#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d25 s SER 2 N 0.00 6.58 0.24 1.61 1.04 -1.26 -3.73 113.70 118.18 3d25 s SER 2 Ca 0.00 1.47 0.01 0.00 0.48 0.00 0.00 55.95 57.91 3d25 s SER 2 Cb 0.00 -2.47 -0.05 0.00 0.10 0.00 0.00 66.02 63.60 3d25 s SER 2 CO 0.00 -0.56 0.09 -1.00 0.98 0.00 0.00 173.24 172.75 3d25 s HIS 3 N -2.59 1.47 0.04 5.02 4.02 -0.63 -4.98 115.29 117.64 3d25 s HIS 3 Ca 0.57 -1.18 -0.10 0.00 1.02 0.00 0.00 55.06 55.37 3d25 s HIS 3 Cb -0.10 -0.85 0.01 0.00 -1.02 0.00 0.00 32.58 30.62 3d25 s HIS 3 CO 0.32 -0.35 0.21 -1.54 1.02 0.00 0.00 174.74 174.40 3d25 s SER 4 N -3.29 0.01 -0.07 1.40 1.04 -1.26 -0.89 113.70 110.65 3d25 s SER 4 Ca 0.36 -0.35 0.05 0.00 0.48 0.00 0.00 55.95 56.50 3d25 s SER 4 Cb 0.08 0.30 -0.01 0.00 0.10 0.00 0.00 66.02 66.48 3d25 s SER 4 CO 0.12 -0.57 -0.23 -0.32 0.98 0.00 0.00 173.24 173.23 3d25 s MET 5 N -2.58 2.65 -0.12 4.02 0.00 -0.43 -0.95 119.30 121.89 3d25 s MET 5 Ca -0.05 -0.87 -0.06 0.00 0.00 0.00 0.00 55.69 54.72 3d25 s MET 5 Cb -0.01 -2.23 0.05 0.00 0.00 0.00 0.00 34.83 32.65 3d25 s MET 5 CO -0.04 0.37 0.27 1.03 0.00 0.00 0.00 175.02 176.66 3d25 s ARG 6 N -0.13 0.21 -0.10 4.11 0.52 -0.63 -0.51 118.95 122.42 3d25 s ARG 6 Ca -0.04 0.63 -0.02 0.00 -0.52 0.00 0.00 55.73 55.78 3d25 s ARG 6 Cb -0.14 -0.08 -0.03 0.00 0.52 0.00 0.00 34.95 35.22 3d25 s ARG 6 CO 0.04 -0.20 -0.03 0.71 0.02 0.00 0.00 175.30 175.84 3d25 s TYR 7 N 1.64 3.07 -0.05 -0.53 2.02 0.03 -0.49 117.35 123.03 3d25 s TYR 7 Ca -0.06 0.03 0.06 0.00 -0.37 0.00 0.00 57.07 56.73 3d25 s TYR 7 Cb -0.11 -1.81 -0.01 0.00 -0.40 0.00 0.00 41.96 39.63 3d25 s TYR 7 CO -0.09 0.31 -0.23 -0.06 -1.57 0.00 0.00 175.55 173.90 3d25 s PHE 8 N -0.55 2.47 -0.05 2.71 0.40 0.09 -2.35 117.98 120.70 3d25 s PHE 8 Ca 0.09 -0.62 0.02 0.00 -0.60 0.00 0.00 56.93 55.82 3d25 s PHE 8 Cb -0.12 -1.60 0.01 0.00 0.51 0.00 0.00 43.02 41.82 3d25 s PHE 8 CO 0.02 -0.15 -0.09 -0.06 0.70 0.00 0.00 175.22 175.64 3d25 s PHE 9 N -0.26 1.16 -0.09 0.36 0.40 0.18 -1.49 117.98 118.24 3d25 s PHE 9 Ca -0.00 -0.38 0.02 0.00 -0.60 0.00 0.00 56.93 55.97 3d25 s PHE 9 Cb -0.13 -0.88 0.01 0.00 0.51 0.00 0.00 43.02 42.54 3d25 s PHE 9 CO 0.03 -0.21 -0.15 0.99 0.70 0.00 0.00 175.22 176.57 3d25 s THR 10 N 0.63 1.43 -0.09 0.64 2.01 -0.49 -0.81 115.64 118.95 3d25 s THR 10 Ca -0.11 -0.62 0.04 0.00 0.31 0.00 0.00 61.69 61.30 3d25 s THR 10 Cb -0.14 -1.30 0.00 0.00 0.01 0.00 0.00 72.50 71.07 3d25 s THR 10 CO 0.02 0.42 -0.22 -0.44 -0.69 0.00 0.00 174.62 173.72 3d25 s SER 11 N 0.83 2.85 -0.20 3.53 0.01 -0.37 -1.20 113.70 119.15 3d25 s SER 11 Ca -0.10 -0.51 0.01 0.00 1.31 0.00 0.00 55.95 56.65 3d25 s SER 11 Cb -0.15 -1.29 0.04 0.00 0.21 0.00 0.00 66.02 64.83 3d25 s SER 11 CO 0.01 0.14 -0.10 -0.69 0.41 0.00 0.00 173.24 173.01 3d25 s VAL 12 N 0.39 1.63 0.53 3.43 1.01 0.04 -1.53 120.40 125.90 3d25 s VAL 12 Ca -0.18 -1.03 -0.22 0.00 0.00 0.00 0.00 61.98 60.55 3d25 s VAL 12 Cb -0.18 -1.73 -0.05 0.00 0.00 0.00 0.00 36.38 34.42 3d25 s VAL 12 CO 0.08 0.14 1.28 -0.94 0.00 0.00 0.00 175.10 175.65 3d25 s SER 13 N 1.39 5.53 -0.62 3.32 1.04 0.02 -1.53 113.70 122.86 3d25 s SER 13 Ca -0.02 2.57 0.05 0.00 0.48 0.00 0.00 55.95 59.02 3d25 s SER 13 Cb -0.17 -2.62 0.15 0.00 0.10 0.00 0.00 66.02 63.49 3d25 s SER 13 CO -0.08 -1.37 0.38 -0.13 0.98 0.00 0.00 173.24 173.02 3d25 s ARG 14 N -2.90 2.23 0.10 4.02 0.52 -1.26 -4.33 118.95 117.33 3d25 s ARG 14 Ca 0.70 -3.01 -0.33 0.00 -0.52 0.00 0.00 55.73 52.57 3d25 s ARG 14 Cb -0.35 -3.37 -0.12 0.00 0.52 0.00 0.00 34.95 31.62 3d25 s ARG 14 CO 0.42 -1.20 1.74 -2.30 0.02 0.00 0.00 175.30 173.97 3d25 n PRO 15 N 2.51 2.41 0.00 3.54 -0.02 -1.26 -3.24 135.00 138.94 3d25 n PRO 15 Ca 0.13 0.88 0.00 0.00 -2.02 0.00 0.00 63.50 62.48 3d25 n PRO 15 Cb 0.34 -2.71 0.00 0.00 -0.02 0.00 0.00 33.50 31.11 3d25 n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3d25 n GLY 16 N 3.92 1.98 3.63 -1.23 0.00 -1.26 -5.00 105.19 107.23 3d25 n GLY 16 Ca 0.18 -0.59 -0.05 0.00 0.00 0.00 0.00 46.02 45.57 3d25 n GLY 16 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3d25 s ARG 17 N 0.00 0.63 0.50 1.61 3.52 -1.20 -5.18 118.95 118.84 3d25 s ARG 17 Ca 0.00 1.19 0.00 0.00 -0.13 0.00 0.00 55.73 56.79 3d25 s ARG 17 Cb 0.00 0.29 0.00 0.00 -1.56 0.00 0.00 34.95 33.68 3d25 s ARG 17 CO 0.00 -0.15 0.00 0.41 -0.81 0.00 0.00 175.30 174.75 3d25 n GLY 18 N 4.50 -1.85 3.95 8.12 0.00 -1.26 -4.81 105.19 113.83 3d25 n GLY 18 Ca -0.18 -1.77 -0.24 0.00 0.00 0.00 0.00 46.02 43.84 3d25 n GLY 18 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3d25 s GLU 19 N 0.00 3.07 0.75 1.61 2.02 -1.26 -4.68 118.70 120.21 3d25 s GLU 19 Ca 0.00 -0.41 -0.14 0.00 0.02 0.00 0.00 54.97 54.45 3d25 s GLU 19 Cb 0.00 -2.52 0.05 0.00 0.10 0.00 0.00 34.13 31.76 3d25 s GLU 19 CO 0.00 -0.32 1.16 -2.14 0.02 0.00 0.00 175.26 173.98 3d25 s PRO 20 N -4.61 2.10 -0.00 0.39 0.02 -1.26 -4.60 135.00 127.03 3d25 s PRO 20 Ca 0.49 1.57 -0.30 0.00 0.02 0.00 0.00 61.00 62.78 3d25 s PRO 20 Cb -0.10 -1.85 -0.05 0.00 0.02 0.00 0.00 34.50 32.52 3d25 s PRO 20 CO 0.39 -1.83 1.31 0.50 -0.33 0.00 0.00 177.00 177.04 3d25 s ARG 21 N -4.20 4.32 -0.15 5.54 6.06 -0.58 -4.85 118.95 125.09 3d25 s ARG 21 Ca 0.70 1.85 -0.00 0.00 -2.50 0.00 0.00 55.73 55.78 3d25 s ARG 21 Cb -0.25 -3.52 0.04 0.00 0.06 0.00 0.00 34.95 31.28 3d25 s ARG 21 CO 0.48 -0.49 -0.06 0.12 -2.50 0.00 0.00 175.30 172.85 3d25 s PHE 22 N 2.10 1.68 -0.16 5.12 5.36 -1.26 -0.78 117.98 130.05 3d25 s PHE 22 Ca 0.61 -1.01 0.01 0.00 -0.96 0.00 0.00 56.93 55.57 3d25 s PHE 22 Cb -0.29 -1.31 0.02 0.00 -0.34 0.00 0.00 43.02 41.10 3d25 s PHE 22 CO 0.25 -0.60 -0.18 0.42 -1.46 0.00 0.00 175.22 173.66 3d25 s ILE 23 N 1.64 1.85 -0.07 3.12 1.01 -0.34 -0.92 121.20 127.49 3d25 s ILE 23 Ca 0.02 -0.82 0.03 0.00 0.00 0.00 0.00 60.65 59.88 3d25 s ILE 23 Cb -0.14 -1.69 -0.02 0.00 0.01 0.00 0.00 42.46 40.62 3d25 s ILE 23 CO -0.08 0.51 -0.15 0.00 0.00 0.00 0.00 174.94 175.22 3d25 s ALA 24 N 1.25 2.60 0.07 9.38 0.00 0.11 -1.40 121.76 133.78 3d25 s ALA 24 Ca 0.02 -0.96 0.04 0.00 0.00 0.00 0.00 51.96 51.06 3d25 s ALA 24 Cb -0.13 -1.01 -0.03 0.00 0.00 0.00 0.00 23.12 21.95 3d25 s ALA 24 CO -0.10 0.45 -0.11 0.14 0.00 0.00 0.00 175.76 176.15 3d25 s VAL 25 N -0.37 0.88 -0.02 0.00 -7.23 -0.55 0.01 120.40 113.12 3d25 s VAL 25 Ca 0.04 -1.33 0.06 0.00 -1.81 0.00 0.00 61.98 58.94 3d25 s VAL 25 Cb -0.12 -1.01 -0.02 0.00 0.56 0.00 0.00 36.38 35.79 3d25 s VAL 25 CO 0.02 -0.37 -0.21 -0.83 -0.31 0.00 0.00 175.10 173.40 3d25 s GLY 26 N -1.90 1.02 0.02 2.32 0.00 -1.03 -0.73 107.32 107.02 3d25 s GLY 26 Ca -0.02 -0.89 0.08 0.00 0.00 0.00 0.00 44.72 43.89 3d25 s GLY 26 CO 0.01 -0.73 -0.25 -0.19 0.00 0.00 0.00 173.10 171.93 3d25 s TYR 27 N -0.47 2.35 -0.24 1.90 2.02 0.35 -1.78 117.35 121.48 3d25 s TYR 27 Ca 0.08 -0.41 -0.07 0.00 -0.37 0.00 0.00 57.07 56.29 3d25 s TYR 27 Cb -0.08 -1.45 -0.03 0.00 -0.40 0.00 0.00 41.96 40.00 3d25 s TYR 27 CO -0.01 0.07 0.07 0.08 -1.57 0.00 0.00 175.55 174.19 3d25 s VAL 28 N -0.73 4.39 0.00 0.71 1.01 -0.32 -1.60 120.40 123.86 3d25 s VAL 28 Ca 0.11 -0.15 0.00 0.00 0.00 0.00 0.00 61.98 61.94 3d25 s VAL 28 Cb -0.10 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.23 3d25 s VAL 28 CO 0.01 0.35 0.00 0.47 0.00 0.00 0.00 175.10 175.93 3d25 n ASP 29 N 4.75 0.00 -1.81 3.32 8.00 -0.12 -0.70 116.55 129.99 3d25 n ASP 29 Ca -0.16 0.00 0.01 0.00 0.71 0.00 0.00 54.79 55.35 3d25 n ASP 29 Cb 0.52 0.00 0.32 0.00 -0.02 0.00 0.00 41.12 41.94 3d25 n ASP 29 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3d25 n ASP 30 N 3.56 4.94 -4.30 -2.24 8.00 -1.26 -4.89 116.55 120.36 3d25 n ASP 30 Ca 0.00 -2.94 -0.36 0.00 0.71 0.00 0.00 54.79 52.19 3d25 n ASP 30 Cb 0.00 -0.69 -0.13 0.00 -0.02 0.00 0.00 41.12 40.28 3d25 n ASP 30 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3d25 s THR 31 N -2.64 3.62 0.38 -3.53 -4.23 0.12 -5.03 115.64 104.33 3d25 s THR 31 Ca 0.49 -0.78 -0.26 0.00 -1.18 0.00 0.00 61.69 59.97 3d25 s THR 31 Cb 0.38 -2.85 -0.09 0.00 1.34 0.00 0.00 72.50 71.29 3d25 s THR 31 CO 0.13 0.13 1.14 -1.58 -0.54 0.00 0.00 174.62 173.91 3d25 s GLN 32 N 1.45 4.18 0.00 3.99 0.74 -1.26 -1.17 119.66 127.58 3d25 s GLN 32 Ca 0.02 1.79 0.00 0.00 0.05 0.00 0.00 55.36 57.22 3d25 s GLN 32 Cb -0.17 -2.75 0.00 0.00 1.10 0.00 0.00 33.01 31.19 3d25 s GLN 32 CO 0.00 -0.20 0.00 1.97 -0.55 0.00 0.00 175.29 176.51 3d25 n PHE 33 N 0.25 0.00 -3.72 1.67 -1.74 -0.74 -4.08 117.46 109.12 3d25 n PHE 33 Ca 0.03 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.82 3d25 n PHE 33 Cb 0.47 0.01 -0.05 0.00 1.52 0.00 0.00 39.48 41.43 3d25 n PHE 33 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 3d25 s VAL 34 N 0.00 0.06 -0.28 1.97 -7.23 -1.22 -2.69 120.40 111.01 3d25 s VAL 34 Ca 0.00 -0.77 -0.20 0.00 -1.81 0.00 0.00 61.98 59.20 3d25 s VAL 34 Cb 0.00 -1.37 0.11 0.00 0.56 0.00 0.00 36.38 35.68 3d25 s VAL 34 CO 0.00 -0.29 0.86 0.00 -0.31 0.00 0.00 175.10 175.37 3d25 s ARG 35 N -3.85 0.58 -0.08 4.82 1.70 -0.85 -2.45 118.95 118.83 3d25 s ARG 35 Ca 0.06 0.87 0.03 0.00 -0.47 0.00 0.00 55.73 56.23 3d25 s ARG 35 Cb 0.01 0.19 0.01 0.00 -0.57 0.00 0.00 34.95 34.59 3d25 s ARG 35 CO -0.08 -0.10 -0.16 0.12 -1.08 0.00 0.00 175.30 174.00 3d25 s PHE 36 N 1.01 1.85 -0.10 5.89 2.19 0.10 -1.26 117.98 127.66 3d25 s PHE 36 Ca -0.05 -0.72 0.02 0.00 0.33 0.00 0.00 56.93 56.51 3d25 s PHE 36 Cb -0.05 -1.30 0.01 0.00 -1.31 0.00 0.00 43.02 40.38 3d25 s PHE 36 CO -0.12 -0.33 -0.17 0.34 1.83 0.00 0.00 175.22 176.77 3d25 s ASP 37 N 0.55 2.55 0.54 6.13 -1.08 -1.26 0.07 116.67 124.17 3d25 s ASP 37 Ca -0.16 -0.46 0.30 0.00 -0.52 0.00 0.00 52.55 51.72 3d25 s ASP 37 Cb -0.17 -1.16 1.53 0.00 -1.46 0.00 0.00 42.92 41.66 3d25 s ASP 37 CO 0.06 0.06 2.08 0.77 0.52 0.00 0.00 175.17 178.65 3d25 h SER 38 N 7.19 0.00 0.64 -0.34 4.64 -1.41 -1.75 113.55 122.52 3d25 h SER 38 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 3d25 h SER 38 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 3d25 h SER 38 CO 0.49 0.09 -0.34 0.47 -0.87 0.00 0.00 176.83 176.67 3d25 n ASP 39 N -3.46 0.36 -4.83 4.97 9.92 -1.26 -4.91 116.55 117.35 3d25 n ASP 39 Ca -0.01 -0.05 -0.33 0.00 -0.53 0.00 0.00 54.79 53.87 3d25 n ASP 39 Cb 0.24 0.02 -0.05 0.00 -0.64 0.00 0.00 41.12 40.69 3d25 n ASP 39 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3d25 s ALA 40 N -2.98 3.05 0.25 2.24 0.00 -0.66 -4.97 121.76 118.69 3d25 s ALA 40 Ca 0.12 0.29 0.08 0.00 0.00 0.00 0.00 51.96 52.46 3d25 s ALA 40 Cb 0.18 -3.14 0.27 0.00 0.00 0.00 0.00 23.12 20.43 3d25 s ALA 40 CO 0.64 -0.08 1.56 0.00 0.00 0.00 0.00 175.76 177.88 3d25 h ALA 41 N 1.37 0.88 -0.14 0.00 0.00 -1.90 -3.26 119.26 116.20 3d25 h ALA 41 Ca -0.48 -0.59 -0.13 0.00 0.00 0.00 0.00 54.91 53.71 3d25 h ALA 41 Cb 1.18 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 3d25 h ALA 41 CO 0.61 0.81 -0.48 0.66 0.00 0.00 0.00 179.25 180.85 3d25 h SER 42 N 0.04 0.40 -5.30 0.00 4.64 -1.93 -3.46 113.55 107.95 3d25 h SER 42 Ca -0.01 -0.19 -0.38 0.00 -0.47 0.00 0.00 61.79 60.74 3d25 h SER 42 Cb 1.17 -0.11 -0.06 0.00 -0.31 0.00 0.00 62.40 63.09 3d25 h SER 42 CO 0.09 0.82 -0.56 0.00 -0.87 0.00 0.00 176.83 176.31 3d25 n GLN 43 N -3.98 -3.63 -4.41 4.77 1.13 -1.23 -4.99 117.38 105.04 3d25 n GLN 43 Ca -0.02 0.54 -0.26 0.00 -1.94 0.00 0.00 57.00 55.32 3d25 n GLN 43 Cb 0.54 -5.27 -0.12 0.00 0.11 0.00 0.00 30.24 25.50 3d25 n GLN 43 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 3d25 s ARG 44 N -5.96 1.48 0.20 -1.09 1.81 -1.26 -5.04 118.95 109.08 3d25 s ARG 44 Ca 0.38 -1.50 -0.32 0.00 -1.72 0.00 0.00 55.73 52.57 3d25 s ARG 44 Cb -0.20 -1.77 -0.12 0.00 -0.45 0.00 0.00 34.95 32.41 3d25 s ARG 44 CO 0.47 0.38 1.71 -0.12 -0.68 0.00 0.00 175.30 177.06 3d25 n MET 45 N 0.29 2.68 -4.57 3.54 0.00 -1.26 -4.71 117.12 113.09 3d25 n MET 45 Ca -0.13 0.97 -0.28 0.00 -0.00 0.00 0.00 57.70 58.26 3d25 n MET 45 Cb 0.56 -2.81 -0.14 0.00 0.00 0.00 0.00 33.22 30.84 3d25 n MET 45 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 175.97 174.76 3d25 s GLU 46 N 1.22 1.49 0.40 2.12 2.02 -0.39 -4.93 118.70 120.63 3d25 s GLU 46 Ca 0.76 -1.21 -0.24 0.00 0.02 0.00 0.00 54.97 54.30 3d25 s GLU 46 Cb -0.53 -1.82 -0.09 0.00 0.10 0.00 0.00 34.13 31.79 3d25 s GLU 46 CO 0.33 0.45 1.05 -1.25 0.02 0.00 0.00 175.26 175.86 3d25 s PRO 47 N -1.69 4.13 0.00 0.39 0.04 -1.26 -2.00 135.00 134.62 3d25 s PRO 47 Ca 0.12 1.51 0.00 0.00 0.04 0.00 0.00 61.00 62.67 3d25 s PRO 47 Cb -0.10 -2.52 0.00 0.00 0.04 0.00 0.00 34.50 31.93 3d25 s PRO 47 CO 0.04 -0.17 0.44 0.54 0.04 0.00 0.00 177.00 177.90 3d25 n ARG 48 N -0.13 0.35 -4.02 4.56 5.12 -1.09 -4.88 116.66 116.56 3d25 n ARG 48 Ca 0.05 -0.51 -0.10 0.00 -1.93 0.00 0.00 57.85 55.36 3d25 n ARG 48 Cb 0.50 -0.60 -0.11 0.00 -1.16 0.00 0.00 32.46 31.09 3d25 n ARG 48 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3d25 s ALA 49 N -0.14 0.29 0.32 7.54 0.00 -1.25 -4.52 121.76 124.00 3d25 s ALA 49 Ca 0.00 -0.72 0.06 0.00 0.00 0.00 0.00 51.96 51.29 3d25 s ALA 49 Cb 0.00 0.14 0.55 0.00 0.00 0.00 0.00 23.12 23.81 3d25 s ALA 49 CO 0.00 -0.16 1.79 -1.00 0.00 0.00 0.00 175.76 176.39 3d25 h PRO 50 N 4.39 0.37 0.00 0.00 0.13 -1.95 -2.64 132.00 132.30 3d25 h PRO 50 Ca -0.33 -0.12 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 3d25 h PRO 50 Cb 1.20 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.30 3d25 h PRO 50 CO 0.45 0.57 0.00 0.11 -0.23 0.00 0.00 178.00 178.90 3d25 h TRP 51 N 0.33 0.00 -0.00 1.56 5.08 -1.97 -2.53 115.95 118.41 3d25 h TRP 51 Ca 0.06 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.03 3d25 h TRP 51 Cb 0.57 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.73 3d25 h TRP 51 CO 0.01 0.00 -0.07 1.51 -1.28 0.00 0.00 178.44 178.61 3d25 n ILE 52 N -2.51 0.00 1.09 0.12 0.13 -0.99 -3.88 119.36 113.32 3d25 n ILE 52 Ca 0.03 -0.03 0.12 0.00 -1.10 0.00 0.00 62.75 61.78 3d25 n ILE 52 Cb 0.36 -0.29 0.29 0.00 -0.84 0.00 0.00 39.64 39.17 3d25 n ILE 52 CO 0.00 0.00 0.00 -0.62 2.80 0.00 0.00 176.55 178.73 3d25 n GLU 53 N -1.17 0.33 -0.06 9.51 1.02 -0.95 -3.26 120.64 126.06 3d25 n GLU 53 Ca 0.13 -0.19 0.12 0.00 -0.02 0.00 0.00 57.16 57.20 3d25 n GLU 53 Cb 0.27 -1.50 0.37 0.00 -0.02 0.00 0.00 31.44 30.56 3d25 n GLU 53 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3d25 n GLN 54 N -1.17 1.88 -2.51 3.49 10.64 -1.25 -4.81 117.38 123.65 3d25 n GLN 54 Ca 0.08 -1.31 -0.38 0.00 -1.83 0.00 0.00 57.00 53.56 3d25 n GLN 54 Cb 0.34 -1.45 -0.04 0.00 -0.86 0.00 0.00 30.24 28.23 3d25 n GLN 54 CO 0.00 0.00 0.00 -1.21 -1.83 0.00 0.00 177.06 174.02 3d25 s GLU 55 N -1.85 4.37 0.76 2.61 0.41 -1.20 -5.06 118.70 118.74 3d25 s GLU 55 Ca 0.34 1.64 -0.05 0.00 -0.41 0.00 0.00 54.97 56.49 3d25 s GLU 55 Cb 0.20 -2.82 0.13 0.00 -1.78 0.00 0.00 34.13 29.85 3d25 s GLU 55 CO 0.30 0.01 1.06 0.20 -0.49 0.00 0.00 175.26 176.34 3d25 s GLY 56 N -1.26 1.76 0.59 -1.39 0.00 -1.26 -4.89 107.32 100.87 3d25 s GLY 56 Ca 0.52 -1.42 0.29 0.00 0.00 0.00 0.00 44.72 44.11 3d25 s GLY 56 CO 0.33 -0.85 2.09 -2.55 0.00 0.00 0.00 173.10 172.12 3d25 h PRO 57 N -0.77 0.00 -0.07 2.90 0.11 -1.98 0.95 132.00 133.13 3d25 h PRO 57 Ca -0.40 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.59 3d25 h PRO 57 Cb 1.27 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 3d25 h PRO 57 CO 0.44 0.00 -0.51 1.05 -0.21 0.00 0.00 178.00 178.78 3d25 h GLU 58 N 0.00 0.19 -0.73 1.05 9.09 -1.99 -0.56 114.58 121.64 3d25 h GLU 58 Ca 0.09 -0.11 -0.03 0.00 0.05 0.00 0.00 59.36 59.35 3d25 h GLU 58 Cb 0.53 0.01 -0.03 0.00 -1.65 0.00 0.00 28.75 27.61 3d25 h GLU 58 CO -0.00 0.66 0.32 -0.92 0.05 0.00 0.00 179.01 179.12 3d25 h TYR 59 N 0.15 1.08 0.03 2.06 5.03 -1.15 -1.68 116.97 122.50 3d25 h TYR 59 Ca 0.00 -0.07 -0.27 0.00 2.58 0.00 0.00 58.73 60.97 3d25 h TYR 59 Cb 0.95 -0.33 -0.03 0.00 1.55 0.00 0.00 36.73 38.87 3d25 h TYR 59 CO 0.01 0.81 -1.47 -1.49 -1.32 0.00 0.00 178.16 174.71 3d25 h TRP 60 N 1.03 0.12 -0.23 -3.82 4.06 -1.46 -0.70 115.95 114.95 3d25 h TRP 60 Ca 0.25 -0.09 0.05 0.00 2.06 0.00 0.00 58.89 61.16 3d25 h TRP 60 Cb 0.17 -0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 28.27 3d25 h TRP 60 CO 0.01 1.12 -0.11 -0.44 -3.56 0.00 0.00 178.44 175.46 3d25 h ASP 61 N 0.02 -0.35 -0.16 -3.49 3.32 -1.16 -1.76 116.42 112.83 3d25 h ASP 61 Ca -0.20 0.09 -0.02 0.00 0.02 0.00 0.00 57.03 56.92 3d25 h ASP 61 Cb 1.94 0.20 -0.01 0.00 0.22 0.00 0.00 39.33 41.68 3d25 h ASP 61 CO 0.11 -0.14 0.01 1.23 -1.72 0.00 0.00 179.24 178.74 3d25 h GLY 62 N -0.08 0.30 1.87 2.75 0.00 -1.13 -1.68 103.07 105.10 3d25 h GLY 62 Ca 0.12 -0.21 -0.13 0.00 0.00 0.00 0.00 47.33 47.11 3d25 h GLY 62 CO -0.28 0.20 -0.54 0.83 0.00 0.00 0.00 176.54 176.75 3d25 h GLU 63 N 0.04 0.14 -0.20 4.80 4.39 -1.19 -2.24 114.58 120.32 3d25 h GLU 63 Ca 0.05 -0.09 -0.04 0.00 0.34 0.00 0.00 59.36 59.63 3d25 h GLU 63 Cb 0.35 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.00 3d25 h GLU 63 CO 0.01 0.65 -0.01 1.15 -1.16 0.00 0.00 179.01 179.64 3d25 h THR 64 N 0.11 1.26 -0.16 1.13 2.02 -1.23 -1.51 112.91 114.53 3d25 h THR 64 Ca -0.00 -0.92 0.05 0.00 0.77 0.00 0.00 66.41 66.31 3d25 h THR 64 Cb 0.99 1.48 -0.06 0.00 -1.74 0.00 0.00 68.15 68.82 3d25 h THR 64 CO 0.08 0.28 -0.20 -0.09 0.37 0.00 0.00 175.52 175.96 3d25 h ARG 65 N 0.10 -0.23 -0.55 6.66 2.43 -1.16 -2.00 114.38 119.64 3d25 h ARG 65 Ca 0.05 0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.18 3d25 h ARG 65 Cb 0.42 0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.00 3d25 h ARG 65 CO 0.01 -0.15 0.10 0.87 -1.51 0.00 0.00 179.97 179.29 3d25 h LYS 66 N -0.24 0.90 -0.05 0.20 1.57 -1.36 -2.36 116.57 115.23 3d25 h LYS 66 Ca 0.11 -0.24 -0.15 0.00 -1.87 0.00 0.00 60.65 58.50 3d25 h LYS 66 Cb 0.40 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 3d25 h LYS 66 CO -0.30 0.87 -0.66 -0.24 -0.57 0.00 0.00 179.45 178.55 3d25 h VAL 67 N 0.79 1.42 -0.53 0.50 3.04 -1.17 0.18 116.25 120.48 3d25 h VAL 67 Ca 0.17 -2.13 -0.09 0.00 -1.01 0.00 0.00 66.70 63.64 3d25 h VAL 67 Cb 0.40 2.12 -0.02 0.00 -2.01 0.00 0.00 31.29 31.77 3d25 h VAL 67 CO 0.01 0.63 -0.02 0.11 -1.01 0.00 0.00 177.57 177.29 3d25 h LYS 68 N 0.14 0.91 -0.22 4.17 1.57 -1.27 -1.97 116.57 119.90 3d25 h LYS 68 Ca -0.01 -0.27 -0.14 0.00 -1.87 0.00 0.00 60.65 58.35 3d25 h LYS 68 Cb 1.19 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.41 3d25 h LYS 68 CO 0.10 0.91 -0.43 0.00 -0.57 0.00 0.00 179.45 179.46 3d25 h ALA 69 N 1.14 0.35 -0.93 3.86 0.00 -0.86 -1.77 119.26 121.05 3d25 h ALA 69 Ca 0.15 -0.46 0.24 0.00 0.00 0.00 0.00 54.91 54.83 3d25 h ALA 69 Cb 0.52 -0.06 -0.17 0.00 0.00 0.00 0.00 17.79 18.08 3d25 h ALA 69 CO 0.03 0.47 -0.00 0.45 0.00 0.00 0.00 179.25 180.20 3d25 h HIS 70 N 0.39 -0.09 -0.14 0.00 3.86 -0.63 -1.88 115.15 116.66 3d25 h HIS 70 Ca 0.01 0.07 -0.08 0.00 -1.16 0.00 0.00 60.37 59.21 3d25 h HIS 70 Cb 1.03 0.19 -0.01 0.00 1.06 0.00 0.00 27.41 29.68 3d25 h HIS 70 CO 0.09 -0.37 -0.27 0.66 0.86 0.00 0.00 177.93 178.89 3d25 h SER 71 N 0.04 0.25 0.00 2.45 4.64 -0.53 -2.55 113.55 117.86 3d25 h SER 71 Ca 0.53 -0.08 -0.26 0.00 -0.47 0.00 0.00 61.79 61.52 3d25 h SER 71 Cb 1.04 -0.07 0.02 0.00 -0.31 0.00 0.00 62.40 63.08 3d25 h SER 71 CO -0.86 0.53 -1.02 1.56 -0.87 0.00 0.00 176.83 176.17 3d25 h GLN 72 N 0.23 0.69 -0.67 4.77 1.08 -0.90 -2.17 115.11 118.14 3d25 h GLN 72 Ca 0.04 -0.74 0.09 0.00 -1.45 0.00 0.00 58.65 56.59 3d25 h GLN 72 Cb 0.60 0.21 -0.07 0.00 -0.05 0.00 0.00 27.48 28.17 3d25 h GLN 72 CO 0.04 1.32 0.30 1.15 -0.95 0.00 0.00 178.83 180.69 3d25 h THR 73 N 0.36 0.81 -0.32 -0.54 2.02 -1.21 -1.05 112.91 112.98 3d25 h THR 73 Ca -0.13 -0.17 -0.05 0.00 0.77 0.00 0.00 66.41 66.83 3d25 h THR 73 Cb 1.68 0.25 -0.01 0.00 -1.74 0.00 0.00 68.15 68.33 3d25 h THR 73 CO 0.20 0.09 0.02 0.45 0.37 0.00 0.00 175.52 176.65 3d25 h HIS 74 N 0.51 0.59 -0.40 3.16 3.86 -1.39 -0.66 115.15 120.82 3d25 h HIS 74 Ca 0.33 -0.10 0.08 0.00 -1.16 0.00 0.00 60.37 59.53 3d25 h HIS 74 Cb 0.38 -0.16 -0.08 0.00 1.06 0.00 0.00 27.41 28.62 3d25 h HIS 74 CO -0.13 0.66 -0.09 -0.09 0.86 0.00 0.00 177.93 179.13 3d25 h ARG 75 N 0.36 0.01 -0.95 2.45 2.43 -1.10 -1.29 114.38 116.29 3d25 h ARG 75 Ca 0.09 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.26 3d25 h ARG 75 Cb 0.41 -0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 29.91 3d25 h ARG 75 CO 0.01 0.01 0.59 0.28 -1.51 0.00 0.00 179.97 179.35 3d25 h VAL 76 N 0.01 1.25 -0.64 0.20 2.07 -0.92 -2.89 116.25 115.33 3d25 h VAL 76 Ca 0.19 -0.52 -0.08 0.00 0.82 0.00 0.00 66.70 67.11 3d25 h VAL 76 Cb 0.29 -0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 29.94 3d25 h VAL 76 CO -0.41 0.26 0.09 0.44 0.02 0.00 0.00 177.57 177.97 3d25 h ASP 77 N 1.30 1.03 -0.94 0.57 3.32 -0.31 -0.88 116.42 120.51 3d25 h ASP 77 Ca 0.34 -0.27 0.02 0.00 0.02 0.00 0.00 57.03 57.14 3d25 h ASP 77 Cb -0.09 -0.27 -0.05 0.00 0.22 0.00 0.00 39.33 39.14 3d25 h ASP 77 CO -0.07 1.04 0.62 -0.07 -1.72 0.00 0.00 179.24 179.04 3d25 h LEU 78 N 0.98 1.06 -0.32 1.55 3.38 -1.06 0.42 115.31 121.33 3d25 h LEU 78 Ca 0.19 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 3d25 h LEU 78 Cb 0.46 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 3d25 h LEU 78 CO 0.02 0.76 0.15 1.23 0.09 0.00 0.00 178.44 180.68 3d25 h GLY 79 N 1.25 0.50 0.84 0.83 0.00 -1.39 -2.66 103.07 102.42 3d25 h GLY 79 Ca 0.35 -0.25 -0.01 0.00 0.00 0.00 0.00 47.33 47.41 3d25 h GLY 79 CO -0.09 0.24 0.04 -0.84 0.00 0.00 0.00 176.54 175.89 3d25 h THR 80 N 0.37 1.20 -0.33 4.70 2.02 0.18 -2.66 112.91 118.39 3d25 h THR 80 Ca 0.11 -0.62 -0.11 0.00 0.77 0.00 0.00 66.41 66.56 3d25 h THR 80 Cb 0.14 1.33 -0.01 0.00 -1.74 0.00 0.00 68.15 67.86 3d25 h THR 80 CO -0.01 0.19 -0.24 -0.07 0.37 0.00 0.00 175.52 175.76 3d25 h LEU 81 N 0.05 0.65 -0.71 2.58 4.07 -0.30 -0.55 115.31 121.10 3d25 h LEU 81 Ca 0.05 -0.23 0.06 0.00 0.08 0.00 0.00 57.88 57.84 3d25 h LEU 81 Cb 0.26 -0.18 -0.06 0.00 1.08 0.00 0.00 40.66 41.76 3d25 h LEU 81 CO 0.00 0.87 0.41 -0.09 -1.08 0.00 0.00 178.44 178.55 3d25 h ARG 82 N 0.57 0.73 0.77 1.13 2.43 -1.37 0.39 114.38 119.02 3d25 h ARG 82 Ca 0.08 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.17 3d25 h ARG 82 Cb 0.71 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 3d25 h ARG 82 CO 0.05 0.48 -0.43 0.78 -1.51 0.00 0.00 179.97 179.35 3d25 h GLY 83 N 0.75 -1.19 -0.89 2.80 0.00 -1.09 -0.51 103.07 102.93 3d25 h GLY 83 Ca 0.32 0.47 0.21 0.00 0.00 0.00 0.00 47.33 48.33 3d25 h GLY 83 CO -0.18 -0.42 -0.11 -1.72 0.00 0.00 0.00 176.54 174.11 3d25 n TYR 84 N -5.58 0.44 0.68 5.60 4.01 -0.25 -0.20 117.16 121.85 3d25 n TYR 84 Ca -0.15 1.08 0.11 0.00 -0.16 0.00 0.00 57.90 58.78 3d25 n TYR 84 Cb 0.46 -1.09 0.26 0.00 -0.31 0.00 0.00 39.34 38.66 3d25 n TYR 84 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 3d25 n TYR 85 N -5.37 0.36 -3.75 -0.72 4.01 0.07 -4.95 117.16 106.82 3d25 n TYR 85 Ca 0.17 -0.18 -0.23 0.00 -0.16 0.00 0.00 57.90 57.50 3d25 n TYR 85 Cb 0.56 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.62 3d25 n TYR 85 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 3d25 n ASN 86 N 1.09 -2.11 -4.88 7.72 2.85 0.72 -4.98 115.26 115.67 3d25 n ASN 86 Ca 0.18 -0.81 -0.30 0.00 -0.11 0.00 0.00 54.58 53.54 3d25 n ASN 86 Cb 0.51 -4.03 -0.05 0.00 1.24 0.00 0.00 39.78 37.45 3d25 n ASN 86 CO 0.00 0.00 0.00 -1.10 -2.11 0.00 0.00 177.26 174.05 3d25 s GLN 87 N -6.14 3.27 1.02 1.20 -0.21 -0.31 -5.04 119.66 113.45 3d25 s GLN 87 Ca 0.17 -0.53 -0.12 0.00 0.02 0.00 0.00 55.36 54.90 3d25 s GLN 87 Cb -0.08 -2.94 0.20 0.00 1.00 0.00 0.00 33.01 31.19 3d25 s GLN 87 CO 0.81 0.59 1.08 -1.54 -2.12 0.00 0.00 175.29 174.11 3d25 s SER 88 N -2.53 2.36 -0.02 5.90 1.04 -1.26 -4.74 113.70 114.45 3d25 s SER 88 Ca 0.33 1.43 0.07 0.00 0.48 0.00 0.00 55.95 58.26 3d25 s SER 88 Cb -0.13 -2.11 0.23 0.00 0.10 0.00 0.00 66.02 64.11 3d25 s SER 88 CO 0.26 -3.33 1.11 -0.62 0.98 0.00 0.00 173.24 171.64 3d25 n GLU 89 N -4.33 1.75 -0.08 4.02 1.02 -1.26 -4.28 120.64 117.47 3d25 n GLU 89 Ca 0.05 -0.91 -0.11 0.00 -0.02 0.00 0.00 57.16 56.18 3d25 n GLU 89 Cb 0.55 -1.34 -0.15 0.00 -0.02 0.00 0.00 31.44 30.49 3d25 n GLU 89 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3d25 n ALA 90 N 0.21 1.48 -2.56 0.62 0.00 -1.26 -4.78 120.51 114.22 3d25 n ALA 90 Ca 0.08 -1.16 -0.28 0.00 0.00 0.00 0.00 53.44 52.09 3d25 n ALA 90 Cb 0.30 -0.36 -0.03 0.00 0.00 0.00 0.00 19.45 19.36 3d25 n ALA 90 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3d25 s GLY 91 N -5.47 1.83 0.24 0.00 0.00 -1.26 -4.83 107.32 97.83 3d25 s GLY 91 Ca -0.11 -0.61 -0.30 0.00 0.00 0.00 0.00 44.72 43.71 3d25 s GLY 91 CO 0.81 -0.51 0.93 -0.56 0.00 0.00 0.00 173.10 173.77 3d25 s SER 92 N -3.20 7.62 0.21 1.64 0.01 -1.26 -4.69 113.70 114.02 3d25 s SER 92 Ca 0.43 1.93 0.03 0.00 1.31 0.00 0.00 55.95 59.65 3d25 s SER 92 Cb -0.11 -2.60 -0.05 0.00 0.21 0.00 0.00 66.02 63.47 3d25 s SER 92 CO 0.30 0.15 -0.01 -1.00 0.41 0.00 0.00 173.24 173.10 3d25 s HIS 93 N -1.19 1.42 -0.03 2.43 3.76 -1.26 -4.94 115.29 115.48 3d25 s HIS 93 Ca 0.41 -0.94 0.04 0.00 -0.15 0.00 0.00 55.06 54.42 3d25 s HIS 93 Cb -0.26 -0.81 -0.00 0.00 1.11 0.00 0.00 32.58 32.62 3d25 s HIS 93 CO 0.31 -0.09 -0.15 0.99 -0.85 0.00 0.00 174.74 174.96 3d25 s THR 94 N -3.49 1.22 -0.01 1.30 2.01 -1.26 -0.80 115.64 114.61 3d25 s THR 94 Ca 0.26 -0.61 0.05 0.00 0.31 0.00 0.00 61.69 61.69 3d25 s THR 94 Cb 0.05 -1.04 -0.03 0.00 0.01 0.00 0.00 72.50 71.49 3d25 s THR 94 CO 0.07 0.35 -0.14 0.68 -0.69 0.00 0.00 174.62 174.88 3d25 s VAL 95 N -0.03 3.05 -0.03 3.82 -7.23 -0.58 -0.17 120.40 119.23 3d25 s VAL 95 Ca -0.01 -0.88 0.03 0.00 -1.81 0.00 0.00 61.98 59.31 3d25 s VAL 95 Cb -0.09 -2.24 -0.00 0.00 0.56 0.00 0.00 36.38 34.61 3d25 s VAL 95 CO 0.01 0.48 -0.13 -1.10 -0.31 0.00 0.00 175.10 174.06 3d25 s GLN 96 N -1.05 1.25 -0.04 4.82 -0.21 -0.63 -1.23 119.66 122.56 3d25 s GLN 96 Ca 0.13 -0.44 0.03 0.00 0.02 0.00 0.00 55.36 55.10 3d25 s GLN 96 Cb -0.11 -1.14 0.01 0.00 1.00 0.00 0.00 33.01 32.77 3d25 s GLN 96 CO 0.03 0.19 -0.12 0.50 -2.12 0.00 0.00 175.29 173.78 3d25 s ARG 97 N 0.03 1.35 -0.03 2.91 3.52 0.01 -1.25 118.95 125.51 3d25 s ARG 97 Ca -0.01 -0.40 0.05 0.00 -0.13 0.00 0.00 55.73 55.24 3d25 s ARG 97 Cb -0.09 -1.19 -0.01 0.00 -1.56 0.00 0.00 34.95 32.10 3d25 s ARG 97 CO 0.01 0.11 -0.16 1.41 -0.81 0.00 0.00 175.30 175.85 3d25 s MET 98 N 0.32 1.50 0.11 5.12 -2.45 -1.09 0.49 119.30 123.31 3d25 s MET 98 Ca -0.07 -0.59 -0.06 0.00 -1.25 0.00 0.00 55.69 53.72 3d25 s MET 98 Cb -0.12 -1.38 -0.02 0.00 1.25 0.00 0.00 34.83 34.56 3d25 s MET 98 CO 0.02 0.30 0.15 1.52 1.05 0.00 0.00 175.02 178.06 3d25 s TYR 99 N -0.19 0.40 -4.09 4.11 -0.85 -0.99 -1.11 117.35 114.63 3d25 s TYR 99 Ca 0.02 -0.83 0.00 0.00 -0.52 0.00 0.00 57.07 55.74 3d25 s TYR 99 Cb -0.09 -0.19 0.00 0.00 0.38 0.00 0.00 41.96 42.07 3d25 s TYR 99 CO 0.01 -0.56 0.00 0.41 -1.52 0.00 0.00 175.55 173.89 3d25 n GLY 100 N -0.08 -1.63 2.93 5.49 0.00 -1.11 -0.79 105.19 110.01 3d25 n GLY 100 Ca -0.11 -1.18 -0.12 0.00 0.00 0.00 0.00 46.02 44.61 3d25 n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d25 s ASP 102 N 0.19 6.46 0.22 0.00 1.01 0.11 -1.32 116.67 123.34 3d25 s ASP 102 Ca -0.01 0.52 0.11 0.00 0.71 0.00 0.00 52.55 53.88 3d25 s ASP 102 Cb -0.02 -2.08 -0.05 0.00 1.01 0.00 0.00 42.92 41.78 3d25 s ASP 102 CO -0.01 0.34 -0.20 0.68 0.21 0.00 0.00 175.17 176.19 3d25 s VAL 103 N -1.15 2.23 0.00 -1.27 -7.23 -0.07 -1.40 120.40 111.51 3d25 s VAL 103 Ca 0.21 -2.16 0.00 0.00 -1.81 0.00 0.00 61.98 58.22 3d25 s VAL 103 Cb -0.13 -2.12 0.00 0.00 0.56 0.00 0.00 36.38 34.69 3d25 s VAL 103 CO 0.10 -0.31 0.00 0.61 -0.31 0.00 0.00 175.10 175.20 3d25 n GLY 104 N -0.11 -0.38 0.26 2.32 0.00 -0.88 -1.60 105.19 104.80 3d25 n GLY 104 Ca -0.09 -1.76 0.12 0.00 0.00 0.00 0.00 46.02 44.28 3d25 n GLY 104 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3d25 h SER 105 N 0.00 0.00 -0.05 1.61 0.02 -1.92 0.03 113.55 113.24 3d25 h SER 105 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3d25 h SER 105 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 3d25 h SER 105 CO 0.00 0.12 0.00 -0.90 -1.14 0.00 0.00 176.83 174.91 3d25 n ASP 106 N -3.76 1.45 -0.08 3.07 5.68 -1.26 -4.73 116.55 116.92 3d25 n ASP 106 Ca -0.02 -1.53 -0.01 0.00 -0.50 0.00 0.00 54.79 52.73 3d25 n ASP 106 Cb 0.23 -0.03 -0.00 0.00 -1.14 0.00 0.00 41.12 40.18 3d25 n ASP 106 CO 0.00 0.00 0.00 0.79 -1.33 0.00 0.00 177.20 176.66 3d25 n TRP 107 N 0.14 0.00 -3.32 2.11 7.02 -0.00 -5.00 117.44 118.38 3d25 n TRP 107 Ca 0.18 0.00 -0.32 0.00 -1.02 0.00 0.00 57.50 56.34 3d25 n TRP 107 Cb 0.33 -0.61 -0.06 0.00 -2.42 0.00 0.00 31.31 28.56 3d25 n TRP 107 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 3d25 s ARG 108 N -0.89 3.88 0.07 -0.99 0.52 -1.26 -4.77 118.95 115.50 3d25 s ARG 108 Ca 0.00 0.41 -0.37 0.00 -0.52 0.00 0.00 55.73 55.26 3d25 s ARG 108 Cb 0.00 -2.58 -0.17 0.00 0.52 0.00 0.00 34.95 32.72 3d25 s ARG 108 CO 0.00 0.27 1.37 0.34 0.02 0.00 0.00 175.30 177.30 3d25 n PHE 109 N -0.19 1.57 -0.04 -0.53 7.35 -1.26 -2.06 117.46 122.30 3d25 n PHE 109 Ca 0.01 0.62 -0.06 0.00 -0.76 0.00 0.00 57.45 57.26 3d25 n PHE 109 Cb 0.53 -2.35 -0.03 0.00 0.35 0.00 0.00 39.48 37.98 3d25 n PHE 109 CO 0.00 0.00 0.00 -0.11 -0.76 0.00 0.00 176.76 175.89 3d25 n LEU 110 N 2.74 1.79 -3.59 -2.13 7.94 -0.49 -4.81 117.00 118.44 3d25 n LEU 110 Ca 0.19 0.02 -0.08 0.00 -1.11 0.00 0.00 56.01 55.04 3d25 n LEU 110 Cb 0.19 -0.23 -0.02 0.00 0.53 0.00 0.00 43.42 43.89 3d25 n LEU 110 CO 0.63 0.39 0.62 0.00 -1.11 0.00 0.00 177.39 177.93 3d25 s ARG 111 N -2.14 1.12 0.32 1.96 1.70 -1.16 -5.02 118.95 115.73 3d25 s ARG 111 Ca -0.10 -0.51 0.02 0.00 -0.47 0.00 0.00 55.73 54.67 3d25 s ARG 111 Cb 0.03 0.45 -0.02 0.00 -0.57 0.00 0.00 34.95 34.85 3d25 s ARG 111 CO 0.15 -0.50 0.34 0.20 -1.08 0.00 0.00 175.30 174.41 3d25 s GLY 112 N -2.71 1.85 0.02 3.88 0.00 -1.26 0.04 107.32 109.15 3d25 s GLY 112 Ca 0.07 -1.78 -0.23 0.00 0.00 0.00 0.00 44.72 42.78 3d25 s GLY 112 CO -0.05 -1.26 0.51 -2.52 0.00 0.00 0.00 173.10 169.79 3d25 s TYR 113 N -3.39 -0.42 -0.32 1.90 -0.85 -0.91 -4.83 117.35 108.51 3d25 s TYR 113 Ca 0.36 0.54 0.03 0.00 -0.52 0.00 0.00 57.07 57.48 3d25 s TYR 113 Cb 0.02 0.32 0.16 0.00 0.38 0.00 0.00 41.96 42.83 3d25 s TYR 113 CO 0.22 -0.60 0.43 -1.58 -1.52 0.00 0.00 175.55 172.50 3d25 s HIS 114 N -2.10 -0.94 0.10 -3.49 2.46 -1.26 -2.74 115.29 107.32 3d25 s HIS 114 Ca -0.07 0.07 0.05 0.00 0.47 0.00 0.00 55.06 55.57 3d25 s HIS 114 Cb -0.01 -0.16 -0.04 0.00 -0.13 0.00 0.00 32.58 32.24 3d25 s HIS 114 CO 0.01 -1.01 0.02 -0.65 -2.47 0.00 0.00 174.74 170.65 3d25 s GLN 115 N 2.22 2.61 -0.05 2.88 -0.21 -0.26 -1.45 119.66 125.41 3d25 s GLN 115 Ca 0.12 -0.85 -0.04 0.00 0.02 0.00 0.00 55.36 54.61 3d25 s GLN 115 Cb -0.12 -2.56 0.02 0.00 1.00 0.00 0.00 33.01 31.35 3d25 s GLN 115 CO -0.22 0.53 0.13 -0.47 -2.12 0.00 0.00 175.29 173.15 3d25 s TYR 116 N -1.41 -0.15 0.01 0.91 5.04 -0.12 -2.67 117.35 118.97 3d25 s TYR 116 Ca 0.27 0.38 0.02 0.00 -2.44 0.00 0.00 57.07 55.30 3d25 s TYR 116 Cb -0.11 0.01 -0.01 0.00 0.35 0.00 0.00 41.96 42.20 3d25 s TYR 116 CO 0.19 -0.10 -0.05 0.00 -1.34 0.00 0.00 175.55 174.25 3d25 s ALA 117 N 0.39 0.41 -0.13 3.97 0.00 -0.38 -0.41 121.76 125.61 3d25 s ALA 117 Ca -0.03 -0.38 0.02 0.00 0.00 0.00 0.00 51.96 51.58 3d25 s ALA 117 Cb -0.04 -0.04 0.01 0.00 0.00 0.00 0.00 23.12 23.05 3d25 s ALA 117 CO -0.02 0.04 -0.19 -0.47 0.00 0.00 0.00 175.76 175.13 3d25 s TYR 118 N -0.55 2.37 -1.37 0.00 5.04 -0.62 -1.61 117.35 120.61 3d25 s TYR 118 Ca -0.03 -1.20 -0.13 0.00 -2.44 0.00 0.00 57.07 53.28 3d25 s TYR 118 Cb -0.05 -1.65 0.11 0.00 0.35 0.00 0.00 41.96 40.72 3d25 s TYR 118 CO -0.00 -0.58 0.56 -0.25 -1.34 0.00 0.00 175.55 173.94 3d25 n ASP 119 N 4.22 -3.25 0.00 4.32 8.00 0.76 -2.27 116.55 128.34 3d25 n ASP 119 Ca -0.19 -0.59 0.00 0.00 0.71 0.00 0.00 54.79 54.72 3d25 n ASP 119 Cb 0.51 -2.70 0.00 0.00 -0.02 0.00 0.00 41.12 38.91 3d25 n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3d25 n GLY 120 N -1.18 0.75 3.37 0.44 0.00 -1.26 -5.01 105.19 102.29 3d25 n GLY 120 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 3d25 n GLY 120 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d25 s LYS 121 N -0.48 1.44 0.06 1.61 -0.14 -0.96 -5.09 119.74 116.18 3d25 s LYS 121 Ca 0.00 -1.29 -0.36 0.00 -1.36 0.00 0.00 55.97 52.95 3d25 s LYS 121 Cb 0.00 -1.86 -0.19 0.00 -1.68 0.00 0.00 37.83 34.10 3d25 s LYS 121 CO 0.00 0.45 0.95 -0.25 -0.76 0.00 0.00 175.35 175.74 3d25 n ASP 122 N 1.07 -0.16 0.00 2.83 8.00 -1.26 -1.59 116.55 125.44 3d25 n ASP 122 Ca -0.18 1.15 0.00 0.00 0.71 0.00 0.00 54.79 56.47 3d25 n ASP 122 Cb 0.53 -0.96 0.00 0.00 -0.02 0.00 0.00 41.12 40.67 3d25 n ASP 122 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3d25 n TYR 123 N 1.17 0.00 -3.84 1.24 9.36 0.45 -4.67 117.16 120.88 3d25 n TYR 123 Ca 0.19 0.00 -0.12 0.00 3.32 0.00 0.00 57.90 61.29 3d25 n TYR 123 Cb 0.14 0.00 -0.11 0.00 -0.63 0.00 0.00 39.34 38.74 3d25 n TYR 123 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 3d25 s ILE 124 N -0.82 0.04 -0.04 2.97 2.07 -0.93 -2.02 121.20 122.47 3d25 s ILE 124 Ca 0.00 -0.36 -0.02 0.00 -1.41 0.00 0.00 60.65 58.85 3d25 s ILE 124 Cb 0.00 -0.36 0.02 0.00 0.13 0.00 0.00 42.46 42.25 3d25 s ILE 124 CO 0.00 -0.20 0.09 0.00 -1.91 0.00 0.00 174.94 172.92 3d25 s ALA 125 N -0.70 -0.18 0.12 1.50 0.00 -0.36 -0.95 121.76 121.20 3d25 s ALA 125 Ca -0.08 0.34 -0.31 0.00 0.00 0.00 0.00 51.96 51.91 3d25 s ALA 125 Cb -0.05 -0.22 -0.09 0.00 0.00 0.00 0.00 23.12 22.77 3d25 s ALA 125 CO 0.01 -0.07 1.48 -1.17 0.00 0.00 0.00 175.76 176.01 3d25 s LEU 126 N 0.43 4.37 0.71 0.00 2.96 -0.53 0.13 118.68 126.75 3d25 s LEU 126 Ca -0.03 2.44 -0.11 0.00 -0.22 0.00 0.00 54.13 56.21 3d25 s LEU 126 Cb -0.05 -3.59 0.02 0.00 0.50 0.00 0.00 46.19 43.07 3d25 s LEU 126 CO -0.02 -0.75 1.08 -0.54 -1.32 0.00 0.00 176.35 174.81 3d25 s LYS 127 N 1.34 2.83 0.50 1.98 1.02 -0.11 -4.45 119.74 122.85 3d25 s LYS 127 Ca 0.68 0.62 0.22 0.00 0.02 0.00 0.00 55.97 57.50 3d25 s LYS 127 Cb -0.39 -2.01 1.29 0.00 -0.52 0.00 0.00 37.83 36.20 3d25 s LYS 127 CO 0.31 -1.09 1.99 1.49 -0.92 0.00 0.00 175.35 177.13 3d25 h GLU 128 N -0.70 0.12 0.00 1.68 4.81 -1.88 0.41 114.58 119.02 3d25 h GLU 128 Ca -0.45 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 3d25 h GLU 128 Cb 1.24 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.59 3d25 h GLU 128 CO 0.62 0.08 0.00 -0.40 -0.73 0.00 0.00 179.01 178.58 3d25 n ASP 129 N -4.41 0.00 -1.24 1.04 5.68 -1.26 -4.82 116.55 111.53 3d25 n ASP 129 Ca 0.10 0.16 -0.16 0.00 -0.50 0.00 0.00 54.79 54.38 3d25 n ASP 129 Cb 0.54 -0.38 -0.07 0.00 -1.14 0.00 0.00 41.12 40.07 3d25 n ASP 129 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 3d25 n LEU 130 N -1.38 -1.17 0.00 -2.12 4.77 0.14 -4.75 117.00 112.49 3d25 n LEU 130 Ca 0.10 0.40 0.00 0.00 -0.03 0.00 0.00 56.01 56.48 3d25 n LEU 130 Cb 0.26 -2.36 0.00 0.00 -2.33 0.00 0.00 43.42 38.98 3d25 n LEU 130 CO 0.22 -0.86 0.05 0.54 -1.33 0.00 0.00 177.39 176.01 3d25 n ARG 131 N -2.48 3.61 -4.04 3.23 1.74 -1.26 -4.62 116.66 112.83 3d25 n ARG 131 Ca -0.16 -0.10 -0.10 0.00 -0.77 0.00 0.00 57.85 56.72 3d25 n ARG 131 Cb 0.54 -0.52 -0.06 0.00 -1.02 0.00 0.00 32.46 31.40 3d25 n ARG 131 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3d25 s SER 132 N -0.55 -0.02 0.07 0.55 1.04 -1.26 -4.97 113.70 108.56 3d25 s SER 132 Ca 0.00 -1.04 0.07 0.00 0.48 0.00 0.00 55.95 55.46 3d25 s SER 132 Cb 0.00 0.54 -0.03 0.00 0.10 0.00 0.00 66.02 66.64 3d25 s SER 132 CO 0.00 -1.08 -0.18 0.26 0.98 0.00 0.00 173.24 173.22 3d25 s TRP 133 N -4.03 1.58 -0.30 5.02 0.52 -1.26 -0.93 118.94 119.53 3d25 s TRP 133 Ca 0.26 -0.40 -0.07 0.00 0.02 0.00 0.00 56.10 55.91 3d25 s TRP 133 Cb 0.01 -0.90 0.01 0.00 -1.15 0.00 0.00 33.47 31.44 3d25 s TRP 133 CO 0.10 0.12 0.08 0.99 0.02 0.00 0.00 176.95 178.25 3d25 s THR 134 N -1.03 3.91 -0.14 2.01 2.01 0.12 -4.87 115.64 117.65 3d25 s THR 134 Ca 0.04 -0.75 -0.01 0.00 0.31 0.00 0.00 61.69 61.27 3d25 s THR 134 Cb -0.09 -3.04 -0.02 0.00 0.01 0.00 0.00 72.50 69.36 3d25 s THR 134 CO 0.03 0.05 -0.10 0.00 -0.69 0.00 0.00 174.62 173.91 3d25 s ALA 135 N 1.48 2.75 0.01 7.40 0.00 -1.26 -1.22 121.76 130.93 3d25 s ALA 135 Ca 0.02 -0.88 0.09 0.00 0.00 0.00 0.00 51.96 51.19 3d25 s ALA 135 Cb -0.17 -1.35 -0.23 0.00 0.00 0.00 0.00 23.12 21.37 3d25 s ALA 135 CO 0.02 0.20 0.87 0.00 0.00 0.00 0.00 175.76 176.85 3d25 h ALA 136 N 6.78 0.60 -2.71 0.00 0.00 -1.71 -3.46 119.26 118.76 3d25 h ALA 136 Ca -0.28 -1.27 0.00 0.00 0.00 0.00 0.00 54.91 53.36 3d25 h ALA 136 Cb 1.20 0.27 0.00 0.00 0.00 0.00 0.00 17.79 19.27 3d25 h ALA 136 CO 0.58 1.45 0.00 -0.40 0.00 0.00 0.00 179.25 180.88 3d25 n ASP 137 N -3.18 0.00 0.08 0.00 5.68 -1.26 -5.03 116.55 112.84 3d25 n ASP 137 Ca -0.12 -0.97 -0.08 0.00 -0.50 0.00 0.00 54.79 53.12 3d25 n ASP 137 Cb 1.02 0.00 -0.07 0.00 -1.14 0.00 0.00 41.12 40.92 3d25 n ASP 137 CO 0.00 0.00 0.00 0.24 -1.33 0.00 0.00 177.20 176.11 3d25 h MET 138 N 0.00 0.09 -0.12 0.11 2.86 -1.98 0.20 114.93 116.08 3d25 h MET 138 Ca 0.00 -0.13 0.03 0.00 -2.06 0.00 0.00 59.70 57.55 3d25 h MET 138 Cb 0.00 0.04 -0.04 0.00 0.06 0.00 0.00 31.60 31.67 3d25 h MET 138 CO 0.00 0.99 -0.10 0.00 1.06 0.00 0.00 176.91 178.86 3d25 h ALA 139 N 0.95 -0.01 0.00 6.32 0.00 -1.98 -2.35 119.26 122.20 3d25 h ALA 139 Ca -0.04 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 3d25 h ALA 139 Cb 1.69 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 19.69 3d25 h ALA 139 CO 0.14 -0.55 -0.17 0.00 0.00 0.00 0.00 179.25 178.67 3d25 h ALA 140 N 0.97 1.64 -0.09 0.00 0.00 -1.70 -2.12 119.26 117.96 3d25 h ALA 140 Ca 0.08 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 54.72 3d25 h ALA 140 Cb 0.23 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3d25 h ALA 140 CO -0.19 0.21 -0.49 0.37 0.00 0.00 0.00 179.25 179.15 3d25 h GLN 141 N 0.00 0.24 -0.54 0.00 5.75 -0.70 -1.40 115.11 118.47 3d25 h GLN 141 Ca -0.00 -0.13 -0.07 0.00 -0.15 0.00 0.00 58.65 58.29 3d25 h GLN 141 Cb 0.31 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.85 3d25 h GLN 141 CO 0.02 0.68 0.05 1.15 -2.65 0.00 0.00 178.83 178.09 3d25 h THR 142 N 0.19 1.26 -0.88 2.39 2.02 -0.85 -1.71 112.91 115.32 3d25 h THR 142 Ca 0.01 -1.02 0.00 0.00 0.77 0.00 0.00 66.41 66.17 3d25 h THR 142 Cb 0.94 0.87 -0.04 0.00 -1.74 0.00 0.00 68.15 68.17 3d25 h THR 142 CO 0.08 0.36 0.55 0.74 0.37 0.00 0.00 175.52 177.62 3d25 h THR 143 N 0.79 1.24 -0.41 3.16 2.02 -1.32 -2.45 112.91 115.94 3d25 h THR 143 Ca 0.16 -0.49 0.01 0.00 0.77 0.00 0.00 66.41 66.86 3d25 h THR 143 Cb 0.46 -0.02 -0.02 0.00 -1.74 0.00 0.00 68.15 66.82 3d25 h THR 143 CO 0.02 0.24 0.26 0.50 0.37 0.00 0.00 175.52 176.91 3d25 h LYS 144 N 1.21 0.52 -0.14 6.66 3.64 -0.84 -0.17 116.57 127.44 3d25 h LYS 144 Ca 0.32 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.68 3d25 h LYS 144 Cb -0.08 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.61 3d25 h LYS 144 CO -0.06 0.34 0.05 0.45 -2.27 0.00 0.00 179.45 177.96 3d25 h HIS 145 N 0.53 0.09 -0.23 1.91 3.86 -1.20 0.12 115.15 120.24 3d25 h HIS 145 Ca 0.16 0.01 0.05 0.00 -1.16 0.00 0.00 60.37 59.43 3d25 h HIS 145 Cb -0.03 -0.02 -0.07 0.00 1.06 0.00 0.00 27.41 28.34 3d25 h HIS 145 CO -0.06 0.05 -0.42 0.87 0.86 0.00 0.00 177.93 179.23 3d25 h LYS 146 N 0.12 -0.41 0.00 2.45 1.57 -1.08 -0.97 116.57 118.25 3d25 h LYS 146 Ca 0.06 0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.84 3d25 h LYS 146 Cb 0.03 0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.43 3d25 h LYS 146 CO -0.06 -0.28 -0.15 -1.49 -0.57 0.00 0.00 179.45 176.91 3d25 h TRP 147 N -0.43 0.00 -0.17 -1.35 4.06 -0.70 -1.99 115.95 115.37 3d25 h TRP 147 Ca 0.10 0.00 -0.17 0.00 2.06 0.00 0.00 58.89 60.88 3d25 h TRP 147 Cb 0.61 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 28.77 3d25 h TRP 147 CO -0.53 0.15 -0.55 0.93 -3.56 0.00 0.00 178.44 174.88 3d25 h GLU 148 N 0.00 0.68 0.00 0.49 5.08 -0.39 -1.56 114.58 118.88 3d25 h GLU 148 Ca -0.00 -0.50 -0.05 0.00 -1.00 0.00 0.00 59.36 57.80 3d25 h GLU 148 Cb 0.69 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.01 3d25 h GLU 148 CO 0.02 1.12 -0.26 0.00 -1.00 0.00 0.00 179.01 178.89 3d25 h ALA 149 N 0.56 1.50 -0.02 3.43 0.00 -0.50 -3.02 119.26 121.22 3d25 h ALA 149 Ca -0.02 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.65 3d25 h ALA 149 Cb 1.17 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.92 3d25 h ALA 149 CO 0.12 0.33 -0.18 0.00 0.00 0.00 0.00 179.25 179.52 3d25 n ALA 150 N -2.46 2.89 -3.31 0.00 0.00 -0.81 -4.96 120.51 111.86 3d25 n ALA 150 Ca -0.02 -0.62 -0.19 0.00 0.00 0.00 0.00 53.44 52.61 3d25 n ALA 150 Cb 0.32 -0.88 0.06 0.00 0.00 0.00 0.00 19.45 18.95 3d25 n ALA 150 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3d25 n HIS 151 N 0.58 -2.23 -0.24 0.00 -0.00 -0.96 -4.91 115.22 107.46 3d25 n HIS 151 Ca 0.13 0.76 -0.07 0.00 -0.00 0.00 0.00 57.72 58.55 3d25 n HIS 151 Cb 0.50 -4.20 0.04 0.00 -0.00 0.00 0.00 29.99 26.34 3d25 n HIS 151 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.34 176.62 3d25 h VAL 152 N -2.04 1.23 -0.90 1.59 2.07 -1.59 -3.06 116.25 113.57 3d25 h VAL 152 Ca -0.45 -0.67 0.06 0.00 0.82 0.00 0.00 66.70 66.45 3d25 h VAL 152 Cb 1.30 0.44 -0.06 0.00 -1.52 0.00 0.00 31.29 31.45 3d25 h VAL 152 CO 0.45 0.27 0.57 0.00 0.02 0.00 0.00 177.57 178.88 3d25 h ALA 153 N 1.14 1.22 -0.81 1.67 0.00 -1.90 -0.25 119.26 120.33 3d25 h ALA 153 Ca 0.23 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.09 3d25 h ALA 153 Cb 0.15 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 3d25 h ALA 153 CO -0.03 0.34 0.39 0.93 0.00 0.00 0.00 179.25 180.89 3d25 h GLU 154 N 1.05 1.16 -0.33 0.00 3.07 -1.79 0.29 114.58 118.03 3d25 h GLU 154 Ca 0.38 -0.17 -0.06 0.00 -0.50 0.00 0.00 59.36 59.02 3d25 h GLU 154 Cb 0.13 -0.21 -0.01 0.00 -0.84 0.00 0.00 28.75 27.82 3d25 h GLU 154 CO -0.16 0.89 -0.01 1.96 -1.40 0.00 0.00 179.01 180.28 3d25 h GLN 155 N 1.15 0.59 -0.37 2.33 4.20 -1.27 -2.38 115.11 119.36 3d25 h GLN 155 Ca 0.28 -0.20 -0.11 0.00 0.06 0.00 0.00 58.65 58.69 3d25 h GLN 155 Cb 0.11 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.83 3d25 h GLN 155 CO -0.04 0.73 -0.20 -0.07 -0.67 0.00 0.00 178.83 178.58 3d25 h LEU 156 N 0.39 0.72 -0.66 1.46 3.38 -0.59 -2.74 115.31 117.27 3d25 h LEU 156 Ca 0.09 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 3d25 h LEU 156 Cb 0.47 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.99 3d25 h LEU 156 CO 0.02 0.91 0.37 -0.09 0.09 0.00 0.00 178.44 179.74 3d25 h ARG 157 N 0.63 0.91 -0.59 1.13 2.43 -0.31 0.87 114.38 119.45 3d25 h ARG 157 Ca 0.09 -0.10 0.02 0.00 -0.81 0.00 0.00 59.98 59.18 3d25 h ARG 157 Cb 0.68 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 30.02 3d25 h ARG 157 CO 0.05 0.68 0.37 0.00 -1.51 0.00 0.00 179.97 179.56 3d25 h ALA 158 N 1.18 0.76 -0.38 2.80 0.00 -1.33 -0.18 119.26 122.11 3d25 h ALA 158 Ca 0.23 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 3d25 h ALA 158 Cb 0.02 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 3d25 h ALA 158 CO -0.04 0.13 0.09 -0.92 0.00 0.00 0.00 179.25 178.51 3d25 h TYR 159 N 0.75 0.64 -0.04 0.00 3.20 -1.12 -1.41 116.97 118.98 3d25 h TYR 159 Ca 0.23 -0.08 -0.18 0.00 3.14 0.00 0.00 58.73 61.84 3d25 h TYR 159 Cb -0.03 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.06 3d25 h TYR 159 CO -0.05 0.63 -0.76 -0.07 -1.64 0.00 0.00 178.16 176.28 3d25 h LEU 160 N 0.46 0.35 0.00 2.82 3.38 -0.45 0.16 115.31 122.03 3d25 h LEU 160 Ca 0.12 -0.24 -0.10 0.00 0.09 0.00 0.00 57.88 57.75 3d25 h LEU 160 Cb 0.32 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 3d25 h LEU 160 CO 0.00 0.98 -1.04 -0.33 0.09 0.00 0.00 178.44 178.15 3d25 h GLU 161 N 0.19 0.00 0.00 1.13 5.08 -1.10 -3.38 114.58 116.50 3d25 h GLU 161 Ca -0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3d25 h GLU 161 Cb 1.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.58 3d25 h GLU 161 CO 0.12 0.24 0.00 0.41 -1.00 0.00 0.00 179.01 178.78 3d25 n GLY 162 N 1.29 -0.02 0.20 -3.84 0.00 -0.53 -4.61 105.19 97.68 3d25 n GLY 162 Ca -0.04 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.93 3d25 n GLY 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d25 h THR 163 N 0.00 1.32 -0.27 2.61 1.03 -1.47 -0.16 112.91 115.97 3d25 h THR 163 Ca 0.00 -1.62 0.03 0.00 -0.01 0.00 0.00 66.41 64.81 3d25 h THR 163 Cb 0.00 1.69 -0.03 0.00 -1.07 0.00 0.00 68.15 68.74 3d25 h THR 163 CO 0.00 0.49 0.09 0.00 -0.01 0.00 0.00 175.52 176.09 3d25 h VAL 165 N 0.20 1.29 -0.47 0.00 2.07 -1.52 -1.97 116.25 115.85 3d25 h VAL 165 Ca 0.12 -1.61 0.03 0.00 0.82 0.00 0.00 66.70 66.06 3d25 h VAL 165 Cb 0.09 1.59 -0.03 0.00 -1.52 0.00 0.00 31.29 31.41 3d25 h VAL 165 CO -0.13 0.52 0.26 -0.33 0.02 0.00 0.00 177.57 177.92 3d25 h GLU 166 N 0.59 0.50 0.09 1.57 5.08 -0.99 -1.85 114.58 119.57 3d25 h GLU 166 Ca 0.03 -0.03 -0.27 0.00 -1.00 0.00 0.00 59.36 58.09 3d25 h GLU 166 Cb 1.02 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.15 3d25 h GLU 166 CO 0.10 0.33 -1.29 -1.49 -1.00 0.00 0.00 179.01 175.66 3d25 h TRP 167 N 0.52 0.36 -0.66 4.33 4.06 -1.31 -1.67 115.95 121.58 3d25 h TRP 167 Ca 0.19 -0.26 0.12 0.00 2.06 0.00 0.00 58.89 61.00 3d25 h TRP 167 Cb 0.06 -0.01 -0.08 0.00 -1.00 0.00 0.00 29.16 28.12 3d25 h TRP 167 CO -0.08 1.24 0.22 1.25 -3.56 0.00 0.00 178.44 177.50 3d25 h LEU 168 N 0.05 0.17 -0.42 -4.49 5.85 -1.35 0.38 115.31 115.50 3d25 h LEU 168 Ca -0.14 0.10 -0.00 0.00 0.84 0.00 0.00 57.88 58.68 3d25 h LEU 168 Cb 1.95 0.10 -0.02 0.00 0.37 0.00 0.00 40.66 43.05 3d25 h LEU 168 CO 0.17 0.08 0.26 0.03 -0.34 0.00 0.00 178.44 178.65 3d25 h ARG 169 N 0.37 0.57 -0.30 1.25 3.08 -0.94 -0.45 114.38 117.97 3d25 h ARG 169 Ca 0.35 -0.05 0.02 0.00 0.07 0.00 0.00 59.98 60.37 3d25 h ARG 169 Cb 0.49 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.40 3d25 h ARG 169 CO -0.37 0.42 0.15 -0.09 -1.07 0.00 0.00 179.97 179.01 3d25 h ARG 170 N 0.56 0.31 -0.42 0.04 2.43 -0.93 -1.91 114.38 114.48 3d25 h ARG 170 Ca 0.15 -0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.33 3d25 h ARG 170 Cb -0.01 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.43 3d25 h ARG 170 CO -0.03 0.21 0.23 1.88 -1.51 0.00 0.00 179.97 180.75 3d25 h TYR 171 N 0.32 0.43 -0.87 2.20 0.05 -0.68 0.41 116.97 118.83 3d25 h TYR 171 Ca 0.12 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.92 3d25 h TYR 171 Cb 0.04 -0.13 -0.04 0.00 1.01 0.00 0.00 36.73 37.60 3d25 h TYR 171 CO -0.09 0.24 0.55 -0.07 -1.05 0.00 0.00 178.16 177.74 3d25 h LEU 172 N 0.47 1.03 -0.02 3.88 3.38 -0.84 -0.31 115.31 122.91 3d25 h LEU 172 Ca 0.17 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 3d25 h LEU 172 Cb 0.04 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.53 3d25 h LEU 172 CO -0.09 0.78 0.00 -0.33 0.09 0.00 0.00 178.44 178.88 3d25 h GLU 173 N 1.19 0.03 -0.25 1.13 5.08 -1.01 -2.74 114.58 118.02 3d25 h GLU 173 Ca 0.32 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.63 3d25 h GLU 173 Cb -0.08 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 3d25 h GLU 173 CO -0.06 0.31 -0.03 -0.91 -1.00 0.00 0.00 179.01 177.32 3d25 h ASN 174 N -0.26 0.35 -0.50 1.42 2.35 -0.56 -2.75 115.58 115.63 3d25 h ASN 174 Ca 0.00 -0.06 -0.09 0.00 -0.55 0.00 0.00 56.30 55.61 3d25 h ASN 174 Cb 0.30 -0.09 -0.05 0.00 0.05 0.00 0.00 38.32 38.53 3d25 h ASN 174 CO 0.00 0.43 0.08 0.61 -1.65 0.00 0.00 177.43 176.90 3d25 n GLY 175 N -0.98 3.78 0.36 2.83 0.00 -0.16 -4.73 105.19 106.29 3d25 n GLY 175 Ca 0.00 -1.02 0.13 0.00 0.00 0.00 0.00 46.02 45.13 3d25 n GLY 175 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3d25 h LYS 176 N 2.50 0.73 -0.88 1.61 3.64 -1.17 0.30 116.57 123.30 3d25 h LYS 176 Ca 0.11 -0.04 0.23 0.00 -1.27 0.00 0.00 60.65 59.67 3d25 h LYS 176 Cb 1.88 -0.16 -0.13 0.00 -0.41 0.00 0.00 32.23 33.41 3d25 h LYS 176 CO 0.47 0.48 0.32 1.49 -2.27 0.00 0.00 179.45 179.94 3d25 h GLU 177 N 0.75 0.30 0.00 1.90 4.81 -1.86 -2.29 114.58 118.19 3d25 h GLU 177 Ca 0.56 -0.02 -0.20 0.00 -0.13 0.00 0.00 59.36 59.58 3d25 h GLU 177 Cb 0.89 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 30.17 3d25 h GLU 177 CO -0.35 0.20 -1.70 0.25 -0.73 0.00 0.00 179.01 176.68 3d25 n THR 178 N -5.13 0.70 0.22 0.32 -2.24 -0.53 -4.44 114.28 103.18 3d25 n THR 178 Ca 0.22 -0.23 0.06 0.00 -2.27 0.00 0.00 64.05 61.82 3d25 n THR 178 Cb 0.67 -1.20 0.49 0.00 -2.10 0.00 0.00 70.33 68.18 3d25 n THR 178 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 3d25 h LEU 179 N -0.17 0.00 -2.42 3.22 3.38 -0.47 -2.12 115.31 116.73 3d25 h LEU 179 Ca -0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.68 3d25 h LEU 179 Cb 1.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.12 3d25 h LEU 179 CO -0.10 0.25 0.00 0.00 0.09 0.00 0.00 178.44 178.68 3d25 n GLN 180 N -4.03 2.53 -3.56 1.13 6.02 -0.86 -4.90 117.38 113.70 3d25 n GLN 180 Ca -0.02 -2.37 -0.37 0.00 -0.01 0.00 0.00 57.00 54.23 3d25 n GLN 180 Cb 0.32 -1.52 -0.07 0.00 1.02 0.00 0.00 30.24 30.00 3d25 n GLN 180 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 3d25 s ARG 181 N -1.18 4.13 -0.13 -1.09 3.52 -0.80 -5.05 118.95 118.35 3d25 s ARG 181 Ca 0.44 0.12 -0.05 0.00 -0.13 0.00 0.00 55.73 56.11 3d25 s ARG 181 Cb 0.23 -3.37 -0.04 0.00 -1.56 0.00 0.00 34.95 30.21 3d25 s ARG 181 CO 0.31 0.35 0.06 0.95 -0.81 0.00 0.00 175.30 176.16 3d25 s THR 182 N 0.11 4.79 -0.46 4.11 -4.23 -1.26 -4.83 115.64 113.86 3d25 s THR 182 Ca 0.17 -0.05 -0.06 0.00 -1.18 0.00 0.00 61.69 60.57 3d25 s THR 182 Cb -0.13 -3.09 0.12 0.00 1.34 0.00 0.00 72.50 70.74 3d25 s THR 182 CO 0.05 0.56 0.30 -1.81 -0.54 0.00 0.00 174.62 173.18 3d25 s ASP 183 N -0.45 5.52 0.40 3.99 1.01 -0.00 -4.93 116.67 122.20 3d25 s ASP 183 Ca 0.10 -2.02 -0.26 0.00 0.71 0.00 0.00 52.55 51.08 3d25 s ASP 183 Cb -0.12 -1.93 -0.10 0.00 1.01 0.00 0.00 42.92 41.77 3d25 s ASP 183 CO 0.02 -0.62 1.34 0.00 0.21 0.00 0.00 175.17 176.12 3d25 n ALA 184 N 4.70 1.63 -1.69 5.23 0.00 -1.26 -1.49 120.51 127.64 3d25 n ALA 184 Ca -0.05 0.30 -0.44 0.00 0.00 0.00 0.00 53.44 53.25 3d25 n ALA 184 Cb 0.41 -2.31 -0.04 0.00 0.00 0.00 0.00 19.45 17.51 3d25 n ALA 184 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3d25 n PRO 185 N 0.19 2.45 -2.57 0.00 -0.04 -1.26 -4.64 135.00 129.13 3d25 n PRO 185 Ca 0.05 0.89 -0.43 0.00 -0.04 0.00 0.00 63.50 63.97 3d25 n PRO 185 Cb 0.39 -2.70 -0.02 0.00 -0.04 0.00 0.00 33.50 31.13 3d25 n PRO 185 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 3d25 s LYS 186 N 1.27 4.13 0.01 0.54 1.02 -0.41 -4.83 119.74 121.47 3d25 s LYS 186 Ca 0.78 1.30 0.05 0.00 0.02 0.00 0.00 55.97 58.11 3d25 s LYS 186 Cb -0.59 -3.74 -0.03 0.00 -0.52 0.00 0.00 37.83 32.94 3d25 s LYS 186 CO 0.36 -0.82 -0.12 0.95 -0.92 0.00 0.00 175.35 174.80 3d25 s THR 187 N 3.61 3.28 0.26 2.17 -4.23 -1.26 -1.29 115.64 118.19 3d25 s THR 187 Ca 0.49 -0.92 -0.14 0.00 -1.18 0.00 0.00 61.69 59.94 3d25 s THR 187 Cb -0.16 -2.40 0.00 0.00 1.34 0.00 0.00 72.50 71.29 3d25 s THR 187 CO 0.14 0.39 0.54 -1.38 -0.54 0.00 0.00 174.62 173.77 3d25 s HIS 188 N -0.95 0.28 0.08 3.99 -3.43 -0.96 -5.00 115.29 109.30 3d25 s HIS 188 Ca 0.16 -0.67 0.09 0.00 -0.80 0.00 0.00 55.06 53.84 3d25 s HIS 188 Cb -0.11 0.31 -0.03 0.00 -1.43 0.00 0.00 32.58 31.32 3d25 s HIS 188 CO 0.06 -1.07 -0.25 1.41 -2.00 0.00 0.00 174.74 172.89 3d25 s MET 189 N -3.88 1.54 0.35 -0.38 1.75 -1.26 -0.19 119.30 117.23 3d25 s MET 189 Ca 0.20 -1.16 0.06 0.00 -1.25 0.00 0.00 55.69 53.55 3d25 s MET 189 Cb -0.02 -1.81 -0.07 0.00 2.84 0.00 0.00 34.83 35.77 3d25 s MET 189 CO 0.09 0.45 -0.00 0.95 -0.65 0.00 0.00 175.02 175.86 3d25 s THR 190 N -0.92 1.74 -0.01 10.11 -4.23 -0.62 -4.98 115.64 116.73 3d25 s THR 190 Ca 0.11 -2.05 0.01 0.00 -1.18 0.00 0.00 61.69 58.58 3d25 s THR 190 Cb -0.10 -2.80 0.01 0.00 1.34 0.00 0.00 72.50 70.95 3d25 s THR 190 CO 0.03 -0.08 -0.01 -2.28 -0.54 0.00 0.00 174.62 171.74 3d25 s HIS 191 N -2.92 0.24 -0.18 3.99 2.46 -1.26 -2.46 115.29 115.17 3d25 s HIS 191 Ca 0.34 -0.02 -0.09 0.00 0.47 0.00 0.00 55.06 55.76 3d25 s HIS 191 Cb 0.07 -0.23 0.06 0.00 -0.13 0.00 0.00 32.58 32.36 3d25 s HIS 191 CO 0.16 -0.05 0.42 -1.01 -2.47 0.00 0.00 174.74 171.79 3d25 s HIS 192 N 0.32 -0.64 -0.23 3.88 3.76 -0.93 -5.01 115.29 116.44 3d25 s HIS 192 Ca -0.03 1.34 -0.10 0.00 -0.15 0.00 0.00 55.06 56.13 3d25 s HIS 192 Cb -0.05 0.28 -0.05 0.00 1.11 0.00 0.00 32.58 33.87 3d25 s HIS 192 CO -0.01 -0.37 0.13 0.00 -0.85 0.00 0.00 174.74 173.65 3d25 s ALA 193 N 1.59 3.56 -0.17 -1.40 0.00 -1.26 -0.30 121.76 123.78 3d25 s ALA 193 Ca -0.08 -0.86 -0.19 0.00 0.00 0.00 0.00 51.96 50.83 3d25 s ALA 193 Cb -0.09 -2.23 -0.22 0.00 0.00 0.00 0.00 23.12 20.58 3d25 s ALA 193 CO -0.13 -0.11 0.34 0.28 0.00 0.00 0.00 175.76 176.14 3d25 h VAL 194 N 4.99 0.95 -0.11 0.00 2.07 -1.66 -3.49 116.25 118.99 3d25 h VAL 194 Ca -0.38 -2.25 0.00 0.00 0.82 0.00 0.00 66.70 64.88 3d25 h VAL 194 Cb 1.17 2.43 0.00 0.00 -1.52 0.00 0.00 31.29 33.37 3d25 h VAL 194 CO 0.67 0.50 0.00 -1.54 0.02 0.00 0.00 177.57 177.22 3d25 n SER 195 N -4.20 0.00 -0.04 0.57 3.41 -1.17 -5.01 113.62 107.17 3d25 n SER 195 Ca -0.29 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.43 3d25 n SER 195 Cb 0.77 0.00 0.19 0.00 -0.26 0.00 0.00 64.21 64.90 3d25 n SER 195 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3d25 n ASP 196 N 0.00 0.70 -0.02 4.04 8.00 -1.26 -4.43 116.55 123.59 3d25 n ASP 196 Ca 0.00 -0.50 0.02 0.00 0.71 0.00 0.00 54.79 55.02 3d25 n ASP 196 Cb 0.00 0.39 -0.08 0.00 -0.02 0.00 0.00 41.12 41.41 3d25 n ASP 196 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 3d25 n HIS 197 N -1.36 0.00 -3.87 1.24 8.25 -1.26 -4.73 115.22 113.49 3d25 n HIS 197 Ca 0.06 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.37 3d25 n HIS 197 Cb 0.34 -0.31 -0.15 0.00 1.12 0.00 0.00 29.99 30.99 3d25 n HIS 197 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 3d25 s GLU 198 N -2.55 0.10 0.14 -0.41 2.12 -1.26 0.25 118.70 117.08 3d25 s GLU 198 Ca -0.04 0.08 0.05 0.00 0.36 0.00 0.00 54.97 55.42 3d25 s GLU 198 Cb 0.05 -0.26 -0.04 0.00 0.26 0.00 0.00 34.13 34.14 3d25 s GLU 198 CO 0.41 -0.10 -0.11 0.00 -0.54 0.00 0.00 175.26 174.93 3d25 s ALA 199 N 0.70 1.42 -0.18 6.30 0.00 0.40 -1.60 121.76 128.80 3d25 s ALA 199 Ca -0.06 -1.42 -0.02 0.00 0.00 0.00 0.00 51.96 50.45 3d25 s ALA 199 Cb -0.09 0.02 -0.01 0.00 0.00 0.00 0.00 23.12 23.04 3d25 s ALA 199 CO -0.02 -0.05 -0.08 0.99 0.00 0.00 0.00 175.76 176.60 3d25 s THR 200 N -3.01 3.25 -0.17 0.00 2.01 0.59 -0.55 115.64 117.77 3d25 s THR 200 Ca 0.14 -0.56 -0.13 0.00 0.31 0.00 0.00 61.69 61.45 3d25 s THR 200 Cb 0.01 -2.43 -0.05 0.00 0.01 0.00 0.00 72.50 70.04 3d25 s THR 200 CO 0.01 0.48 0.27 -0.76 -0.69 0.00 0.00 174.62 173.93 3d25 s LEU 201 N 0.89 4.23 -0.16 4.42 1.43 -0.25 -2.20 118.68 127.05 3d25 s LEU 201 Ca -0.02 0.47 0.01 0.00 -1.03 0.00 0.00 54.13 53.55 3d25 s LEU 201 Cb -0.15 -2.34 0.00 0.00 0.03 0.00 0.00 46.19 43.74 3d25 s LEU 201 CO 0.00 0.10 -0.17 -0.60 0.23 0.00 0.00 176.35 175.92 3d25 s ARG 202 N 0.50 3.16 -0.30 1.70 3.52 -1.03 -0.61 118.95 125.90 3d25 s ARG 202 Ca 0.15 -0.77 -0.13 0.00 -0.13 0.00 0.00 55.73 54.85 3d25 s ARG 202 Cb -0.13 -2.60 -0.04 0.00 -1.56 0.00 0.00 34.95 30.63 3d25 s ARG 202 CO 0.03 -0.03 0.26 0.00 -0.81 0.00 0.00 175.30 174.76 3d25 s TRP 204 N 1.85 3.36 -0.17 0.00 0.52 0.73 -1.25 118.94 123.98 3d25 s TRP 204 Ca 0.09 0.31 0.00 0.00 0.02 0.00 0.00 56.10 56.52 3d25 s TRP 204 Cb -0.16 -1.91 0.03 0.00 -1.15 0.00 0.00 33.47 30.28 3d25 s TRP 204 CO 0.11 0.52 -0.11 0.00 0.02 0.00 0.00 176.95 177.48 3d25 s ALA 205 N -0.69 1.84 0.02 0.98 0.00 -0.33 -2.26 121.76 121.33 3d25 s ALA 205 Ca 0.12 -0.98 0.07 0.00 0.00 0.00 0.00 51.96 51.17 3d25 s ALA 205 Cb -0.12 -1.13 -0.02 0.00 0.00 0.00 0.00 23.12 21.85 3d25 s ALA 205 CO 0.02 -0.58 -0.21 -0.51 0.00 0.00 0.00 175.76 174.48 3d25 s LEU 206 N 1.48 2.13 -0.60 0.00 1.43 -0.41 -1.53 118.68 121.18 3d25 s LEU 206 Ca 0.02 -0.48 -0.03 0.00 -1.03 0.00 0.00 54.13 52.61 3d25 s LEU 206 Cb -0.14 -1.03 0.00 0.00 0.03 0.00 0.00 46.19 45.05 3d25 s LEU 206 CO -0.09 0.20 0.52 -0.24 0.23 0.00 0.00 176.35 176.97 3d25 n SER 207 N 2.07 -3.51 -4.45 2.29 2.88 -0.34 -1.29 113.62 111.27 3d25 n SER 207 Ca -0.17 -0.26 -0.26 0.00 -1.33 0.00 0.00 58.87 56.86 3d25 n SER 207 Cb 0.53 -2.59 -0.11 0.00 -0.75 0.00 0.00 64.21 61.29 3d25 n SER 207 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 3d25 s PHE 208 N -3.15 2.34 -0.30 0.66 -0.12 -1.00 -4.69 117.98 111.72 3d25 s PHE 208 Ca 0.20 -0.34 -0.16 0.00 -0.05 0.00 0.00 56.93 56.59 3d25 s PHE 208 Cb -0.09 -1.11 0.16 0.00 -0.63 0.00 0.00 43.02 41.35 3d25 s PHE 208 CO 0.33 0.56 1.02 -0.47 -0.05 0.00 0.00 175.22 176.61 3d25 s TYR 209 N -1.91 -0.56 0.65 3.49 5.04 -0.55 -1.30 117.35 122.21 3d25 s TYR 209 Ca 0.24 1.03 -0.10 0.00 -2.44 0.00 0.00 57.07 55.80 3d25 s TYR 209 Cb -0.07 0.33 0.15 0.00 0.35 0.00 0.00 41.96 42.72 3d25 s TYR 209 CO 0.12 -0.28 0.89 -0.35 -1.34 0.00 0.00 175.55 174.59 3d25 n PRO 210 N 4.25 -0.75 0.23 4.97 -0.04 -1.26 -0.82 135.00 141.58 3d25 n PRO 210 Ca -0.14 -1.49 0.11 0.00 -0.04 0.00 0.00 63.50 61.94 3d25 n PRO 210 Cb 0.55 -0.87 0.43 0.00 -0.04 0.00 0.00 33.50 33.57 3d25 n PRO 210 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3d25 h ALA 211 N -1.67 0.98 -2.83 0.55 0.00 -1.96 -3.45 119.26 110.88 3d25 h ALA 211 Ca -0.29 -0.16 -0.52 0.00 0.00 0.00 0.00 54.91 53.95 3d25 h ALA 211 Cb 0.82 -0.03 0.04 0.00 0.00 0.00 0.00 17.79 18.63 3d25 h ALA 211 CO 0.22 0.21 0.58 -2.00 0.00 0.00 0.00 179.25 178.26 3d25 s GLU 212 N -3.53 4.47 0.00 0.00 2.56 -1.26 -4.98 118.70 115.95 3d25 s GLU 212 Ca 0.02 2.04 0.00 0.00 0.00 0.00 0.00 54.97 57.03 3d25 s GLU 212 Cb 0.09 -3.13 0.00 0.00 2.00 0.00 0.00 34.13 33.09 3d25 s GLU 212 CO 0.63 -0.04 0.00 1.51 -0.56 0.00 0.00 175.26 176.80 3d25 n ILE 213 N 1.13 0.00 -4.28 -3.70 3.06 -1.26 -4.60 119.36 109.71 3d25 n ILE 213 Ca 0.00 0.00 -0.29 0.00 -2.50 0.00 0.00 62.75 59.97 3d25 n ILE 213 Cb 0.43 0.00 -0.17 0.00 0.54 0.00 0.00 39.64 40.44 3d25 n ILE 213 CO 0.00 0.00 0.00 -0.89 -2.50 0.00 0.00 176.55 173.16 3d25 s THR 214 N -1.58 1.45 -0.12 9.51 2.01 -0.65 -5.00 115.64 121.26 3d25 s THR 214 Ca 0.00 -0.59 -0.02 0.00 0.31 0.00 0.00 61.69 61.39 3d25 s THR 214 Cb 0.00 -1.35 -0.03 0.00 0.01 0.00 0.00 72.50 71.13 3d25 s THR 214 CO 0.00 0.43 -0.06 -0.76 -0.69 0.00 0.00 174.62 173.54 3d25 s LEU 215 N 1.19 3.15 0.03 4.42 1.43 -1.26 -1.34 118.68 126.30 3d25 s LEU 215 Ca -0.03 -0.12 -0.01 0.00 -1.03 0.00 0.00 54.13 52.95 3d25 s LEU 215 Cb -0.14 -1.73 -0.02 0.00 0.03 0.00 0.00 46.19 44.33 3d25 s LEU 215 CO -0.05 0.24 -0.01 0.42 0.23 0.00 0.00 176.35 177.18 3d25 s THR 216 N -0.04 0.13 0.07 5.49 -4.23 -0.78 -4.98 115.64 111.30 3d25 s THR 216 Ca 0.00 -1.08 0.04 0.00 -1.18 0.00 0.00 61.69 59.47 3d25 s THR 216 Cb -0.13 -0.57 -0.04 0.00 1.34 0.00 0.00 72.50 73.10 3d25 s THR 216 CO 0.03 -0.60 0.02 0.26 -0.54 0.00 0.00 174.62 173.80 3d25 s TRP 217 N -2.02 3.06 0.06 3.99 0.52 -1.26 -0.41 118.94 122.88 3d25 s TRP 217 Ca -0.11 0.02 0.07 0.00 0.02 0.00 0.00 56.10 56.10 3d25 s TRP 217 Cb -0.06 -1.58 -0.03 0.00 -1.15 0.00 0.00 33.47 30.66 3d25 s TRP 217 CO -0.03 0.49 -0.19 -0.65 0.02 0.00 0.00 176.95 176.59 3d25 s GLN 218 N -2.22 1.21 -0.27 4.98 -0.21 -0.33 -1.38 119.66 121.44 3d25 s GLN 218 Ca 0.26 -0.95 -0.07 0.00 0.02 0.00 0.00 55.36 54.62 3d25 s GLN 218 Cb -0.12 -1.33 -0.01 0.00 1.00 0.00 0.00 33.01 32.55 3d25 s GLN 218 CO 0.18 0.33 0.08 0.50 -2.12 0.00 0.00 175.29 174.26 3d25 s ARG 219 N -1.35 3.41 -1.44 2.91 3.00 0.57 -1.51 118.95 124.53 3d25 s ARG 219 Ca 0.06 -0.64 -0.04 0.00 -1.00 0.00 0.00 55.73 54.10 3d25 s ARG 219 Cb -0.09 -3.36 0.02 0.00 0.00 0.00 0.00 34.95 31.52 3d25 s ARG 219 CO 0.02 -0.31 0.34 -0.25 0.00 0.00 0.00 175.30 175.10 3d25 n ASP 220 N 4.91 -5.12 0.00 -2.12 8.00 -0.64 -2.06 116.55 119.51 3d25 n ASP 220 Ca -0.15 -0.16 0.00 0.00 0.71 0.00 0.00 54.79 55.19 3d25 n ASP 220 Cb 0.50 -4.21 0.00 0.00 -0.02 0.00 0.00 41.12 37.39 3d25 n ASP 220 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3d25 n GLY 221 N -1.20 0.78 3.27 0.44 0.00 -1.26 -5.05 105.19 102.17 3d25 n GLY 221 Ca -0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.58 3d25 n GLY 221 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3d25 s GLU 222 N -0.68 2.50 0.12 1.61 2.12 -0.88 -5.04 118.70 118.45 3d25 s GLU 222 Ca 0.00 -0.91 -0.35 0.00 0.36 0.00 0.00 54.97 54.07 3d25 s GLU 222 Cb 0.00 -2.15 -0.14 0.00 0.26 0.00 0.00 34.13 32.10 3d25 s GLU 222 CO 0.00 0.40 1.54 -0.25 -0.54 0.00 0.00 175.26 176.41 3d25 n ASP 223 N 2.89 2.75 -4.17 -1.70 8.00 -1.26 -0.31 116.55 122.74 3d25 n ASP 223 Ca -0.17 1.08 -0.31 0.00 0.71 0.00 0.00 54.79 56.10 3d25 n ASP 223 Cb 0.52 -1.36 -0.17 0.00 -0.02 0.00 0.00 41.12 40.09 3d25 n ASP 223 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 3d25 s GLN 224 N 1.05 2.81 -0.05 -1.24 0.74 -0.48 -4.78 119.66 117.70 3d25 s GLN 224 Ca 0.81 -0.79 0.07 0.00 0.05 0.00 0.00 55.36 55.51 3d25 s GLN 224 Cb -0.75 -2.20 -0.10 0.00 1.10 0.00 0.00 33.01 31.05 3d25 s GLN 224 CO 0.41 0.08 0.08 0.25 -0.55 0.00 0.00 175.29 175.57 3d25 n THR 225 N 3.78 0.32 -2.00 -0.34 -2.24 -1.26 -4.28 114.28 108.27 3d25 n THR 225 Ca -0.20 -0.27 -0.41 0.00 -2.27 0.00 0.00 64.05 60.91 3d25 n THR 225 Cb 0.52 -0.39 -0.01 0.00 -2.10 0.00 0.00 70.33 68.35 3d25 n THR 225 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3d25 s GLN 226 N -2.32 4.26 -1.45 -0.78 -0.21 -1.26 -2.67 119.66 115.23 3d25 s GLN 226 Ca -0.03 2.35 0.00 0.00 0.02 0.00 0.00 55.36 57.70 3d25 s GLN 226 Cb 0.03 -3.03 0.00 0.00 1.00 0.00 0.00 33.01 31.01 3d25 s GLN 226 CO 0.31 -0.32 0.00 -0.25 -2.12 0.00 0.00 175.29 172.91 3d25 n ASP 227 N 0.70 -4.92 -4.51 5.90 8.00 -1.26 -4.87 116.55 115.58 3d25 n ASP 227 Ca 0.00 0.03 -0.24 0.00 0.71 0.00 0.00 54.79 55.29 3d25 n ASP 227 Cb 0.41 -4.02 -0.10 0.00 -0.02 0.00 0.00 41.12 37.40 3d25 n ASP 227 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3d25 s THR 228 N -2.81 2.73 -0.00 -3.53 -4.23 -1.09 -1.29 115.64 105.42 3d25 s THR 228 Ca 0.00 -2.20 0.00 0.00 -1.18 0.00 0.00 61.69 58.31 3d25 s THR 228 Cb 0.00 -2.42 0.00 0.00 1.34 0.00 0.00 72.50 71.42 3d25 s THR 228 CO 0.00 -0.34 -0.01 -0.70 -0.54 0.00 0.00 174.62 173.03 3d25 s GLU 229 N -3.40 0.12 -0.18 3.99 2.12 0.10 -4.97 118.70 116.49 3d25 s GLU 229 Ca 0.29 -0.04 -0.01 0.00 0.36 0.00 0.00 54.97 55.56 3d25 s GLU 229 Cb -0.06 -0.13 0.05 0.00 0.26 0.00 0.00 34.13 34.25 3d25 s GLU 229 CO 0.15 0.02 -0.01 -1.17 -0.54 0.00 0.00 175.26 173.72 3d25 s LEU 230 N 0.02 1.45 0.33 2.70 2.96 -1.26 -0.68 118.68 124.19 3d25 s LEU 230 Ca 0.00 -0.73 -0.27 0.00 -0.22 0.00 0.00 54.13 52.91 3d25 s LEU 230 Cb -0.01 -0.77 -0.09 0.00 0.50 0.00 0.00 46.19 45.82 3d25 s LEU 230 CO -0.00 -0.24 1.03 0.68 -1.32 0.00 0.00 176.35 176.50 3d25 s VAL 231 N 1.73 3.79 0.26 1.68 -7.23 -1.10 -5.00 120.40 114.53 3d25 s VAL 231 Ca -0.00 1.58 -0.29 0.00 -1.81 0.00 0.00 61.98 61.45 3d25 s VAL 231 Cb -0.16 -3.92 -0.14 0.00 0.56 0.00 0.00 36.38 32.72 3d25 s VAL 231 CO -0.07 0.21 1.08 1.21 -0.31 0.00 0.00 175.10 177.21 3d25 n GLU 232 N 0.65 1.36 -1.69 4.82 2.13 -1.26 -4.61 120.64 122.04 3d25 n GLU 232 Ca 0.02 0.48 -0.44 0.00 0.66 0.00 0.00 57.16 57.87 3d25 n GLU 232 Cb 0.48 -1.90 -0.04 0.00 0.27 0.00 0.00 31.44 30.25 3d25 n GLU 232 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 3d25 n THR 233 N 0.64 0.12 -4.35 6.31 -1.04 -1.26 -4.87 114.28 109.83 3d25 n THR 233 Ca 0.11 -0.02 -0.23 0.00 -2.04 0.00 0.00 64.05 61.86 3d25 n THR 233 Cb 0.30 -1.83 -0.12 0.00 -1.82 0.00 0.00 70.33 66.86 3d25 n THR 233 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3d25 s ARG 234 N 1.61 1.31 0.19 -2.82 1.70 -0.94 -4.98 118.95 115.03 3d25 s ARG 234 Ca 0.79 -1.40 -0.30 0.00 -0.47 0.00 0.00 55.73 54.36 3d25 s ARG 234 Cb -0.58 -1.48 -0.08 0.00 -0.57 0.00 0.00 34.95 32.24 3d25 s ARG 234 CO 0.37 0.31 0.93 -1.25 -1.08 0.00 0.00 175.30 174.58 3d25 s PRO 235 N -2.61 4.78 0.21 3.89 0.04 -1.26 -0.78 135.00 139.26 3d25 s PRO 235 Ca 0.15 1.45 0.04 0.00 0.04 0.00 0.00 61.00 62.69 3d25 s PRO 235 Cb -0.07 -3.31 0.14 0.00 0.04 0.00 0.00 34.50 31.30 3d25 s PRO 235 CO 0.07 0.43 1.48 0.00 0.04 0.00 0.00 177.00 179.02 3d25 h ALA 236 N 4.62 0.71 0.00 8.56 0.00 -1.36 -3.46 119.26 128.33 3d25 h ALA 236 Ca -0.44 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 53.83 3d25 h ALA 236 Cb 1.20 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3d25 h ALA 236 CO 0.69 0.83 0.00 0.41 0.00 0.00 0.00 179.25 181.18 3d25 n GLY 237 N 0.55 0.70 0.69 0.00 0.00 -1.26 -4.92 105.19 100.95 3d25 n GLY 237 Ca -0.03 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.06 3d25 n GLY 237 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3d25 n ASP 238 N 0.00 3.12 0.00 1.61 5.68 -1.26 -4.94 116.55 120.76 3d25 n ASP 238 Ca 0.00 -2.21 0.00 0.00 -0.50 0.00 0.00 54.79 52.08 3d25 n ASP 238 Cb 0.00 -0.29 0.00 0.00 -1.14 0.00 0.00 41.12 39.69 3d25 n ASP 238 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3d25 n GLY 239 N 0.29 1.66 3.88 6.12 0.00 -1.26 -5.07 105.19 110.81 3d25 n GLY 239 Ca 0.13 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.95 3d25 n GLY 239 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3d25 n THR 240 N -1.45 0.00 -4.16 2.61 -2.24 -1.26 -4.93 114.28 102.85 3d25 n THR 240 Ca 0.00 -1.99 -0.12 0.00 -2.27 0.00 0.00 64.05 59.67 3d25 n THR 240 Cb 0.00 -0.41 -0.10 0.00 -2.10 0.00 0.00 70.33 67.72 3d25 n THR 240 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 3d25 s PHE 241 N -2.63 0.94 0.15 4.78 0.40 -0.42 -0.95 117.98 120.25 3d25 s PHE 241 Ca 0.55 -0.78 0.06 0.00 -0.60 0.00 0.00 56.93 56.16 3d25 s PHE 241 Cb -0.04 -0.53 -0.04 0.00 0.51 0.00 0.00 43.02 42.92 3d25 s PHE 241 CO 0.35 -0.08 -0.14 -0.65 0.70 0.00 0.00 175.22 175.40 3d25 s GLN 242 N -3.25 1.13 0.04 0.44 -0.21 0.04 -1.20 119.66 116.65 3d25 s GLN 242 Ca 0.08 -1.39 -0.27 0.00 0.02 0.00 0.00 55.36 53.79 3d25 s GLN 242 Cb 0.01 -0.94 0.07 0.00 1.00 0.00 0.00 33.01 33.15 3d25 s GLN 242 CO -0.02 0.16 0.67 0.21 -2.12 0.00 0.00 175.29 174.19 3d25 s LYS 243 N -3.16 1.12 0.04 2.91 2.20 -0.58 -2.21 119.74 120.06 3d25 s LYS 243 Ca 0.15 -0.08 -0.02 0.00 -0.36 0.00 0.00 55.97 55.66 3d25 s LYS 243 Cb -0.02 0.52 -0.03 0.00 -1.51 0.00 0.00 37.83 36.79 3d25 s LYS 243 CO 0.04 -0.42 -0.00 1.67 -0.36 0.00 0.00 175.35 176.27 3d25 s TRP 244 N -2.37 0.41 -0.03 4.03 1.48 -1.26 -1.19 118.94 120.01 3d25 s TRP 244 Ca -0.05 -0.87 0.02 0.00 -1.06 0.00 0.00 56.10 54.14 3d25 s TRP 244 Cb -0.00 -0.30 0.01 0.00 -1.16 0.00 0.00 33.47 32.01 3d25 s TRP 244 CO -0.01 -0.35 -0.06 0.00 -4.06 0.00 0.00 176.95 172.47 3d25 s ALA 245 N -3.25 0.67 0.13 2.67 0.00 -0.38 -2.71 121.76 118.88 3d25 s ALA 245 Ca 0.01 -0.16 0.08 0.00 0.00 0.00 0.00 51.96 51.89 3d25 s ALA 245 Cb 0.03 -0.32 -0.04 0.00 0.00 0.00 0.00 23.12 22.79 3d25 s ALA 245 CO -0.08 0.06 -0.19 0.00 0.00 0.00 0.00 175.76 175.55 3d25 s ALA 246 N 0.47 1.83 0.01 0.00 0.00 0.14 0.11 121.76 124.34 3d25 s ALA 246 Ca -0.06 -1.33 0.02 0.00 0.00 0.00 0.00 51.96 50.59 3d25 s ALA 246 Cb -0.10 -0.21 -0.01 0.00 0.00 0.00 0.00 23.12 22.80 3d25 s ALA 246 CO 0.00 0.29 -0.07 0.54 0.00 0.00 0.00 175.76 176.53 3d25 s VAL 247 N -1.55 0.49 -0.15 0.00 0.11 0.22 -0.72 120.40 118.80 3d25 s VAL 247 Ca 0.10 -0.54 -0.16 0.00 -2.93 0.00 0.00 61.98 58.45 3d25 s VAL 247 Cb -0.08 -0.47 -0.04 0.00 -1.53 0.00 0.00 36.38 34.26 3d25 s VAL 247 CO 0.05 -0.05 0.38 -0.69 -3.33 0.00 0.00 175.10 171.47 3d25 s VAL 248 N -0.56 5.24 0.06 2.04 1.01 -0.41 -1.09 120.40 126.69 3d25 s VAL 248 Ca -0.02 0.74 0.04 0.00 0.00 0.00 0.00 61.98 62.74 3d25 s VAL 248 Cb -0.05 -3.72 -0.03 0.00 0.00 0.00 0.00 36.38 32.58 3d25 s VAL 248 CO 0.00 0.34 -0.11 0.68 0.00 0.00 0.00 175.10 176.00 3d25 s VAL 249 N 0.68 0.88 0.15 2.92 -7.23 0.29 -4.97 120.40 113.13 3d25 s VAL 249 Ca 0.21 -1.24 -0.33 0.00 -1.81 0.00 0.00 61.98 58.81 3d25 s VAL 249 Cb -0.14 -0.91 -0.12 0.00 0.56 0.00 0.00 36.38 35.76 3d25 s VAL 249 CO 0.07 -0.31 1.71 -2.65 -0.31 0.00 0.00 175.10 173.62 3d25 n PRO 250 N 1.30 2.52 -1.68 4.82 -0.02 -1.26 -0.46 135.00 140.22 3d25 n PRO 250 Ca -0.21 0.91 -0.46 0.00 -2.02 0.00 0.00 63.50 61.72 3d25 n PRO 250 Cb 0.55 -2.74 -0.04 0.00 -0.02 0.00 0.00 33.50 31.24 3d25 n PRO 250 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 3d25 n SER 251 N 4.37 3.36 0.00 2.55 7.64 0.14 -1.75 113.62 129.93 3d25 n SER 251 Ca 0.17 1.05 0.00 0.00 1.01 0.00 0.00 58.87 61.10 3d25 n SER 251 Cb 0.33 -1.44 0.00 0.00 -1.01 0.00 0.00 64.21 62.08 3d25 n SER 251 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3d25 n GLY 252 N 3.75 1.60 1.14 0.23 0.00 -1.26 -4.92 105.19 105.73 3d25 n GLY 252 Ca 0.18 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.28 3d25 n GLY 252 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3d25 n GLN 253 N -1.43 3.40 -0.24 1.61 1.13 -0.72 -4.65 117.38 116.48 3d25 n GLN 253 Ca 0.00 -2.77 0.16 0.00 -1.94 0.00 0.00 57.00 52.45 3d25 n GLN 253 Cb 0.00 -1.82 0.46 0.00 0.11 0.00 0.00 30.24 28.99 3d25 n GLN 253 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 3d25 h GLU 254 N 2.61 0.50 0.00 -1.09 3.07 -1.92 -1.91 114.58 115.85 3d25 h GLU 254 Ca 0.00 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.83 3d25 h GLU 254 Cb 1.41 -0.11 0.00 0.00 -0.84 0.00 0.00 28.75 29.21 3d25 h GLU 254 CO 0.23 0.33 0.00 1.04 -1.40 0.00 0.00 179.01 179.21 3d25 n GLN 255 N -4.54 0.10 0.17 2.33 6.02 -1.26 -2.17 117.38 118.03 3d25 n GLN 255 Ca 0.18 0.38 0.06 0.00 -0.01 0.00 0.00 57.00 57.61 3d25 n GLN 255 Cb 0.59 -1.71 0.20 0.00 1.02 0.00 0.00 30.24 30.34 3d25 n GLN 255 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3d25 h ARG 256 N 0.00 0.00 -5.83 -1.09 3.08 -1.73 -3.46 114.38 105.35 3d25 h ARG 256 Ca 0.00 0.00 -0.67 0.00 0.07 0.00 0.00 59.98 59.38 3d25 h ARG 256 Cb 0.26 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 30.21 3d25 h ARG 256 CO 0.00 0.37 -0.54 0.71 -1.07 0.00 0.00 179.97 179.44 3d25 s TYR 257 N -3.26 3.40 0.01 3.04 1.51 -0.92 -1.62 117.35 119.51 3d25 s TYR 257 Ca 0.03 0.35 0.04 0.00 -1.01 0.00 0.00 57.07 56.47 3d25 s TYR 257 Cb 0.09 -1.84 -0.02 0.00 -0.11 0.00 0.00 41.96 40.08 3d25 s TYR 257 CO 0.70 0.61 -0.13 0.95 -1.11 0.00 0.00 175.55 176.58 3d25 s THR 258 N -1.05 1.01 -0.12 -0.71 -4.23 -0.57 -4.53 115.64 105.43 3d25 s THR 258 Ca 0.17 -0.76 -0.05 0.00 -1.18 0.00 0.00 61.69 59.88 3d25 s THR 258 Cb -0.12 -0.89 -0.04 0.00 1.34 0.00 0.00 72.50 72.80 3d25 s THR 258 CO 0.07 0.12 0.04 0.00 -0.54 0.00 0.00 174.62 174.32 3d25 s HIS 260 N -0.49 2.24 -0.21 0.00 3.76 0.45 -1.04 115.29 120.00 3d25 s HIS 260 Ca 0.10 -1.21 -0.01 0.00 -0.15 0.00 0.00 55.06 53.79 3d25 s HIS 260 Cb -0.12 -1.61 0.01 0.00 1.11 0.00 0.00 32.58 31.97 3d25 s HIS 260 CO 0.02 -0.63 -0.12 0.08 -0.85 0.00 0.00 174.74 173.24 3d25 s VAL 261 N 1.27 2.62 -0.12 -0.90 1.01 -0.75 -1.87 120.40 121.65 3d25 s VAL 261 Ca 0.01 -0.86 -0.03 0.00 0.00 0.00 0.00 61.98 61.10 3d25 s VAL 261 Cb -0.14 -2.20 -0.03 0.00 0.00 0.00 0.00 36.38 34.01 3d25 s VAL 261 CO -0.08 0.41 -0.02 -1.10 0.00 0.00 0.00 175.10 174.31 3d25 s GLN 262 N 1.34 3.33 -0.03 2.72 -0.21 -0.45 -1.83 119.66 124.53 3d25 s GLN 262 Ca 0.04 -0.48 -0.29 0.00 0.02 0.00 0.00 55.36 54.65 3d25 s GLN 262 Cb -0.14 -2.84 0.10 0.00 1.00 0.00 0.00 33.01 31.12 3d25 s GLN 262 CO -0.08 0.46 0.82 -1.58 -2.12 0.00 0.00 175.29 172.78 3d25 s HIS 263 N -0.22 -0.46 0.05 0.91 2.46 -1.26 -1.64 115.29 115.12 3d25 s HIS 263 Ca 0.04 0.56 0.31 0.00 0.47 0.00 0.00 55.06 56.44 3d25 s HIS 263 Cb -0.13 0.49 1.53 0.00 -0.13 0.00 0.00 32.58 34.34 3d25 s HIS 263 CO 0.02 -0.56 1.94 1.49 -2.47 0.00 0.00 174.74 175.16 3d25 h GLU 264 N 2.38 0.00 -0.01 2.88 4.81 -1.94 -1.93 114.58 120.76 3d25 h GLU 264 Ca -0.24 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.99 3d25 h GLU 264 Cb 1.21 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.59 3d25 h GLU 264 CO 0.34 0.00 -0.37 0.41 -0.73 0.00 0.00 179.01 178.66 3d25 n GLY 265 N -0.67 0.05 3.61 1.92 0.00 -1.26 -4.76 105.19 104.08 3d25 n GLY 265 Ca -0.01 -0.56 -0.38 0.00 0.00 0.00 0.00 46.02 45.08 3d25 n GLY 265 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d25 s LEU 266 N -2.21 4.05 0.40 0.99 1.43 -0.73 -4.53 118.68 118.08 3d25 s LEU 266 Ca 0.16 0.08 0.07 0.00 -1.03 0.00 0.00 54.13 53.41 3d25 s LEU 266 Cb 0.16 -2.18 0.81 0.00 0.03 0.00 0.00 46.19 45.01 3d25 s LEU 266 CO 0.47 -0.05 2.02 -0.65 0.23 0.00 0.00 176.35 178.38 3d25 h PRO 267 N 8.12 0.54 -5.02 1.29 0.11 -1.85 -3.43 132.00 131.76 3d25 h PRO 267 Ca -0.35 -0.05 -0.41 0.00 0.11 0.00 0.00 66.00 65.30 3d25 h PRO 267 Cb 1.18 -0.11 -0.26 0.00 0.11 0.00 0.00 31.00 31.91 3d25 h PRO 267 CO 0.59 0.40 -0.78 0.15 -0.21 0.00 0.00 178.00 178.14 3d25 s LYS 268 N -5.39 0.84 0.72 1.05 1.02 -1.26 -5.13 119.74 111.58 3d25 s LYS 268 Ca -0.08 -0.57 -0.16 0.00 0.02 0.00 0.00 55.97 55.18 3d25 s LYS 268 Cb 0.17 -0.80 0.01 0.00 -0.52 0.00 0.00 37.83 36.68 3d25 s LYS 268 CO 0.74 0.21 0.97 -2.30 -0.92 0.00 0.00 175.35 174.05 3d25 n PRO 269 N 2.29 0.52 -3.73 -1.68 -0.02 -1.26 -5.00 135.00 126.12 3d25 n PRO 269 Ca -0.16 0.23 -0.27 0.00 -2.02 0.00 0.00 63.50 61.28 3d25 n PRO 269 Cb 0.56 -2.23 -0.03 0.00 -0.02 0.00 0.00 33.50 31.78 3d25 n PRO 269 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3d25 s LEU 270 N -3.14 4.24 -0.08 2.45 1.43 -0.76 -4.92 118.68 117.91 3d25 s LEU 270 Ca 0.73 0.37 0.02 0.00 -1.03 0.00 0.00 54.13 54.22 3d25 s LEU 270 Cb -0.35 -3.13 0.02 0.00 0.03 0.00 0.00 46.19 42.76 3d25 s LEU 270 CO 0.50 -0.03 -0.11 -0.89 0.23 0.00 0.00 176.35 176.05 3d25 s THR 271 N -1.85 1.10 0.03 5.49 2.01 -1.26 -1.81 115.64 119.34 3d25 s THR 271 Ca 0.38 -0.43 0.05 0.00 0.31 0.00 0.00 61.69 62.00 3d25 s THR 271 Cb -0.11 -1.03 -0.03 0.00 0.01 0.00 0.00 72.50 71.33 3d25 s THR 271 CO 0.29 0.36 -0.13 -0.76 -0.69 0.00 0.00 174.62 173.69 3d25 s LEU 272 N 0.90 2.88 -0.04 4.42 1.02 -0.21 -4.95 118.68 122.70 3d25 s LEU 272 Ca -0.10 -0.30 -0.03 0.00 0.02 0.00 0.00 54.13 53.72 3d25 s LEU 272 Cb -0.15 -1.67 0.02 0.00 0.02 0.00 0.00 46.19 44.41 3d25 s LEU 272 CO 0.01 0.26 0.11 -0.60 0.02 0.00 0.00 176.35 176.15 3d25 s ARG 273 N -1.45 0.09 0.00 1.70 3.52 -1.26 -1.69 118.95 119.86 3d25 s ARG 273 Ca 0.16 0.21 0.03 0.00 -0.13 0.00 0.00 55.73 56.00 3d25 s ARG 273 Cb -0.11 -0.04 0.17 0.00 -1.56 0.00 0.00 34.95 33.41 3d25 s ARG 273 CO 0.07 -0.07 0.65 1.87 -0.81 0.00 0.00 175.30 177.00