 Ca 0.12 0.01 0.02 0.00 0.05 0.00 0.00 58.73 58.94 1qew h TYR 171 Cb -0.05 -0.19 -0.03 0.00 1.01 0.00 0.00 36.73 37.48 1qew h TYR 171 CO -0.05 0.35 0.36 -0.07 -1.05 0.00 0.00 178.16 177.70 1qew h LEU 172 N 0.61 0.57 -0.04 3.88 3.38 -1.04 0.18 115.31 122.85 1qew h LEU 172 Ca 0.17 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.06 1qew h LEU 172 Cb -0.06 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.56 1qew h LEU 172 CO -0.04 0.40 -0.23 -0.08 0.09 0.00 0.00 178.44 178.58 1qew h GLU 173 N 0.67 0.22 0.00 1.13 4.57 -0.76 -2.56 114.58 117.84 1qew h GLU 173 Ca 0.21 -0.19 -0.06 0.00 -1.18 0.00 0.00 59.36 58.14 1qew h GLU 173 Cb 0.01 0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.64 1qew h GLU 173 CO -0.05 0.85 -0.29 -0.91 -1.18 0.00 0.00 179.01 177.43 1qew h ASN 174 N -0.36 0.00 -0.69 1.04 2.35 -0.47 -2.61 115.58 114.85 1qew h ASN 174 Ca -0.02 0.00 -0.36 0.00 -0.55 0.00 0.00 56.30 55.37 1qew h ASN 174 Cb 0.90 0.00 -0.22 0.00 0.05 0.00 0.00 38.32 39.06 1qew h ASN 174 CO 0.05 0.29 0.29 0.61 -1.65 0.00 0.00 177.43 177.02 1qew n GLY 175 N -0.53 4.75 0.00 2.83 0.00 0.60 -4.73 105.19 108.11 1qew n GLY 175 Ca -0.02 -1.20 0.00 0.00 0.00 0.00 0.00 46.02 44.80 1qew n GLY 175 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1qew n LYS 176 N -1.13 0.00 0.00 1.61 2.85 -0.97 -0.67 118.16 119.85 1qew n LYS 176 Ca 0.47 0.33 0.11 0.00 -1.05 0.00 0.00 58.31 58.18 1qew n LYS 176 Cb 1.35 -1.50 0.07 0.00 -0.65 0.00 0.00 35.03 34.30 1qew n LYS 176 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1qew n GLU 177 N -1.33 0.58 0.00 -1.58 1.02 -1.26 -4.65 120.64 113.42 1qew n GLU 177 Ca 0.00 -0.44 0.00 0.00 -0.02 0.00 0.00 57.16 56.70 1qew n GLU 177 Cb 0.00 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 29.93 1qew n GLU 177 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1qew n THR 178 N -0.83 0.00 0.07 2.62 -2.24 -0.70 -4.93 114.28 108.28 1qew n THR 178 Ca 0.08 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.95 1qew n THR 178 Cb 0.38 -0.21 0.56 0.00 -2.10 0.00 0.00 70.33 68.96 1qew n THR 178 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1qew h LEU 179 N 0.00 0.21 -0.90 3.22 5.85 -1.19 -2.58 115.31 119.92 1qew h LEU 179 Ca 0.00 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1qew h LEU 179 Cb 0.00 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 40.98 1qew h LEU 179 CO 0.00 0.14 -0.03 0.00 -0.34 0.00 0.00 178.44 178.21 1qew n GLN 180 N -4.48 1.56 -2.43 1.25 6.02 -1.26 -4.94 117.38 113.11 1qew n GLN 180 Ca 0.04 -0.90 -0.35 0.00 -0.01 0.00 0.00 57.00 55.78 1qew n GLN 180 Cb 0.23 -1.48 -0.02 0.00 1.02 0.00 0.00 30.24 29.99 1qew n GLN 180 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 1qew s ARG 181 N -2.06 3.63 -0.42 -1.09 1.70 -0.97 -5.02 118.95 114.72 1qew s ARG 181 Ca 0.37 1.47 0.02 0.00 -0.47 0.00 0.00 55.73 57.11 1qew s ARG 181 Cb 0.21 -2.07 0.14 0.00 -0.57 0.00 0.00 34.95 32.65 1qew s ARG 181 CO 0.36 -0.59 0.23 0.95 -1.08 0.00 0.00 175.30 175.17 1qew s THR 182 N -1.88 1.21 -0.40 4.99 -4.23 -1.26 -4.65 115.64 109.42 1qew s THR 182 Ca 0.69 -2.41 -0.27 0.00 -1.18 0.00 0.00 61.69 58.51 1qew s THR 182 Cb -0.20 -1.85 0.02 0.00 1.34 0.00 0.00 72.50 71.81 1qew s THR 182 CO 0.23 -0.91 1.02 -1.81 -0.54 0.00 0.00 174.62 172.61 1qew s ASP 183 N 0.48 6.70 0.56 3.99 1.01 0.46 -4.45 116.67 125.41 1qew s ASP 183 Ca 0.18 0.60 -0.19 0.00 0.71 0.00 0.00 52.55 53.84 1qew s ASP 183 Cb -0.24 -2.50 -0.05 0.00 1.01 0.00 0.00 42.92 41.13 1qew s ASP 183 CO 0.01 -1.00 1.18 0.00 0.21 0.00 0.00 175.17 175.57 1qew s ALA 184 N 3.82 2.65 0.51 5.23 0.00 -1.26 -1.60 121.76 131.11 1qew s ALA 184 Ca 0.42 0.94 -0.21 0.00 0.00 0.00 0.00 51.96 53.12 1qew s ALA 184 Cb -0.10 -3.41 -0.07 0.00 0.00 0.00 0.00 23.12 19.54 1qew s ALA 184 CO 0.22 -0.97 1.13 -1.25 0.00 0.00 0.00 175.76 174.89 1qew s PRO 185 N -3.25 3.54 -0.12 0.00 0.04 -1.26 -4.56 135.00 129.40 1qew s PRO 185 Ca 0.74 1.62 -0.18 0.00 0.04 0.00 0.00 61.00 63.22 1qew s PRO 185 Cb -0.28 -2.14 -0.04 0.00 0.04 0.00 0.00 34.50 32.08 1qew s PRO 185 CO 0.31 -0.70 0.49 0.15 0.04 0.00 0.00 177.00 177.29 1qew s LYS 186 N -3.09 4.34 0.26 4.56 1.02 0.47 -4.83 119.74 122.47 1qew s LYS 186 Ca 0.69 0.47 0.11 0.00 0.02 0.00 0.00 55.97 57.26 1qew s LYS 186 Cb -0.24 -3.44 -0.05 0.00 -0.52 0.00 0.00 37.83 33.58 1qew s LYS 186 CO 0.28 0.15 -0.19 0.95 -0.92 0.00 0.00 175.35 175.62 1qew s THR 187 N 0.65 2.31 0.05 2.17 -4.23 -1.26 -1.26 115.64 114.08 1qew s THR 187 Ca 0.26 -2.34 -0.28 0.00 -1.18 0.00 0.00 61.69 58.16 1qew s THR 187 Cb -0.15 -2.23 0.09 0.00 1.34 0.00 0.00 72.50 71.55 1qew s THR 187 CO 0.11 -0.42 1.01 -1.38 -0.54 0.00 0.00 174.62 173.40 1qew s HIS 188 N -2.54 -0.18 -0.01 3.99 -3.43 -1.14 -5.01 115.29 106.97 1qew s HIS 188 Ca 0.28 -0.02 0.03 0.00 -0.80 0.00 0.00 55.06 54.55 1qew s HIS 188 Cb -0.04 0.58 -0.01 0.00 -1.43 0.00 0.00 32.58 31.68 1qew s HIS 188 CO 0.13 -0.60 -0.11 1.41 -2.00 0.00 0.00 174.74 173.56 1qew s MET 189 N -3.02 0.92 0.22 -0.38 1.75 -1.26 -1.01 119.30 116.52 1qew s MET 189 Ca 0.10 -0.40 0.08 0.00 -1.25 0.00 0.00 55.69 54.22 1qew s MET 189 Cb -0.00 -0.89 -0.04 0.00 2.84 0.00 0.00 34.83 36.74 1qew s MET 189 CO -0.03 0.24 0.02 0.95 -0.65 0.00 0.00 175.02 175.55 1qew s THR 190 N -0.26 3.67 -0.05 10.11 -4.23 -0.48 -4.96 115.64 119.45 1qew s THR 190 Ca 0.04 -1.63 0.00 0.00 -1.18 0.00 0.00 61.69 58.92 1qew s THR 190 Cb -0.04 -2.91 0.02 0.00 1.34 0.00 0.00 72.50 70.91 1qew s THR 190 CO -0.00 -0.25 -0.02 -2.28 -0.54 0.00 0.00 174.62 171.53 1qew s HIS 191 N -2.02 0.59 -0.03 3.99 2.46 -1.26 -2.05 115.29 116.97 1qew s HIS 191 Ca 0.30 -0.13 -0.00 0.00 0.47 0.00 0.00 55.06 55.69 1qew s HIS 191 Cb -0.08 -0.61 0.03 0.00 -0.13 0.00 0.00 32.58 31.79 1qew s HIS 191 CO 0.20 -0.20 0.03 -1.01 -2.47 0.00 0.00 174.74 171.29 1qew s HIS 192 N 1.18 0.09 0.13 3.88 3.76 -0.66 -4.97 115.29 118.70 1qew s HIS 192 Ca -0.07 0.12 -0.31 0.00 -0.15 0.00 0.00 55.06 54.65 1qew s HIS 192 Cb -0.14 -0.31 -0.08 0.00 1.11 0.00 0.00 32.58 33.17 1qew s HIS 192 CO -0.02 -0.11 1.32 0.00 -0.85 0.00 0.00 174.74 175.08 1qew s ALA 193 N 1.24 3.53 -0.10 -1.40 0.00 -1.26 0.33 121.76 124.09 1qew s ALA 193 Ca -0.07 1.06 0.09 0.00 0.00 0.00 0.00 51.96 53.04 1qew s ALA 193 Cb -0.13 -3.50 -0.24 0.00 0.00 0.00 0.00 23.12 19.26 1qew s ALA 193 CO -0.03 -0.55 0.44 0.28 0.00 0.00 0.00 175.76 175.90 1qew n VAL 194 N 3.52 1.60 -3.04 0.00 0.31 0.49 -4.87 118.33 116.34 1qew n VAL 194 Ca 0.09 -0.77 0.00 0.00 -0.01 0.00 0.00 64.34 63.66 1qew n VAL 194 Cb 0.43 -1.10 0.00 0.00 -0.91 0.00 0.00 33.84 32.27 1qew n VAL 194 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1qew n SER 195 N -3.09 0.00 0.09 4.52 3.41 -0.98 -4.97 113.62 112.59 1qew n SER 195 Ca -0.25 -0.97 0.11 0.00 -0.26 0.00 0.00 58.87 57.50 1qew n SER 195 Cb 1.07 0.00 0.44 0.00 -0.26 0.00 0.00 64.21 65.46 1qew n SER 195 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1qew n ASP 196 N -0.91 0.49 -0.03 4.04 9.92 -1.26 -3.65 116.55 125.15 1qew n ASP 196 Ca 0.00 0.61 0.01 0.00 -0.53 0.00 0.00 54.79 54.87 1qew n ASP 196 Cb 0.00 -0.72 0.01 0.00 -0.64 0.00 0.00 41.12 39.77 1qew n ASP 196 CO 0.00 0.00 0.00 1.41 0.13 0.00 0.00 177.20 178.74 1qew n HIS 197 N -2.02 0.00 -3.80 1.24 8.25 -1.26 -4.85 115.22 112.77 1qew n HIS 197 Ca 0.03 -0.27 -0.13 0.00 -0.26 0.00 0.00 57.72 57.10 1qew n HIS 197 Cb 0.24 -0.03 -0.11 0.00 1.12 0.00 0.00 29.99 31.21 1qew n HIS 197 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1qew s GLU 198 N -0.59 0.35 0.06 -0.41 2.02 -1.24 -1.12 118.70 117.77 1qew s GLU 198 Ca 0.02 0.17 0.03 0.00 0.02 0.00 0.00 54.97 55.21 1qew s GLU 198 Cb 0.02 0.16 -0.03 0.00 0.10 0.00 0.00 34.13 34.38 1qew s GLU 198 CO 0.00 -0.06 -0.08 0.00 0.02 0.00 0.00 175.26 175.14 1qew s ALA 199 N -0.25 0.73 -0.18 5.21 0.00 0.09 -0.38 121.76 126.99 1qew s ALA 199 Ca -0.04 -0.91 -0.10 0.00 0.00 0.00 0.00 51.96 50.92 1qew s ALA 199 Cb -0.03 0.05 -0.05 0.00 0.00 0.00 0.00 23.12 23.09 1qew s ALA 199 CO 0.01 -0.03 0.14 0.99 0.00 0.00 0.00 175.76 176.86 1qew s THR 200 N -1.78 5.43 -0.22 0.00 2.01 0.15 -0.52 115.64 120.70 1qew s THR 200 Ca -0.05 0.21 -0.02 0.00 0.31 0.00 0.00 61.69 62.14 1qew s THR 200 Cb -0.07 -3.46 0.01 0.00 0.01 0.00 0.00 72.50 68.99 1qew s THR 200 CO -0.00 0.48 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.55 1qew s LEU 201 N 0.07 2.84 -0.11 4.42 1.43 0.08 -1.65 118.68 125.77 1qew s LEU 201 Ca 0.10 -0.67 0.00 0.00 -1.03 0.00 0.00 54.13 52.53 1qew s LEU 201 Cb -0.11 -1.64 -0.02 0.00 0.03 0.00 0.00 46.19 44.44 1qew s LEU 201 CO -0.00 -0.06 -0.11 -0.60 0.23 0.00 0.00 176.35 175.80 1qew s ARG 202 N 1.36 3.19 -0.24 1.70 3.52 -0.87 -1.54 118.95 126.08 1qew s ARG 202 Ca 0.03 -0.64 -0.05 0.00 -0.13 0.00 0.00 55.73 54.94 1qew s ARG 202 Cb -0.15 -2.63 -0.01 0.00 -1.56 0.00 0.00 34.95 30.60 1qew s ARG 202 CO -0.06 0.36 0.00 0.00 -0.81 0.00 0.00 175.30 174.79 1qew s TRP 204 N 1.51 3.42 -0.10 0.00 0.52 -0.18 -1.28 118.94 122.83 1qew s TRP 204 Ca 0.05 0.32 -0.01 0.00 0.02 0.00 0.00 56.10 56.47 1qew s TRP 204 Cb -0.15 -1.81 0.03 0.00 -1.15 0.00 0.00 33.47 30.39 1qew s TRP 204 CO -0.01 0.61 -0.00 0.00 0.02 0.00 0.00 176.95 177.57 1qew s ALA 205 N -1.17 0.84 0.17 0.98 0.00 -0.34 -2.87 121.76 119.38 1qew s ALA 205 Ca 0.22 -0.29 0.03 0.00 0.00 0.00 0.00 51.96 51.92 1qew s ALA 205 Cb -0.12 -0.85 -0.05 0.00 0.00 0.00 0.00 23.12 22.10 1qew s ALA 205 CO 0.12 -0.59 -0.05 -0.51 0.00 0.00 0.00 175.76 174.73 1qew s LEU 206 N 1.92 2.35 -1.45 0.00 1.43 -0.39 -1.46 118.68 121.08 1qew s LEU 206 Ca 0.04 -1.10 -0.06 0.00 -1.03 0.00 0.00 54.13 51.98 1qew s LEU 206 Cb -0.13 -0.24 0.03 0.00 0.03 0.00 0.00 46.19 45.87 1qew s LEU 206 CO -0.06 -0.44 0.49 -1.20 0.23 0.00 0.00 176.35 175.37 1qew n SER 207 N -0.26 -5.18 -4.82 2.29 7.64 -0.99 -0.39 113.62 111.91 1qew n SER 207 Ca -0.08 -0.27 -0.25 0.00 1.01 0.00 0.00 58.87 59.28 1qew n SER 207 Cb 0.62 -4.23 -0.05 0.00 -1.01 0.00 0.00 64.21 59.54 1qew n SER 207 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1qew s PHE 208 N -3.05 3.19 -0.24 1.43 -0.12 -1.12 -4.64 117.98 113.42 1qew s PHE 208 Ca 0.30 -0.02 -0.15 0.00 -0.05 0.00 0.00 56.93 57.00 1qew s PHE 208 Cb -0.14 -1.51 0.07 0.00 -0.63 0.00 0.00 43.02 40.81 1qew s PHE 208 CO 0.36 0.52 0.60 -0.47 -0.05 0.00 0.00 175.22 176.18 1qew s TYR 209 N -1.81 -0.86 1.04 3.49 6.14 -0.63 -0.13 117.35 124.58 1qew s TYR 209 Ca 0.32 1.81 -0.13 0.00 0.64 0.00 0.00 57.07 59.71 1qew s TYR 209 Cb -0.10 0.45 0.21 0.00 0.42 0.00 0.00 41.96 42.94 1qew s TYR 209 CO 0.24 -0.44 1.09 -1.25 0.64 0.00 0.00 175.55 175.84 1qew s PRO 210 N 1.30 0.12 0.53 4.97 0.04 -1.26 -0.40 135.00 140.30 1qew s PRO 210 Ca -0.08 0.42 0.23 0.00 0.04 0.00 0.00 61.00 61.62 1qew s PRO 210 Cb -0.06 -1.71 1.47 0.00 0.04 0.00 0.00 34.50 34.24 1qew s PRO 210 CO -0.14 -2.92 2.14 0.00 0.04 0.00 0.00 177.00 176.13 1qew h ALA 211 N -2.02 1.60 -2.53 8.56 0.00 -1.96 -3.44 119.26 119.47 1qew h ALA 211 Ca -0.54 -0.06 -0.55 0.00 0.00 0.00 0.00 54.91 53.77 1qew h ALA 211 Cb 1.33 -0.01 0.07 0.00 0.00 0.00 0.00 17.79 19.18 1qew h ALA 211 CO 0.55 0.08 0.90 -1.91 0.00 0.00 0.00 179.25 178.87 1qew n GLU 212 N -4.04 2.53 -3.55 0.00 4.07 -1.26 -4.96 120.64 113.43 1qew n GLU 212 Ca -0.03 0.91 -0.06 0.00 -0.06 0.00 0.00 57.16 57.92 1qew n GLU 212 Cb 0.15 -2.71 -0.02 0.00 -0.06 0.00 0.00 31.44 28.80 1qew n GLU 212 CO 0.00 0.00 0.00 -1.50 -0.06 0.00 0.00 177.13 175.57 1qew s ILE 213 N 0.81 0.00 -0.08 6.31 2.07 -1.26 -4.68 121.20 124.36 1qew s ILE 213 Ca 0.74 -0.05 -0.01 0.00 -1.41 0.00 0.00 60.65 59.92 1qew s ILE 213 Cb -0.57 -1.10 0.03 0.00 0.13 0.00 0.00 42.46 40.95 1qew s ILE 213 CO 0.38 0.00 -0.03 -0.89 -1.91 0.00 0.00 174.94 172.49 1qew s THR 214 N -2.87 0.61 -0.21 4.00 2.01 -0.68 -5.00 115.64 113.51 1qew s THR 214 Ca 0.07 -0.03 0.01 0.00 0.31 0.00 0.00 61.69 62.05 1qew s THR 214 Cb -0.01 -0.71 0.04 0.00 0.01 0.00 0.00 72.50 71.83 1qew s THR 214 CO -0.07 0.30 -0.12 -0.76 -0.69 0.00 0.00 174.62 173.28 1qew s LEU 215 N 1.82 2.48 0.15 4.42 1.43 -1.26 -0.93 118.68 126.79 1qew s LEU 215 Ca 0.04 -0.95 0.05 0.00 -1.03 0.00 0.00 54.13 52.24 1qew s LEU 215 Cb -0.12 -1.33 -0.04 0.00 0.03 0.00 0.00 46.19 44.73 1qew s LEU 215 CO -0.06 -0.13 -0.12 0.42 0.23 0.00 0.00 176.35 176.69 1qew s THR 216 N 1.32 1.29 -0.02 5.49 -4.23 -0.45 -4.92 115.64 114.12 1qew s THR 216 Ca -0.02 -1.95 0.04 0.00 -1.18 0.00 0.00 61.69 58.58 1qew s THR 216 Cb -0.16 -1.75 -0.03 0.00 1.34 0.00 0.00 72.50 71.90 1qew s THR 216 CO -0.08 -0.61 -0.14 0.26 -0.54 0.00 0.00 174.62 173.51 1qew s TRP 217 N -2.85 2.71 0.05 3.99 0.52 -1.26 -0.31 118.94 121.78 1qew s TRP 217 Ca 0.14 -0.15 0.06 0.00 0.02 0.00 0.00 56.10 56.16 1qew s TRP 217 Cb -0.01 -1.59 -0.02 0.00 -1.15 0.00 0.00 33.47 30.70 1qew s TRP 217 CO 0.02 0.23 -0.16 -0.65 0.02 0.00 0.00 176.95 176.42 1qew s GLN 218 N -0.99 0.98 -0.18 4.98 -0.21 -0.00 -1.16 119.66 123.07 1qew s GLN 218 Ca 0.13 -0.86 0.01 0.00 0.02 0.00 0.00 55.36 54.66 1qew s GLN 218 Cb -0.11 -1.03 0.02 0.00 1.00 0.00 0.00 33.01 32.90 1qew s GLN 218 CO 0.03 0.25 -0.19 0.50 -2.12 0.00 0.00 175.29 173.75 1qew s ARG 219 N -1.34 2.91 -1.41 2.91 3.52 0.54 -1.11 118.95 124.97 1qew s ARG 219 Ca 0.02 -0.86 -0.08 0.00 -0.13 0.00 0.00 55.73 54.68 1qew s ARG 219 Cb -0.09 -2.58 0.05 0.00 -1.56 0.00 0.00 34.95 30.78 1qew s ARG 219 CO 0.02 -0.24 0.61 -0.25 -0.81 0.00 0.00 175.30 174.63 1qew n ASP 220 N 4.61 -4.69 0.00 -2.12 8.00 0.20 0.30 116.55 122.85 1qew n ASP 220 Ca -0.20 -0.41 0.00 0.00 0.71 0.00 0.00 54.79 54.89 1qew n ASP 220 Cb 0.49 -3.82 0.00 0.00 -0.02 0.00 0.00 41.12 37.77 1qew n ASP 220 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1qew n GLY 221 N -1.37 0.41 3.83 0.44 0.00 -1.26 -5.01 105.19 102.23 1qew n GLY 221 Ca -0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.61 1qew n GLY 221 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1qew s GLU 222 N -0.44 3.71 0.29 1.61 2.02 0.15 -5.02 118.70 121.03 1qew s GLU 222 Ca 0.00 -0.03 -0.29 0.00 0.02 0.00 0.00 54.97 54.66 1qew s GLU 222 Cb 0.00 -3.25 -0.11 0.00 0.10 0.00 0.00 34.13 30.87 1qew s GLU 222 CO 0.00 0.64 1.46 0.34 0.02 0.00 0.00 175.26 177.71 1qew s ASP 223 N -0.67 6.57 -0.20 -0.19 2.15 -1.26 -0.34 116.67 122.72 1qew s ASP 223 Ca 0.15 2.79 0.12 0.00 0.43 0.00 0.00 52.55 56.05 1qew s ASP 223 Cb -0.13 -2.64 0.43 0.00 -0.30 0.00 0.00 42.92 40.28 1qew s ASP 223 CO 0.05 -0.74 1.21 0.00 -0.17 0.00 0.00 175.17 175.51 1qew n GLN 224 N 1.72 1.64 -0.25 4.34 1.13 -0.31 -4.84 117.38 120.81 1qew n GLN 224 Ca 0.05 -3.27 0.06 0.00 -1.94 0.00 0.00 57.00 51.90 1qew n GLN 224 Cb 0.40 -1.52 0.18 0.00 0.11 0.00 0.00 30.24 29.41 1qew n GLN 224 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 1qew h THR 225 N 1.84 0.47 0.00 5.09 2.02 -1.92 -0.21 112.91 120.20 1qew h THR 225 Ca 0.01 -0.08 -0.01 0.00 0.77 0.00 0.00 66.41 67.10 1qew h THR 225 Cb 1.16 0.22 -0.00 0.00 -1.74 0.00 0.00 68.15 67.79 1qew h THR 225 CO 0.10 0.04 -0.05 0.06 0.37 0.00 0.00 175.52 176.03 1qew h GLN 226 N 0.23 0.00 -0.02 6.66 -0.00 -1.98 -1.99 115.11 118.02 1qew h GLN 226 Ca 0.42 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.07 1qew h GLN 226 Cb 0.73 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.21 1qew h GLN 226 CO -0.54 0.05 -0.32 -0.25 -0.00 0.00 0.00 178.83 177.77 1qew n ASP 227 N -3.40 1.85 -4.87 0.06 9.92 -0.14 -4.96 116.55 115.02 1qew n ASP 227 Ca -0.02 -1.41 -0.34 0.00 -0.53 0.00 0.00 54.79 52.49 1qew n ASP 227 Cb 0.19 0.28 -0.05 0.00 -0.64 0.00 0.00 41.12 40.90 1qew n ASP 227 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1qew s THR 228 N -2.38 5.12 -0.43 -3.53 2.01 -0.75 -4.61 115.64 111.06 1qew s THR 228 Ca 0.23 0.40 -0.11 0.00 0.31 0.00 0.00 61.69 62.52 1qew s THR 228 Cb 0.19 -3.64 0.07 0.00 0.01 0.00 0.00 72.50 69.14 1qew s THR 228 CO 0.50 0.28 0.29 -0.70 -0.69 0.00 0.00 174.62 174.30 1qew s GLU 229 N -1.95 2.72 -0.27 4.92 2.12 0.17 -4.93 118.70 121.47 1qew s GLU 229 Ca 0.33 -1.41 -0.03 0.00 0.36 0.00 0.00 54.97 54.22 1qew s GLU 229 Cb -0.14 -3.88 0.03 0.00 0.26 0.00 0.00 34.13 30.40 1qew s GLU 229 CO 0.18 -0.96 -0.00 -1.17 -0.54 0.00 0.00 175.26 172.77 1qew s LEU 230 N 1.49 3.54 0.64 2.70 2.96 -1.26 -1.30 118.68 127.46 1qew s LEU 230 Ca 0.03 -0.91 -0.11 0.00 -0.22 0.00 0.00 54.13 52.92 1qew s LEU 230 Cb -0.23 -1.74 -0.02 0.00 0.50 0.00 0.00 46.19 44.70 1qew s LEU 230 CO 0.04 -0.18 1.04 0.68 -1.32 0.00 0.00 176.35 176.61 1qew s VAL 231 N 1.36 4.47 0.41 1.68 -7.23 -1.08 -5.02 120.40 114.99 1qew s VAL 231 Ca -0.00 0.81 -0.24 0.00 -1.81 0.00 0.00 61.98 60.73 1qew s VAL 231 Cb -0.17 -3.70 -0.08 0.00 0.56 0.00 0.00 36.38 32.98 1qew s VAL 231 CO -0.02 -1.04 1.14 -0.70 -0.31 0.00 0.00 175.10 174.17 1qew s GLU 232 N -5.11 4.01 0.15 4.82 2.12 -1.26 -4.63 118.70 118.80 1qew s GLU 232 Ca 0.56 1.73 -0.31 0.00 0.36 0.00 0.00 54.97 57.31 1qew s GLU 232 Cb -0.12 -2.57 -0.11 0.00 0.26 0.00 0.00 34.13 31.59 1qew s GLU 232 CO 0.54 -0.33 1.79 0.99 -0.54 0.00 0.00 175.26 177.71 1qew s THR 233 N -1.51 2.39 0.06 -1.70 2.01 -1.26 -4.82 115.64 110.80 1qew s THR 233 Ca 0.59 0.05 0.06 0.00 0.31 0.00 0.00 61.69 62.70 1qew s THR 233 Cb -0.28 -3.03 -0.04 0.00 0.01 0.00 0.00 72.50 69.16 1qew s THR 233 CO 0.35 0.00 -0.10 -0.13 -0.69 0.00 0.00 174.62 174.05 1qew s ARG 234 N 2.23 2.26 -0.01 4.92 0.52 0.12 -4.93 118.95 124.07 1qew s ARG 234 Ca 0.79 -0.92 -0.25 0.00 -0.52 0.00 0.00 55.73 54.83 1qew s ARG 234 Cb -0.47 -2.35 -0.04 0.00 0.52 0.00 0.00 34.95 32.60 1qew s ARG 234 CO 0.35 0.54 0.77 -1.25 0.02 0.00 0.00 175.30 175.73 1qew s PRO 235 N -1.83 4.48 0.43 3.54 0.04 -1.26 0.55 135.00 140.95 1qew s PRO 235 Ca 0.19 1.04 0.24 0.00 0.04 0.00 0.00 61.00 62.50 1qew s PRO 235 Cb -0.11 -3.41 0.86 0.00 0.04 0.00 0.00 34.50 31.88 1qew s PRO 235 CO 0.10 0.15 1.80 0.00 0.04 0.00 0.00 177.00 179.10 1qew h ALA 236 N 6.25 1.00 0.00 8.56 0.00 -1.16 -3.47 119.26 130.43 1qew h ALA 236 Ca -0.42 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.28 1qew h ALA 236 Cb 1.20 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1qew h ALA 236 CO 0.73 0.29 0.00 0.41 0.00 0.00 0.00 179.25 180.68 1qew n GLY 237 N 0.25 0.35 0.53 0.00 0.00 -1.26 -4.93 105.19 100.13 1qew n GLY 237 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.10 1qew n GLY 237 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1qew n ASP 238 N 0.00 3.09 0.00 1.61 5.75 -1.26 -4.94 116.55 120.80 1qew n ASP 238 Ca 0.00 -2.73 0.00 0.00 -0.01 0.00 0.00 54.79 52.05 1qew n ASP 238 Cb 0.00 -0.39 0.00 0.00 -1.03 0.00 0.00 41.12 39.70 1qew n ASP 238 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1qew n GLY 239 N -0.56 0.55 3.64 6.12 0.00 -1.26 -5.07 105.19 108.62 1qew n GLY 239 Ca 0.16 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.91 1qew n GLY 239 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1qew s THR 240 N -2.26 2.20 0.40 2.61 -4.23 -1.26 -4.80 115.64 108.30 1qew s THR 240 Ca 0.00 -1.94 0.05 0.00 -1.18 0.00 0.00 61.69 58.62 1qew s THR 240 Cb 0.00 -2.93 -0.06 0.00 1.34 0.00 0.00 72.50 70.85 1qew s THR 240 CO 0.00 -0.05 0.03 -0.36 -0.54 0.00 0.00 174.62 173.70 1qew s PHE 241 N -2.64 2.25 0.06 3.99 0.40 0.81 -0.61 117.98 122.23 1qew s PHE 241 Ca 0.36 -0.82 -0.03 0.00 -0.60 0.00 0.00 56.93 55.84 1qew s PHE 241 Cb 0.06 -1.59 -0.03 0.00 0.51 0.00 0.00 43.02 41.97 1qew s PHE 241 CO 0.19 0.26 0.03 -0.65 0.70 0.00 0.00 175.22 175.76 1qew s GLN 242 N -3.78 0.65 -0.14 0.44 -0.21 0.19 -2.35 119.66 114.45 1qew s GLN 242 Ca 0.31 -1.08 -0.31 0.00 0.02 0.00 0.00 55.36 54.30 1qew s GLN 242 Cb 0.08 0.24 0.13 0.00 1.00 0.00 0.00 33.01 34.46 1qew s GLN 242 CO 0.15 -0.15 1.05 0.21 -2.12 0.00 0.00 175.29 174.43 1qew s LYS 243 N -3.65 0.54 0.07 2.91 2.20 -0.53 -0.70 119.74 120.58 1qew s LYS 243 Ca 0.04 -0.03 -0.12 0.00 -0.36 0.00 0.00 55.97 55.50 1qew s LYS 243 Cb 0.05 0.25 0.01 0.00 -1.51 0.00 0.00 37.83 36.64 1qew s LYS 243 CO -0.09 -0.20 0.28 1.67 -0.36 0.00 0.00 175.35 176.64 1qew s TRP 244 N -1.83 -0.03 -0.03 4.03 1.48 -1.26 -1.20 118.94 120.10 1qew s TRP 244 Ca 0.03 -0.25 0.01 0.00 -1.06 0.00 0.00 56.10 54.84 1qew s TRP 244 Cb -0.01 0.07 0.01 0.00 -1.16 0.00 0.00 33.47 32.38 1qew s TRP 244 CO -0.03 -0.55 -0.05 0.00 -4.06 0.00 0.00 176.95 172.26 1qew s ALA 245 N -3.23 0.58 0.04 2.67 0.00 -0.40 -2.64 121.76 118.78 1qew s ALA 245 Ca -0.00 -0.12 0.04 0.00 0.00 0.00 0.00 51.96 51.88 1qew s ALA 245 Cb 0.02 -0.29 -0.02 0.00 0.00 0.00 0.00 23.12 22.83 1qew s ALA 245 CO -0.08 0.05 -0.13 0.00 0.00 0.00 0.00 175.76 175.60 1qew s ALA 246 N 0.47 1.05 0.01 0.00 0.00 -0.42 0.46 121.76 123.33 1qew s ALA 246 Ca -0.06 -0.82 -0.00 0.00 0.00 0.00 0.00 51.96 51.08 1qew s ALA 246 Cb -0.09 -0.13 -0.01 0.00 0.00 0.00 0.00 23.12 22.89 1qew s ALA 246 CO -0.00 0.17 -0.01 0.14 0.00 0.00 0.00 175.76 176.06 1qew s VAL 247 N -0.96 0.05 -0.21 0.00 -7.23 -0.59 -0.65 120.40 110.80 1qew s VAL 247 Ca -0.01 -0.40 -0.10 0.00 -1.81 0.00 0.00 61.98 59.66 1qew s VAL 247 Cb -0.08 -0.13 -0.05 0.00 0.56 0.00 0.00 36.38 36.68 1qew s VAL 247 CO 0.01 -0.22 0.13 -0.69 -0.31 0.00 0.00 175.10 174.03 1qew s VAL 248 N -0.64 5.34 0.19 1.32 1.01 -1.26 -0.74 120.40 125.61 1qew s VAL 248 Ca -0.07 0.17 0.06 0.00 0.00 0.00 0.00 61.98 62.14 1qew s VAL 248 Cb -0.04 -3.45 -0.05 0.00 0.00 0.00 0.00 36.38 32.84 1qew s VAL 248 CO -0.00 0.41 -0.12 0.68 0.00 0.00 0.00 175.10 176.07 1qew s VAL 249 N 0.59 1.49 0.18 2.92 -7.23 0.32 -4.93 120.40 113.73 1qew s VAL 249 Ca 0.07 -2.14 -0.31 0.00 -1.81 0.00 0.00 61.98 57.79 1qew s VAL 249 Cb -0.12 -1.99 -0.09 0.00 0.56 0.00 0.00 36.38 34.74 1qew s VAL 249 CO 0.00 -0.64 1.39 -2.84 -0.31 0.00 0.00 175.10 172.71 1qew s PRO 250 N -3.70 4.32 0.16 4.82 0.02 -1.26 -0.73 135.00 138.64 1qew s PRO 250 Ca 0.21 2.15 -0.34 0.00 0.02 0.00 0.00 61.00 63.04 1qew s PRO 250 Cb 0.01 -3.19 -0.14 0.00 0.02 0.00 0.00 34.50 31.20 1qew s PRO 250 CO 0.05 -0.39 1.58 0.43 -0.33 0.00 0.00 177.00 178.34 1qew n SER 251 N 3.12 3.11 0.00 2.53 7.64 -0.28 -1.07 113.62 128.67 1qew n SER 251 Ca 0.09 1.08 0.00 0.00 1.01 0.00 0.00 58.87 61.05 1qew n SER 251 Cb 0.42 -1.43 0.00 0.00 -1.01 0.00 0.00 64.21 62.19 1qew n SER 251 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1qew n GLY 252 N 3.42 1.02 0.97 0.23 0.00 -1.26 -4.90 105.19 104.67 1qew n GLY 252 Ca 0.17 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.27 1qew n GLY 252 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1qew n GLN 253 N -1.98 2.96 -0.27 1.61 1.13 -0.23 -4.66 117.38 115.94 1qew n GLN 253 Ca 0.00 -2.39 0.05 0.00 -1.94 0.00 0.00 57.00 52.71 1qew n GLN 253 Cb 0.00 -1.48 0.19 0.00 0.11 0.00 0.00 30.24 29.05 1qew n GLN 253 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 1qew h GLU 254 N 2.86 0.58 -0.31 -1.09 3.07 -1.91 -2.40 114.58 115.38 1qew h GLU 254 Ca 0.00 -0.03 0.09 0.00 -0.50 0.00 0.00 59.36 58.91 1qew h GLU 254 Cb 0.96 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 28.73 1qew h GLU 254 CO 0.05 0.38 0.39 -0.56 -1.40 0.00 0.00 179.01 177.88 1qew h GLN 255 N 0.60 0.00 0.00 2.33 3.07 -1.85 -0.56 115.11 118.69 1qew h GLN 255 Ca 0.41 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.15 1qew h GLN 255 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.10 1qew h GLN 255 CO -0.33 0.00 0.00 0.54 0.09 0.00 0.00 178.83 179.13 1qew n ARG 256 N -3.57 0.13 -3.82 0.06 1.74 -0.90 -4.84 116.66 105.46 1qew n ARG 256 Ca 0.05 0.13 -0.36 0.00 -0.77 0.00 0.00 57.85 56.91 1qew n ARG 256 Cb 0.54 -1.66 -0.06 0.00 -1.02 0.00 0.00 32.46 30.26 1qew n ARG 256 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1qew s TYR 257 N -3.06 3.59 -0.01 -1.55 1.51 -0.22 -0.63 117.35 116.98 1qew s TYR 257 Ca 0.12 0.54 0.01 0.00 -1.01 0.00 0.00 57.07 56.73 1qew s TYR 257 Cb 0.15 -1.96 0.01 0.00 -0.11 0.00 0.00 41.96 40.05 1qew s TYR 257 CO 0.54 0.67 -0.02 0.95 -1.11 0.00 0.00 175.55 176.58 1qew s THR 258 N -1.18 0.25 -0.19 -0.71 -4.23 -0.27 -4.51 115.64 104.81 1qew s THR 258 Ca 0.22 -0.08 -0.10 0.00 -1.18 0.00 0.00 61.69 60.55 1qew s THR 258 Cb -0.13 -0.25 -0.05 0.00 1.34 0.00 0.00 72.50 73.41 1qew s THR 258 CO 0.11 0.10 0.14 0.00 -0.54 0.00 0.00 174.62 174.43 1qew s HIS 260 N 0.18 2.81 -0.16 0.00 3.76 0.57 0.51 115.29 122.96 1qew s HIS 260 Ca 0.09 -0.67 0.02 0.00 -0.15 0.00 0.00 55.06 54.35 1qew s HIS 260 Cb -0.11 -1.85 0.02 0.00 1.11 0.00 0.00 32.58 31.74 1qew s HIS 260 CO -0.01 -0.23 -0.21 0.08 -0.85 0.00 0.00 174.74 173.52 1qew s VAL 261 N 0.40 2.03 -0.11 -0.90 1.01 -0.18 -1.34 120.40 121.30 1qew s VAL 261 Ca -0.10 -0.94 0.02 0.00 0.00 0.00 0.00 61.98 60.96 1qew s VAL 261 Cb -0.16 -1.81 -0.01 0.00 0.00 0.00 0.00 36.38 34.40 1qew s VAL 261 CO 0.05 0.54 -0.18 -1.10 0.00 0.00 0.00 175.10 174.41 1qew s GLN 262 N 1.07 3.18 -0.27 2.72 -0.21 -0.10 -0.97 119.66 125.07 1qew s GLN 262 Ca -0.01 -0.77 -0.24 0.00 0.02 0.00 0.00 55.36 54.36 1qew s GLN 262 Cb -0.14 -2.47 0.08 0.00 1.00 0.00 0.00 33.01 31.48 1qew s GLN 262 CO -0.07 0.23 0.80 -1.58 -2.12 0.00 0.00 175.29 172.54 1qew s HIS 263 N 0.28 -0.73 0.46 0.91 2.46 -1.26 -1.68 115.29 115.72 1qew s HIS 263 Ca -0.13 1.74 0.27 0.00 0.47 0.00 0.00 55.06 57.42 1qew s HIS 263 Cb -0.16 0.32 1.32 0.00 -0.13 0.00 0.00 32.58 33.93 1qew s HIS 263 CO 0.07 -0.35 1.75 1.49 -2.47 0.00 0.00 174.74 175.22 1qew h GLU 264 N 4.99 0.20 0.00 2.88 4.81 -1.95 0.12 114.58 125.63 1qew h GLU 264 Ca -0.29 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.93 1qew h GLU 264 Cb 1.17 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.51 1qew h GLU 264 CO 0.08 0.13 0.00 0.41 -0.73 0.00 0.00 179.01 178.90 1qew n GLY 265 N -1.59 -1.52 3.67 1.92 0.00 -1.26 -4.80 105.19 101.61 1qew n GLY 265 Ca 0.28 -0.08 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 1qew n GLY 265 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1qew s LEU 266 N -3.31 4.17 0.49 0.99 1.43 0.42 -4.33 118.68 118.53 1qew s LEU 266 Ca 0.13 0.92 0.25 0.00 -1.03 0.00 0.00 54.13 54.39 1qew s LEU 266 Cb 0.17 -2.95 1.25 0.00 0.03 0.00 0.00 46.19 44.68 1qew s LEU 266 CO 0.53 -0.27 1.99 1.55 0.23 0.00 0.00 176.35 180.38 1qew h PRO 267 N 7.37 0.00 -3.54 1.29 0.13 -1.87 -3.43 132.00 131.96 1qew h PRO 267 Ca -0.32 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.62 1qew h PRO 267 Cb 1.15 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 32.02 1qew h PRO 267 CO 0.78 0.17 -0.59 0.15 -0.23 0.00 0.00 178.00 178.28 1qew s LYS 268 N -4.07 0.20 0.65 0.86 -0.14 -1.26 -5.14 119.74 110.84 1qew s LYS 268 Ca -0.02 -0.02 -0.18 0.00 -1.36 0.00 0.00 55.97 54.39 1qew s LYS 268 Cb 0.13 0.09 -0.01 0.00 -1.68 0.00 0.00 37.83 36.35 1qew s LYS 268 CO 0.61 -0.03 1.29 -2.14 -0.76 0.00 0.00 175.35 174.32 1qew s PRO 269 N -0.32 2.52 0.00 -1.68 0.02 -1.26 -4.97 135.00 129.31 1qew s PRO 269 Ca -0.04 2.05 -0.05 0.00 0.02 0.00 0.00 61.00 62.99 1qew s PRO 269 Cb -0.03 -1.84 -0.04 0.00 0.02 0.00 0.00 34.50 32.61 1qew s PRO 269 CO 0.00 -1.62 0.23 -0.51 -0.33 0.00 0.00 177.00 174.77 1qew s LEU 270 N -4.42 4.37 -0.23 -5.54 1.43 -0.14 -4.93 118.68 109.21 1qew s LEU 270 Ca 0.82 0.45 -0.01 0.00 -1.03 0.00 0.00 54.13 54.37 1qew s LEU 270 Cb -0.37 -2.67 0.07 0.00 0.03 0.00 0.00 46.19 43.24 1qew s LEU 270 CO 0.40 0.25 0.00 -0.89 0.23 0.00 0.00 176.35 176.34 1qew s THR 271 N -1.33 1.11 0.10 5.49 2.01 -1.26 -1.01 115.64 120.75 1qew s THR 271 Ca 0.28 -1.04 0.04 0.00 0.31 0.00 0.00 61.69 61.28 1qew s THR 271 Cb -0.13 -1.53 -0.04 0.00 0.01 0.00 0.00 72.50 70.81 1qew s THR 271 CO 0.18 -0.23 0.07 -0.76 -0.69 0.00 0.00 174.62 173.19 1qew s LEU 272 N 1.57 3.70 -0.10 4.42 2.01 0.18 -4.91 118.68 125.56 1qew s LEU 272 Ca -0.02 -0.09 -0.08 0.00 0.01 0.00 0.00 54.13 53.96 1qew s LEU 272 Cb -0.18 -2.38 0.03 0.00 0.01 0.00 0.00 46.19 43.67 1qew s LEU 272 CO -0.09 0.15 0.25 0.00 1.01 0.00 0.00 176.35 177.66 1qew s ARG 273 N -2.55 0.27 0.26 1.70 1.70 -1.26 0.06 118.95 119.13 1qew s ARG 273 Ca 0.29 0.40 -0.30 0.00 -0.47 0.00 0.00 55.73 55.64 1qew s ARG 273 Cb -0.11 0.07 -0.11 0.00 -0.57 0.00 0.00 34.95 34.22 1qew s ARG 273 CO 0.21 -0.07 1.56 -0.46 -1.08 0.00 0.00 175.30 175.47 1qew s TRP 274 N 0.44 2.87 0.00 5.89 -0.11 -1.26 -5.07 118.94 121.70 1qew s TRP 274 Ca -0.03 0.79 0.00 0.00 1.22 0.00 0.00 56.10 58.09 1qew s TRP 274 Cb -0.04 -4.00 0.00 0.00 -1.50 0.00 0.00 33.47 27.93 1qew s TRP 274 CO -0.02 -3.39 0.15 0.39 -4.62 0.00 0.00 176.95 169.45