#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h9h s SER 2 N 0.00 6.55 0.10 1.61 0.01 -1.26 -3.61 113.70 117.10 3h9h s SER 2 Ca 0.00 1.30 0.02 0.00 1.31 0.00 0.00 55.95 58.58 3h9h s SER 2 Cb 0.00 -2.40 -0.04 0.00 0.21 0.00 0.00 66.02 63.79 3h9h s SER 2 CO 0.00 -0.48 -0.06 -1.00 0.41 0.00 0.00 173.24 172.11 3h9h s HIS 3 N -2.49 0.89 0.03 2.43 4.02 -0.38 -4.96 115.29 114.82 3h9h s HIS 3 Ca 0.54 -0.93 -0.06 0.00 1.02 0.00 0.00 55.06 55.63 3h9h s HIS 3 Cb -0.10 -0.52 -0.01 0.00 -1.02 0.00 0.00 32.58 30.93 3h9h s HIS 3 CO 0.32 -0.17 0.10 -1.54 1.02 0.00 0.00 174.74 174.47 3h9h s SER 4 N -3.04 0.14 -0.08 1.40 1.04 -1.26 -0.42 113.70 111.47 3h9h s SER 4 Ca 0.12 -0.44 0.04 0.00 0.48 0.00 0.00 55.95 56.16 3h9h s SER 4 Cb 0.06 0.21 -0.01 0.00 0.10 0.00 0.00 66.02 66.38 3h9h s SER 4 CO -0.04 -0.46 -0.23 -0.32 0.98 0.00 0.00 173.24 173.17 3h9h s MET 5 N -2.18 2.87 0.00 4.02 1.75 -0.66 -0.77 119.30 124.33 3h9h s MET 5 Ca -0.09 -0.86 0.00 0.00 -1.25 0.00 0.00 55.69 53.49 3h9h s MET 5 Cb -0.04 -2.29 -0.00 0.00 2.84 0.00 0.00 34.83 35.35 3h9h s MET 5 CO -0.03 0.28 -0.00 1.03 -0.65 0.00 0.00 175.02 175.65 3h9h s ARG 6 N 0.10 0.00 -0.06 4.11 0.52 -0.18 -1.78 118.95 121.66 3h9h s ARG 6 Ca -0.11 -0.00 0.04 0.00 -0.52 0.00 0.00 55.73 55.13 3h9h s ARG 6 Cb -0.16 -0.00 -0.02 0.00 0.52 0.00 0.00 34.95 35.29 3h9h s ARG 6 CO 0.06 -0.00 -0.17 0.71 0.02 0.00 0.00 175.30 175.92 3h9h s TYR 7 N -0.01 2.64 -0.11 -0.53 2.02 -0.31 -0.34 117.35 120.70 3h9h s TYR 7 Ca -0.00 -0.37 0.03 0.00 -0.37 0.00 0.00 57.07 56.36 3h9h s TYR 7 Cb -0.00 -1.65 0.01 0.00 -0.40 0.00 0.00 41.96 39.92 3h9h s TYR 7 CO -0.00 0.02 -0.20 -0.06 -1.57 0.00 0.00 175.55 173.74 3h9h s PHE 8 N -0.43 2.31 -0.02 2.71 0.40 0.24 -2.17 117.98 121.01 3h9h s PHE 8 Ca 0.05 -1.02 0.05 0.00 -0.60 0.00 0.00 56.93 55.41 3h9h s PHE 8 Cb -0.12 -1.58 -0.01 0.00 0.51 0.00 0.00 43.02 41.82 3h9h s PHE 8 CO 0.02 -0.46 -0.17 -0.06 0.70 0.00 0.00 175.22 175.25 3h9h s PHE 9 N 0.63 1.62 -0.07 0.36 0.08 0.37 -1.79 117.98 119.18 3h9h s PHE 9 Ca -0.13 -0.36 0.01 0.00 0.12 0.00 0.00 56.93 56.57 3h9h s PHE 9 Cb -0.16 -1.06 0.02 0.00 -0.57 0.00 0.00 43.02 41.25 3h9h s PHE 9 CO 0.03 -0.07 -0.07 0.99 -0.10 0.00 0.00 175.22 176.00 3h9h s THR 10 N -0.26 0.84 -0.09 0.64 2.01 0.07 -1.68 115.64 117.16 3h9h s THR 10 Ca 0.03 -0.26 0.02 0.00 0.31 0.00 0.00 61.69 61.80 3h9h s THR 10 Cb -0.08 -0.84 0.01 0.00 0.01 0.00 0.00 72.50 71.60 3h9h s THR 10 CO 0.00 0.31 -0.17 -0.55 -0.69 0.00 0.00 174.62 173.52 3h9h s SER 11 N 1.14 2.43 -0.12 3.53 0.15 0.53 -0.88 113.70 120.47 3h9h s SER 11 Ca -0.07 -0.43 0.01 0.00 0.70 0.00 0.00 55.95 56.17 3h9h s SER 11 Cb -0.14 -1.11 0.02 0.00 -1.71 0.00 0.00 66.02 63.08 3h9h s SER 11 CO -0.01 0.06 -0.14 -0.69 1.20 0.00 0.00 173.24 173.65 3h9h s VAL 12 N 0.72 1.48 0.48 4.45 1.01 -0.41 -0.96 120.40 127.17 3h9h s VAL 12 Ca -0.12 -0.61 -0.19 0.00 0.00 0.00 0.00 61.98 61.06 3h9h s VAL 12 Cb -0.16 -1.38 -0.09 0.00 0.00 0.00 0.00 36.38 34.75 3h9h s VAL 12 CO 0.03 0.44 0.97 -0.94 0.00 0.00 0.00 175.10 175.60 3h9h s SER 13 N 1.19 6.77 -0.41 3.32 1.04 -0.45 -0.76 113.70 124.40 3h9h s SER 13 Ca -0.02 1.63 0.04 0.00 0.48 0.00 0.00 55.95 58.07 3h9h s SER 13 Cb -0.14 -2.52 0.17 0.00 0.10 0.00 0.00 66.02 63.62 3h9h s SER 13 CO -0.05 -0.48 0.37 0.00 0.98 0.00 0.00 173.24 174.06 3h9h s ARG 14 N -3.65 0.85 0.30 4.02 1.70 -1.26 -4.06 118.95 116.84 3h9h s ARG 14 Ca 0.60 -1.75 -0.30 0.00 -0.47 0.00 0.00 55.73 53.82 3h9h s ARG 14 Cb -0.10 -1.15 -0.12 0.00 -0.57 0.00 0.00 34.95 33.01 3h9h s ARG 14 CO 0.23 -1.34 1.46 -2.30 -1.08 0.00 0.00 175.30 172.27 3h9h n PRO 15 N 3.16 2.38 0.00 3.89 -0.02 -1.26 -1.55 135.00 141.59 3h9h n PRO 15 Ca 0.24 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.56 3h9h n PRO 15 Cb 0.47 -2.53 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 3h9h n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3h9h n GLY 16 N 1.58 2.62 1.01 -1.23 0.00 -1.26 -4.80 105.19 103.12 3h9h n GLY 16 Ca 0.07 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.07 3h9h n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h9h n ARG 17 N -2.00 2.08 0.00 1.61 1.74 -0.60 -5.08 116.66 114.41 3h9h n ARG 17 Ca 0.00 -3.48 0.00 0.00 -0.77 0.00 0.00 57.85 53.60 3h9h n ARG 17 Cb 0.00 -1.80 0.00 0.00 -1.02 0.00 0.00 32.46 29.64 3h9h n ARG 17 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h9h n GLY 18 N -1.03 1.36 3.77 -0.13 0.00 -1.24 -4.91 105.19 103.02 3h9h n GLY 18 Ca 0.27 -0.70 -0.38 0.00 0.00 0.00 0.00 46.02 45.21 3h9h n GLY 18 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h9h s GLU 19 N 0.00 4.09 0.36 1.61 2.02 -1.26 -4.47 118.70 121.04 3h9h s GLU 19 Ca 0.00 1.76 -0.28 0.00 0.02 0.00 0.00 54.97 56.47 3h9h s GLU 19 Cb 0.00 -2.66 -0.12 0.00 0.10 0.00 0.00 34.13 31.46 3h9h s GLU 19 CO 0.00 -0.26 1.29 -2.30 0.02 0.00 0.00 175.26 174.00 3h9h n PRO 20 N 0.07 2.10 -2.50 0.39 -0.02 -1.26 -4.67 135.00 129.10 3h9h n PRO 20 Ca 0.04 0.74 -0.40 0.00 -2.02 0.00 0.00 63.50 61.86 3h9h n PRO 20 Cb 0.47 -2.34 -0.04 0.00 -0.02 0.00 0.00 33.50 31.57 3h9h n PRO 20 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 3h9h s ARG 21 N -1.94 4.64 -0.07 -0.52 3.52 0.06 -4.83 118.95 119.81 3h9h s ARG 21 Ca 0.56 1.77 0.00 0.00 -0.13 0.00 0.00 55.73 57.94 3h9h s ARG 21 Cb -0.56 -3.18 0.02 0.00 -1.56 0.00 0.00 34.95 29.68 3h9h s ARG 21 CO 0.62 0.23 -0.05 0.12 -0.81 0.00 0.00 175.30 175.40 3h9h s PHE 22 N -1.18 0.98 -0.09 5.12 5.36 -1.26 -1.28 117.98 125.63 3h9h s PHE 22 Ca 0.45 -0.35 0.03 0.00 -0.96 0.00 0.00 56.93 56.09 3h9h s PHE 22 Cb -0.31 -0.88 0.01 0.00 -0.34 0.00 0.00 43.02 41.50 3h9h s PHE 22 CO 0.40 -0.31 -0.19 0.42 -1.46 0.00 0.00 175.22 174.08 3h9h s ILE 23 N 1.35 1.66 -0.04 3.12 1.01 -0.06 -1.22 121.20 127.03 3h9h s ILE 23 Ca -0.04 -0.78 0.07 0.00 0.00 0.00 0.00 60.65 59.90 3h9h s ILE 23 Cb -0.14 -1.46 -0.02 0.00 0.01 0.00 0.00 42.46 40.86 3h9h s ILE 23 CO -0.03 0.47 -0.25 0.00 0.00 0.00 0.00 174.94 175.13 3h9h s ALA 24 N 0.53 2.12 0.02 9.38 0.00 -0.40 -0.76 121.76 132.66 3h9h s ALA 24 Ca -0.16 -1.07 0.01 0.00 0.00 0.00 0.00 51.96 50.74 3h9h s ALA 24 Cb -0.17 -0.60 -0.02 0.00 0.00 0.00 0.00 23.12 22.34 3h9h s ALA 24 CO 0.06 0.47 -0.04 0.14 0.00 0.00 0.00 175.76 176.39 3h9h s VAL 25 N -0.39 0.23 -0.02 0.00 -7.23 -0.74 -0.53 120.40 111.73 3h9h s VAL 25 Ca 0.04 -0.78 0.06 0.00 -1.81 0.00 0.00 61.98 59.49 3h9h s VAL 25 Cb -0.12 -0.32 -0.02 0.00 0.56 0.00 0.00 36.38 36.48 3h9h s VAL 25 CO 0.01 -0.36 -0.21 -0.83 -0.31 0.00 0.00 175.10 173.40 3h9h s GLY 26 N -1.20 1.03 0.07 2.32 0.00 -0.90 -0.59 107.32 108.05 3h9h s GLY 26 Ca -0.11 -0.91 0.07 0.00 0.00 0.00 0.00 44.72 43.77 3h9h s GLY 26 CO -0.00 -0.75 -0.19 -0.19 0.00 0.00 0.00 173.10 171.97 3h9h s TYR 27 N -0.49 1.61 -0.20 1.90 1.51 0.53 -0.94 117.35 121.27 3h9h s TYR 27 Ca 0.08 -0.40 -0.03 0.00 -1.01 0.00 0.00 57.07 55.70 3h9h s TYR 27 Cb -0.08 -0.92 -0.01 0.00 -0.11 0.00 0.00 41.96 40.84 3h9h s TYR 27 CO -0.01 0.12 -0.05 0.08 -1.11 0.00 0.00 175.55 174.59 3h9h s VAL 28 N -1.03 3.46 0.00 0.71 1.01 -0.00 -1.01 120.40 123.54 3h9h s VAL 28 Ca 0.05 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.55 3h9h s VAL 28 Cb -0.09 -2.55 0.00 0.00 0.00 0.00 0.00 36.38 33.73 3h9h s VAL 28 CO 0.03 0.44 0.00 0.47 0.00 0.00 0.00 175.10 176.04 3h9h n ASP 29 N 4.43 0.00 -1.88 3.32 8.00 0.05 -0.13 116.55 130.34 3h9h n ASP 29 Ca -0.18 0.00 -0.06 0.00 0.71 0.00 0.00 54.79 55.26 3h9h n ASP 29 Cb 0.51 0.00 0.29 0.00 -0.02 0.00 0.00 41.12 41.90 3h9h n ASP 29 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3h9h n ASP 30 N 4.40 4.56 -4.13 -2.24 8.00 -1.26 -4.88 116.55 120.99 3h9h n ASP 30 Ca 0.00 -3.27 -0.33 0.00 0.71 0.00 0.00 54.79 51.89 3h9h n ASP 30 Cb 0.00 -0.73 -0.15 0.00 -0.02 0.00 0.00 41.12 40.22 3h9h n ASP 30 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3h9h s THR 31 N -3.02 2.32 0.25 -3.53 2.01 0.81 -5.01 115.64 109.46 3h9h s THR 31 Ca 0.54 -1.12 -0.30 0.00 0.31 0.00 0.00 61.69 61.12 3h9h s THR 31 Cb 0.44 -2.13 -0.09 0.00 0.01 0.00 0.00 72.50 70.73 3h9h s THR 31 CO 0.12 0.31 1.32 -1.58 -0.69 0.00 0.00 174.62 174.11 3h9h s GLN 32 N 1.26 4.37 0.00 4.92 0.74 -1.26 -0.82 119.66 128.86 3h9h s GLN 32 Ca 0.00 2.13 0.00 0.00 0.05 0.00 0.00 55.36 57.54 3h9h s GLN 32 Cb -0.16 -3.15 0.00 0.00 1.10 0.00 0.00 33.01 30.81 3h9h s GLN 32 CO -0.09 -0.24 0.00 1.97 -0.55 0.00 0.00 175.29 176.38 3h9h n PHE 33 N 2.04 0.00 -4.14 1.67 -1.74 -0.12 -4.22 117.46 110.95 3h9h n PHE 33 Ca 0.04 0.00 -0.09 0.00 -0.56 0.00 0.00 57.45 56.84 3h9h n PHE 33 Cb 0.42 0.00 -0.10 0.00 1.52 0.00 0.00 39.48 41.32 3h9h n PHE 33 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 3h9h s VAL 34 N -1.46 0.31 0.08 1.97 -7.23 -1.20 -0.20 120.40 112.67 3h9h s VAL 34 Ca 0.00 -1.88 -0.11 0.00 -1.81 0.00 0.00 61.98 58.17 3h9h s VAL 34 Cb 0.00 -1.79 0.01 0.00 0.56 0.00 0.00 36.38 35.16 3h9h s VAL 34 CO 0.00 -0.74 0.26 0.00 -0.31 0.00 0.00 175.10 174.31 3h9h s ARG 35 N -3.95 0.88 -0.01 4.82 1.70 -0.63 -2.11 118.95 119.64 3h9h s ARG 35 Ca 0.16 -0.79 -0.01 0.00 -0.47 0.00 0.00 55.73 54.62 3h9h s ARG 35 Cb 0.07 0.37 0.01 0.00 -0.57 0.00 0.00 34.95 34.83 3h9h s ARG 35 CO -0.04 -0.30 0.03 0.12 -1.08 0.00 0.00 175.30 174.04 3h9h s PHE 36 N -3.51 -0.02 -0.10 5.89 5.36 0.31 -1.24 117.98 124.67 3h9h s PHE 36 Ca 0.02 0.08 -0.02 0.00 -0.96 0.00 0.00 56.93 56.05 3h9h s PHE 36 Cb 0.03 -0.01 0.03 0.00 -0.34 0.00 0.00 43.02 42.73 3h9h s PHE 36 CO -0.09 -0.02 0.00 0.34 -1.46 0.00 0.00 175.22 173.98 3h9h s ASP 37 N 0.13 1.91 0.65 6.13 2.15 -1.26 -1.28 116.67 125.11 3h9h s ASP 37 Ca -0.01 -0.25 0.44 0.00 0.43 0.00 0.00 52.55 53.16 3h9h s ASP 37 Cb -0.02 -0.51 2.35 0.00 -0.30 0.00 0.00 42.92 44.45 3h9h s ASP 37 CO -0.00 -0.21 2.34 0.77 -0.17 0.00 0.00 175.17 177.90 3h9h h SER 38 N 8.30 0.00 0.68 -0.34 4.64 -1.56 -0.77 113.55 124.50 3h9h h SER 38 Ca -0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 3h9h h SER 38 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 3h9h h SER 38 CO 0.29 0.00 -0.51 0.47 -0.87 0.00 0.00 176.83 176.21 3h9h n ASP 39 N -3.06 0.53 -4.82 4.97 9.92 -1.26 -4.93 116.55 117.90 3h9h n ASP 39 Ca -0.03 -0.05 -0.30 0.00 -0.53 0.00 0.00 54.79 53.89 3h9h n ASP 39 Cb 0.08 0.16 0.08 0.00 -0.64 0.00 0.00 41.12 40.80 3h9h n ASP 39 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3h9h s ALA 40 N -3.06 2.41 0.16 2.24 0.00 -0.30 -4.99 121.76 118.22 3h9h s ALA 40 Ca 0.09 -0.25 -0.05 0.00 0.00 0.00 0.00 51.96 51.76 3h9h s ALA 40 Cb 0.16 -3.08 0.00 0.00 0.00 0.00 0.00 23.12 20.20 3h9h s ALA 40 CO 0.69 -1.59 1.40 0.00 0.00 0.00 0.00 175.76 176.27 3h9h h ALA 41 N -0.99 0.53 -0.30 0.00 0.00 -1.91 -3.33 119.26 113.26 3h9h h ALA 41 Ca -0.46 -0.60 -0.10 0.00 0.00 0.00 0.00 54.91 53.74 3h9h h ALA 41 Cb 1.27 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 3h9h h ALA 41 CO 0.60 0.74 -0.25 0.66 0.00 0.00 0.00 179.25 181.00 3h9h h SER 42 N 0.36 0.59 -4.86 0.00 4.64 -1.94 -3.47 113.55 108.87 3h9h h SER 42 Ca -0.03 -0.21 -0.38 0.00 -0.47 0.00 0.00 61.79 60.70 3h9h h SER 42 Cb 1.32 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 63.23 3h9h h SER 42 CO 0.13 0.83 -0.56 0.00 -0.87 0.00 0.00 176.83 176.36 3h9h n GLN 43 N -4.11 -3.93 -4.22 4.77 1.13 -1.25 -5.00 117.38 104.77 3h9h n GLN 43 Ca -0.00 0.68 -0.19 0.00 -1.94 0.00 0.00 57.00 55.55 3h9h n GLN 43 Cb 0.42 -5.45 -0.12 0.00 0.11 0.00 0.00 30.24 25.21 3h9h n GLN 43 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 3h9h s ARG 44 N -5.78 0.96 0.28 -1.09 1.81 -1.26 -5.02 118.95 108.84 3h9h s ARG 44 Ca 0.32 -1.10 -0.29 0.00 -1.72 0.00 0.00 55.73 52.93 3h9h s ARG 44 Cb -0.16 -0.98 -0.10 0.00 -0.45 0.00 0.00 34.95 33.27 3h9h s ARG 44 CO 0.39 0.21 1.35 1.41 -0.68 0.00 0.00 175.30 177.98 3h9h s MET 45 N -2.11 4.34 0.04 3.54 -2.45 -1.26 -4.70 119.30 116.70 3h9h s MET 45 Ca 0.04 2.21 0.05 0.00 -1.25 0.00 0.00 55.69 56.74 3h9h s MET 45 Cb -0.08 -3.11 -0.02 0.00 1.25 0.00 0.00 34.83 32.87 3h9h s MET 45 CO 0.03 -0.27 -0.16 -1.21 1.05 0.00 0.00 175.02 174.46 3h9h s GLU 46 N -0.99 1.05 0.38 4.11 2.02 -0.38 -4.90 118.70 119.99 3h9h s GLU 46 Ca 0.54 -0.78 -0.26 0.00 0.02 0.00 0.00 54.97 54.49 3h9h s GLU 46 Cb -0.40 -1.08 -0.09 0.00 0.10 0.00 0.00 34.13 32.66 3h9h s GLU 46 CO 0.47 0.27 1.15 -1.25 0.02 0.00 0.00 175.26 175.92 3h9h s PRO 47 N -1.07 4.19 -0.04 0.39 0.04 -1.26 -1.61 135.00 135.63 3h9h s PRO 47 Ca 0.03 1.82 0.06 0.00 0.04 0.00 0.00 61.00 62.95 3h9h s PRO 47 Cb -0.08 -2.77 0.09 0.00 0.04 0.00 0.00 34.50 31.78 3h9h s PRO 47 CO 0.01 -0.20 0.99 0.54 0.04 0.00 0.00 177.00 178.39 3h9h n ARG 48 N 0.29 0.63 -3.79 4.56 5.12 0.72 -4.84 116.66 119.34 3h9h n ARG 48 Ca 0.03 -1.49 -0.13 0.00 -1.93 0.00 0.00 57.85 54.34 3h9h n ARG 48 Cb 0.46 -0.86 -0.11 0.00 -1.16 0.00 0.00 32.46 30.80 3h9h n ARG 48 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3h9h s ALA 49 N -1.00 -0.62 0.49 7.54 0.00 -1.24 -4.56 121.76 122.37 3h9h s ALA 49 Ca 0.10 0.52 0.14 0.00 0.00 0.00 0.00 51.96 52.72 3h9h s ALA 49 Cb 0.09 -0.24 1.17 0.00 0.00 0.00 0.00 23.12 24.13 3h9h s ALA 49 CO 0.01 -0.16 2.11 -1.35 0.00 0.00 0.00 175.76 176.37 3h9h h PRO 50 N 5.14 0.09 0.00 0.00 0.11 -1.95 -3.07 132.00 132.32 3h9h h PRO 50 Ca -0.27 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.83 3h9h h PRO 50 Cb 1.19 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.28 3h9h h PRO 50 CO 0.36 0.08 0.00 0.11 -0.21 0.00 0.00 178.00 178.35 3h9h h TRP 51 N 0.09 0.00 0.00 0.65 5.08 -1.97 -2.86 115.95 116.95 3h9h h TRP 51 Ca 0.02 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.99 3h9h h TRP 51 Cb 0.04 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.20 3h9h h TRP 51 CO 0.00 0.00 -1.13 1.51 -1.28 0.00 0.00 178.44 177.54 3h9h n ILE 52 N -2.54 0.29 0.29 0.12 0.13 -1.16 -3.96 119.36 112.53 3h9h n ILE 52 Ca 0.02 -0.37 0.18 0.00 -1.10 0.00 0.00 62.75 61.49 3h9h n ILE 52 Cb 0.31 -0.00 0.99 0.00 -0.84 0.00 0.00 39.64 40.09 3h9h n ILE 52 CO 0.00 0.00 0.00 -0.33 2.80 0.00 0.00 176.55 179.02 3h9h h GLU 53 N 0.00 0.00 0.00 9.51 5.08 -1.56 -1.92 114.58 125.69 3h9h h GLU 53 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3h9h h GLU 53 Cb 0.85 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.10 3h9h h GLU 53 CO 0.00 0.00 0.00 -0.56 -1.00 0.00 0.00 179.01 177.45 3h9h h GLN 54 N 0.00 0.00 -6.89 2.33 3.07 -1.72 -3.44 115.11 108.45 3h9h h GLN 54 Ca 0.02 0.00 -0.53 0.00 0.09 0.00 0.00 58.65 58.24 3h9h h GLN 54 Cb 0.20 0.00 0.07 0.00 0.08 0.00 0.00 27.48 27.83 3h9h h GLN 54 CO -0.00 0.00 0.66 -1.21 0.09 0.00 0.00 178.83 178.36 3h9h s GLU 55 N -3.81 4.30 0.41 0.06 0.41 -0.72 -5.00 118.70 114.35 3h9h s GLU 55 Ca -0.01 2.26 -0.06 0.00 -0.41 0.00 0.00 54.97 56.75 3h9h s GLU 55 Cb 0.10 -3.04 0.09 0.00 -1.78 0.00 0.00 34.13 29.51 3h9h s GLU 55 CO 0.49 -0.25 0.56 0.41 -0.49 0.00 0.00 175.26 175.97 3h9h n GLY 56 N 0.74 -1.03 0.28 -1.39 0.00 -1.26 -4.85 105.19 97.68 3h9h n GLY 56 Ca 0.00 -1.73 0.06 0.00 0.00 0.00 0.00 46.02 44.36 3h9h n GLY 56 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h9h h PRO 57 N 0.00 0.25 -0.63 1.61 0.13 -1.98 -2.62 132.00 128.76 3h9h h PRO 57 Ca -0.18 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 64.93 3h9h h PRO 57 Cb 0.51 -0.06 -0.03 0.00 0.13 0.00 0.00 31.00 31.56 3h9h h PRO 57 CO 0.13 0.17 0.39 1.49 -0.23 0.00 0.00 178.00 179.95 3h9h h GLU 58 N 0.26 0.85 -0.17 0.86 4.22 -1.99 0.13 114.58 118.74 3h9h h GLU 58 Ca 0.07 -0.07 -0.01 0.00 0.08 0.00 0.00 59.36 59.43 3h9h h GLU 58 Cb -0.01 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.05 3h9h h GLU 58 CO -0.01 0.60 0.07 -0.92 -2.18 0.00 0.00 179.01 176.57 3h9h h TYR 59 N 0.85 0.26 -0.31 0.92 3.20 -1.82 -1.36 116.97 118.71 3h9h h TYR 59 Ca 0.23 -0.02 -0.18 0.00 3.14 0.00 0.00 58.73 61.90 3h9h h TYR 59 Cb -0.04 -0.08 -0.00 0.00 1.54 0.00 0.00 36.73 38.15 3h9h h TYR 59 CO -0.02 0.32 -0.50 -1.49 -1.64 0.00 0.00 178.16 174.82 3h9h h TRP 60 N 0.12 1.09 -0.35 -3.82 4.06 -1.32 -0.33 115.95 115.40 3h9h h TRP 60 Ca 0.06 -0.37 -0.01 0.00 2.06 0.00 0.00 58.89 60.62 3h9h h TRP 60 Cb 0.17 -0.21 -0.02 0.00 -1.00 0.00 0.00 29.16 28.10 3h9h h TRP 60 CO -0.01 1.20 0.16 -0.44 -3.56 0.00 0.00 178.44 175.78 3h9h h ASP 61 N 0.69 0.46 -0.47 -3.49 3.32 -0.76 -1.72 116.42 114.45 3h9h h ASP 61 Ca 0.03 -0.14 -0.08 0.00 0.02 0.00 0.00 57.03 56.87 3h9h h ASP 61 Cb 1.10 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.52 3h9h h ASP 61 CO 0.11 0.47 -0.00 1.23 -1.72 0.00 0.00 179.24 179.33 3h9h h GLY 62 N 0.42 0.90 1.65 2.75 0.00 -1.08 -1.29 103.07 106.42 3h9h h GLY 62 Ca 0.12 -0.66 -0.07 0.00 0.00 0.00 0.00 47.33 46.72 3h9h h GLY 62 CO -0.01 0.61 -0.13 0.83 0.00 0.00 0.00 176.54 177.84 3h9h h GLU 63 N 0.68 0.43 -0.26 4.80 4.39 -1.05 -1.65 114.58 121.92 3h9h h GLU 63 Ca 0.13 -0.12 -0.06 0.00 0.34 0.00 0.00 59.36 59.66 3h9h h GLU 63 Cb 0.51 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.10 3h9h h GLU 63 CO 0.02 0.56 -0.07 1.15 -1.16 0.00 0.00 179.01 179.51 3h9h h THR 64 N 0.40 1.29 -0.04 1.13 2.02 -1.11 -1.41 112.91 115.19 3h9h h THR 64 Ca 0.08 -1.09 0.03 0.00 0.77 0.00 0.00 66.41 66.20 3h9h h THR 64 Cb 0.47 1.47 -0.04 0.00 -1.74 0.00 0.00 68.15 68.31 3h9h h THR 64 CO 0.03 0.34 -0.18 -0.09 0.37 0.00 0.00 175.52 175.99 3h9h h ARG 65 N 0.24 -0.26 -0.72 6.66 2.43 -1.06 -1.60 114.38 120.07 3h9h h ARG 65 Ca 0.06 0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.21 3h9h h ARG 65 Cb 0.54 0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.12 3h9h h ARG 65 CO 0.03 -0.17 0.31 0.87 -1.51 0.00 0.00 179.97 179.49 3h9h h LYS 66 N -0.27 1.07 -0.03 0.20 1.57 -1.28 -1.96 116.57 115.87 3h9h h LYS 66 Ca 0.07 -0.18 -0.13 0.00 -1.87 0.00 0.00 60.65 58.54 3h9h h LYS 66 Cb 0.36 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 3h9h h LYS 66 CO -0.20 0.87 -0.57 -0.24 -0.57 0.00 0.00 179.45 178.74 3h9h h VAL 67 N 1.03 1.39 -0.08 0.50 3.04 -1.16 0.16 116.25 121.14 3h9h h VAL 67 Ca 0.24 -1.93 -0.13 0.00 -1.01 0.00 0.00 66.70 63.87 3h9h h VAL 67 Cb 0.19 2.01 -0.01 0.00 -2.01 0.00 0.00 31.29 31.46 3h9h h VAL 67 CO -0.02 0.56 -0.54 0.11 -1.01 0.00 0.00 177.57 176.67 3h9h h LYS 68 N 0.08 0.24 -0.31 4.17 1.57 -1.16 -1.20 116.57 119.96 3h9h h LYS 68 Ca -0.00 -0.15 -0.09 0.00 -1.87 0.00 0.00 60.65 58.54 3h9h h LYS 68 Cb 1.03 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.35 3h9h h LYS 68 CO 0.08 0.72 -0.16 0.00 -0.57 0.00 0.00 179.45 179.52 3h9h h ALA 69 N 1.25 0.44 -0.62 3.86 0.00 -0.65 -1.74 119.26 121.80 3h9h h ALA 69 Ca 0.00 -0.34 0.12 0.00 0.00 0.00 0.00 54.91 54.69 3h9h h ALA 69 Cb 1.01 -0.11 -0.09 0.00 0.00 0.00 0.00 17.79 18.61 3h9h h ALA 69 CO 0.08 0.35 0.15 0.45 0.00 0.00 0.00 179.25 180.28 3h9h h HIS 70 N 0.42 0.23 -0.42 0.00 3.86 -0.91 -1.08 115.15 117.25 3h9h h HIS 70 Ca 0.07 0.04 0.06 0.00 -1.16 0.00 0.00 60.37 59.37 3h9h h HIS 70 Cb 0.69 -0.01 -0.05 0.00 1.06 0.00 0.00 27.41 29.10 3h9h h HIS 70 CO 0.06 -0.03 0.14 1.03 0.86 0.00 0.00 177.93 179.99 3h9h h SER 71 N 0.28 0.13 -0.46 2.45 0.87 -1.01 -1.46 113.55 114.34 3h9h h SER 71 Ca 0.33 0.05 -0.10 0.00 -1.23 0.00 0.00 61.79 60.84 3h9h h SER 71 Cb 0.49 0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 62.48 3h9h h SER 71 CO -0.41 0.11 -0.09 1.56 -0.53 0.00 0.00 176.83 177.47 3h9h h GLN 72 N 0.30 0.88 -0.12 2.24 1.08 -0.69 -1.89 115.11 116.91 3h9h h GLN 72 Ca 0.20 -0.33 -0.06 0.00 -1.45 0.00 0.00 58.65 57.01 3h9h h GLN 72 Cb 0.20 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.56 3h9h h GLN 72 CO -0.21 0.97 -0.21 0.00 -0.95 0.00 0.00 178.83 178.43 3h9h h THR 73 N 0.72 1.21 -0.16 -0.54 1.03 -0.94 -2.00 112.91 112.23 3h9h h THR 73 Ca 0.12 -0.96 -0.14 0.00 -0.01 0.00 0.00 66.41 65.42 3h9h h THR 73 Cb 0.63 1.35 -0.01 0.00 -1.07 0.00 0.00 68.15 69.06 3h9h h THR 73 CO 0.04 0.29 -0.50 0.45 -0.01 0.00 0.00 175.52 175.79 3h9h h HIS 74 N 0.19 0.55 -0.69 0.00 3.86 -1.02 -1.11 115.15 116.92 3h9h h HIS 74 Ca 0.03 -0.18 -0.01 0.00 -1.16 0.00 0.00 60.37 59.05 3h9h h HIS 74 Cb 0.48 -0.11 -0.03 0.00 1.06 0.00 0.00 27.41 28.81 3h9h h HIS 74 CO 0.01 0.86 0.38 -0.09 0.86 0.00 0.00 177.93 179.95 3h9h h ARG 75 N 0.35 0.97 -0.46 2.45 2.43 -0.92 -1.81 114.38 117.38 3h9h h ARG 75 Ca 0.01 -0.11 -0.05 0.00 -0.81 0.00 0.00 59.98 59.02 3h9h h ARG 75 Cb 1.01 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 30.35 3h9h h ARG 75 CO 0.09 0.73 0.11 0.28 -1.51 0.00 0.00 179.97 179.66 3h9h h VAL 76 N 0.95 1.24 -0.79 0.20 2.07 -1.19 -3.22 116.25 115.50 3h9h h VAL 76 Ca 0.24 -0.83 0.04 0.00 0.82 0.00 0.00 66.70 66.97 3h9h h VAL 76 Cb 0.04 0.90 -0.05 0.00 -1.52 0.00 0.00 31.29 30.66 3h9h h VAL 76 CO -0.04 0.30 0.50 0.44 0.02 0.00 0.00 177.57 178.79 3h9h h ASP 77 N 0.62 0.81 -0.80 0.57 3.32 -0.90 -1.89 116.42 118.15 3h9h h ASP 77 Ca 0.14 0.00 0.06 0.00 0.02 0.00 0.00 57.03 57.26 3h9h h ASP 77 Cb 0.33 -0.17 -0.05 0.00 0.22 0.00 0.00 39.33 39.66 3h9h h ASP 77 CO 0.00 0.55 0.52 -0.07 -1.72 0.00 0.00 179.24 178.52 3h9h h LEU 78 N 0.95 0.77 -0.32 1.55 3.38 -1.34 0.24 115.31 120.54 3h9h h LEU 78 Ca 0.33 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.20 3h9h h LEU 78 Cb 0.06 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 3h9h h LEU 78 CO -0.13 0.50 -0.20 1.23 0.09 0.00 0.00 178.44 179.93 3h9h h GLY 79 N 0.87 0.75 1.01 0.83 0.00 -1.46 -2.32 103.07 102.76 3h9h h GLY 79 Ca 0.34 -0.71 -0.07 0.00 0.00 0.00 0.00 47.33 46.89 3h9h h GLY 79 CO -0.12 0.64 0.04 -0.84 0.00 0.00 0.00 176.54 176.26 3h9h h THR 80 N 0.45 1.26 -0.27 4.70 2.02 -0.60 -1.72 112.91 118.76 3h9h h THR 80 Ca 0.06 -1.02 -0.14 0.00 0.77 0.00 0.00 66.41 66.08 3h9h h THR 80 Cb 0.75 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 68.06 3h9h h THR 80 CO 0.06 0.36 -0.42 -0.07 0.37 0.00 0.00 175.52 175.82 3h9h h LEU 81 N 0.76 0.70 -0.85 2.58 3.38 -1.02 0.18 115.31 121.03 3h9h h LEU 81 Ca 0.15 -0.32 0.04 0.00 0.09 0.00 0.00 57.88 57.84 3h9h h LEU 81 Cb 0.47 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.97 3h9h h LEU 81 CO 0.02 1.03 0.54 -0.09 0.09 0.00 0.00 178.44 180.03 3h9h h ARG 82 N 0.53 1.01 -0.11 1.13 2.43 -1.21 -1.63 114.38 116.53 3h9h h ARG 82 Ca 0.04 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.14 3h9h h ARG 82 Cb 0.95 -0.23 -0.00 0.00 -0.42 0.00 0.00 29.97 30.27 3h9h h ARG 82 CO 0.09 0.67 0.05 0.78 -1.51 0.00 0.00 179.97 180.04 3h9h h GLY 83 N 1.04 0.17 0.65 2.80 0.00 -0.75 -1.14 103.07 105.84 3h9h h GLY 83 Ca 0.35 -0.09 0.08 0.00 0.00 0.00 0.00 47.33 47.67 3h9h h GLY 83 CO -0.13 0.08 0.59 -0.97 0.00 0.00 0.00 176.54 176.12 3h9h h TYR 84 N 0.04 1.09 -0.69 5.60 0.05 -0.45 -2.93 116.97 119.68 3h9h h TYR 84 Ca 0.04 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.85 3h9h h TYR 84 Cb 0.14 -0.35 0.00 0.00 1.01 0.00 0.00 36.73 37.53 3h9h h TYR 84 CO -0.02 0.52 0.00 0.66 -1.05 0.00 0.00 178.16 178.27 3h9h n TYR 85 N -4.59 0.92 -4.10 4.88 4.01 -0.63 -4.95 117.16 112.70 3h9h n TYR 85 Ca 0.15 -0.50 -0.33 0.00 -0.16 0.00 0.00 57.90 57.07 3h9h n TYR 85 Cb 0.23 -0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.24 3h9h n TYR 85 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 3h9h n ASN 86 N 1.52 -3.07 -4.89 7.72 4.13 -0.91 -4.98 115.26 114.78 3h9h n ASN 86 Ca 0.23 -0.95 -0.29 0.00 1.68 0.00 0.00 54.58 55.24 3h9h n ASN 86 Cb 0.60 -3.09 -0.03 0.00 -1.54 0.00 0.00 39.78 35.72 3h9h n ASN 86 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 3h9h s GLN 87 N -6.78 3.71 0.71 3.52 -0.21 -0.48 -5.05 119.66 115.09 3h9h s GLN 87 Ca 0.58 0.34 -0.13 0.00 0.02 0.00 0.00 55.36 56.17 3h9h s GLN 87 Cb -0.31 -2.44 0.02 0.00 1.00 0.00 0.00 33.01 31.29 3h9h s GLN 87 CO 0.90 -0.02 1.09 0.45 -2.12 0.00 0.00 175.29 175.59 3h9h s SER 88 N -3.31 4.90 0.00 5.90 0.15 -1.26 -4.80 113.70 115.28 3h9h s SER 88 Ca 0.49 1.88 0.25 0.00 0.70 0.00 0.00 55.95 59.26 3h9h s SER 88 Cb -0.10 -2.53 1.29 0.00 -1.71 0.00 0.00 66.02 62.96 3h9h s SER 88 CO 0.33 -1.77 1.82 -0.62 1.20 0.00 0.00 173.24 174.20 3h9h n GLU 89 N -2.95 0.44 0.02 5.44 1.02 -1.26 -3.90 120.64 119.45 3h9h n GLU 89 Ca 0.09 0.04 0.11 0.00 -0.02 0.00 0.00 57.16 57.39 3h9h n GLU 89 Cb 0.53 -1.50 -0.09 0.00 -0.02 0.00 0.00 31.44 30.36 3h9h n GLU 89 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3h9h n ALA 90 N -1.22 3.10 -2.47 0.62 0.00 -1.26 -4.74 120.51 114.53 3h9h n ALA 90 Ca 0.13 -0.45 -0.31 0.00 0.00 0.00 0.00 53.44 52.81 3h9h n ALA 90 Cb 0.17 -0.87 -0.05 0.00 0.00 0.00 0.00 19.45 18.70 3h9h n ALA 90 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3h9h s GLY 91 N -4.13 2.22 0.08 0.00 0.00 -1.25 -4.66 107.32 99.57 3h9h s GLY 91 Ca -0.02 -0.36 -0.22 0.00 0.00 0.00 0.00 44.72 44.12 3h9h s GLY 91 CO 0.86 -0.23 0.65 -0.45 0.00 0.00 0.00 173.10 173.93 3h9h s SER 92 N -2.48 7.15 0.10 1.64 0.15 -1.26 -4.68 113.70 114.32 3h9h s SER 92 Ca 0.46 1.37 0.02 0.00 0.70 0.00 0.00 55.95 58.50 3h9h s SER 92 Cb -0.11 -2.41 -0.04 0.00 -1.71 0.00 0.00 66.02 61.75 3h9h s SER 92 CO 0.23 0.20 -0.07 -1.00 1.20 0.00 0.00 173.24 173.79 3h9h s HIS 93 N -0.84 0.94 -0.08 3.44 3.76 -1.26 -4.95 115.29 116.31 3h9h s HIS 93 Ca 0.32 -0.85 0.03 0.00 -0.15 0.00 0.00 55.06 54.41 3h9h s HIS 93 Cb -0.20 -0.53 0.00 0.00 1.11 0.00 0.00 32.58 32.96 3h9h s HIS 93 CO 0.21 -0.10 -0.19 0.99 -0.85 0.00 0.00 174.74 174.80 3h9h s THR 94 N -3.38 1.64 -0.12 1.30 2.01 -1.26 -1.34 115.64 114.49 3h9h s THR 94 Ca 0.11 -0.78 -0.02 0.00 0.31 0.00 0.00 61.69 61.31 3h9h s THR 94 Cb 0.03 -1.44 -0.03 0.00 0.01 0.00 0.00 72.50 71.08 3h9h s THR 94 CO -0.03 0.47 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.62 3h9h s VAL 95 N 0.44 3.81 0.06 3.82 1.01 -0.14 0.06 120.40 129.46 3h9h s VAL 95 Ca -0.16 -0.41 0.07 0.00 0.00 0.00 0.00 61.98 61.48 3h9h s VAL 95 Cb -0.17 -2.62 -0.03 0.00 0.00 0.00 0.00 36.38 33.57 3h9h s VAL 95 CO 0.06 0.54 -0.19 -1.10 0.00 0.00 0.00 175.10 174.42 3h9h s GLN 96 N -0.13 1.15 -0.03 2.72 -0.21 -0.60 -0.35 119.66 122.22 3h9h s GLN 96 Ca 0.02 -0.96 -0.02 0.00 0.02 0.00 0.00 55.36 54.42 3h9h s GLN 96 Cb -0.13 -1.27 0.01 0.00 1.00 0.00 0.00 33.01 32.62 3h9h s GLN 96 CO 0.03 0.31 0.07 0.50 -2.12 0.00 0.00 175.29 174.07 3h9h s ARG 97 N -1.42 0.06 0.01 2.91 3.52 -0.68 -0.27 118.95 123.08 3h9h s ARG 97 Ca 0.05 0.13 0.03 0.00 -0.13 0.00 0.00 55.73 55.81 3h9h s ARG 97 Cb -0.09 -0.02 -0.01 0.00 -1.56 0.00 0.00 34.95 33.27 3h9h s ARG 97 CO 0.02 -0.05 -0.10 1.41 -0.81 0.00 0.00 175.30 175.78 3h9h s MET 98 N 0.28 0.72 0.13 5.12 -2.45 0.09 -0.48 119.30 122.71 3h9h s MET 98 Ca -0.02 -0.44 -0.09 0.00 -1.25 0.00 0.00 55.69 53.89 3h9h s MET 98 Cb -0.03 -0.68 -0.00 0.00 1.25 0.00 0.00 34.83 35.36 3h9h s MET 98 CO -0.01 0.18 0.25 1.52 1.05 0.00 0.00 175.02 178.01 3h9h s TYR 99 N -0.45 0.25 -5.00 4.11 -0.85 -0.92 -0.89 117.35 113.60 3h9h s TYR 99 Ca 0.02 -0.64 0.00 0.00 -0.52 0.00 0.00 57.07 55.92 3h9h s TYR 99 Cb -0.05 -0.04 0.00 0.00 0.38 0.00 0.00 41.96 42.25 3h9h s TYR 99 CO 0.00 -0.64 0.00 0.41 -1.52 0.00 0.00 175.55 173.80 3h9h n GLY 100 N -0.14 -0.75 3.17 5.49 0.00 -0.89 -1.17 105.19 110.90 3h9h n GLY 100 Ca -0.11 -1.20 -0.11 0.00 0.00 0.00 0.00 46.02 44.60 3h9h n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h9h s ASP 102 N -1.90 4.56 0.20 0.00 1.01 -0.06 -1.66 116.67 118.82 3h9h s ASP 102 Ca -0.07 -0.06 0.10 0.00 0.71 0.00 0.00 52.55 53.23 3h9h s ASP 102 Cb -0.03 -1.17 -0.04 0.00 1.01 0.00 0.00 42.92 42.69 3h9h s ASP 102 CO -0.02 0.34 -0.13 0.68 0.21 0.00 0.00 175.17 176.26 3h9h s VAL 103 N -0.71 2.96 0.00 -1.27 -7.23 0.44 -0.03 120.40 114.57 3h9h s VAL 103 Ca 0.11 -1.85 0.00 0.00 -1.81 0.00 0.00 61.98 58.43 3h9h s VAL 103 Cb -0.11 -2.48 0.00 0.00 0.56 0.00 0.00 36.38 34.35 3h9h s VAL 103 CO 0.01 -0.17 0.00 0.61 -0.31 0.00 0.00 175.10 175.24 3h9h n GLY 104 N -0.09 0.15 0.38 2.32 0.00 -0.72 -1.25 105.19 105.98 3h9h n GLY 104 Ca -0.10 -1.85 0.20 0.00 0.00 0.00 0.00 46.02 44.27 3h9h n GLY 104 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3h9h h SER 105 N 0.00 0.00 -0.08 1.61 0.02 -1.90 -0.55 113.55 112.65 3h9h h SER 105 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3h9h h SER 105 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 3h9h h SER 105 CO 0.00 0.00 0.00 -0.90 -1.14 0.00 0.00 176.83 174.79 3h9h n ASP 106 N -4.30 1.06 -1.39 3.07 5.75 -1.26 -4.79 116.55 114.68 3h9h n ASP 106 Ca 0.09 -1.52 -0.17 0.00 -0.01 0.00 0.00 54.79 53.19 3h9h n ASP 106 Cb 0.59 -0.05 -0.06 0.00 -1.03 0.00 0.00 41.12 40.57 3h9h n ASP 106 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 3h9h n TRP 107 N -0.12 -0.15 -3.88 2.11 7.02 -0.21 -5.01 117.44 117.20 3h9h n TRP 107 Ca 0.17 0.00 -0.30 0.00 -1.02 0.00 0.00 57.50 56.35 3h9h n TRP 107 Cb 0.25 -2.97 -0.04 0.00 -2.42 0.00 0.00 31.31 26.13 3h9h n TRP 107 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 3h9h s ARG 108 N -3.67 3.47 0.08 -0.99 0.52 -1.26 -4.80 118.95 112.30 3h9h s ARG 108 Ca 0.00 -0.41 -0.35 0.00 -0.52 0.00 0.00 55.73 54.45 3h9h s ARG 108 Cb 0.00 -3.00 -0.14 0.00 0.52 0.00 0.00 34.95 32.33 3h9h s ARG 108 CO 0.00 0.57 1.60 0.34 0.02 0.00 0.00 175.30 177.84 3h9h n PHE 109 N 0.13 2.15 -0.07 -0.53 7.35 -1.26 -1.75 117.46 123.49 3h9h n PHE 109 Ca -0.05 0.29 -0.13 0.00 -0.76 0.00 0.00 57.45 56.80 3h9h n PHE 109 Cb 0.52 -2.53 -0.05 0.00 0.35 0.00 0.00 39.48 37.77 3h9h n PHE 109 CO 0.00 0.00 0.00 -0.11 -0.76 0.00 0.00 176.76 175.89 3h9h n LEU 110 N 3.97 1.56 -3.55 -2.13 7.94 0.96 -4.85 117.00 120.90 3h9h n LEU 110 Ca 0.19 0.09 -0.17 0.00 -1.11 0.00 0.00 56.01 55.01 3h9h n LEU 110 Cb 0.27 -0.40 -0.06 0.00 0.53 0.00 0.00 43.42 43.75 3h9h n LEU 110 CO 0.66 0.41 0.42 -0.13 -1.11 0.00 0.00 177.39 177.64 3h9h s ARG 111 N -2.25 1.00 0.08 1.96 0.52 -1.14 -4.98 118.95 114.14 3h9h s ARG 111 Ca -0.18 0.41 0.06 0.00 -0.52 0.00 0.00 55.73 55.51 3h9h s ARG 111 Cb 0.06 0.47 -0.03 0.00 0.52 0.00 0.00 34.95 35.98 3h9h s ARG 111 CO 0.25 -0.27 -0.17 0.20 0.02 0.00 0.00 175.30 175.32 3h9h s GLY 112 N -0.84 1.02 0.02 -3.53 0.00 -1.26 -0.89 107.32 101.85 3h9h s GLY 112 Ca -0.09 -1.09 -0.04 0.00 0.00 0.00 0.00 44.72 43.51 3h9h s GLY 112 CO 0.08 -1.09 0.06 -2.52 0.00 0.00 0.00 173.10 169.62 3h9h s TYR 113 N -1.16 0.20 -0.27 1.90 -0.85 -0.48 -4.82 117.35 111.85 3h9h s TYR 113 Ca 0.02 -0.44 -0.03 0.00 -0.52 0.00 0.00 57.07 56.10 3h9h s TYR 113 Cb -0.10 -0.15 0.16 0.00 0.38 0.00 0.00 41.96 42.25 3h9h s TYR 113 CO 0.03 -0.28 0.52 -1.58 -1.52 0.00 0.00 175.55 172.72 3h9h s HIS 114 N -1.92 -1.26 0.05 -3.49 2.46 -1.26 -2.10 115.29 107.76 3h9h s HIS 114 Ca -0.11 1.49 0.02 0.00 0.47 0.00 0.00 55.06 56.93 3h9h s HIS 114 Cb -0.06 0.40 -0.03 0.00 -0.13 0.00 0.00 32.58 32.77 3h9h s HIS 114 CO -0.02 -0.77 -0.08 -0.65 -2.47 0.00 0.00 174.74 170.75 3h9h s GLN 115 N 2.74 0.55 -0.05 2.88 -0.21 -0.07 -0.46 119.66 125.05 3h9h s GLN 115 Ca 0.13 -0.80 -0.04 0.00 0.02 0.00 0.00 55.36 54.67 3h9h s GLN 115 Cb -0.15 -0.30 0.01 0.00 1.00 0.00 0.00 33.01 33.58 3h9h s GLN 115 CO -0.18 0.05 0.13 -0.47 -2.12 0.00 0.00 175.29 172.69 3h9h s TYR 116 N -1.51 -0.14 0.04 0.91 6.14 -0.22 -0.74 117.35 121.83 3h9h s TYR 116 Ca -0.09 0.35 0.06 0.00 0.64 0.00 0.00 57.07 58.03 3h9h s TYR 116 Cb -0.09 0.04 -0.02 0.00 0.42 0.00 0.00 41.96 42.31 3h9h s TYR 116 CO 0.00 -0.07 -0.16 0.00 0.64 0.00 0.00 175.55 175.96 3h9h s ALA 117 N 0.13 1.37 -0.11 3.97 0.00 0.63 -1.09 121.76 126.65 3h9h s ALA 117 Ca -0.01 -0.89 0.03 0.00 0.00 0.00 0.00 51.96 51.10 3h9h s ALA 117 Cb -0.01 -0.24 0.00 0.00 0.00 0.00 0.00 23.12 22.86 3h9h s ALA 117 CO -0.00 0.28 -0.23 -0.47 0.00 0.00 0.00 175.76 175.34 3h9h s TYR 118 N -0.80 2.60 -1.52 0.00 5.04 -0.69 -1.55 117.35 120.42 3h9h s TYR 118 Ca 0.04 -1.08 -0.14 0.00 -2.44 0.00 0.00 57.07 53.45 3h9h s TYR 118 Cb -0.08 -1.74 0.09 0.00 0.35 0.00 0.00 41.96 40.58 3h9h s TYR 118 CO 0.01 -0.44 0.86 -0.25 -1.34 0.00 0.00 175.55 174.39 3h9h n ASP 119 N 3.64 -4.51 0.00 4.32 8.00 0.11 -2.05 116.55 126.06 3h9h n ASP 119 Ca -0.19 -0.73 0.00 0.00 0.71 0.00 0.00 54.79 54.58 3h9h n ASP 119 Cb 0.53 -3.63 0.00 0.00 -0.02 0.00 0.00 41.12 38.00 3h9h n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h9h n GLY 120 N -1.55 0.77 3.51 0.44 0.00 -1.26 -5.01 105.19 102.09 3h9h n GLY 120 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 3h9h n GLY 120 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h9h s LYS 121 N -0.12 2.27 0.11 1.61 1.02 -0.87 -5.09 119.74 118.67 3h9h s LYS 121 Ca 0.00 -0.88 -0.36 0.00 0.02 0.00 0.00 55.97 54.76 3h9h s LYS 121 Cb 0.00 -2.32 -0.16 0.00 -0.52 0.00 0.00 37.83 34.83 3h9h s LYS 121 CO 0.00 0.56 1.36 -0.25 -0.92 0.00 0.00 175.35 176.10 3h9h n ASP 122 N 1.54 1.86 -0.01 2.83 10.43 -1.26 -1.70 116.55 130.24 3h9h n ASP 122 Ca -0.16 1.12 -0.02 0.00 2.57 0.00 0.00 54.79 58.30 3h9h n ASP 122 Cb 0.52 -1.24 -0.01 0.00 1.84 0.00 0.00 41.12 42.24 3h9h n ASP 122 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3h9h n TYR 123 N 2.51 0.00 -3.87 1.24 9.36 -0.25 -4.73 117.16 121.41 3h9h n TYR 123 Ca 0.18 0.00 -0.12 0.00 3.32 0.00 0.00 57.90 61.28 3h9h n TYR 123 Cb 0.22 -0.13 -0.13 0.00 -0.63 0.00 0.00 39.34 38.67 3h9h n TYR 123 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 3h9h s ILE 124 N -1.82 0.02 -0.02 2.97 2.07 -1.06 -1.23 121.20 122.13 3h9h s ILE 124 Ca -0.08 -0.17 -0.01 0.00 -1.41 0.00 0.00 60.65 58.98 3h9h s ILE 124 Cb 0.01 -0.12 0.01 0.00 0.13 0.00 0.00 42.46 42.49 3h9h s ILE 124 CO 0.11 -0.09 0.05 0.00 -1.91 0.00 0.00 174.94 173.10 3h9h s ALA 125 N -0.27 -0.08 0.10 1.50 0.00 -0.38 -1.06 121.76 121.57 3h9h s ALA 125 Ca -0.03 0.21 -0.31 0.00 0.00 0.00 0.00 51.96 51.84 3h9h s ALA 125 Cb -0.02 -0.15 -0.07 0.00 0.00 0.00 0.00 23.12 22.88 3h9h s ALA 125 CO -0.00 -0.05 1.30 -1.17 0.00 0.00 0.00 175.76 175.84 3h9h s LEU 126 N 0.35 4.38 0.89 0.00 2.96 0.39 -0.40 118.68 127.25 3h9h s LEU 126 Ca -0.03 2.21 -0.12 0.00 -0.22 0.00 0.00 54.13 55.97 3h9h s LEU 126 Cb -0.04 -3.59 0.12 0.00 0.50 0.00 0.00 46.19 43.19 3h9h s LEU 126 CO -0.01 -0.57 1.15 -0.54 -1.32 0.00 0.00 176.35 175.06 3h9h s LYS 127 N 0.97 1.35 0.49 1.98 1.02 0.10 -4.62 119.74 121.04 3h9h s LYS 127 Ca 0.61 0.25 0.18 0.00 0.02 0.00 0.00 55.97 57.03 3h9h s LYS 127 Cb -0.34 -1.87 1.22 0.00 -0.52 0.00 0.00 37.83 36.33 3h9h s LYS 127 CO 0.30 -2.05 2.08 1.49 -0.92 0.00 0.00 175.35 176.26 3h9h h GLU 128 N -1.39 0.00 0.00 1.68 4.81 -1.87 -1.75 114.58 116.06 3h9h h GLU 128 Ca -0.49 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 3h9h h GLU 128 Cb 1.33 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.71 3h9h h GLU 128 CO 0.63 0.10 0.00 -0.40 -0.73 0.00 0.00 179.01 178.61 3h9h n ASP 129 N -4.28 0.61 -0.26 1.04 5.75 -1.26 -4.82 116.55 113.34 3h9h n ASP 129 Ca -0.03 0.67 -0.03 0.00 -0.01 0.00 0.00 54.79 55.39 3h9h n ASP 129 Cb 0.18 -0.79 -0.01 0.00 -1.03 0.00 0.00 41.12 39.46 3h9h n ASP 129 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 3h9h n LEU 130 N -2.20 0.07 -0.01 -2.12 4.77 -0.66 -4.83 117.00 112.01 3h9h n LEU 130 Ca 0.01 0.08 -0.02 0.00 -0.03 0.00 0.00 56.01 56.06 3h9h n LEU 130 Cb 0.19 -1.50 -0.02 0.00 -2.33 0.00 0.00 43.42 39.76 3h9h n LEU 130 CO 0.17 -0.49 -0.60 0.54 -1.33 0.00 0.00 177.39 175.69 3h9h n ARG 131 N -1.66 1.73 -4.00 3.23 1.74 -1.26 -4.77 116.66 111.66 3h9h n ARG 131 Ca -0.03 0.01 -0.30 0.00 -0.77 0.00 0.00 57.85 56.75 3h9h n ARG 131 Cb 0.26 -1.07 -0.05 0.00 -1.02 0.00 0.00 32.46 30.58 3h9h n ARG 131 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3h9h s SER 132 N -3.85 5.84 -0.07 0.55 1.04 -1.26 -4.92 113.70 111.03 3h9h s SER 132 Ca -0.03 0.09 0.03 0.00 0.48 0.00 0.00 55.95 56.51 3h9h s SER 132 Cb 0.01 -1.66 -0.02 0.00 0.10 0.00 0.00 66.02 64.45 3h9h s SER 132 CO 0.09 0.16 -0.14 0.26 0.98 0.00 0.00 173.24 174.59 3h9h s TRP 133 N -1.46 2.72 -0.38 5.02 0.52 -1.26 0.03 118.94 124.13 3h9h s TRP 133 Ca 0.31 -0.33 -0.22 0.00 0.02 0.00 0.00 56.10 55.88 3h9h s TRP 133 Cb -0.12 -1.69 0.01 0.00 -1.15 0.00 0.00 33.47 30.52 3h9h s TRP 133 CO 0.24 0.05 0.75 0.99 0.02 0.00 0.00 176.95 179.00 3h9h s THR 134 N -0.38 4.76 -0.20 2.01 2.01 0.46 -4.93 115.64 119.37 3h9h s THR 134 Ca 0.04 0.71 -0.11 0.00 0.31 0.00 0.00 61.69 62.64 3h9h s THR 134 Cb -0.12 -4.20 -0.05 0.00 0.01 0.00 0.00 72.50 68.14 3h9h s THR 134 CO 0.02 -0.46 0.20 0.00 -0.69 0.00 0.00 174.62 173.69 3h9h s ALA 135 N 3.03 3.63 -0.57 7.40 0.00 -1.26 -1.24 121.76 132.75 3h9h s ALA 135 Ca 0.29 -0.68 0.24 0.00 0.00 0.00 0.00 51.96 51.82 3h9h s ALA 135 Cb -0.13 -2.30 0.48 0.00 0.00 0.00 0.00 23.12 21.16 3h9h s ALA 135 CO 0.17 0.01 1.54 0.00 0.00 0.00 0.00 175.76 177.49 3h9h h ALA 136 N 6.96 0.85 -2.13 0.00 0.00 -1.46 -3.47 119.26 120.02 3h9h h ALA 136 Ca -0.40 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.51 3h9h h ALA 136 Cb 1.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.95 3h9h h ALA 136 CO 0.73 0.00 0.00 -0.40 0.00 0.00 0.00 179.25 179.58 3h9h n ASP 137 N -2.52 0.00 -0.18 0.00 5.68 -1.26 -5.03 116.55 113.24 3h9h n ASP 137 Ca 0.04 -0.95 -0.03 0.00 -0.50 0.00 0.00 54.79 53.35 3h9h n ASP 137 Cb 0.48 0.00 0.17 0.00 -1.14 0.00 0.00 41.12 40.62 3h9h n ASP 137 CO 0.00 0.00 0.00 0.24 -1.33 0.00 0.00 177.20 176.11 3h9h h MET 138 N 0.00 0.94 -0.24 0.11 2.86 -1.99 -1.59 114.93 115.01 3h9h h MET 138 Ca 0.00 -0.17 -0.05 0.00 -2.06 0.00 0.00 59.70 57.42 3h9h h MET 138 Cb 0.00 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.50 3h9h h MET 138 CO 0.00 0.79 -0.04 0.00 1.06 0.00 0.00 176.91 178.73 3h9h h ALA 139 N 1.32 0.33 -0.11 6.32 0.00 -1.97 -2.48 119.26 122.67 3h9h h ALA 139 Ca 0.21 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 3h9h h ALA 139 Cb 0.24 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3h9h h ALA 139 CO -0.01 0.11 -0.06 0.00 0.00 0.00 0.00 179.25 179.28 3h9h h ALA 140 N 0.78 1.70 -0.16 0.00 0.00 -1.82 -2.15 119.26 117.61 3h9h h ALA 140 Ca 0.06 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 3h9h h ALA 140 Cb 0.48 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 3h9h h ALA 140 CO 0.02 0.23 -0.14 1.96 0.00 0.00 0.00 179.25 181.32 3h9h h GLN 141 N 0.16 0.26 -0.46 0.00 4.20 -0.86 0.14 115.11 118.54 3h9h h GLN 141 Ca 0.04 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 3h9h h GLN 141 Cb 0.22 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 27.94 3h9h h GLN 141 CO 0.01 0.41 0.24 1.15 -0.67 0.00 0.00 178.83 179.97 3h9h h THR 142 N 0.25 1.17 -0.48 -0.54 2.02 -0.99 -2.21 112.91 112.13 3h9h h THR 142 Ca 0.05 -0.45 -0.05 0.00 0.77 0.00 0.00 66.41 66.74 3h9h h THR 142 Cb 0.40 0.62 -0.02 0.00 -1.74 0.00 0.00 68.15 67.42 3h9h h THR 142 CO 0.02 0.18 0.12 0.74 0.37 0.00 0.00 175.52 176.95 3h9h h THR 143 N 0.60 1.24 -0.81 3.16 2.02 -1.29 -3.07 112.91 114.76 3h9h h THR 143 Ca 0.16 -0.83 0.13 0.00 0.77 0.00 0.00 66.41 66.64 3h9h h THR 143 Cb 0.07 0.86 -0.09 0.00 -1.74 0.00 0.00 68.15 67.26 3h9h h THR 143 CO -0.02 0.30 0.42 0.50 0.37 0.00 0.00 175.52 177.08 3h9h h LYS 144 N 0.64 0.62 -0.10 6.66 3.64 -0.49 0.02 116.57 127.55 3h9h h LYS 144 Ca 0.15 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.45 3h9h h LYS 144 Cb 0.32 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.99 3h9h h LYS 144 CO 0.00 0.41 -0.14 0.45 -2.27 0.00 0.00 179.45 177.90 3h9h h HIS 145 N 0.63 0.17 -0.14 1.91 3.86 -1.31 -1.48 115.15 118.80 3h9h h HIS 145 Ca 0.43 -0.02 -0.21 0.00 -1.16 0.00 0.00 60.37 59.41 3h9h h HIS 145 Cb 0.55 -0.05 0.01 0.00 1.06 0.00 0.00 27.41 28.98 3h9h h HIS 145 CO -0.10 0.31 -0.75 0.87 0.86 0.00 0.00 177.93 179.12 3h9h h LYS 146 N 0.16 0.75 -0.00 2.45 1.57 -1.01 -3.35 116.57 117.12 3h9h h LYS 146 Ca 0.03 -0.62 0.00 0.00 -1.87 0.00 0.00 60.65 58.19 3h9h h LYS 146 Cb 0.35 0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.79 3h9h h LYS 146 CO 0.02 1.23 -0.18 0.91 -0.57 0.00 0.00 179.45 180.87 3h9h n TRP 147 N -3.99 0.00 0.10 -1.35 7.02 -0.23 -3.67 117.44 115.32 3h9h n TRP 147 Ca -0.08 0.00 0.11 0.00 -1.02 0.00 0.00 57.50 56.51 3h9h n TRP 147 Cb 0.73 -0.19 -0.01 0.00 -2.42 0.00 0.00 31.31 29.42 3h9h n TRP 147 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 3h9h n GLU 148 N -0.93 0.61 -1.73 -0.99 1.02 -0.62 -4.20 120.64 113.80 3h9h n GLU 148 Ca 0.13 0.11 -0.41 0.00 -0.02 0.00 0.00 57.16 56.97 3h9h n GLU 148 Cb 0.31 -1.81 0.00 0.00 -0.02 0.00 0.00 31.44 29.92 3h9h n GLU 148 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3h9h n ALA 149 N -2.19 1.66 -0.09 0.62 0.00 -1.24 -4.74 120.51 114.53 3h9h n ALA 149 Ca -0.01 0.31 -0.02 0.00 0.00 0.00 0.00 53.44 53.72 3h9h n ALA 149 Cb 0.56 -2.32 -0.02 0.00 0.00 0.00 0.00 19.45 17.67 3h9h n ALA 149 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3h9h n PRO 150 N 0.28 -0.09 -0.30 0.00 -0.01 -1.26 -2.26 135.00 131.35 3h9h n PRO 150 Ca 0.04 0.74 -0.02 0.00 -0.01 0.00 0.00 63.50 64.25 3h9h n PRO 150 Cb 0.38 -1.09 0.15 0.00 -0.01 0.00 0.00 33.50 32.93 3h9h n PRO 150 CO 0.00 0.00 0.00 1.12 -0.01 0.00 0.00 175.50 176.61 3h9h h HIS 151 N 0.00 1.14 -0.15 6.00 2.07 -1.99 -2.88 115.15 119.34 3h9h h HIS 151 Ca 0.03 0.00 -0.20 0.00 -2.85 0.00 0.00 60.37 57.36 3h9h h HIS 151 Cb 0.09 -0.38 0.00 0.00 2.57 0.00 0.00 27.41 29.69 3h9h h HIS 151 CO -0.61 0.75 -0.71 -0.24 -3.07 0.00 0.00 177.93 174.06 3h9h h VAL 152 N 1.20 1.31 -0.35 6.12 3.04 -1.79 -2.84 116.25 122.94 3h9h h VAL 152 Ca 0.31 -1.97 0.04 0.00 -1.01 0.00 0.00 66.70 64.07 3h9h h VAL 152 Cb -0.06 1.95 -0.04 0.00 -2.01 0.00 0.00 31.29 31.13 3h9h h VAL 152 CO -0.06 0.62 0.13 0.00 -1.01 0.00 0.00 177.57 177.24 3h9h h ALA 153 N 0.75 0.41 -0.63 3.17 0.00 -1.32 -2.62 119.26 119.01 3h9h h ALA 153 Ca -0.03 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 3h9h h ALA 153 Cb 1.30 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.08 3h9h h ALA 153 CO 0.14 -0.27 0.24 1.49 0.00 0.00 0.00 179.25 180.85 3h9h h GLU 154 N 0.28 0.96 -0.71 0.00 4.22 -1.53 -2.36 114.58 115.43 3h9h h GLU 154 Ca 0.16 -0.18 -0.03 0.00 0.08 0.00 0.00 59.36 59.39 3h9h h GLU 154 Cb 0.13 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 3h9h h GLU 154 CO -0.16 0.82 0.34 1.96 -2.18 0.00 0.00 179.01 179.79 3h9h h GLN 155 N 0.89 1.03 -0.18 1.92 4.20 -1.32 0.22 115.11 121.86 3h9h h GLN 155 Ca 0.21 -0.15 -0.17 0.00 0.06 0.00 0.00 58.65 58.59 3h9h h GLN 155 Cb 0.23 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 27.82 3h9h h GLN 155 CO -0.01 0.81 -0.59 1.25 -0.67 0.00 0.00 178.83 179.62 3h9h h LEU 156 N 1.00 0.67 -0.56 1.46 5.85 -1.45 -1.61 115.31 120.67 3h9h h LEU 156 Ca 0.24 -0.37 -0.03 0.00 0.84 0.00 0.00 57.88 58.57 3h9h h LEU 156 Cb 0.12 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.94 3h9h h LEU 156 CO -0.03 1.10 0.24 -0.09 -0.34 0.00 0.00 178.44 179.33 3h9h h ARG 157 N 0.45 0.83 -0.47 1.25 2.43 -0.91 -0.69 114.38 117.26 3h9h h ARG 157 Ca 0.00 -0.14 -0.04 0.00 -0.81 0.00 0.00 59.98 58.99 3h9h h ARG 157 Cb 1.15 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 30.53 3h9h h ARG 157 CO 0.11 0.70 0.11 0.00 -1.51 0.00 0.00 179.97 179.38 3h9h h ALA 158 N 1.08 1.31 0.15 2.80 0.00 -0.42 -1.42 119.26 122.78 3h9h h ALA 158 Ca 0.19 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 3h9h h ALA 158 Cb 0.17 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.76 3h9h h ALA 158 CO -0.02 0.49 -0.07 -0.92 0.00 0.00 0.00 179.25 178.72 3h9h h TYR 159 N 0.69 -0.19 -0.02 0.00 3.20 -1.07 -2.41 116.97 117.17 3h9h h TYR 159 Ca 0.15 -0.00 -0.19 0.00 3.14 0.00 0.00 58.73 61.83 3h9h h TYR 159 Cb 0.26 0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.59 3h9h h TYR 159 CO 0.01 0.11 -0.82 -0.07 -1.64 0.00 0.00 178.16 175.76 3h9h h LEU 160 N -0.50 0.30 0.00 2.82 3.38 -0.76 0.19 115.31 120.74 3h9h h LEU 160 Ca -0.02 -0.23 -0.25 0.00 0.09 0.00 0.00 57.88 57.47 3h9h h LEU 160 Cb 0.39 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.01 3h9h h LEU 160 CO 0.03 1.00 -1.48 -0.33 0.09 0.00 0.00 178.44 177.75 3h9h h GLU 161 N 0.15 0.00 0.00 1.13 5.08 -1.44 -3.38 114.58 116.12 3h9h h GLU 161 Ca -0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 3h9h h GLU 161 Cb 1.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.67 3h9h h GLU 161 CO 0.13 0.57 0.00 0.41 -1.00 0.00 0.00 179.01 179.12 3h9h n GLY 162 N 1.48 -0.27 0.23 -3.84 0.00 -0.93 -4.44 105.19 97.42 3h9h n GLY 162 Ca -0.12 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.88 3h9h n GLY 162 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3h9h h THR 163 N 0.00 0.95 -0.43 2.61 2.02 -1.18 -0.60 112.91 116.28 3h9h h THR 163 Ca 0.00 -0.20 -0.06 0.00 0.77 0.00 0.00 66.41 66.92 3h9h h THR 163 Cb 0.00 0.31 -0.02 0.00 -1.74 0.00 0.00 68.15 66.70 3h9h h THR 163 CO 0.00 0.11 0.06 0.00 0.37 0.00 0.00 175.52 176.05 3h9h h VAL 165 N 0.58 1.21 -0.39 0.00 2.07 -1.64 -0.63 116.25 117.45 3h9h h VAL 165 Ca 0.13 -0.66 0.07 0.00 0.82 0.00 0.00 66.70 67.06 3h9h h VAL 165 Cb 0.40 1.37 -0.06 0.00 -1.52 0.00 0.00 31.29 31.48 3h9h h VAL 165 CO 0.01 0.20 -0.00 -0.33 0.02 0.00 0.00 177.57 177.47 3h9h h GLU 166 N 0.03 0.10 -0.20 1.57 5.08 -0.93 -1.33 114.58 118.90 3h9h h GLU 166 Ca 0.05 -0.01 -0.18 0.00 -1.00 0.00 0.00 59.36 58.22 3h9h h GLU 166 Cb 0.28 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.50 3h9h h GLU 166 CO 0.00 0.07 -0.61 -1.49 -1.00 0.00 0.00 179.01 175.98 3h9h h TRP 167 N 0.10 0.87 -0.38 4.33 4.06 -1.07 -1.39 115.95 122.47 3h9h h TRP 167 Ca 0.19 -0.33 0.07 0.00 2.06 0.00 0.00 58.89 60.88 3h9h h TRP 167 Cb 0.27 -0.16 -0.06 0.00 -1.00 0.00 0.00 29.16 28.22 3h9h h TRP 167 CO -0.27 1.11 0.02 1.25 -3.56 0.00 0.00 178.44 177.00 3h9h h LEU 168 N 0.50 -0.10 -0.77 -4.49 5.85 -0.89 -0.86 115.31 114.55 3h9h h LEU 168 Ca -0.00 0.08 -0.08 0.00 0.84 0.00 0.00 57.88 58.72 3h9h h LEU 168 Cb 1.19 0.13 -0.02 0.00 0.37 0.00 0.00 40.66 42.33 3h9h h LEU 168 CO 0.12 -0.02 0.06 0.03 -0.34 0.00 0.00 178.44 178.29 3h9h h ARG 169 N 0.13 0.99 -0.48 1.25 3.08 -1.00 -0.15 114.38 118.20 3h9h h ARG 169 Ca 0.18 -0.27 0.02 0.00 0.07 0.00 0.00 59.98 59.98 3h9h h ARG 169 Cb 0.25 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.16 3h9h h ARG 169 CO -0.29 0.94 0.30 -0.09 -1.07 0.00 0.00 179.97 179.76 3h9h h ARG 170 N 0.92 0.58 -0.39 0.04 2.43 -0.86 -1.30 114.38 115.79 3h9h h ARG 170 Ca 0.18 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.30 3h9h h ARG 170 Cb 0.46 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.86 3h9h h ARG 170 CO 0.02 0.38 0.19 1.88 -1.51 0.00 0.00 179.97 180.93 3h9h h TYR 171 N 0.60 0.57 -0.80 2.20 0.05 -0.79 0.19 116.97 118.99 3h9h h TYR 171 Ca 0.18 -0.03 0.11 0.00 0.05 0.00 0.00 58.73 59.04 3h9h h TYR 171 Cb -0.02 -0.18 -0.08 0.00 1.01 0.00 0.00 36.73 37.47 3h9h h TYR 171 CO -0.06 0.48 0.43 -0.07 -1.05 0.00 0.00 178.16 177.89 3h9h h LEU 172 N 0.50 0.58 0.08 3.88 3.38 -0.74 0.28 115.31 123.28 3h9h h LEU 172 Ca 0.14 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.16 3h9h h LEU 172 Cb 0.12 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3h9h h LEU 172 CO -0.02 0.31 -0.04 -0.33 0.09 0.00 0.00 178.44 178.46 3h9h h GLU 173 N 0.70 -0.10 -0.12 1.13 5.08 -0.90 -2.63 114.58 117.74 3h9h h GLU 173 Ca 0.40 0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.70 3h9h h GLU 173 Cb 0.44 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 3h9h h GLU 173 CO -0.28 0.37 -0.22 -0.91 -1.00 0.00 0.00 179.01 176.96 3h9h h ASN 174 N -0.64 0.20 -0.70 1.42 2.35 -0.38 -2.91 115.58 114.92 3h9h h ASN 174 Ca -0.01 -0.05 -0.42 0.00 -0.55 0.00 0.00 56.30 55.26 3h9h h ASN 174 Cb 0.52 -0.05 -0.24 0.00 0.05 0.00 0.00 38.32 38.60 3h9h h ASN 174 CO 0.02 0.43 0.16 0.61 -1.65 0.00 0.00 177.43 177.00 3h9h n GLY 175 N -0.67 5.29 0.25 2.83 0.00 0.98 -4.86 105.19 109.01 3h9h n GLY 175 Ca -0.01 -1.68 -0.02 0.00 0.00 0.00 0.00 46.02 44.32 3h9h n GLY 175 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3h9h h LYS 176 N 1.42 -0.02 -0.18 1.61 3.64 -1.26 0.40 116.57 122.18 3h9h h LYS 176 Ca 0.42 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.84 3h9h h LYS 176 Cb 1.71 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.52 3h9h h LYS 176 CO 0.87 -0.01 0.13 0.93 -2.27 0.00 0.00 179.45 179.09 3h9h h GLU 177 N -0.02 0.05 0.02 1.90 5.08 -1.89 -0.76 114.58 118.96 3h9h h GLU 177 Ca 0.28 -0.00 -0.36 0.00 -1.00 0.00 0.00 59.36 58.28 3h9h h GLU 177 Cb 0.46 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.64 3h9h h GLU 177 CO -0.63 0.03 -2.03 2.41 -1.00 0.00 0.00 179.01 177.80 3h9h n THR 178 N -4.49 1.57 -0.00 1.13 -1.04 -0.71 -4.40 114.28 106.32 3h9h n THR 178 Ca 0.01 -0.34 -0.08 0.00 -2.04 0.00 0.00 64.05 61.60 3h9h n THR 178 Cb 0.23 -1.84 -0.14 0.00 -1.82 0.00 0.00 70.33 66.76 3h9h n THR 178 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 3h9h h LEU 179 N -0.68 0.00 -1.58 -4.42 3.38 -0.16 -3.30 115.31 108.56 3h9h h LEU 179 Ca -0.53 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.44 3h9h h LEU 179 Cb 1.62 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.37 3h9h h LEU 179 CO -0.22 1.00 0.00 0.00 0.09 0.00 0.00 178.44 179.31 3h9h n GLN 180 N -3.11 2.02 -2.07 1.13 6.02 -0.30 -4.93 117.38 116.15 3h9h n GLN 180 Ca -0.13 -1.56 -0.31 0.00 -0.01 0.00 0.00 57.00 54.99 3h9h n GLN 180 Cb 1.03 -1.41 0.00 0.00 1.02 0.00 0.00 30.24 30.88 3h9h n GLN 180 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 3h9h s ARG 181 N -1.58 3.66 -0.10 -1.09 1.70 -1.25 -5.03 118.95 115.25 3h9h s ARG 181 Ca 0.33 0.72 -0.01 0.00 -0.47 0.00 0.00 55.73 56.30 3h9h s ARG 181 Cb 0.18 -2.13 0.03 0.00 -0.57 0.00 0.00 34.95 32.47 3h9h s ARG 181 CO 0.26 -0.47 -0.01 0.99 -1.08 0.00 0.00 175.30 174.99 3h9h s THR 182 N -3.02 0.53 -0.35 4.99 2.01 -1.26 -4.64 115.64 113.89 3h9h s THR 182 Ca 0.55 -0.09 -0.10 0.00 0.31 0.00 0.00 61.69 62.35 3h9h s THR 182 Cb -0.11 -0.73 0.02 0.00 0.01 0.00 0.00 72.50 71.69 3h9h s THR 182 CO 0.49 0.19 0.18 -1.81 -0.69 0.00 0.00 174.62 172.97 3h9h s ASP 183 N 1.90 5.64 0.39 3.53 1.01 0.90 -4.89 116.67 125.15 3h9h s ASP 183 Ca 0.04 -0.89 -0.27 0.00 0.71 0.00 0.00 52.55 52.14 3h9h s ASP 183 Cb -0.13 -2.00 -0.09 0.00 1.01 0.00 0.00 42.92 41.70 3h9h s ASP 183 CO -0.06 -0.33 1.33 0.00 0.21 0.00 0.00 175.17 176.32 3h9h s ALA 184 N 1.55 3.33 0.41 5.23 0.00 -1.26 -1.56 121.76 129.47 3h9h s ALA 184 Ca 0.02 1.29 -0.26 0.00 0.00 0.00 0.00 51.96 53.01 3h9h s ALA 184 Cb -0.19 -3.50 -0.09 0.00 0.00 0.00 0.00 23.12 19.34 3h9h s ALA 184 CO 0.06 -0.84 1.31 -1.25 0.00 0.00 0.00 175.76 175.04 3h9h s PRO 185 N -2.16 3.93 -0.14 0.00 0.04 -1.26 -4.54 135.00 130.87 3h9h s PRO 185 Ca 0.55 2.17 -0.20 0.00 0.04 0.00 0.00 61.00 63.56 3h9h s PRO 185 Cb -0.40 -2.74 -0.03 0.00 0.04 0.00 0.00 34.50 31.37 3h9h s PRO 185 CO 0.52 -0.53 0.57 0.15 0.04 0.00 0.00 177.00 177.75 3h9h s LYS 186 N -2.28 4.31 0.12 4.56 1.02 0.59 -4.85 119.74 123.21 3h9h s LYS 186 Ca 0.57 0.59 0.10 0.00 0.02 0.00 0.00 55.97 57.25 3h9h s LYS 186 Cb -0.38 -3.49 -0.04 0.00 -0.52 0.00 0.00 37.83 33.40 3h9h s LYS 186 CO 0.49 -0.01 -0.25 0.95 -0.92 0.00 0.00 175.35 175.62 3h9h s THR 187 N 1.14 2.04 0.39 2.17 -4.23 -1.26 -1.17 115.64 114.74 3h9h s THR 187 Ca 0.29 -1.66 -0.13 0.00 -1.18 0.00 0.00 61.69 59.01 3h9h s THR 187 Cb -0.16 -1.82 0.05 0.00 1.34 0.00 0.00 72.50 71.91 3h9h s THR 187 CO 0.12 0.04 0.76 -1.38 -0.54 0.00 0.00 174.62 173.62 3h9h s HIS 188 N -1.09 0.28 0.01 3.99 -3.43 -1.09 -5.00 115.29 108.97 3h9h s HIS 188 Ca 0.11 -0.93 0.03 0.00 -0.80 0.00 0.00 55.06 53.47 3h9h s HIS 188 Cb -0.10 0.74 -0.01 0.00 -1.43 0.00 0.00 32.58 31.77 3h9h s HIS 188 CO 0.05 -1.56 -0.10 1.41 -2.00 0.00 0.00 174.74 172.55 3h9h s MET 189 N -2.21 0.71 0.24 -0.38 1.75 -1.26 -0.35 119.30 117.80 3h9h s MET 189 Ca 0.18 -0.48 0.11 0.00 -1.25 0.00 0.00 55.69 54.26 3h9h s MET 189 Cb -0.04 -0.66 -0.05 0.00 2.84 0.00 0.00 34.83 36.91 3h9h s MET 189 CO 0.13 0.17 -0.21 0.95 -0.65 0.00 0.00 175.02 175.41 3h9h s THR 190 N -0.53 2.37 -0.08 10.11 -4.23 -0.09 -4.97 115.64 118.22 3h9h s THR 190 Ca 0.01 -2.23 -0.00 0.00 -1.18 0.00 0.00 61.69 58.29 3h9h s THR 190 Cb -0.05 -2.20 0.02 0.00 1.34 0.00 0.00 72.50 71.61 3h9h s THR 190 CO 0.00 -0.29 -0.04 -2.28 -0.54 0.00 0.00 174.62 171.47 3h9h s HIS 191 N -2.17 0.99 -0.05 3.99 2.46 -1.26 -1.06 115.29 118.20 3h9h s HIS 191 Ca 0.25 -0.37 0.01 0.00 0.47 0.00 0.00 55.06 55.43 3h9h s HIS 191 Cb -0.06 -0.91 0.02 0.00 -0.13 0.00 0.00 32.58 31.49 3h9h s HIS 191 CO 0.12 -0.34 -0.07 -1.01 -2.47 0.00 0.00 174.74 170.97 3h9h s HIS 192 N 1.53 0.97 0.00 3.88 3.76 -0.48 -4.97 115.29 119.98 3h9h s HIS 192 Ca -0.00 -0.31 -0.30 0.00 -0.15 0.00 0.00 55.06 54.30 3h9h s HIS 192 Cb -0.13 -0.78 -0.06 0.00 1.11 0.00 0.00 32.58 32.72 3h9h s HIS 192 CO -0.04 -0.21 1.42 0.00 -0.85 0.00 0.00 174.74 175.05 3h9h s ALA 193 N 0.80 3.59 -0.33 -1.40 0.00 -1.26 0.44 121.76 123.60 3h9h s ALA 193 Ca -0.13 0.90 0.22 0.00 0.00 0.00 0.00 51.96 52.95 3h9h s ALA 193 Cb -0.15 -3.60 -0.10 0.00 0.00 0.00 0.00 23.12 19.27 3h9h s ALA 193 CO 0.01 -0.93 0.85 1.33 0.00 0.00 0.00 175.76 177.02 3h9h n VAL 194 N 4.68 0.24 -2.80 0.00 0.24 -0.23 -4.89 118.33 115.57 3h9h n VAL 194 Ca 0.13 -0.41 0.00 0.00 -2.04 0.00 0.00 64.34 62.02 3h9h n VAL 194 Cb 0.43 0.01 0.00 0.00 -1.47 0.00 0.00 33.84 32.81 3h9h n VAL 194 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 3h9h n SER 195 N -2.25 0.00 -0.08 -1.34 3.41 -1.03 -4.97 113.62 107.36 3h9h n SER 195 Ca -0.00 -0.69 0.14 0.00 -0.26 0.00 0.00 58.87 58.05 3h9h n SER 195 Cb 0.51 0.00 0.62 0.00 -0.26 0.00 0.00 64.21 65.08 3h9h n SER 195 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3h9h n ASP 196 N -0.84 0.36 -0.02 4.04 5.68 -1.26 -3.90 116.55 120.62 3h9h n ASP 196 Ca 0.00 -0.42 0.01 0.00 -0.50 0.00 0.00 54.79 53.88 3h9h n ASP 196 Cb 0.00 -0.12 -0.01 0.00 -1.14 0.00 0.00 41.12 39.85 3h9h n ASP 196 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3h9h n HIS 197 N -1.07 0.00 -4.01 2.11 1.44 -1.26 -4.87 115.22 107.56 3h9h n HIS 197 Ca 0.14 0.00 -0.10 0.00 -2.01 0.00 0.00 57.72 55.74 3h9h n HIS 197 Cb 0.28 0.00 -0.11 0.00 0.12 0.00 0.00 29.99 30.27 3h9h n HIS 197 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 3h9h s GLU 198 N -1.10 0.38 0.08 -1.40 2.02 -1.25 -0.08 118.70 117.34 3h9h s GLU 198 Ca 0.01 -0.64 0.03 0.00 0.02 0.00 0.00 54.97 54.39 3h9h s GLU 198 Cb 0.02 -0.03 -0.03 0.00 0.10 0.00 0.00 34.13 34.19 3h9h s GLU 198 CO 0.10 -0.02 -0.09 0.00 0.02 0.00 0.00 175.26 175.27 3h9h s ALA 199 N -1.39 0.94 -0.20 5.21 0.00 0.17 -1.07 121.76 125.42 3h9h s ALA 199 Ca -0.14 -1.08 -0.14 0.00 0.00 0.00 0.00 51.96 50.60 3h9h s ALA 199 Cb -0.10 0.05 -0.04 0.00 0.00 0.00 0.00 23.12 23.03 3h9h s ALA 199 CO -0.01 -0.05 0.30 0.99 0.00 0.00 0.00 175.76 176.99 3h9h s THR 200 N -2.26 5.28 -0.23 0.00 2.01 0.17 -0.46 115.64 120.15 3h9h s THR 200 Ca 0.02 0.51 -0.10 0.00 0.31 0.00 0.00 61.69 62.42 3h9h s THR 200 Cb -0.04 -3.63 -0.05 0.00 0.01 0.00 0.00 72.50 68.79 3h9h s THR 200 CO -0.01 0.32 0.15 -0.76 -0.69 0.00 0.00 174.62 173.63 3h9h s LEU 201 N 0.98 4.10 -0.13 4.42 1.43 -0.12 -1.39 118.68 127.98 3h9h s LEU 201 Ca 0.15 0.13 0.02 0.00 -1.03 0.00 0.00 54.13 53.39 3h9h s LEU 201 Cb -0.14 -2.09 0.01 0.00 0.03 0.00 0.00 46.19 44.01 3h9h s LEU 201 CO 0.05 0.09 -0.18 -0.60 0.23 0.00 0.00 176.35 175.94 3h9h s ARG 202 N 0.89 2.61 -0.23 1.70 3.52 -0.22 -1.02 118.95 126.19 3h9h s ARG 202 Ca 0.07 -0.70 -0.12 0.00 -0.13 0.00 0.00 55.73 54.85 3h9h s ARG 202 Cb -0.13 -2.16 -0.05 0.00 -1.56 0.00 0.00 34.95 31.05 3h9h s ARG 202 CO 0.03 -0.05 0.21 0.00 -0.81 0.00 0.00 175.30 174.68 3h9h s TRP 204 N 1.08 2.97 -0.14 0.00 0.52 0.53 -1.61 118.94 122.28 3h9h s TRP 204 Ca 0.10 -0.04 0.01 0.00 0.02 0.00 0.00 56.10 56.19 3h9h s TRP 204 Cb -0.14 -1.77 0.02 0.00 -1.15 0.00 0.00 33.47 30.43 3h9h s TRP 204 CO 0.05 0.26 -0.18 0.00 0.02 0.00 0.00 176.95 177.10 3h9h s ALA 205 N -0.57 2.04 0.13 0.98 0.00 0.37 -2.67 121.76 122.03 3h9h s ALA 205 Ca 0.09 -0.99 0.06 0.00 0.00 0.00 0.00 51.96 51.12 3h9h s ALA 205 Cb -0.12 -1.02 -0.04 0.00 0.00 0.00 0.00 23.12 21.95 3h9h s ALA 205 CO 0.02 -0.21 -0.15 -0.51 0.00 0.00 0.00 175.76 174.92 3h9h s LEU 206 N 1.14 2.40 -1.48 0.00 1.43 -0.31 -0.93 118.68 120.94 3h9h s LEU 206 Ca -0.01 -0.81 -0.05 0.00 -1.03 0.00 0.00 54.13 52.23 3h9h s LEU 206 Cb -0.14 -0.60 0.01 0.00 0.03 0.00 0.00 46.19 45.48 3h9h s LEU 206 CO -0.07 -0.12 0.64 -0.24 0.23 0.00 0.00 176.35 176.79 3h9h n SER 207 N 0.52 -5.99 -4.84 2.29 2.88 -0.79 -0.30 113.62 107.38 3h9h n SER 207 Ca -0.15 -0.30 -0.25 0.00 -1.33 0.00 0.00 58.87 56.84 3h9h n SER 207 Cb 0.57 -4.79 -0.05 0.00 -0.75 0.00 0.00 64.21 59.19 3h9h n SER 207 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 3h9h s PHE 208 N -3.17 3.23 -0.26 0.66 -0.12 -1.04 -4.68 117.98 112.59 3h9h s PHE 208 Ca 0.32 -0.01 -0.15 0.00 -0.05 0.00 0.00 56.93 57.04 3h9h s PHE 208 Cb -0.14 -1.52 0.08 0.00 -0.63 0.00 0.00 43.02 40.80 3h9h s PHE 208 CO 0.39 0.51 0.63 -0.47 -0.05 0.00 0.00 175.22 176.24 3h9h s TYR 209 N -1.84 -0.96 1.12 3.49 5.04 -0.60 -0.82 117.35 122.78 3h9h s TYR 209 Ca 0.32 1.96 -0.19 0.00 -2.44 0.00 0.00 57.07 56.72 3h9h s TYR 209 Cb -0.10 0.55 0.26 0.00 0.35 0.00 0.00 41.96 43.03 3h9h s TYR 209 CO 0.25 -0.49 1.22 -1.25 -1.34 0.00 0.00 175.55 173.94 3h9h s PRO 210 N 1.53 -0.62 0.26 4.97 0.04 -1.26 -0.07 135.00 139.84 3h9h s PRO 210 Ca -0.09 -0.32 0.06 0.00 0.04 0.00 0.00 61.00 60.69 3h9h s PRO 210 Cb -0.06 -1.69 0.32 0.00 0.04 0.00 0.00 34.50 33.12 3h9h s PRO 210 CO -0.18 -3.27 1.61 0.00 0.04 0.00 0.00 177.00 175.20 3h9h h ALA 211 N -2.26 0.94 -1.84 8.56 0.00 -1.95 -3.45 119.26 119.27 3h9h h ALA 211 Ca -0.44 -0.51 -0.66 0.00 0.00 0.00 0.00 54.91 53.30 3h9h h ALA 211 Cb 1.26 -0.09 0.03 0.00 0.00 0.00 0.00 17.79 18.99 3h9h h ALA 211 CO 0.32 0.70 0.81 -1.91 0.00 0.00 0.00 179.25 179.17 3h9h n GLU 212 N -3.90 1.60 -3.56 0.00 4.07 -1.26 -4.97 120.64 112.62 3h9h n GLU 212 Ca -0.02 0.58 -0.15 0.00 -0.06 0.00 0.00 57.16 57.51 3h9h n GLU 212 Cb 0.58 -2.31 -0.06 0.00 -0.06 0.00 0.00 31.44 29.60 3h9h n GLU 212 CO 0.00 0.00 0.00 -1.50 -0.06 0.00 0.00 177.13 175.57 3h9h s ILE 213 N 2.34 0.02 -0.11 6.31 2.07 -1.26 -4.68 121.20 125.90 3h9h s ILE 213 Ca 0.89 -0.17 0.03 0.00 -1.41 0.00 0.00 60.65 59.99 3h9h s ILE 213 Cb -0.87 -0.95 0.01 0.00 0.13 0.00 0.00 42.46 40.77 3h9h s ILE 213 CO 0.52 -0.09 -0.20 -0.89 -1.91 0.00 0.00 174.94 172.37 3h9h s THR 214 N -2.03 1.81 -0.12 4.00 2.01 -0.66 -5.00 115.64 115.65 3h9h s THR 214 Ca -0.07 -0.85 0.02 0.00 0.31 0.00 0.00 61.69 61.10 3h9h s THR 214 Cb -0.01 -1.60 0.01 0.00 0.01 0.00 0.00 72.50 70.92 3h9h s THR 214 CO 0.02 0.50 -0.18 -0.76 -0.69 0.00 0.00 174.62 173.51 3h9h s LEU 215 N 0.67 1.87 0.01 4.42 1.02 -1.26 -0.92 118.68 124.48 3h9h s LEU 215 Ca -0.12 -0.50 -0.03 0.00 0.02 0.00 0.00 54.13 53.50 3h9h s LEU 215 Cb -0.16 -1.22 -0.01 0.00 0.02 0.00 0.00 46.19 44.81 3h9h s LEU 215 CO 0.03 0.04 0.04 0.42 0.02 0.00 0.00 176.35 176.90 3h9h s THR 216 N 0.93 0.09 -0.09 5.49 -4.23 -0.78 -4.96 115.64 112.09 3h9h s THR 216 Ca -0.07 -0.71 -0.05 0.00 -1.18 0.00 0.00 61.69 59.69 3h9h s THR 216 Cb -0.15 -0.30 -0.04 0.00 1.34 0.00 0.00 72.50 73.35 3h9h s THR 216 CO -0.02 -0.39 0.10 0.26 -0.54 0.00 0.00 174.62 174.03 3h9h s TRP 217 N -1.23 3.44 0.10 3.99 0.52 -1.26 -0.26 118.94 124.25 3h9h s TRP 217 Ca -0.13 0.39 0.10 0.00 0.02 0.00 0.00 56.10 56.48 3h9h s TRP 217 Cb -0.08 -1.87 -0.04 0.00 -1.15 0.00 0.00 33.47 30.33 3h9h s TRP 217 CO 0.00 0.64 -0.26 -0.65 0.02 0.00 0.00 176.95 176.70 3h9h s GLN 218 N -1.10 1.56 -0.19 4.98 -0.21 0.63 -1.48 119.66 123.86 3h9h s GLN 218 Ca 0.16 -1.26 0.01 0.00 0.02 0.00 0.00 55.36 54.29 3h9h s GLN 218 Cb -0.12 -1.94 0.02 0.00 1.00 0.00 0.00 33.01 31.98 3h9h s GLN 218 CO 0.05 0.47 -0.19 0.50 -2.12 0.00 0.00 175.29 174.01 3h9h s ARG 219 N -1.78 2.90 -1.63 2.91 3.52 -0.20 -0.69 118.95 123.98 3h9h s ARG 219 Ca 0.13 -0.87 -0.16 0.00 -0.13 0.00 0.00 55.73 54.70 3h9h s ARG 219 Cb -0.10 -2.58 0.13 0.00 -1.56 0.00 0.00 34.95 30.84 3h9h s ARG 219 CO 0.05 -0.24 0.87 -0.25 -0.81 0.00 0.00 175.30 174.92 3h9h n ASP 220 N 4.61 -3.94 0.00 -2.12 8.00 0.01 -1.80 116.55 121.31 3h9h n ASP 220 Ca -0.20 -0.91 0.00 0.00 0.71 0.00 0.00 54.79 54.39 3h9h n ASP 220 Cb 0.49 -3.25 0.00 0.00 -0.02 0.00 0.00 41.12 38.34 3h9h n ASP 220 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h9h n GLY 221 N -1.53 0.93 3.57 0.44 0.00 -1.26 -5.02 105.19 102.32 3h9h n GLY 221 Ca 0.06 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 3h9h n GLY 221 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3h9h s GLU 222 N -0.13 3.90 0.06 1.61 2.12 -0.75 -5.01 118.70 120.50 3h9h s GLU 222 Ca 0.00 -0.35 -0.36 0.00 0.36 0.00 0.00 54.97 54.61 3h9h s GLU 222 Cb 0.00 -3.51 -0.16 0.00 0.26 0.00 0.00 34.13 30.72 3h9h s GLU 222 CO 0.00 -0.10 1.47 -0.25 -0.54 0.00 0.00 175.26 175.84 3h9h n ASP 223 N 4.76 2.20 -2.24 -1.70 9.92 -1.26 -1.03 116.55 127.20 3h9h n ASP 223 Ca -0.15 1.10 -0.32 0.00 -0.53 0.00 0.00 54.79 54.89 3h9h n ASP 223 Cb 0.52 -1.26 0.06 0.00 -0.64 0.00 0.00 41.12 39.80 3h9h n ASP 223 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3h9h n GLN 224 N 3.27 2.96 -0.17 -1.24 1.13 -0.55 -4.84 117.38 117.94 3h9h n GLN 224 Ca 0.19 -3.55 -0.01 0.00 -1.94 0.00 0.00 57.00 51.69 3h9h n GLN 224 Cb 0.22 -2.29 0.08 0.00 0.11 0.00 0.00 30.24 28.36 3h9h n GLN 224 CO 0.00 0.00 0.00 1.79 -1.44 0.00 0.00 177.06 177.41 3h9h h THR 225 N 1.34 0.71 0.00 5.09 1.35 -1.91 -1.01 112.91 118.49 3h9h h THR 225 Ca 0.54 -0.09 0.00 0.00 -0.55 0.00 0.00 66.41 66.31 3h9h h THR 225 Cb 1.02 0.42 0.00 0.00 -1.73 0.00 0.00 68.15 67.87 3h9h h THR 225 CO 1.35 0.05 0.00 0.00 -0.25 0.00 0.00 175.52 176.67 3h9h n GLN 226 N -5.10 0.08 -0.05 4.72 6.02 -1.26 -3.05 117.38 118.74 3h9h n GLN 226 Ca 0.07 0.26 0.02 0.00 -0.01 0.00 0.00 57.00 57.34 3h9h n GLN 226 Cb 0.26 -1.63 0.05 0.00 1.02 0.00 0.00 30.24 29.94 3h9h n GLN 226 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 3h9h n ASP 227 N -1.78 2.11 -4.73 1.08 9.92 -0.47 -4.99 116.55 117.70 3h9h n ASP 227 Ca 0.04 -1.78 -0.36 0.00 -0.53 0.00 0.00 54.79 52.15 3h9h n ASP 227 Cb 0.24 -0.07 -0.07 0.00 -0.64 0.00 0.00 41.12 40.58 3h9h n ASP 227 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 3h9h s THR 228 N -0.83 5.33 -0.27 -3.53 2.01 -0.70 -4.57 115.64 113.07 3h9h s THR 228 Ca 0.08 0.47 -0.22 0.00 0.31 0.00 0.00 61.69 62.33 3h9h s THR 228 Cb 0.05 -3.60 -0.01 0.00 0.01 0.00 0.00 72.50 68.95 3h9h s THR 228 CO 0.06 0.40 0.72 -0.70 -0.69 0.00 0.00 174.62 174.41 3h9h s GLU 229 N 0.47 4.08 -0.18 4.92 2.12 0.05 -4.92 118.70 125.25 3h9h s GLU 229 Ca 0.15 0.65 0.01 0.00 0.36 0.00 0.00 54.97 56.13 3h9h s GLU 229 Cb -0.13 -3.67 0.03 0.00 0.26 0.00 0.00 34.13 30.63 3h9h s GLU 229 CO 0.03 -0.51 -0.13 -1.17 -0.54 0.00 0.00 175.26 172.94 3h9h s LEU 230 N 2.70 2.10 0.39 2.70 2.96 -1.26 -0.43 118.68 127.84 3h9h s LEU 230 Ca 0.30 -0.74 -0.11 0.00 -0.22 0.00 0.00 54.13 53.35 3h9h s LEU 230 Cb -0.15 -1.25 -0.07 0.00 0.50 0.00 0.00 46.19 45.22 3h9h s LEU 230 CO 0.09 -0.10 0.76 0.68 -1.32 0.00 0.00 176.35 176.46 3h9h s VAL 231 N 1.40 4.76 0.34 1.68 -7.23 -1.03 -5.02 120.40 115.30 3h9h s VAL 231 Ca 0.01 0.69 -0.29 0.00 -1.81 0.00 0.00 61.98 60.59 3h9h s VAL 231 Cb -0.15 -3.70 -0.12 0.00 0.56 0.00 0.00 36.38 32.97 3h9h s VAL 231 CO -0.09 -0.45 1.43 1.21 -0.31 0.00 0.00 175.10 176.89 3h9h n GLU 232 N -1.09 2.43 -1.73 4.82 2.13 -1.26 -4.64 120.64 121.29 3h9h n GLU 232 Ca 0.03 0.85 -0.42 0.00 0.66 0.00 0.00 57.16 58.28 3h9h n GLU 232 Cb 0.54 -2.53 -0.02 0.00 0.27 0.00 0.00 31.44 29.70 3h9h n GLU 232 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 3h9h n THR 233 N 0.81 1.13 -4.01 6.31 -1.04 -1.26 -4.87 114.28 111.34 3h9h n THR 233 Ca 0.05 -0.28 -0.12 0.00 -2.04 0.00 0.00 64.05 61.65 3h9h n THR 233 Cb 0.37 -1.88 -0.13 0.00 -1.82 0.00 0.00 70.33 66.88 3h9h n THR 233 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3h9h s ARG 234 N -0.68 0.32 0.16 -2.82 1.70 -0.54 -4.96 118.95 112.13 3h9h s ARG 234 Ca 0.63 -0.42 -0.30 0.00 -0.47 0.00 0.00 55.73 55.18 3h9h s ARG 234 Cb -0.52 -0.13 -0.07 0.00 -0.57 0.00 0.00 34.95 33.66 3h9h s ARG 234 CO 0.50 0.02 1.14 -1.25 -1.08 0.00 0.00 175.30 174.64 3h9h s PRO 235 N -0.87 4.54 0.39 3.89 0.04 -1.26 -1.06 135.00 140.66 3h9h s PRO 235 Ca -0.07 1.77 0.21 0.00 0.04 0.00 0.00 61.00 62.95 3h9h s PRO 235 Cb -0.06 -3.28 0.52 0.00 0.04 0.00 0.00 34.50 31.72 3h9h s PRO 235 CO -0.00 -0.02 1.65 0.00 0.04 0.00 0.00 177.00 178.67 3h9h h ALA 236 N 5.41 0.89 0.00 8.56 0.00 -1.55 -3.47 119.26 129.09 3h9h h ALA 236 Ca -0.44 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.22 3h9h h ALA 236 Cb 1.21 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3h9h h ALA 236 CO 0.74 0.34 0.00 0.41 0.00 0.00 0.00 179.25 180.74 3h9h n GLY 237 N 0.72 0.07 1.21 0.00 0.00 -1.26 -4.91 105.19 101.01 3h9h n GLY 237 Ca 0.02 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.12 3h9h n GLY 237 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3h9h n ASP 238 N 0.00 4.23 0.00 1.61 5.75 -1.26 -4.93 116.55 121.94 3h9h n ASP 238 Ca 0.00 -2.60 0.00 0.00 -0.01 0.00 0.00 54.79 52.18 3h9h n ASP 238 Cb 0.00 -0.51 0.00 0.00 -1.03 0.00 0.00 41.12 39.58 3h9h n ASP 238 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3h9h n GLY 239 N 0.41 0.65 3.82 6.12 0.00 -1.26 -5.06 105.19 109.87 3h9h n GLY 239 Ca 0.22 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.95 3h9h n GLY 239 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3h9h s THR 240 N -2.58 1.61 0.25 2.61 -4.23 -1.26 -4.88 115.64 107.16 3h9h s THR 240 Ca 0.00 -1.71 0.04 0.00 -1.18 0.00 0.00 61.69 58.85 3h9h s THR 240 Cb 0.00 -2.32 -0.05 0.00 1.34 0.00 0.00 72.50 71.47 3h9h s THR 240 CO 0.00 0.00 -0.01 -0.36 -0.54 0.00 0.00 174.62 173.71 3h9h s PHE 241 N -2.78 1.71 0.03 3.99 0.40 0.00 -1.41 117.98 119.93 3h9h s PHE 241 Ca 0.26 -0.86 0.02 0.00 -0.60 0.00 0.00 56.93 55.74 3h9h s PHE 241 Cb 0.00 -1.00 -0.02 0.00 0.51 0.00 0.00 43.02 42.51 3h9h s PHE 241 CO 0.15 0.06 -0.06 -0.65 0.70 0.00 0.00 175.22 175.42 3h9h s GLN 242 N -3.82 0.46 -0.03 0.44 -0.21 -0.22 -1.89 119.66 114.37 3h9h s GLN 242 Ca 0.29 -0.66 -0.24 0.00 0.02 0.00 0.00 55.36 54.77 3h9h s GLN 242 Cb 0.05 -0.21 0.05 0.00 1.00 0.00 0.00 33.01 33.91 3h9h s GLN 242 CO 0.10 0.03 0.53 0.21 -2.12 0.00 0.00 175.29 174.04 3h9h s LYS 243 N -1.39 0.90 0.12 2.91 2.20 -0.10 -1.47 119.74 122.92 3h9h s LYS 243 Ca -0.10 0.07 0.01 0.00 -0.36 0.00 0.00 55.97 55.60 3h9h s LYS 243 Cb -0.09 0.42 -0.04 0.00 -1.51 0.00 0.00 37.83 36.60 3h9h s LYS 243 CO 0.00 -0.27 -0.03 1.67 -0.36 0.00 0.00 175.35 176.36 3h9h s TRP 244 N -1.25 0.98 -0.03 4.03 1.48 -1.26 -0.48 118.94 122.41 3h9h s TRP 244 Ca -0.12 -0.98 0.01 0.00 -1.06 0.00 0.00 56.10 53.96 3h9h s TRP 244 Cb -0.02 -0.57 0.01 0.00 -1.16 0.00 0.00 33.47 31.74 3h9h s TRP 244 CO 0.08 -0.20 -0.05 0.00 -4.06 0.00 0.00 176.95 172.71 3h9h s ALA 245 N -3.67 0.65 0.06 2.67 0.00 -0.64 -2.48 121.76 118.35 3h9h s ALA 245 Ca 0.17 -0.12 0.08 0.00 0.00 0.00 0.00 51.96 52.09 3h9h s ALA 245 Cb 0.06 -0.34 -0.03 0.00 0.00 0.00 0.00 23.12 22.81 3h9h s ALA 245 CO -0.02 0.04 -0.21 0.00 0.00 0.00 0.00 175.76 175.57 3h9h s ALA 246 N 0.60 1.81 0.08 0.00 0.00 0.43 -0.38 121.76 124.30 3h9h s ALA 246 Ca -0.08 -1.13 0.06 0.00 0.00 0.00 0.00 51.96 50.81 3h9h s ALA 246 Cb -0.11 -0.32 -0.03 0.00 0.00 0.00 0.00 23.12 22.66 3h9h s ALA 246 CO 0.00 0.39 -0.17 0.14 0.00 0.00 0.00 175.76 176.12 3h9h s VAL 247 N -0.91 1.38 -0.25 0.00 -7.23 -0.19 -0.77 120.40 112.42 3h9h s VAL 247 Ca 0.07 -1.37 -0.11 0.00 -1.81 0.00 0.00 61.98 58.77 3h9h s VAL 247 Cb -0.09 -1.28 -0.05 0.00 0.56 0.00 0.00 36.38 35.52 3h9h s VAL 247 CO 0.03 -0.12 0.20 -0.69 -0.31 0.00 0.00 175.10 174.21 3h9h s VAL 248 N -1.17 5.32 -0.12 1.32 1.01 -1.26 -0.94 120.40 124.56 3h9h s VAL 248 Ca 0.02 0.24 0.01 0.00 0.00 0.00 0.00 61.98 62.25 3h9h s VAL 248 Cb -0.10 -3.54 -0.01 0.00 0.00 0.00 0.00 36.38 32.73 3h9h s VAL 248 CO 0.03 0.29 -0.16 -0.69 0.00 0.00 0.00 175.10 174.57 3h9h s VAL 249 N 1.39 2.74 0.39 2.92 1.01 0.39 -4.94 120.40 124.31 3h9h s VAL 249 Ca 0.09 -0.77 -0.26 0.00 0.00 0.00 0.00 61.98 61.03 3h9h s VAL 249 Cb -0.15 -2.12 -0.09 0.00 0.00 0.00 0.00 36.38 34.02 3h9h s VAL 249 CO 0.07 0.54 1.26 -2.84 0.00 0.00 0.00 175.10 174.13 3h9h s PRO 250 N 0.32 4.04 0.23 2.72 0.02 -1.26 -0.66 135.00 140.42 3h9h s PRO 250 Ca -0.13 2.05 -0.32 0.00 0.02 0.00 0.00 61.00 62.63 3h9h s PRO 250 Cb -0.16 -2.77 -0.13 0.00 0.02 0.00 0.00 34.50 31.46 3h9h s PRO 250 CO 0.07 -0.40 1.59 0.43 -0.33 0.00 0.00 177.00 178.35 3h9h n SER 251 N 0.19 3.51 0.00 2.53 7.64 0.88 -1.26 113.62 127.11 3h9h n SER 251 Ca 0.03 1.11 0.00 0.00 1.01 0.00 0.00 58.87 61.02 3h9h n SER 251 Cb 0.44 -1.52 0.00 0.00 -1.01 0.00 0.00 64.21 62.12 3h9h n SER 251 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3h9h n GLY 252 N 2.89 1.50 1.13 0.23 0.00 -1.26 -4.92 105.19 104.76 3h9h n GLY 252 Ca 0.13 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.26 3h9h n GLY 252 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3h9h n GLN 253 N -2.00 2.51 -0.34 1.61 6.02 -0.39 -4.65 117.38 120.14 3h9h n GLN 253 Ca 0.00 -2.32 0.20 0.00 -0.01 0.00 0.00 57.00 54.87 3h9h n GLN 253 Cb 0.00 -1.49 0.44 0.00 1.02 0.00 0.00 30.24 30.20 3h9h n GLN 253 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 3h9h h GLU 254 N 4.08 0.48 0.00 -1.09 3.07 -1.91 -0.81 114.58 118.40 3h9h h GLU 254 Ca 0.00 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.83 3h9h h GLU 254 Cb 0.94 -0.11 0.00 0.00 -0.84 0.00 0.00 28.75 28.74 3h9h h GLU 254 CO 0.00 0.32 0.00 0.00 -1.40 0.00 0.00 179.01 177.93 3h9h n GLN 255 N -4.82 0.21 0.24 2.33 0.00 -1.26 -2.07 117.38 112.00 3h9h n GLN 255 Ca 0.27 0.36 0.15 0.00 0.00 0.00 0.00 57.00 57.79 3h9h n GLN 255 Cb 0.83 -1.85 0.50 0.00 0.00 0.00 0.00 30.24 29.72 3h9h n GLN 255 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3h9h h ARG 256 N 0.00 0.00 -5.74 2.61 3.08 -1.50 -3.46 114.38 109.36 3h9h h ARG 256 Ca 0.00 0.00 -0.63 0.00 0.07 0.00 0.00 59.98 59.42 3h9h h ARG 256 Cb 0.47 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.44 3h9h h ARG 256 CO 0.00 0.00 -0.33 0.71 -1.07 0.00 0.00 179.97 179.28 3h9h s TYR 257 N -3.47 3.61 -0.02 3.04 1.51 -0.88 -0.81 117.35 120.34 3h9h s TYR 257 Ca 0.04 0.73 0.03 0.00 -1.01 0.00 0.00 57.07 56.85 3h9h s TYR 257 Cb 0.08 -2.18 -0.00 0.00 -0.11 0.00 0.00 41.96 39.75 3h9h s TYR 257 CO 0.57 0.57 -0.10 0.95 -1.11 0.00 0.00 175.55 176.43 3h9h s THR 258 N -0.66 0.81 -0.13 -0.71 -4.23 0.14 -4.47 115.64 106.39 3h9h s THR 258 Ca 0.19 -0.40 -0.06 0.00 -1.18 0.00 0.00 61.69 60.23 3h9h s THR 258 Cb -0.14 -0.71 -0.04 0.00 1.34 0.00 0.00 72.50 72.95 3h9h s THR 258 CO 0.08 0.24 0.10 0.00 -0.54 0.00 0.00 174.62 174.50 3h9h s HIS 260 N -0.66 2.19 -0.13 0.00 3.76 0.64 -0.25 115.29 120.84 3h9h s HIS 260 Ca 0.12 -0.88 0.01 0.00 -0.15 0.00 0.00 55.06 54.17 3h9h s HIS 260 Cb -0.12 -1.50 0.02 0.00 1.11 0.00 0.00 32.58 32.09 3h9h s HIS 260 CO 0.02 -0.37 -0.16 0.08 -0.85 0.00 0.00 174.74 173.46 3h9h s VAL 261 N 0.45 1.67 -0.07 -0.90 1.01 0.26 -1.87 120.40 120.94 3h9h s VAL 261 Ca -0.18 -0.72 0.05 0.00 0.00 0.00 0.00 61.98 61.13 3h9h s VAL 261 Cb -0.17 -1.52 -0.01 0.00 0.00 0.00 0.00 36.38 34.67 3h9h s VAL 261 CO 0.07 0.47 -0.21 -1.10 0.00 0.00 0.00 175.10 174.33 3h9h s GLN 262 N 1.17 2.71 -0.02 2.72 -0.21 -0.10 -1.63 119.66 124.29 3h9h s GLN 262 Ca -0.01 -0.83 -0.30 0.00 0.02 0.00 0.00 55.36 54.23 3h9h s GLN 262 Cb -0.14 -2.28 0.07 0.00 1.00 0.00 0.00 33.01 31.66 3h9h s GLN 262 CO -0.06 0.38 0.68 -1.58 -2.12 0.00 0.00 175.29 172.59 3h9h s HIS 263 N -0.14 -0.64 0.42 0.91 2.46 -1.26 -1.65 115.29 115.39 3h9h s HIS 263 Ca -0.03 1.00 0.33 0.00 0.47 0.00 0.00 55.06 56.83 3h9h s HIS 263 Cb -0.14 0.43 1.71 0.00 -0.13 0.00 0.00 32.58 34.45 3h9h s HIS 263 CO 0.04 -0.64 2.14 1.05 -2.47 0.00 0.00 174.74 174.86 3h9h h GLU 264 N 2.84 0.00 0.00 2.88 4.11 -1.94 -2.47 114.58 120.00 3h9h h GLU 264 Ca -0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.15 3h9h h GLU 264 Cb 1.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.42 3h9h h GLU 264 CO 0.39 0.06 0.00 0.41 0.07 0.00 0.00 179.01 179.93 3h9h n GLY 265 N -0.65 -1.47 3.57 1.06 0.00 -1.26 -4.69 105.19 101.74 3h9h n GLY 265 Ca -0.02 0.03 -0.39 0.00 0.00 0.00 0.00 46.02 45.64 3h9h n GLY 265 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h9h s LEU 266 N -4.47 4.26 0.28 0.99 1.43 -0.93 -4.59 118.68 115.64 3h9h s LEU 266 Ca 0.07 -0.12 -0.02 0.00 -1.03 0.00 0.00 54.13 53.03 3h9h s LEU 266 Cb 0.11 -2.24 0.41 0.00 0.03 0.00 0.00 46.19 44.50 3h9h s LEU 266 CO 0.49 -0.20 1.91 1.55 0.23 0.00 0.00 176.35 180.33 3h9h h PRO 267 N 8.39 1.14 -6.21 1.29 0.13 -1.85 -3.41 132.00 131.49 3h9h h PRO 267 Ca -0.32 -0.07 -0.61 0.00 -0.87 0.00 0.00 66.00 64.13 3h9h h PRO 267 Cb 1.16 -0.26 -0.27 0.00 0.13 0.00 0.00 31.00 31.77 3h9h h PRO 267 CO 0.63 0.76 -0.85 0.15 -0.23 0.00 0.00 178.00 178.45 3h9h s LYS 268 N -6.01 1.55 0.50 0.86 1.02 -1.26 -5.12 119.74 111.28 3h9h s LYS 268 Ca -0.12 -0.93 -0.23 0.00 0.02 0.00 0.00 55.97 54.71 3h9h s LYS 268 Cb 0.19 -1.63 -0.06 0.00 -0.52 0.00 0.00 37.83 35.81 3h9h s LYS 268 CO 0.81 0.43 1.37 -1.25 -0.92 0.00 0.00 175.35 175.79 3h9h s PRO 269 N -1.01 3.40 0.06 -1.68 0.04 -1.26 -4.97 135.00 129.57 3h9h s PRO 269 Ca 0.08 2.28 -0.20 0.00 0.04 0.00 0.00 61.00 63.20 3h9h s PRO 269 Cb -0.09 -2.43 -0.06 0.00 0.04 0.00 0.00 34.50 31.96 3h9h s PRO 269 CO 0.01 -1.00 0.59 -0.51 0.04 0.00 0.00 177.00 176.13 3h9h s LEU 270 N -3.17 4.50 -0.19 -3.56 1.43 -0.65 -4.91 118.68 112.14 3h9h s LEU 270 Ca 0.67 1.26 -0.03 0.00 -1.03 0.00 0.00 54.13 55.00 3h9h s LEU 270 Cb -0.41 -2.93 -0.01 0.00 0.03 0.00 0.00 46.19 42.87 3h9h s LEU 270 CO 0.50 0.22 -0.06 -0.89 0.23 0.00 0.00 176.35 176.35 3h9h s THR 271 N -0.85 3.38 0.11 5.49 2.01 -1.26 -0.57 115.64 123.94 3h9h s THR 271 Ca 0.30 -0.51 0.10 0.00 0.31 0.00 0.00 61.69 61.89 3h9h s THR 271 Cb -0.19 -2.50 -0.04 0.00 0.01 0.00 0.00 72.50 69.77 3h9h s THR 271 CO 0.19 0.46 -0.24 -0.76 -0.69 0.00 0.00 174.62 173.58 3h9h s LEU 272 N 1.05 2.41 0.02 4.42 1.43 0.66 -4.94 118.68 123.72 3h9h s LEU 272 Ca 0.01 -0.66 0.01 0.00 -1.03 0.00 0.00 54.13 52.46 3h9h s LEU 272 Cb -0.15 -1.33 -0.02 0.00 0.03 0.00 0.00 46.19 44.73 3h9h s LEU 272 CO -0.00 0.20 -0.03 -0.60 0.23 0.00 0.00 176.35 176.14 3h9h s ARG 273 N -1.91 0.30 -0.34 1.70 3.52 -1.26 -0.16 118.95 120.79 3h9h s ARG 273 Ca 0.15 -0.48 -0.26 0.00 -0.13 0.00 0.00 55.73 55.01 3h9h s ARG 273 Cb -0.10 -0.03 0.01 0.00 -1.56 0.00 0.00 34.95 33.27 3h9h s ARG 273 CO 0.06 -0.01 0.91 -0.46 -0.81 0.00 0.00 175.30 174.99 3h9h s TRP 274 N -1.05 3.13 0.00 5.12 -0.11 -1.26 -5.05 118.94 119.72 3h9h s TRP 274 Ca -0.10 0.86 0.00 0.00 1.22 0.00 0.00 56.10 58.08 3h9h s TRP 274 Cb -0.07 -3.51 0.00 0.00 -1.50 0.00 0.00 33.47 28.39 3h9h s TRP 274 CO -0.00 -0.73 0.00 -0.85 -4.62 0.00 0.00 176.95 170.75