#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bd2 n SER 2 N 0.00 -1.16 -3.80 1.61 7.64 -1.26 -4.18 113.62 112.47 1bd2 n SER 2 Ca 0.00 0.33 -0.10 0.00 1.01 0.00 0.00 58.87 60.12 1bd2 n SER 2 Cb 0.00 -1.30 -0.05 0.00 -1.01 0.00 0.00 64.21 61.84 1bd2 n SER 2 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1bd2 s HIS 3 N -2.48 0.06 0.01 1.43 4.02 -0.46 -4.93 115.29 112.93 1bd2 s HIS 3 Ca 0.61 -0.41 -0.27 0.00 1.02 0.00 0.00 55.06 56.01 1bd2 s HIS 3 Cb -0.22 0.18 0.06 0.00 -1.02 0.00 0.00 32.58 31.58 1bd2 s HIS 3 CO 0.64 -0.77 0.62 -1.54 1.02 0.00 0.00 174.74 174.70 1bd2 s SER 4 N -2.89 -0.58 -0.04 1.40 1.04 -1.26 -0.49 113.70 110.88 1bd2 s SER 4 Ca 0.10 0.46 0.04 0.00 0.48 0.00 0.00 55.95 57.03 1bd2 s SER 4 Cb 0.02 0.53 -0.00 0.00 0.10 0.00 0.00 66.02 66.66 1bd2 s SER 4 CO -0.05 -0.68 -0.16 -0.32 0.98 0.00 0.00 173.24 173.01 1bd2 s MET 5 N -1.86 1.68 -0.02 4.02 0.00 -0.78 -0.24 119.30 122.10 1bd2 s MET 5 Ca -0.08 -0.55 -0.03 0.00 0.00 0.00 0.00 55.69 55.03 1bd2 s MET 5 Cb -0.01 -1.46 0.00 0.00 0.00 0.00 0.00 34.83 33.37 1bd2 s MET 5 CO 0.04 0.20 0.07 1.03 0.00 0.00 0.00 175.02 176.36 1bd2 s ARG 6 N 0.12 0.17 -0.04 4.11 1.81 0.07 -1.90 118.95 123.29 1bd2 s ARG 6 Ca -0.05 -0.05 0.06 0.00 -1.72 0.00 0.00 55.73 53.98 1bd2 s ARG 6 Cb -0.12 0.07 -0.02 0.00 -0.45 0.00 0.00 34.95 34.44 1bd2 s ARG 6 CO 0.02 -0.03 -0.24 0.71 -0.68 0.00 0.00 175.30 175.09 1bd2 s TYR 7 N -0.33 2.44 -0.12 -0.53 2.02 -0.12 0.05 117.35 120.75 1bd2 s TYR 7 Ca -0.04 -0.53 0.01 0.00 -0.37 0.00 0.00 57.07 56.14 1bd2 s TYR 7 Cb -0.03 -1.57 0.02 0.00 -0.40 0.00 0.00 41.96 39.98 1bd2 s TYR 7 CO 0.00 -0.09 -0.13 -0.06 -1.57 0.00 0.00 175.55 173.69 1bd2 s PHE 8 N -0.40 1.89 -0.07 2.71 0.40 0.34 -1.94 117.98 120.91 1bd2 s PHE 8 Ca 0.04 -0.93 0.06 0.00 -0.60 0.00 0.00 56.93 55.49 1bd2 s PHE 8 Cb -0.12 -1.40 -0.01 0.00 0.51 0.00 0.00 43.02 42.00 1bd2 s PHE 8 CO 0.01 -0.52 -0.24 -0.06 0.70 0.00 0.00 175.22 175.12 1bd2 s PHE 9 N 1.23 2.48 -0.07 0.36 0.40 0.21 -1.47 117.98 121.11 1bd2 s PHE 9 Ca -0.02 -0.75 0.02 0.00 -0.60 0.00 0.00 56.93 55.58 1bd2 s PHE 9 Cb -0.14 -1.62 0.02 0.00 0.51 0.00 0.00 43.02 41.78 1bd2 s PHE 9 CO -0.05 -0.23 -0.11 0.99 0.70 0.00 0.00 175.22 176.52 1bd2 s THR 10 N -0.10 1.08 -0.10 0.64 2.01 -0.20 -1.42 115.64 117.56 1bd2 s THR 10 Ca -0.05 -0.42 -0.00 0.00 0.31 0.00 0.00 61.69 61.52 1bd2 s THR 10 Cb -0.14 -1.01 0.02 0.00 0.01 0.00 0.00 72.50 71.38 1bd2 s THR 10 CO 0.04 0.35 -0.07 -0.44 -0.69 0.00 0.00 174.62 173.82 1bd2 s SER 11 N 0.87 2.01 -0.19 3.53 0.01 -0.81 -1.21 113.70 117.92 1bd2 s SER 11 Ca -0.11 -0.26 -0.00 0.00 1.31 0.00 0.00 55.95 56.89 1bd2 s SER 11 Cb -0.15 -0.77 0.01 0.00 0.21 0.00 0.00 66.02 65.32 1bd2 s SER 11 CO 0.01 -0.12 -0.16 -0.69 0.41 0.00 0.00 173.24 172.70 1bd2 s VAL 12 N 1.64 2.43 0.46 3.43 1.01 -0.35 -1.60 120.40 127.42 1bd2 s VAL 12 Ca 0.03 -0.82 -0.23 0.00 0.00 0.00 0.00 61.98 60.96 1bd2 s VAL 12 Cb -0.13 -2.04 -0.07 0.00 0.00 0.00 0.00 36.38 34.14 1bd2 s VAL 12 CO -0.07 0.51 1.20 -0.94 0.00 0.00 0.00 175.10 175.80 1bd2 s SER 13 N 1.27 6.08 -0.60 3.32 1.04 -0.62 -1.47 113.70 122.72 1bd2 s SER 13 Ca 0.04 2.38 0.06 0.00 0.48 0.00 0.00 55.95 58.91 1bd2 s SER 13 Cb -0.14 -2.61 0.27 0.00 0.10 0.00 0.00 66.02 63.65 1bd2 s SER 13 CO -0.09 -0.98 0.78 0.54 0.98 0.00 0.00 173.24 174.47 1bd2 n ARG 14 N -0.50 2.51 -1.68 4.02 1.74 -1.25 -4.31 116.66 117.19 1bd2 n ARG 14 Ca 0.07 -4.57 -0.55 0.00 -0.77 0.00 0.00 57.85 52.03 1bd2 n ARG 14 Cb 0.47 -2.15 -0.07 0.00 -1.02 0.00 0.00 32.46 29.69 1bd2 n ARG 14 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 1bd2 n PRO 15 N 0.61 1.25 0.00 5.56 -0.02 -1.26 -1.48 135.00 139.66 1bd2 n PRO 15 Ca 0.29 0.46 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 1bd2 n PRO 15 Cb 0.42 -2.14 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 1bd2 n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1bd2 n GLY 16 N 3.77 2.06 0.00 -1.23 0.00 -1.26 -4.67 105.19 103.86 1bd2 n GLY 16 Ca 0.24 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1bd2 n GLY 16 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1bd2 n ARG 17 N 0.00 0.00 0.00 1.61 3.00 -0.83 -4.89 116.66 115.55 1bd2 n ARG 17 Ca 0.00 0.30 0.00 0.00 -0.00 0.00 0.00 57.85 58.15 1bd2 n ARG 17 Cb 0.00 -1.72 0.00 0.00 0.00 0.00 0.00 32.46 30.74 1bd2 n ARG 17 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1bd2 n GLY 18 N -1.29 0.73 3.76 5.14 0.00 -0.55 -5.03 105.19 107.95 1bd2 n GLY 18 Ca -0.00 -2.11 -0.36 0.00 0.00 0.00 0.00 46.02 43.55 1bd2 n GLY 18 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1bd2 s GLU 19 N -1.03 3.05 0.32 1.61 0.41 -1.26 -3.90 118.70 117.91 1bd2 s GLU 19 Ca 0.00 1.81 -0.29 0.00 -0.41 0.00 0.00 54.97 56.08 1bd2 s GLU 19 Cb 0.00 -1.96 -0.12 0.00 -1.78 0.00 0.00 34.13 30.27 1bd2 s GLU 19 CO 0.00 -1.14 1.34 -0.35 -0.49 0.00 0.00 175.26 174.63 1bd2 n PRO 20 N -1.51 2.19 -2.30 0.39 -0.04 -1.26 -4.52 135.00 127.94 1bd2 n PRO 20 Ca 0.13 0.77 -0.42 0.00 -0.04 0.00 0.00 63.50 63.94 1bd2 n PRO 20 Cb 0.50 -2.39 -0.03 0.00 -0.04 0.00 0.00 33.50 31.54 1bd2 n PRO 20 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 1bd2 s ARG 21 N -1.56 4.36 -0.10 0.54 6.06 -0.54 -4.82 118.95 122.88 1bd2 s ARG 21 Ca 0.58 1.90 0.01 0.00 -2.50 0.00 0.00 55.73 55.72 1bd2 s ARG 21 Cb -0.57 -3.38 0.02 0.00 0.06 0.00 0.00 34.95 31.07 1bd2 s ARG 21 CO 0.59 -0.40 -0.10 0.12 -2.50 0.00 0.00 175.30 173.01 1bd2 s PHE 22 N 1.48 1.52 -0.02 5.12 5.36 -1.26 -1.21 117.98 128.97 1bd2 s PHE 22 Ca 0.61 -0.70 0.06 0.00 -0.96 0.00 0.00 56.93 55.95 1bd2 s PHE 22 Cb -0.32 -1.20 -0.02 0.00 -0.34 0.00 0.00 43.02 41.15 1bd2 s PHE 22 CO 0.28 -0.44 -0.21 0.42 -1.46 0.00 0.00 175.22 173.81 1bd2 s ILE 23 N 1.30 1.70 -0.03 3.12 -1.09 -0.35 -1.32 121.20 124.52 1bd2 s ILE 23 Ca -0.02 -0.91 0.00 0.00 -2.23 0.00 0.00 60.65 57.48 1bd2 s ILE 23 Cb -0.14 -1.41 0.03 0.00 -1.58 0.00 0.00 42.46 39.36 1bd2 s ILE 23 CO -0.04 0.48 0.01 0.00 -1.23 0.00 0.00 174.94 174.16 1bd2 s ALA 24 N -0.46 0.30 0.05 9.38 0.00 0.42 -1.03 121.76 130.42 1bd2 s ALA 24 Ca 0.07 0.17 0.03 0.00 0.00 0.00 0.00 51.96 52.23 1bd2 s ALA 24 Cb -0.09 -0.34 -0.02 0.00 0.00 0.00 0.00 23.12 22.67 1bd2 s ALA 24 CO -0.01 -0.11 -0.10 0.14 0.00 0.00 0.00 175.76 175.69 1bd2 s VAL 25 N 1.11 0.72 0.04 0.00 -7.23 -0.55 -0.97 120.40 113.53 1bd2 s VAL 25 Ca -0.08 -1.06 0.06 0.00 -1.81 0.00 0.00 61.98 59.09 1bd2 s VAL 25 Cb -0.13 -0.74 -0.02 0.00 0.56 0.00 0.00 36.38 36.05 1bd2 s VAL 25 CO -0.02 -0.27 -0.17 -0.83 -0.31 0.00 0.00 175.10 173.50 1bd2 s GLY 26 N -1.46 0.94 0.03 2.32 0.00 -0.88 -0.50 107.32 107.77 1bd2 s GLY 26 Ca -0.06 -0.94 0.03 0.00 0.00 0.00 0.00 44.72 43.75 1bd2 s GLY 26 CO 0.01 -0.89 -0.09 -0.19 0.00 0.00 0.00 173.10 171.93 1bd2 s TYR 27 N -0.84 0.83 -0.27 1.90 2.02 0.11 -0.98 117.35 120.12 1bd2 s TYR 27 Ca 0.04 -0.33 -0.01 0.00 -0.37 0.00 0.00 57.07 56.40 1bd2 s TYR 27 Cb -0.08 -0.50 0.04 0.00 -0.40 0.00 0.00 41.96 41.02 1bd2 s TYR 27 CO 0.02 -0.02 -0.05 0.08 -1.57 0.00 0.00 175.55 174.01 1bd2 s VAL 28 N -0.84 2.81 0.00 0.71 1.01 0.07 -0.75 120.40 123.40 1bd2 s VAL 28 Ca -0.02 -1.23 0.00 0.00 0.00 0.00 0.00 61.98 60.73 1bd2 s VAL 28 Cb -0.07 -2.52 0.00 0.00 0.00 0.00 0.00 36.38 33.79 1bd2 s VAL 28 CO 0.01 0.07 0.00 0.47 0.00 0.00 0.00 175.10 175.64 1bd2 n ASP 29 N 4.62 0.00 -0.88 3.32 8.00 0.67 -1.57 116.55 130.70 1bd2 n ASP 29 Ca -0.15 0.00 0.07 0.00 0.71 0.00 0.00 54.79 55.42 1bd2 n ASP 29 Cb 0.45 0.00 0.21 0.00 -0.02 0.00 0.00 41.12 41.76 1bd2 n ASP 29 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1bd2 n ASP 30 N 3.64 2.56 -4.49 -2.24 8.00 -1.26 -4.85 116.55 117.91 1bd2 n ASP 30 Ca 0.00 -2.03 -0.36 0.00 0.71 0.00 0.00 54.79 53.11 1bd2 n ASP 30 Cb 0.00 -0.33 -0.12 0.00 -0.02 0.00 0.00 41.12 40.65 1bd2 n ASP 30 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1bd2 s THR 31 N -1.42 4.39 0.16 -3.53 2.01 -0.61 -5.05 115.64 111.58 1bd2 s THR 31 Ca 0.31 -0.16 -0.30 0.00 0.31 0.00 0.00 61.69 61.86 1bd2 s THR 31 Cb 0.17 -3.03 -0.07 0.00 0.01 0.00 0.00 72.50 69.58 1bd2 s THR 31 CO 0.20 0.38 1.02 -1.58 -0.69 0.00 0.00 174.62 173.95 1bd2 s GLN 32 N 1.25 4.67 0.00 4.92 0.74 -1.26 -0.75 119.66 129.22 1bd2 s GLN 32 Ca 0.05 1.57 0.00 0.00 0.05 0.00 0.00 55.36 57.03 1bd2 s GLN 32 Cb -0.15 -3.32 0.00 0.00 1.10 0.00 0.00 33.01 30.64 1bd2 s GLN 32 CO 0.03 0.19 0.00 1.97 -0.55 0.00 0.00 175.29 176.93 1bd2 n PHE 33 N 2.45 0.00 -4.18 1.67 -1.74 -0.15 -4.34 117.46 111.16 1bd2 n PHE 33 Ca 0.02 0.00 -0.11 0.00 -0.56 0.00 0.00 57.45 56.80 1bd2 n PHE 33 Cb 0.48 0.00 -0.10 0.00 1.52 0.00 0.00 39.48 41.38 1bd2 n PHE 33 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 1bd2 s VAL 34 N -1.95 0.76 0.28 1.97 -7.23 -1.22 0.36 120.40 113.37 1bd2 s VAL 34 Ca 0.00 -1.95 -0.11 0.00 -1.81 0.00 0.00 61.98 58.10 1bd2 s VAL 34 Cb 0.00 -1.72 0.00 0.00 0.56 0.00 0.00 36.38 35.23 1bd2 s VAL 34 CO 0.00 -0.85 0.52 0.00 -0.31 0.00 0.00 175.10 174.46 1bd2 s ARG 35 N -3.82 1.71 -0.29 4.82 1.70 -0.36 -2.07 118.95 120.64 1bd2 s ARG 35 Ca 0.13 -1.37 -0.20 0.00 -0.47 0.00 0.00 55.73 53.82 1bd2 s ARG 35 Cb 0.05 0.49 0.14 0.00 -0.57 0.00 0.00 34.95 35.05 1bd2 s ARG 35 CO -0.04 -0.73 1.01 0.12 -1.08 0.00 0.00 175.30 174.59 1bd2 s PHE 36 N -3.62 -0.52 -0.05 5.89 2.19 -0.15 -0.85 117.98 120.87 1bd2 s PHE 36 Ca 0.23 1.12 -0.02 0.00 0.33 0.00 0.00 56.93 58.59 1bd2 s PHE 36 Cb -0.01 0.36 0.04 0.00 -1.31 0.00 0.00 43.02 42.09 1bd2 s PHE 36 CO 0.12 -0.25 0.11 0.34 1.83 0.00 0.00 175.22 177.36 1bd2 s ASP 37 N 0.88 0.19 0.41 6.13 2.15 -1.26 -0.43 116.67 124.73 1bd2 s ASP 37 Ca -0.04 0.22 0.08 0.00 0.43 0.00 0.00 52.55 53.25 1bd2 s ASP 37 Cb -0.04 0.11 0.86 0.00 -0.30 0.00 0.00 42.92 43.55 1bd2 s ASP 37 CO -0.12 -0.17 2.01 0.77 -0.17 0.00 0.00 175.17 177.50 1bd2 h SER 38 N 7.55 0.35 -0.18 -0.34 4.64 -1.58 -2.38 113.55 121.61 1bd2 h SER 38 Ca -0.36 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 1bd2 h SER 38 Cb 1.13 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 1bd2 h SER 38 CO 0.37 0.34 0.00 0.47 -0.87 0.00 0.00 176.83 177.13 1bd2 n ASP 39 N -4.41 1.46 -4.76 4.97 9.92 -1.26 -4.89 116.55 117.58 1bd2 n ASP 39 Ca 0.01 -1.75 -0.27 0.00 -0.53 0.00 0.00 54.79 52.25 1bd2 n ASP 39 Cb 0.14 -0.12 0.10 0.00 -0.64 0.00 0.00 41.12 40.60 1bd2 n ASP 39 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1bd2 s ALA 40 N -1.76 2.97 -0.08 2.24 0.00 -0.90 -5.03 121.76 119.20 1bd2 s ALA 40 Ca 0.29 -1.01 -0.21 0.00 0.00 0.00 0.00 51.96 51.02 1bd2 s ALA 40 Cb 0.15 -2.63 -0.29 0.00 0.00 0.00 0.00 23.12 20.35 1bd2 s ALA 40 CO 0.22 -1.58 0.78 0.00 0.00 0.00 0.00 175.76 175.19 1bd2 h ALA 41 N -0.85 -0.01 -0.86 0.00 0.00 -1.90 -3.39 119.26 112.25 1bd2 h ALA 41 Ca -0.44 -0.78 0.12 0.00 0.00 0.00 0.00 54.91 53.81 1bd2 h ALA 41 Cb 1.30 0.20 -0.06 0.00 0.00 0.00 0.00 17.79 19.22 1bd2 h ALA 41 CO 0.55 0.45 0.56 0.66 0.00 0.00 0.00 179.25 181.47 1bd2 h SER 42 N -0.44 0.69 -3.47 0.00 4.64 -1.96 -3.46 113.55 109.55 1bd2 h SER 42 Ca -0.17 0.03 -0.39 0.00 -0.47 0.00 0.00 61.79 60.79 1bd2 h SER 42 Cb 1.59 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 63.57 1bd2 h SER 42 CO 0.10 0.38 -0.52 0.00 -0.87 0.00 0.00 176.83 175.93 1bd2 n GLN 43 N -4.54 -2.41 -4.11 4.77 1.13 -1.26 -4.96 117.38 106.00 1bd2 n GLN 43 Ca 0.16 0.92 -0.10 0.00 -1.94 0.00 0.00 57.00 56.03 1bd2 n GLN 43 Cb 0.39 -5.62 -0.10 0.00 0.11 0.00 0.00 30.24 25.01 1bd2 n GLN 43 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1bd2 s ARG 44 N -5.19 0.66 0.00 -1.09 0.52 -1.26 -5.02 118.95 107.56 1bd2 s ARG 44 Ca 0.07 -1.09 -0.30 0.00 -0.52 0.00 0.00 55.73 53.88 1bd2 s ARG 44 Cb -0.03 -0.11 -0.05 0.00 0.52 0.00 0.00 34.95 35.28 1bd2 s ARG 44 CO 0.08 -0.02 1.37 1.41 0.02 0.00 0.00 175.30 178.16 1bd2 s MET 45 N -3.05 4.30 0.08 3.54 -2.45 -1.26 -4.72 119.30 115.74 1bd2 s MET 45 Ca 0.03 1.92 0.05 0.00 -1.25 0.00 0.00 55.69 56.44 1bd2 s MET 45 Cb 0.01 -3.55 -0.04 0.00 1.25 0.00 0.00 34.83 32.50 1bd2 s MET 45 CO -0.04 -0.54 -0.04 -1.21 1.05 0.00 0.00 175.02 174.24 1bd2 s GLU 46 N 2.26 2.42 -0.00 4.11 2.02 -0.03 -4.92 118.70 124.56 1bd2 s GLU 46 Ca 0.63 -0.87 -0.30 0.00 0.02 0.00 0.00 54.97 54.44 1bd2 s GLU 46 Cb -0.31 -2.46 -0.04 0.00 0.10 0.00 0.00 34.13 31.42 1bd2 s GLU 46 CO 0.26 0.54 1.08 -2.14 0.02 0.00 0.00 175.26 175.02 1bd2 s PRO 47 N -2.13 4.48 -0.06 0.39 0.02 -1.26 -1.23 135.00 135.21 1bd2 s PRO 47 Ca 0.23 1.56 0.09 0.00 0.02 0.00 0.00 61.00 62.90 1bd2 s PRO 47 Cb -0.11 -3.45 0.13 0.00 0.02 0.00 0.00 34.50 31.09 1bd2 s PRO 47 CO 0.15 -0.20 1.06 0.54 -0.33 0.00 0.00 177.00 178.22 1bd2 n ARG 48 N 4.22 2.13 -3.80 5.54 1.74 0.16 -4.92 116.66 121.72 1bd2 n ARG 48 Ca 0.08 -1.98 -0.13 0.00 -0.77 0.00 0.00 57.85 55.05 1bd2 n ARG 48 Cb 0.49 -1.22 -0.13 0.00 -1.02 0.00 0.00 32.46 30.58 1bd2 n ARG 48 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1bd2 s ALA 49 N -1.84 -0.31 0.48 7.54 0.00 -1.06 -4.64 121.76 121.94 1bd2 s ALA 49 Ca 0.15 0.47 0.13 0.00 0.00 0.00 0.00 51.96 52.71 1bd2 s ALA 49 Cb 0.13 -0.29 1.12 0.00 0.00 0.00 0.00 23.12 24.08 1bd2 s ALA 49 CO 0.01 -0.09 2.11 -1.35 0.00 0.00 0.00 175.76 176.44 1bd2 h PRO 50 N 6.35 0.16 0.00 0.00 0.11 -1.94 -2.48 132.00 134.21 1bd2 h PRO 50 Ca -0.31 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.72 1bd2 h PRO 50 Cb 1.18 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 1bd2 h PRO 50 CO 0.43 0.12 -0.34 0.11 -0.21 0.00 0.00 178.00 178.10 1bd2 h TRP 51 N 0.16 0.00 0.00 0.65 5.08 -1.97 -2.95 115.95 116.92 1bd2 h TRP 51 Ca 0.04 0.00 -0.15 0.00 1.08 0.00 0.00 58.89 59.86 1bd2 h TRP 51 Cb 0.01 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.15 1bd2 h TRP 51 CO 0.00 0.34 -0.86 0.97 -1.28 0.00 0.00 178.44 177.61 1bd2 h ILE 52 N 0.00 1.02 -0.25 0.12 6.09 -1.79 -3.29 117.51 119.41 1bd2 h ILE 52 Ca -0.00 -2.52 0.07 0.00 -1.37 0.00 0.00 64.86 61.04 1bd2 h ILE 52 Cb 0.84 2.46 -0.01 0.00 0.47 0.00 0.00 36.82 40.59 1bd2 h ILE 52 CO 0.04 0.58 0.27 -0.33 -3.07 0.00 0.00 178.15 175.65 1bd2 h GLU 53 N 0.00 0.00 0.00 2.19 5.08 -1.37 0.53 114.58 121.01 1bd2 h GLU 53 Ca -0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1bd2 h GLU 53 Cb 1.56 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.81 1bd2 h GLU 53 CO 0.08 0.00 0.00 1.96 -1.00 0.00 0.00 179.01 180.05 1bd2 h GLN 54 N 0.00 0.00 -6.82 2.33 4.20 -1.70 -3.46 115.11 109.67 1bd2 h GLN 54 Ca 0.12 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.30 1bd2 h GLN 54 Cb 0.66 0.00 0.08 0.00 0.30 0.00 0.00 27.48 28.52 1bd2 h GLN 54 CO -0.00 0.00 0.79 -1.21 -0.67 0.00 0.00 178.83 177.74 1bd2 s GLU 55 N -3.35 4.20 0.97 1.46 0.41 0.17 -4.97 118.70 117.60 1bd2 s GLU 55 Ca 0.05 2.44 -0.12 0.00 -0.41 0.00 0.00 54.97 56.92 1bd2 s GLU 55 Cb 0.09 -3.05 0.09 0.00 -1.78 0.00 0.00 34.13 29.48 1bd2 s GLU 55 CO 0.50 -0.49 0.61 0.41 -0.49 0.00 0.00 175.26 175.80 1bd2 n GLY 56 N 1.69 -1.60 0.29 -1.39 0.00 -1.26 -4.79 105.19 98.13 1bd2 n GLY 56 Ca 0.05 -0.77 0.04 0.00 0.00 0.00 0.00 46.02 45.34 1bd2 n GLY 56 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1bd2 h PRO 57 N -1.77 0.44 -0.39 1.61 0.11 -1.98 -0.31 132.00 129.71 1bd2 h PRO 57 Ca -0.45 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 1bd2 h PRO 57 Cb 1.29 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 1bd2 h PRO 57 CO 0.37 0.32 0.21 0.93 -0.21 0.00 0.00 178.00 179.62 1bd2 h GLU 58 N 0.45 0.53 0.10 1.05 5.08 -1.98 0.44 114.58 120.24 1bd2 h GLU 58 Ca 0.12 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1bd2 h GLU 58 Cb 0.01 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.15 1bd2 h GLU 58 CO -0.02 0.39 -0.05 -0.92 -1.00 0.00 0.00 179.01 177.42 1bd2 h TYR 59 N 0.54 -0.12 -0.28 4.33 5.03 -1.38 0.45 116.97 125.53 1bd2 h TYR 59 Ca 0.14 -0.00 -0.06 0.00 2.58 0.00 0.00 58.73 61.39 1bd2 h TYR 59 Cb 0.02 0.04 -0.02 0.00 1.55 0.00 0.00 36.73 38.33 1bd2 h TYR 59 CO 0.00 0.18 -0.08 -1.49 -1.32 0.00 0.00 178.16 175.45 1bd2 h TRP 60 N -0.43 0.47 0.00 -3.82 4.06 -1.00 0.41 115.95 115.65 1bd2 h TRP 60 Ca -0.01 -0.06 -0.00 0.00 2.06 0.00 0.00 58.89 60.88 1bd2 h TRP 60 Cb 0.36 -0.13 0.00 0.00 -1.00 0.00 0.00 29.16 28.38 1bd2 h TRP 60 CO 0.02 0.53 -0.00 -0.44 -3.56 0.00 0.00 178.44 174.99 1bd2 h ASP 61 N 0.42 -0.00 -0.28 -3.49 3.32 -0.01 -0.36 116.42 116.02 1bd2 h ASP 61 Ca 0.09 -0.56 -0.03 0.00 0.02 0.00 0.00 57.03 56.54 1bd2 h ASP 61 Cb 0.41 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.94 1bd2 h ASP 61 CO 0.02 0.56 0.08 1.23 -1.72 0.00 0.00 179.24 179.41 1bd2 h GLY 62 N -0.57 0.56 2.00 2.75 0.00 0.18 -2.20 103.07 105.79 1bd2 h GLY 62 Ca -0.00 -0.29 -0.20 0.00 0.00 0.00 0.00 47.33 46.84 1bd2 h GLY 62 CO 0.00 0.28 -0.95 0.83 0.00 0.00 0.00 176.54 176.69 1bd2 h GLU 63 N 0.52 0.00 -0.53 4.80 4.39 -0.16 -2.86 114.58 120.75 1bd2 h GLU 63 Ca 0.12 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.72 1bd2 h GLU 63 Cb 0.21 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.84 1bd2 h GLU 63 CO -0.00 0.95 -0.06 1.15 -1.16 0.00 0.00 179.01 179.89 1bd2 h THR 64 N 0.00 1.27 0.31 1.13 2.02 -0.71 -1.27 112.91 115.66 1bd2 h THR 64 Ca -0.01 -1.19 -0.02 0.00 0.77 0.00 0.00 66.41 65.97 1bd2 h THR 64 Cb 1.71 0.97 0.00 0.00 -1.74 0.00 0.00 68.15 69.09 1bd2 h THR 64 CO 0.12 0.42 -0.15 -0.09 0.37 0.00 0.00 175.52 176.19 1bd2 h ARG 65 N 0.84 -0.40 -0.76 6.66 2.43 -1.41 -0.81 114.38 120.93 1bd2 h ARG 65 Ca 0.14 0.03 0.17 0.00 -0.81 0.00 0.00 59.98 59.51 1bd2 h ARG 65 Cb 0.61 0.09 -0.13 0.00 -0.42 0.00 0.00 29.97 30.12 1bd2 h ARG 65 CO 0.04 -0.27 0.08 0.87 -1.51 0.00 0.00 179.97 179.18 1bd2 h LYS 66 N -0.42 0.15 -0.68 0.20 1.57 -1.57 0.14 116.57 115.96 1bd2 h LYS 66 Ca -0.04 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 1bd2 h LYS 66 Cb 0.32 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.56 1bd2 h LYS 66 CO 0.07 0.10 0.40 -0.24 -0.57 0.00 0.00 179.45 179.21 1bd2 h VAL 67 N 0.16 1.20 -0.16 0.50 3.04 -1.19 0.04 116.25 119.84 1bd2 h VAL 67 Ca 0.43 -0.48 -0.03 0.00 -1.01 0.00 0.00 66.70 65.61 1bd2 h VAL 67 Cb 0.76 0.28 -0.01 0.00 -2.01 0.00 0.00 31.29 30.31 1bd2 h VAL 67 CO -0.61 0.22 -0.02 0.11 -1.01 0.00 0.00 177.57 176.26 1bd2 h LYS 68 N 0.93 0.24 -0.47 4.17 1.57 0.67 0.12 116.57 123.80 1bd2 h LYS 68 Ca 0.24 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.98 1bd2 h LYS 68 Cb -0.00 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 1bd2 h LYS 68 CO -0.04 0.28 0.26 0.00 -0.57 0.00 0.00 179.45 179.38 1bd2 h ALA 69 N 1.76 0.60 -0.84 3.86 0.00 0.59 -0.62 119.26 124.61 1bd2 h ALA 69 Ca 0.06 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.92 1bd2 h ALA 69 Cb 0.19 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 1bd2 h ALA 69 CO 0.01 0.12 0.55 0.45 0.00 0.00 0.00 179.25 180.38 1bd2 h HIS 70 N 0.62 1.01 0.35 0.00 3.86 0.99 -0.82 115.15 121.16 1bd2 h HIS 70 Ca 0.17 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.38 1bd2 h HIS 70 Cb 0.04 -0.34 0.00 0.00 1.06 0.00 0.00 27.41 28.18 1bd2 h HIS 70 CO -0.02 0.59 -0.17 1.03 0.86 0.00 0.00 177.93 180.22 1bd2 h SER 71 N 1.04 -0.40 -0.97 2.45 0.87 -0.06 -2.46 113.55 114.03 1bd2 h SER 71 Ca 0.33 -0.07 0.02 0.00 -1.23 0.00 0.00 61.79 60.84 1bd2 h SER 71 Cb 0.03 0.10 -0.05 0.00 -0.44 0.00 0.00 62.40 62.04 1bd2 h SER 71 CO -0.10 -0.17 0.64 -0.61 -0.53 0.00 0.00 176.83 176.06 1bd2 h GLN 72 N -0.61 1.23 -0.90 2.24 5.75 -0.82 -1.22 115.11 120.79 1bd2 h GLN 72 Ca -0.05 -0.07 0.01 0.00 -0.15 0.00 0.00 58.65 58.39 1bd2 h GLN 72 Cb 0.44 -0.28 -0.05 0.00 1.07 0.00 0.00 27.48 28.67 1bd2 h GLN 72 CO 0.08 0.82 0.59 1.15 -2.65 0.00 0.00 178.83 178.82 1bd2 h THR 73 N 1.27 1.22 -0.13 2.39 2.02 -1.07 -2.39 112.91 116.22 1bd2 h THR 73 Ca 0.37 -0.41 -0.19 0.00 0.77 0.00 0.00 66.41 66.94 1bd2 h THR 73 Cb -0.08 -0.09 0.00 0.00 -1.74 0.00 0.00 68.15 66.24 1bd2 h THR 73 CO -0.10 0.22 -0.71 0.45 0.37 0.00 0.00 175.52 175.75 1bd2 h HIS 74 N 1.21 0.78 -0.93 3.16 3.86 -0.85 -1.16 115.15 121.22 1bd2 h HIS 74 Ca 0.33 -0.33 0.09 0.00 -1.16 0.00 0.00 60.37 59.30 1bd2 h HIS 74 Cb -0.12 -0.13 -0.07 0.00 1.06 0.00 0.00 27.41 28.15 1bd2 h HIS 74 CO -0.01 1.11 0.58 -0.09 0.86 0.00 0.00 177.93 180.38 1bd2 h ARG 75 N 0.41 0.97 -0.11 2.45 2.43 -1.03 0.11 114.38 119.60 1bd2 h ARG 75 Ca -0.03 -0.06 -0.05 0.00 -0.81 0.00 0.00 59.98 59.03 1bd2 h ARG 75 Cb 1.30 -0.22 -0.00 0.00 -0.42 0.00 0.00 29.97 30.63 1bd2 h ARG 75 CO 0.13 0.64 -0.14 0.28 -1.51 0.00 0.00 179.97 179.38 1bd2 h VAL 76 N 1.00 1.37 -0.84 0.20 2.07 -1.30 -3.26 116.25 115.48 1bd2 h VAL 76 Ca 0.43 -1.34 0.08 0.00 0.82 0.00 0.00 66.70 66.69 1bd2 h VAL 76 Cb 0.30 1.99 -0.07 0.00 -1.52 0.00 0.00 31.29 31.99 1bd2 h VAL 76 CO -0.22 0.38 0.50 0.44 0.02 0.00 0.00 177.57 178.70 1bd2 h ASP 77 N -0.12 0.75 -0.48 0.57 3.32 0.10 -1.41 116.42 119.15 1bd2 h ASP 77 Ca 0.01 0.03 0.10 0.00 0.02 0.00 0.00 57.03 57.20 1bd2 h ASP 77 Cb 0.68 -0.12 -0.09 0.00 0.22 0.00 0.00 39.33 40.02 1bd2 h ASP 77 CO 0.03 0.45 -0.10 -0.07 -1.72 0.00 0.00 179.24 177.83 1bd2 h LEU 78 N 0.87 -0.42 -0.22 1.55 3.38 -0.89 0.82 115.31 120.40 1bd2 h LEU 78 Ca 0.39 0.14 -0.16 0.00 0.09 0.00 0.00 57.88 58.34 1bd2 h LEU 78 Cb 0.28 0.29 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1bd2 h LEU 78 CO -0.21 -0.15 -0.49 1.23 0.09 0.00 0.00 178.44 178.91 1bd2 h GLY 79 N 0.01 0.79 0.18 0.83 0.00 -1.57 -0.44 103.07 102.87 1bd2 h GLY 79 Ca 0.23 -0.96 0.09 0.00 0.00 0.00 0.00 47.33 46.70 1bd2 h GLY 79 CO -0.49 0.86 -0.02 -0.84 0.00 0.00 0.00 176.54 176.05 1bd2 h THR 80 N 0.44 0.61 -0.33 4.70 2.02 -0.53 -0.85 112.91 118.96 1bd2 h THR 80 Ca 0.00 -0.03 -0.14 0.00 0.77 0.00 0.00 66.41 67.01 1bd2 h THR 80 Cb 1.10 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 68.01 1bd2 h THR 80 CO 0.11 0.02 -0.35 -0.07 0.37 0.00 0.00 175.52 175.59 1bd2 h LEU 81 N 0.09 0.79 -1.41 2.58 3.38 -0.76 -1.72 115.31 118.26 1bd2 h LEU 81 Ca 0.24 -0.34 0.10 0.00 0.09 0.00 0.00 57.88 57.97 1bd2 h LEU 81 Cb 0.36 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.84 1bd2 h LEU 81 CO -0.42 1.06 0.50 -0.09 0.09 0.00 0.00 178.44 179.59 1bd2 h ARG 82 N 0.62 0.63 -0.10 1.13 2.43 -0.02 -1.01 114.38 118.06 1bd2 h ARG 82 Ca 0.06 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.14 1bd2 h ARG 82 Cb 0.89 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 30.29 1bd2 h ARG 82 CO 0.08 0.42 -0.14 0.78 -1.51 0.00 0.00 179.97 179.60 1bd2 h GLY 83 N 0.65 0.30 0.24 2.80 0.00 -0.56 0.92 103.07 107.43 1bd2 h GLY 83 Ca 0.36 -0.33 0.17 0.00 0.00 0.00 0.00 47.33 47.53 1bd2 h GLY 83 CO -0.13 0.29 0.62 -0.97 0.00 0.00 0.00 176.54 176.35 1bd2 h TYR 84 N -0.15 1.07 0.00 5.60 0.05 -0.34 -1.74 116.97 121.46 1bd2 h TYR 84 Ca 0.01 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.83 1bd2 h TYR 84 Cb 0.68 -0.33 0.00 0.00 1.01 0.00 0.00 36.73 38.09 1bd2 h TYR 84 CO 0.10 0.30 -1.10 0.66 -1.05 0.00 0.00 178.16 177.07 1bd2 n TYR 85 N -4.71 0.03 -2.89 4.88 4.01 -0.74 -4.88 117.16 112.86 1bd2 n TYR 85 Ca 0.22 0.01 -0.11 0.00 -0.16 0.00 0.00 57.90 57.85 1bd2 n TYR 85 Cb 0.51 -0.14 0.06 0.00 -0.31 0.00 0.00 39.34 39.46 1bd2 n TYR 85 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1bd2 n ASN 86 N -1.65 -3.21 -5.00 7.72 5.15 0.09 -5.03 115.26 113.33 1bd2 n ASN 86 Ca 0.03 -0.45 -0.18 0.00 -0.60 0.00 0.00 54.58 53.37 1bd2 n ASN 86 Cb 0.37 -3.74 0.02 0.00 -0.53 0.00 0.00 39.78 35.90 1bd2 n ASN 86 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1bd2 s GLN 87 N -4.59 2.78 0.73 1.20 -0.21 0.08 -5.02 119.66 114.62 1bd2 s GLN 87 Ca 0.12 -1.11 -0.11 0.00 0.02 0.00 0.00 55.36 54.27 1bd2 s GLN 87 Cb -0.02 -2.70 0.03 0.00 1.00 0.00 0.00 33.01 31.33 1bd2 s GLN 87 CO 0.51 -0.36 1.08 0.45 -2.12 0.00 0.00 175.29 174.85 1bd2 s SER 88 N -4.36 4.89 0.19 5.90 0.15 -1.26 -4.84 113.70 114.38 1bd2 s SER 88 Ca 0.55 1.78 0.02 0.00 0.70 0.00 0.00 55.95 59.00 1bd2 s SER 88 Cb -0.10 -2.52 0.10 0.00 -1.71 0.00 0.00 66.02 61.80 1bd2 s SER 88 CO 0.34 -1.77 1.46 -0.33 1.20 0.00 0.00 173.24 174.14 1bd2 h GLU 89 N -0.80 0.29 0.00 5.44 3.07 -1.98 -3.25 114.58 117.35 1bd2 h GLU 89 Ca -0.44 -0.24 0.00 0.00 -0.50 0.00 0.00 59.36 58.18 1bd2 h GLU 89 Cb 1.23 0.05 0.00 0.00 -0.84 0.00 0.00 28.75 29.19 1bd2 h GLU 89 CO 0.53 0.90 0.00 0.00 -1.40 0.00 0.00 179.01 179.04 1bd2 h ALA 90 N 1.03 1.00 -2.68 3.43 0.00 -1.95 -3.43 119.26 116.66 1bd2 h ALA 90 Ca -0.03 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.35 1bd2 h ALA 90 Cb 1.29 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.05 1bd2 h ALA 90 CO 0.12 0.00 0.19 0.20 0.00 0.00 0.00 179.25 179.76 1bd2 s GLY 91 N -3.83 2.88 0.01 0.00 0.00 -1.23 -4.71 107.32 100.44 1bd2 s GLY 91 Ca 0.04 0.35 -0.28 0.00 0.00 0.00 0.00 44.72 44.84 1bd2 s GLY 91 CO 0.50 1.03 0.89 -0.45 0.00 0.00 0.00 173.10 175.07 1bd2 s SER 92 N -0.56 7.28 0.19 1.64 0.15 -1.26 -4.77 113.70 116.36 1bd2 s SER 92 Ca 0.38 1.54 0.02 0.00 0.70 0.00 0.00 55.95 58.59 1bd2 s SER 92 Cb -0.22 -2.52 -0.05 0.00 -1.71 0.00 0.00 66.02 61.52 1bd2 s SER 92 CO 0.25 -0.17 0.01 -1.00 1.20 0.00 0.00 173.24 173.53 1bd2 s HIS 93 N 0.69 1.29 0.11 3.44 3.76 -1.26 -4.95 115.29 118.37 1bd2 s HIS 93 Ca 0.46 -1.02 0.09 0.00 -0.15 0.00 0.00 55.06 54.44 1bd2 s HIS 93 Cb -0.20 -0.73 -0.04 0.00 1.11 0.00 0.00 32.58 32.71 1bd2 s HIS 93 CO 0.25 -0.20 -0.22 0.99 -0.85 0.00 0.00 174.74 174.72 1bd2 s THR 94 N -3.63 1.82 -0.02 1.30 2.01 -1.26 -1.59 115.64 114.27 1bd2 s THR 94 Ca 0.26 -1.60 0.02 0.00 0.31 0.00 0.00 61.69 60.68 1bd2 s THR 94 Cb 0.06 -1.65 -0.00 0.00 0.01 0.00 0.00 72.50 70.92 1bd2 s THR 94 CO 0.05 -0.04 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.17 1bd2 s VAL 95 N -1.19 0.65 -0.00 3.82 1.01 -0.63 -0.50 120.40 123.57 1bd2 s VAL 95 Ca 0.08 -0.32 0.00 0.00 0.00 0.00 0.00 61.98 61.75 1bd2 s VAL 95 Cb -0.10 -0.57 0.00 0.00 0.00 0.00 0.00 36.38 35.71 1bd2 s VAL 95 CO 0.05 0.20 0.00 -1.10 0.00 0.00 0.00 175.10 174.25 1bd2 s GLN 96 N 0.05 0.00 0.01 2.72 -0.21 0.15 -1.92 119.66 120.46 1bd2 s GLN 96 Ca -0.00 0.01 0.03 0.00 0.02 0.00 0.00 55.36 55.42 1bd2 s GLN 96 Cb -0.06 -0.03 -0.01 0.00 1.00 0.00 0.00 33.01 33.91 1bd2 s GLN 96 CO -0.00 -0.01 -0.10 0.50 -2.12 0.00 0.00 175.29 173.55 1bd2 s ARG 97 N 0.10 0.76 -0.06 2.91 3.52 -0.50 -0.24 118.95 125.43 1bd2 s ARG 97 Ca -0.01 -0.51 -0.05 0.00 -0.13 0.00 0.00 55.73 55.04 1bd2 s ARG 97 Cb -0.01 -0.72 0.02 0.00 -1.56 0.00 0.00 34.95 32.68 1bd2 s ARG 97 CO -0.00 0.19 0.15 1.41 -0.81 0.00 0.00 175.30 176.24 1bd2 s MET 98 N -0.67 0.16 0.03 5.12 1.75 -0.60 -0.62 119.30 124.47 1bd2 s MET 98 Ca 0.01 0.26 -0.21 0.00 -1.25 0.00 0.00 55.69 54.50 1bd2 s MET 98 Cb -0.06 0.02 0.05 0.00 2.84 0.00 0.00 34.83 37.68 1bd2 s MET 98 CO 0.00 -0.06 0.49 1.52 -0.65 0.00 0.00 175.02 176.32 1bd2 s TYR 99 N 0.38 -0.38 0.00 4.11 -0.85 -0.82 -0.73 117.35 119.06 1bd2 s TYR 99 Ca -0.02 0.45 0.00 0.00 -0.52 0.00 0.00 57.07 56.98 1bd2 s TYR 99 Cb -0.04 0.29 0.00 0.00 0.38 0.00 0.00 41.96 42.60 1bd2 s TYR 99 CO -0.02 -0.60 0.00 0.41 -1.52 0.00 0.00 175.55 173.82 1bd2 n GLY 100 N 0.55 -1.02 3.17 5.49 0.00 -1.06 -0.95 105.19 111.38 1bd2 n GLY 100 Ca -0.19 -1.07 -0.12 0.00 0.00 0.00 0.00 46.02 44.64 1bd2 n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bd2 s ASP 102 N -2.78 2.28 0.08 0.00 1.01 -0.52 -1.86 116.67 114.88 1bd2 s ASP 102 Ca 0.09 -0.38 0.07 0.00 0.71 0.00 0.00 52.55 53.04 1bd2 s ASP 102 Cb 0.01 -0.74 -0.04 0.00 1.01 0.00 0.00 42.92 43.17 1bd2 s ASP 102 CO -0.02 0.14 -0.15 0.68 0.21 0.00 0.00 175.17 176.03 1bd2 s VAL 103 N 0.15 3.03 0.00 -1.27 -7.23 0.36 -1.04 120.40 114.39 1bd2 s VAL 103 Ca -0.07 -1.28 0.00 0.00 -1.81 0.00 0.00 61.98 58.82 1bd2 s VAL 103 Cb -0.13 -2.36 0.00 0.00 0.56 0.00 0.00 36.38 34.45 1bd2 s VAL 103 CO 0.03 0.21 0.00 0.61 -0.31 0.00 0.00 175.10 175.64 1bd2 n GLY 104 N 1.08 -1.21 0.23 2.32 0.00 -0.49 -1.35 105.19 105.78 1bd2 n GLY 104 Ca -0.15 -1.63 0.10 0.00 0.00 0.00 0.00 46.02 44.33 1bd2 n GLY 104 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1bd2 h SER 105 N -0.10 0.00 0.00 1.61 0.02 -1.91 0.12 113.55 113.29 1bd2 h SER 105 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1bd2 h SER 105 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1bd2 h SER 105 CO 0.00 0.22 0.00 -0.90 -1.14 0.00 0.00 176.83 175.01 1bd2 n ASP 106 N -3.61 0.00 -1.14 3.07 5.75 -1.26 -4.53 116.55 114.83 1bd2 n ASP 106 Ca -0.01 -1.22 -0.15 0.00 -0.01 0.00 0.00 54.79 53.40 1bd2 n ASP 106 Cb 0.35 0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 40.38 1bd2 n ASP 106 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 1bd2 n TRP 107 N -0.88 0.00 -4.01 2.11 7.02 0.41 -4.99 117.44 117.11 1bd2 n TRP 107 Ca 0.18 0.00 -0.23 0.00 -1.02 0.00 0.00 57.50 56.43 1bd2 n TRP 107 Cb 0.08 -2.82 -0.03 0.00 -2.42 0.00 0.00 31.31 26.12 1bd2 n TRP 107 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 1bd2 s ARG 108 N -3.20 3.28 0.36 -0.99 0.52 -1.26 -4.72 118.95 112.93 1bd2 s ARG 108 Ca 0.00 -0.79 -0.23 0.00 -0.52 0.00 0.00 55.73 54.18 1bd2 s ARG 108 Cb 0.00 -2.81 -0.15 0.00 0.52 0.00 0.00 34.95 32.51 1bd2 s ARG 108 CO 0.00 0.45 0.36 0.34 0.02 0.00 0.00 175.30 176.47 1bd2 n PHE 109 N -1.05 -1.11 0.14 -0.53 7.35 -1.26 -1.39 117.46 119.60 1bd2 n PHE 109 Ca -0.08 0.70 0.00 0.00 -0.76 0.00 0.00 57.45 57.31 1bd2 n PHE 109 Cb 0.56 -1.90 0.00 0.00 0.35 0.00 0.00 39.48 38.49 1bd2 n PHE 109 CO 0.00 0.00 0.00 -0.11 -0.76 0.00 0.00 176.76 175.89 1bd2 n LEU 110 N 1.90 -0.07 -3.81 -2.13 7.94 -0.21 -4.63 117.00 115.99 1bd2 n LEU 110 Ca 0.13 0.47 -0.12 0.00 -1.11 0.00 0.00 56.01 55.38 1bd2 n LEU 110 Cb 0.36 0.36 -0.09 0.00 0.53 0.00 0.00 43.42 44.57 1bd2 n LEU 110 CO 0.55 -0.79 -0.07 -0.13 -1.11 0.00 0.00 177.39 175.83 1bd2 s ARG 111 N -1.99 0.57 0.07 1.96 0.52 -1.18 -4.99 118.95 113.90 1bd2 s ARG 111 Ca 0.00 -0.28 0.10 0.00 -0.52 0.00 0.00 55.73 55.03 1bd2 s ARG 111 Cb 0.00 0.25 -0.03 0.00 0.52 0.00 0.00 34.95 35.68 1bd2 s ARG 111 CO 0.00 -0.15 -0.26 0.20 0.02 0.00 0.00 175.30 175.11 1bd2 s GLY 112 N -1.32 1.44 0.13 -3.53 0.00 -1.26 -1.43 107.32 101.35 1bd2 s GLY 112 Ca -0.14 -1.32 0.04 0.00 0.00 0.00 0.00 44.72 43.30 1bd2 s GLY 112 CO 0.03 -1.24 -0.09 -0.19 0.00 0.00 0.00 173.10 171.61 1bd2 s TYR 113 N -0.89 1.18 -0.30 1.90 1.51 0.33 -4.84 117.35 116.24 1bd2 s TYR 113 Ca 0.12 -0.79 -0.14 0.00 -1.01 0.00 0.00 57.07 55.25 1bd2 s TYR 113 Cb -0.10 -0.61 0.18 0.00 -0.11 0.00 0.00 41.96 41.31 1bd2 s TYR 113 CO 0.03 0.03 1.10 -1.58 -1.11 0.00 0.00 175.55 174.02 1bd2 s HIS 114 N -3.36 -0.41 -0.00 2.71 2.46 -1.26 -2.56 115.29 112.88 1bd2 s HIS 114 Ca 0.15 0.43 0.02 0.00 0.47 0.00 0.00 55.06 56.14 1bd2 s HIS 114 Cb 0.03 0.14 -0.01 0.00 -0.13 0.00 0.00 32.58 32.62 1bd2 s HIS 114 CO -0.01 -0.22 -0.07 -0.65 -2.47 0.00 0.00 174.74 171.32 1bd2 s GLN 115 N 2.96 0.58 0.01 2.88 -0.21 0.09 -1.83 119.66 124.15 1bd2 s GLN 115 Ca -0.03 -0.30 0.08 0.00 0.02 0.00 0.00 55.36 55.13 1bd2 s GLN 115 Cb -0.10 -0.55 -0.02 0.00 1.00 0.00 0.00 33.01 33.34 1bd2 s GLN 115 CO -0.10 0.15 -0.24 -0.47 -2.12 0.00 0.00 175.29 172.50 1bd2 s TYR 116 N -0.26 2.17 -0.04 0.91 5.04 0.30 -1.56 117.35 123.90 1bd2 s TYR 116 Ca 0.02 -0.41 -0.03 0.00 -2.44 0.00 0.00 57.07 54.21 1bd2 s TYR 116 Cb -0.03 -1.35 0.02 0.00 0.35 0.00 0.00 41.96 40.94 1bd2 s TYR 116 CO -0.00 0.03 0.10 0.00 -1.34 0.00 0.00 175.55 174.34 1bd2 s ALA 117 N -0.67 -0.22 -0.18 3.97 0.00 0.66 -1.80 121.76 123.52 1bd2 s ALA 117 Ca 0.10 0.39 0.00 0.00 0.00 0.00 0.00 51.96 52.45 1bd2 s ALA 117 Cb -0.09 -0.25 0.01 0.00 0.00 0.00 0.00 23.12 22.79 1bd2 s ALA 117 CO 0.00 -0.08 -0.18 -0.47 0.00 0.00 0.00 175.76 175.04 1bd2 s TYR 118 N 0.44 2.80 -1.01 0.00 5.04 -0.76 0.31 117.35 124.17 1bd2 s TYR 118 Ca -0.03 -1.51 0.00 0.00 -2.44 0.00 0.00 57.07 53.09 1bd2 s TYR 118 Cb -0.05 -1.94 0.00 0.00 0.35 0.00 0.00 41.96 40.32 1bd2 s TYR 118 CO -0.02 -0.75 0.00 -0.25 -1.34 0.00 0.00 175.55 173.19 1bd2 n ASP 119 N 4.60 -3.79 0.00 4.32 8.00 0.34 -3.24 116.55 126.78 1bd2 n ASP 119 Ca -0.20 -0.01 0.00 0.00 0.71 0.00 0.00 54.79 55.29 1bd2 n ASP 119 Cb 0.50 -3.00 0.00 0.00 -0.02 0.00 0.00 41.12 38.60 1bd2 n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1bd2 n GLY 120 N -1.02 1.27 3.48 0.44 0.00 -1.26 -4.99 105.19 103.11 1bd2 n GLY 120 Ca -0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.58 1bd2 n GLY 120 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1bd2 s LYS 121 N -0.37 1.92 0.43 1.61 2.20 -1.20 -5.09 119.74 119.23 1bd2 s LYS 121 Ca 0.00 -1.09 -0.24 0.00 -0.36 0.00 0.00 55.97 54.28 1bd2 s LYS 121 Cb 0.00 -2.15 -0.10 0.00 -1.51 0.00 0.00 37.83 34.07 1bd2 s LYS 121 CO 0.00 0.51 1.07 -0.25 -0.36 0.00 0.00 175.35 176.32 1bd2 n ASP 122 N 1.13 1.55 0.06 1.43 8.00 -1.26 -1.82 116.55 125.64 1bd2 n ASP 122 Ca -0.16 1.04 0.00 0.00 0.71 0.00 0.00 54.79 56.38 1bd2 n ASP 122 Cb 0.52 -1.39 0.00 0.00 -0.02 0.00 0.00 41.12 40.23 1bd2 n ASP 122 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bd2 n TYR 123 N -0.48 -0.49 -3.64 1.24 9.36 -0.75 -4.69 117.16 117.71 1bd2 n TYR 123 Ca 0.09 0.09 -0.15 0.00 3.32 0.00 0.00 57.90 61.25 1bd2 n TYR 123 Cb 0.40 0.14 -0.08 0.00 -0.63 0.00 0.00 39.34 39.17 1bd2 n TYR 123 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 1bd2 s ILE 124 N -2.00 0.01 0.00 2.97 2.07 -1.05 -1.93 121.20 121.27 1bd2 s ILE 124 Ca 0.00 -0.05 -0.07 0.00 -1.41 0.00 0.00 60.65 59.12 1bd2 s ILE 124 Cb 0.00 -0.86 0.00 0.00 0.13 0.00 0.00 42.46 41.73 1bd2 s ILE 124 CO 0.00 -0.03 0.14 0.00 -1.91 0.00 0.00 174.94 173.14 1bd2 s ALA 125 N -0.20 -0.33 -0.09 1.50 0.00 -1.04 -0.54 121.76 121.06 1bd2 s ALA 125 Ca -0.04 -0.11 -0.27 0.00 0.00 0.00 0.00 51.96 51.54 1bd2 s ALA 125 Cb -0.03 0.10 -0.02 0.00 0.00 0.00 0.00 23.12 23.16 1bd2 s ALA 125 CO 0.03 -0.20 0.86 -1.17 0.00 0.00 0.00 175.76 175.28 1bd2 s LEU 126 N -1.33 4.27 0.66 0.00 2.96 -0.76 -0.74 118.68 123.75 1bd2 s LEU 126 Ca -0.14 1.36 -0.16 0.00 -0.22 0.00 0.00 54.13 54.97 1bd2 s LEU 126 Cb -0.07 -3.33 0.00 0.00 0.50 0.00 0.00 46.19 43.29 1bd2 s LEU 126 CO 0.02 -0.30 1.19 -0.54 -1.32 0.00 0.00 176.35 175.40 1bd2 s LYS 127 N 1.48 2.58 0.58 1.98 1.02 0.18 -4.70 119.74 122.86 1bd2 s LYS 127 Ca 0.43 1.71 0.38 0.00 0.02 0.00 0.00 55.97 58.52 1bd2 s LYS 127 Cb -0.18 -1.89 1.42 0.00 -0.52 0.00 0.00 37.83 36.65 1bd2 s LYS 127 CO 0.19 -1.48 1.57 1.49 -0.92 0.00 0.00 175.35 176.19 1bd2 h GLU 128 N 0.22 0.00 0.00 1.68 4.81 -1.89 0.52 114.58 119.91 1bd2 h GLU 128 Ca -0.49 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 1bd2 h GLU 128 Cb 1.29 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.67 1bd2 h GLU 128 CO 0.53 0.00 0.00 -0.40 -0.73 0.00 0.00 179.01 178.41 1bd2 n ASP 129 N -3.74 0.00 -3.72 1.04 5.75 -1.26 -4.76 116.55 109.87 1bd2 n ASP 129 Ca 0.30 0.01 -0.27 0.00 -0.01 0.00 0.00 54.79 54.83 1bd2 n ASP 129 Cb 1.58 -0.33 0.05 0.00 -1.03 0.00 0.00 41.12 41.39 1bd2 n ASP 129 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1bd2 n LEU 130 N -1.33 -2.92 0.00 -2.12 4.77 0.18 -4.83 117.00 110.76 1bd2 n LEU 130 Ca 0.12 -0.64 0.00 0.00 -0.03 0.00 0.00 56.01 55.46 1bd2 n LEU 130 Cb 0.23 -2.79 0.00 0.00 -2.33 0.00 0.00 43.42 38.54 1bd2 n LEU 130 CO 0.21 0.54 -0.06 0.54 -1.33 0.00 0.00 177.39 177.29 1bd2 n ARG 131 N -4.79 3.73 -4.54 3.23 1.74 -1.26 -4.60 116.66 110.16 1bd2 n ARG 131 Ca 0.02 0.00 -0.26 0.00 -0.77 0.00 0.00 57.85 56.84 1bd2 n ARG 131 Cb 0.55 -0.56 -0.09 0.00 -1.02 0.00 0.00 32.46 31.34 1bd2 n ARG 131 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1bd2 s SER 132 N -0.56 2.92 0.13 0.55 1.04 -1.26 -4.91 113.70 111.60 1bd2 s SER 132 Ca 0.00 -1.60 0.08 0.00 0.48 0.00 0.00 55.95 54.91 1bd2 s SER 132 Cb 0.00 0.35 -0.04 0.00 0.10 0.00 0.00 66.02 66.43 1bd2 s SER 132 CO 0.00 -0.83 -0.19 0.26 0.98 0.00 0.00 173.24 173.46 1bd2 s TRP 133 N -3.17 1.73 -0.36 5.02 0.52 -1.26 -0.65 118.94 120.78 1bd2 s TRP 133 Ca 0.24 -0.45 -0.02 0.00 0.02 0.00 0.00 56.10 55.89 1bd2 s TRP 133 Cb 0.04 -0.91 0.09 0.00 -1.15 0.00 0.00 33.47 31.53 1bd2 s TRP 133 CO 0.13 0.24 0.10 0.99 0.02 0.00 0.00 176.95 178.43 1bd2 s THR 134 N -1.59 3.04 -0.17 2.01 2.01 0.08 -4.87 115.64 116.15 1bd2 s THR 134 Ca 0.10 -1.83 -0.12 0.00 0.31 0.00 0.00 61.69 60.14 1bd2 s THR 134 Cb -0.08 -2.97 -0.05 0.00 0.01 0.00 0.00 72.50 69.41 1bd2 s THR 134 CO 0.05 -0.45 0.23 0.00 -0.69 0.00 0.00 174.62 173.76 1bd2 s ALA 135 N 1.15 3.63 0.00 7.40 0.00 -1.26 -2.49 121.76 130.20 1bd2 s ALA 135 Ca 0.03 -0.54 0.00 0.00 0.00 0.00 0.00 51.96 51.45 1bd2 s ALA 135 Cb -0.21 -2.30 0.00 0.00 0.00 0.00 0.00 23.12 20.61 1bd2 s ALA 135 CO -0.03 0.13 0.50 0.00 0.00 0.00 0.00 175.76 176.36 1bd2 n ALA 136 N 3.49 -0.06 -2.13 0.00 0.00 -0.81 -4.84 120.51 116.16 1bd2 n ALA 136 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1bd2 n ALA 136 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1bd2 n ALA 136 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1bd2 n ASP 137 N -0.69 0.18 -0.13 0.00 5.68 -1.26 -4.96 116.55 115.37 1bd2 n ASP 137 Ca 0.00 0.00 -0.12 0.00 -0.50 0.00 0.00 54.79 54.17 1bd2 n ASP 137 Cb 0.00 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 39.96 1bd2 n ASP 137 CO 0.00 0.00 0.00 0.24 -1.33 0.00 0.00 177.20 176.11 1bd2 h MET 138 N 0.00 0.79 0.31 0.11 2.86 -1.99 -2.68 114.93 114.32 1bd2 h MET 138 Ca 0.00 -0.35 0.00 0.00 -2.06 0.00 0.00 59.70 57.29 1bd2 h MET 138 Cb 0.00 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.62 1bd2 h MET 138 CO 0.00 0.97 -0.33 0.00 1.06 0.00 0.00 176.91 178.61 1bd2 h ALA 139 N 0.80 -0.70 -0.96 6.32 0.00 -1.95 -0.93 119.26 121.84 1bd2 h ALA 139 Ca 0.08 -0.11 0.25 0.00 0.00 0.00 0.00 54.91 55.14 1bd2 h ALA 139 Cb 0.74 0.48 -0.06 0.00 0.00 0.00 0.00 17.79 18.95 1bd2 h ALA 139 CO 0.06 -0.93 0.66 0.00 0.00 0.00 0.00 179.25 179.03 1bd2 h ALA 140 N -0.16 2.53 -0.42 0.00 0.00 -1.82 0.32 119.26 119.70 1bd2 h ALA 140 Ca -0.02 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.76 1bd2 h ALA 140 Cb 0.63 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1bd2 h ALA 140 CO -0.07 -0.83 -0.29 1.96 0.00 0.00 0.00 179.25 180.02 1bd2 h GLN 141 N 0.22 0.92 0.11 0.00 4.20 -0.84 0.17 115.11 119.89 1bd2 h GLN 141 Ca 0.49 -0.42 0.01 0.00 0.06 0.00 0.00 58.65 58.79 1bd2 h GLN 141 Cb 1.54 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 29.29 1bd2 h GLN 141 CO -0.13 1.08 -0.15 1.15 -0.67 0.00 0.00 178.83 180.11 1bd2 h THR 142 N 0.78 0.65 -0.97 -0.54 2.02 0.40 0.62 112.91 115.86 1bd2 h THR 142 Ca 0.09 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.29 1bd2 h THR 142 Cb 0.86 0.65 -0.05 0.00 -1.74 0.00 0.00 68.15 67.86 1bd2 h THR 142 CO 0.08 0.00 0.64 0.74 0.37 0.00 0.00 175.52 177.35 1bd2 h THR 143 N -0.31 1.21 -0.29 3.16 2.02 -1.32 -0.43 112.91 116.95 1bd2 h THR 143 Ca 0.02 -0.44 0.04 0.00 0.77 0.00 0.00 66.41 66.80 1bd2 h THR 143 Cb 0.32 -0.18 -0.04 0.00 -1.74 0.00 0.00 68.15 66.51 1bd2 h THR 143 CO -0.07 0.23 0.06 0.50 0.37 0.00 0.00 175.52 176.61 1bd2 h LYS 144 N 1.28 0.16 -0.11 6.66 3.64 0.22 -0.02 116.57 128.39 1bd2 h LYS 144 Ca 0.37 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.76 1bd2 h LYS 144 Cb -0.08 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.69 1bd2 h LYS 144 CO -0.10 0.10 0.02 1.25 -2.27 0.00 0.00 179.45 178.46 1bd2 h HIS 145 N 0.16 0.03 -0.29 1.91 2.76 0.32 -0.63 115.15 119.42 1bd2 h HIS 145 Ca 0.13 0.01 0.07 0.00 -2.20 0.00 0.00 60.37 58.38 1bd2 h HIS 145 Cb 0.14 0.00 -0.07 0.00 1.55 0.00 0.00 27.41 29.03 1bd2 h HIS 145 CO -0.17 0.01 -0.19 0.87 -1.30 0.00 0.00 177.93 177.15 1bd2 h LYS 146 N 0.06 -0.16 0.00 5.26 1.57 -0.53 -1.51 116.57 121.26 1bd2 h LYS 146 Ca 0.05 0.01 -0.07 0.00 -1.87 0.00 0.00 60.65 58.77 1bd2 h LYS 146 Cb 0.04 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 1bd2 h LYS 146 CO -0.06 -0.11 -0.34 -1.49 -0.57 0.00 0.00 179.45 176.88 1bd2 h TRP 147 N -0.17 0.00 -0.11 -1.35 4.06 -0.62 -1.14 115.95 116.62 1bd2 h TRP 147 Ca 0.15 0.00 -0.21 0.00 2.06 0.00 0.00 58.89 60.89 1bd2 h TRP 147 Cb 0.40 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.57 1bd2 h TRP 147 CO -0.38 0.34 -0.77 0.93 -3.56 0.00 0.00 178.44 175.00 1bd2 h GLU 148 N 0.00 0.61 -0.44 0.49 5.08 -0.79 -1.75 114.58 117.78 1bd2 h GLU 148 Ca -0.00 -0.51 -0.08 0.00 -1.00 0.00 0.00 59.36 57.77 1bd2 h GLU 148 Cb 0.72 0.11 -0.02 0.00 0.50 0.00 0.00 28.75 30.06 1bd2 h GLU 148 CO 0.04 1.13 -0.03 0.00 -1.00 0.00 0.00 179.01 179.15 1bd2 h ALA 149 N 0.72 0.60 -0.06 3.43 0.00 -0.95 -2.66 119.26 120.35 1bd2 h ALA 149 Ca -0.05 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1bd2 h ALA 149 Cb 1.38 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1bd2 h ALA 149 CO 0.15 0.42 0.00 0.00 0.00 0.00 0.00 179.25 179.82 1bd2 n ALA 150 N -2.43 2.58 -3.55 0.00 0.00 -0.46 -4.92 120.51 111.72 1bd2 n ALA 150 Ca -0.00 -0.26 -0.26 0.00 0.00 0.00 0.00 53.44 52.92 1bd2 n ALA 150 Cb 0.32 -1.22 0.01 0.00 0.00 0.00 0.00 19.45 18.56 1bd2 n ALA 150 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1bd2 n HIS 151 N -0.39 -1.96 -0.19 0.00 -0.00 -0.93 -4.88 115.22 106.87 1bd2 n HIS 151 Ca 0.14 0.63 -0.05 0.00 -0.00 0.00 0.00 57.72 58.44 1bd2 n HIS 151 Cb 0.16 -3.44 0.04 0.00 -0.00 0.00 0.00 29.99 26.75 1bd2 n HIS 151 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.34 176.62 1bd2 h VAL 152 N -1.39 1.09 -0.56 1.59 2.07 -1.61 -2.55 116.25 114.89 1bd2 h VAL 152 Ca -0.50 -0.24 0.09 0.00 0.82 0.00 0.00 66.70 66.86 1bd2 h VAL 152 Cb 1.33 0.32 -0.07 0.00 -1.52 0.00 0.00 31.29 31.35 1bd2 h VAL 152 CO 0.60 0.13 0.19 0.00 0.02 0.00 0.00 177.57 178.51 1bd2 h ALA 153 N 1.23 0.69 0.00 1.67 0.00 -1.90 -0.49 119.26 120.46 1bd2 h ALA 153 Ca 0.22 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.21 1bd2 h ALA 153 Cb -0.02 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1bd2 h ALA 153 CO -0.08 -0.22 -0.01 0.93 0.00 0.00 0.00 179.25 179.87 1bd2 h GLU 154 N 0.36 0.00 0.11 0.00 5.08 -1.74 0.16 114.58 118.55 1bd2 h GLU 154 Ca 0.28 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 58.29 1bd2 h GLU 154 Cb 0.34 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 1bd2 h GLU 154 CO -0.30 0.01 -1.90 0.37 -1.00 0.00 0.00 179.01 176.19 1bd2 h GLN 155 N 0.00 0.24 -0.54 2.33 5.75 -1.17 -3.28 115.11 118.45 1bd2 h GLN 155 Ca -0.00 -0.41 -0.03 0.00 -0.15 0.00 0.00 58.65 58.05 1bd2 h GLN 155 Cb 0.03 0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.71 1bd2 h GLN 155 CO 0.00 1.12 0.20 -0.07 -2.65 0.00 0.00 178.83 177.43 1bd2 h LEU 156 N 0.07 0.76 -0.87 -2.39 3.38 0.19 -2.17 115.31 114.27 1bd2 h LEU 156 Ca -0.38 -0.18 0.12 0.00 0.09 0.00 0.00 57.88 57.52 1bd2 h LEU 156 Cb 2.04 -0.20 -0.08 0.00 0.09 0.00 0.00 40.66 42.51 1bd2 h LEU 156 CO 0.10 0.74 0.50 -0.09 0.09 0.00 0.00 178.44 179.78 1bd2 h ARG 157 N 0.74 0.75 0.00 1.13 2.43 -0.90 0.37 114.38 118.90 1bd2 h ARG 157 Ca 0.18 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.26 1bd2 h ARG 157 Cb 0.22 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 1bd2 h ARG 157 CO -0.01 0.50 -0.21 0.00 -1.51 0.00 0.00 179.97 178.74 1bd2 h ALA 158 N 1.51 1.01 0.03 2.80 0.00 -1.51 -1.24 119.26 121.86 1bd2 h ALA 158 Ca 0.44 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 1bd2 h ALA 158 Cb 0.49 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1bd2 h ALA 158 CO -0.29 0.26 -0.01 -0.92 0.00 0.00 0.00 179.25 178.29 1bd2 h TYR 159 N 0.00 -0.04 0.15 0.00 3.20 -0.01 -2.89 116.97 117.38 1bd2 h TYR 159 Ca -0.00 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1bd2 h TYR 159 Cb 0.74 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 39.02 1bd2 h TYR 159 CO 0.00 0.30 -0.13 -0.07 -1.64 0.00 0.00 178.16 176.62 1bd2 h LEU 160 N -1.00 -0.33 -0.65 2.82 3.38 -0.46 0.64 115.31 119.71 1bd2 h LEU 160 Ca -0.00 0.03 -0.14 0.00 0.09 0.00 0.00 57.88 57.86 1bd2 h LEU 160 Cb 0.36 0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1bd2 h LEU 160 CO 0.01 -0.20 -0.45 -0.33 0.09 0.00 0.00 178.44 177.56 1bd2 h GLU 161 N -0.29 0.52 0.00 1.13 5.08 -1.42 -3.32 114.58 116.28 1bd2 h GLU 161 Ca -0.00 -0.28 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 1bd2 h GLU 161 Cb 0.27 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.53 1bd2 h GLU 161 CO -0.02 0.87 0.00 0.41 -1.00 0.00 0.00 179.01 179.27 1bd2 n GLY 162 N 0.06 -0.23 0.36 -3.84 0.00 -1.10 -4.59 105.19 95.85 1bd2 n GLY 162 Ca -0.02 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.07 1bd2 n GLY 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bd2 h THR 163 N 0.00 0.99 -0.15 2.61 1.03 -1.38 -1.14 112.91 114.87 1bd2 h THR 163 Ca 0.00 -0.28 -0.00 0.00 -0.01 0.00 0.00 66.41 66.11 1bd2 h THR 163 Cb 0.00 0.09 -0.01 0.00 -1.07 0.00 0.00 68.15 67.16 1bd2 h THR 163 CO 0.00 0.15 0.08 0.00 -0.01 0.00 0.00 175.52 175.74 1bd2 h VAL 165 N 0.13 0.40 -0.99 0.00 2.07 -1.50 -1.94 116.25 114.41 1bd2 h VAL 165 Ca 0.05 -0.08 0.24 0.00 0.82 0.00 0.00 66.70 67.73 1bd2 h VAL 165 Cb 0.10 0.43 -0.12 0.00 -1.52 0.00 0.00 31.29 30.18 1bd2 h VAL 165 CO -0.01 0.01 0.58 -0.08 0.02 0.00 0.00 177.57 178.09 1bd2 h GLU 166 N -0.85 0.55 -0.02 1.57 4.57 -1.10 -0.38 114.58 118.91 1bd2 h GLU 166 Ca -0.08 -0.03 -0.20 0.00 -1.18 0.00 0.00 59.36 57.86 1bd2 h GLU 166 Cb 0.63 -0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 29.10 1bd2 h GLU 166 CO 0.13 0.36 -0.86 -1.49 -1.18 0.00 0.00 179.01 175.98 1bd2 h TRP 167 N 0.57 0.49 -0.37 0.92 4.06 -1.11 -2.82 115.95 117.69 1bd2 h TRP 167 Ca 0.64 -0.25 -0.02 0.00 2.06 0.00 0.00 58.89 61.32 1bd2 h TRP 167 Cb 1.21 -0.06 -0.02 0.00 -1.00 0.00 0.00 29.16 29.29 1bd2 h TRP 167 CO -0.02 1.05 0.16 1.25 -3.56 0.00 0.00 178.44 177.32 1bd2 h LEU 168 N 0.21 0.49 -0.85 -4.49 5.85 -0.29 0.83 115.31 117.06 1bd2 h LEU 168 Ca -0.05 -0.15 0.05 0.00 0.84 0.00 0.00 57.88 58.57 1bd2 h LEU 168 Cb 1.47 -0.13 -0.06 0.00 0.37 0.00 0.00 40.66 42.31 1bd2 h LEU 168 CO 0.14 0.51 0.53 0.03 -0.34 0.00 0.00 178.44 179.31 1bd2 h ARG 169 N 0.45 0.96 0.40 1.25 3.08 -1.39 0.33 114.38 119.45 1bd2 h ARG 169 Ca 0.12 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.10 1bd2 h ARG 169 Cb 0.16 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 30.00 1bd2 h ARG 169 CO -0.01 0.63 -0.21 0.00 -1.07 0.00 0.00 179.97 179.32 1bd2 h ARG 170 N 0.99 -0.54 -0.24 0.04 3.08 -1.09 0.77 114.38 117.39 1bd2 h ARG 170 Ca 0.36 0.04 0.04 0.00 0.07 0.00 0.00 59.98 60.49 1bd2 h ARG 170 Cb 0.13 0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.27 1bd2 h ARG 170 CO -0.16 -0.36 0.03 1.88 -1.07 0.00 0.00 179.97 180.29 1bd2 h TYR 171 N -0.56 0.04 -0.02 3.04 0.05 -0.23 0.13 116.97 119.42 1bd2 h TYR 171 Ca -0.05 0.02 0.03 0.00 0.05 0.00 0.00 58.73 58.78 1bd2 h TYR 171 Cb 0.44 0.02 -0.04 0.00 1.01 0.00 0.00 36.73 38.16 1bd2 h TYR 171 CO -0.06 -0.01 -0.20 -0.07 -1.05 0.00 0.00 178.16 176.77 1bd2 h LEU 172 N 0.11 -0.60 -0.47 3.88 3.38 -0.21 0.55 115.31 121.95 1bd2 h LEU 172 Ca 0.11 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1bd2 h LEU 172 Cb 0.13 0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 1bd2 h LEU 172 CO -0.17 -0.27 0.31 -0.08 0.09 0.00 0.00 178.44 178.32 1bd2 h GLU 173 N -0.31 0.63 0.00 1.13 4.57 -0.17 0.47 114.58 120.90 1bd2 h GLU 173 Ca 0.07 -0.04 -0.13 0.00 -1.18 0.00 0.00 59.36 58.07 1bd2 h GLU 173 Cb 0.40 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 28.83 1bd2 h GLU 173 CO -0.20 0.43 -0.62 -0.91 -1.18 0.00 0.00 179.01 176.53 1bd2 h ASN 174 N 0.64 0.00 -0.66 1.04 -0.26 -0.44 -3.00 115.58 112.89 1bd2 h ASN 174 Ca 0.17 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.91 1bd2 h ASN 174 Cb -0.06 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.20 1bd2 h ASN 174 CO -0.04 0.62 0.00 0.61 -1.06 0.00 0.00 177.43 177.56 1bd2 n GLY 175 N 0.50 2.76 0.05 2.83 0.00 0.19 -4.80 105.19 106.71 1bd2 n GLY 175 Ca -0.01 -0.87 -0.01 0.00 0.00 0.00 0.00 46.02 45.13 1bd2 n GLY 175 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1bd2 n LYS 176 N 1.14 -0.05 -0.30 1.61 4.81 0.16 -0.47 118.16 125.06 1bd2 n LYS 176 Ca 0.26 0.41 0.13 0.00 -0.87 0.00 0.00 58.31 58.25 1bd2 n LYS 176 Cb 0.93 -0.62 0.30 0.00 0.02 0.00 0.00 35.03 35.66 1bd2 n LYS 176 CO 0.00 0.00 0.00 1.49 1.17 0.00 0.00 177.40 180.06 1bd2 h GLU 177 N 0.00 0.35 0.00 1.64 4.81 -1.87 0.08 114.58 119.59 1bd2 h GLU 177 Ca 0.02 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.20 1bd2 h GLU 177 Cb 0.05 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.34 1bd2 h GLU 177 CO -0.10 0.23 -0.20 1.15 -0.73 0.00 0.00 179.01 179.36 1bd2 h THR 178 N 0.36 0.64 -0.28 0.32 2.02 -1.16 -3.42 112.91 111.40 1bd2 h THR 178 Ca 0.56 -1.53 -0.04 0.00 0.77 0.00 0.00 66.41 66.17 1bd2 h THR 178 Cb 1.08 1.27 -0.01 0.00 -1.74 0.00 0.00 68.15 68.74 1bd2 h THR 178 CO -0.55 0.22 0.04 -0.07 0.37 0.00 0.00 175.52 175.53 1bd2 h LEU 179 N -1.00 0.46 -5.42 2.58 3.38 -1.06 -3.31 115.31 110.95 1bd2 h LEU 179 Ca -0.04 -0.27 -0.70 0.00 0.09 0.00 0.00 57.88 56.96 1bd2 h LEU 179 Cb 0.51 -0.12 -0.09 0.00 0.09 0.00 0.00 40.66 41.05 1bd2 h LEU 179 CO -0.02 0.61 2.59 0.00 0.09 0.00 0.00 178.44 181.70 1bd2 n GLN 180 N -4.64 4.25 -4.09 1.13 6.02 0.00 -4.91 117.38 115.14 1bd2 n GLN 180 Ca -0.03 -3.09 -0.09 0.00 -0.01 0.00 0.00 57.00 53.79 1bd2 n GLN 180 Cb 0.22 -2.63 -0.10 0.00 1.02 0.00 0.00 30.24 28.74 1bd2 n GLN 180 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 1bd2 s ARG 181 N -0.42 0.62 -0.22 -1.09 1.70 -1.25 -4.88 118.95 113.41 1bd2 s ARG 181 Ca 0.58 -1.12 -0.04 0.00 -0.47 0.00 0.00 55.73 54.68 1bd2 s ARG 181 Cb 0.20 0.03 0.08 0.00 -0.57 0.00 0.00 34.95 34.69 1bd2 s ARG 181 CO -0.09 -0.06 0.10 0.99 -1.08 0.00 0.00 175.30 175.16 1bd2 s THR 182 N -3.23 -0.05 -0.37 4.99 2.01 -1.26 -4.58 115.64 113.15 1bd2 s THR 182 Ca 0.03 -0.42 -0.15 0.00 0.31 0.00 0.00 61.69 61.47 1bd2 s THR 182 Cb 0.03 -0.76 -0.00 0.00 0.01 0.00 0.00 72.50 71.78 1bd2 s THR 182 CO -0.06 -0.45 0.34 -1.81 -0.69 0.00 0.00 174.62 171.95 1bd2 s ASP 183 N 2.11 6.15 0.64 3.53 1.01 -0.14 -4.89 116.67 125.09 1bd2 s ASP 183 Ca 0.05 -0.44 -0.13 0.00 0.71 0.00 0.00 52.55 52.73 1bd2 s ASP 183 Cb -0.16 -2.18 -0.01 0.00 1.01 0.00 0.00 42.92 41.57 1bd2 s ASP 183 CO -0.20 -0.38 1.06 0.00 0.21 0.00 0.00 175.17 175.87 1bd2 s ALA 184 N 1.93 2.70 0.24 5.23 0.00 -1.26 -0.86 121.76 129.74 1bd2 s ALA 184 Ca 0.10 0.25 -0.30 0.00 0.00 0.00 0.00 51.96 52.01 1bd2 s ALA 184 Cb -0.17 -3.21 -0.09 0.00 0.00 0.00 0.00 23.12 19.65 1bd2 s ALA 184 CO 0.12 -1.02 1.15 -1.25 0.00 0.00 0.00 175.76 174.75 1bd2 s PRO 185 N -4.53 4.56 -0.59 0.00 0.04 -1.26 -4.41 135.00 128.82 1bd2 s PRO 185 Ca 0.61 1.85 -0.19 0.00 0.04 0.00 0.00 61.00 63.31 1bd2 s PRO 185 Cb -0.15 -3.21 0.09 0.00 0.04 0.00 0.00 34.50 31.27 1bd2 s PRO 185 CO 0.45 0.06 0.72 0.15 0.04 0.00 0.00 177.00 178.43 1bd2 s LYS 186 N -0.92 3.06 0.45 4.56 1.02 -0.41 -4.87 119.74 122.62 1bd2 s LYS 186 Ca 0.48 -1.20 0.01 0.00 0.02 0.00 0.00 55.97 55.28 1bd2 s LYS 186 Cb -0.32 -4.24 -0.00 0.00 -0.52 0.00 0.00 37.83 32.75 1bd2 s LYS 186 CO 0.40 -1.52 0.66 0.95 -0.92 0.00 0.00 175.35 174.92 1bd2 s THR 187 N 2.82 3.94 -0.03 2.17 -4.23 -1.26 -2.64 115.64 116.41 1bd2 s THR 187 Ca 0.13 -0.54 -0.30 0.00 -1.18 0.00 0.00 61.69 59.80 1bd2 s THR 187 Cb -0.23 -3.45 0.12 0.00 1.34 0.00 0.00 72.50 70.28 1bd2 s THR 187 CO 0.07 -0.30 1.31 -1.38 -0.54 0.00 0.00 174.62 173.78 1bd2 s HIS 188 N -2.54 -0.01 0.01 3.99 -3.43 -1.20 -5.01 115.29 107.09 1bd2 s HIS 188 Ca 0.49 -0.08 0.02 0.00 -0.80 0.00 0.00 55.06 54.69 1bd2 s HIS 188 Cb -0.10 0.54 -0.01 0.00 -1.43 0.00 0.00 32.58 31.58 1bd2 s HIS 188 CO 0.37 -0.23 -0.07 1.41 -2.00 0.00 0.00 174.74 174.22 1bd2 s MET 189 N -2.23 0.57 0.35 -0.38 1.75 -1.26 -1.47 119.30 116.62 1bd2 s MET 189 Ca 0.19 -0.36 0.09 0.00 -1.25 0.00 0.00 55.69 54.36 1bd2 s MET 189 Cb 0.04 -0.52 -0.06 0.00 2.84 0.00 0.00 34.83 37.13 1bd2 s MET 189 CO -0.03 0.14 -0.03 0.95 -0.65 0.00 0.00 175.02 175.40 1bd2 s THR 190 N -0.41 2.41 -0.20 10.11 -4.23 -0.18 -5.01 115.64 118.14 1bd2 s THR 190 Ca 0.00 -2.06 -0.03 0.00 -1.18 0.00 0.00 61.69 58.42 1bd2 s THR 190 Cb -0.04 -2.76 0.07 0.00 1.34 0.00 0.00 72.50 71.11 1bd2 s THR 190 CO -0.00 -0.18 0.06 -2.28 -0.54 0.00 0.00 174.62 171.68 1bd2 s HIS 191 N -2.57 0.78 0.14 3.99 2.46 -1.26 -1.92 115.29 116.91 1bd2 s HIS 191 Ca 0.34 -0.76 0.05 0.00 0.47 0.00 0.00 55.06 55.17 1bd2 s HIS 191 Cb 0.02 -0.96 -0.04 0.00 -0.13 0.00 0.00 32.58 31.47 1bd2 s HIS 191 CO 0.18 -0.61 0.06 -1.01 -2.47 0.00 0.00 174.74 170.89 1bd2 s HIS 192 N 1.94 3.04 -0.29 3.88 4.02 0.13 -4.95 115.29 123.06 1bd2 s HIS 192 Ca 0.01 -0.04 -0.15 0.00 1.02 0.00 0.00 55.06 55.90 1bd2 s HIS 192 Cb -0.17 -1.49 0.14 0.00 -1.02 0.00 0.00 32.58 30.04 1bd2 s HIS 192 CO -0.11 0.51 0.93 0.00 1.02 0.00 0.00 174.74 177.08 1bd2 s ALA 193 N -1.61 -2.30 0.00 -1.40 0.00 -1.26 0.17 121.76 115.35 1bd2 s ALA 193 Ca 0.29 2.21 0.00 0.00 0.00 0.00 0.00 51.96 54.46 1bd2 s ALA 193 Cb -0.10 -1.75 0.00 0.00 0.00 0.00 0.00 23.12 21.27 1bd2 s ALA 193 CO 0.21 -0.50 0.88 0.28 0.00 0.00 0.00 175.76 176.63 1bd2 n VAL 194 N 4.12 0.77 -4.11 0.00 0.31 -1.26 -5.02 118.33 113.14 1bd2 n VAL 194 Ca -0.17 -0.87 -0.08 0.00 -0.01 0.00 0.00 64.34 63.21 1bd2 n VAL 194 Cb 0.56 0.62 -0.10 0.00 -0.91 0.00 0.00 33.84 34.01 1bd2 n VAL 194 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1bd2 s SER 195 N -0.77 0.47 -0.31 4.52 0.15 -1.26 -5.06 113.70 111.45 1bd2 s SER 195 Ca 0.00 -1.06 0.01 0.00 0.70 0.00 0.00 55.95 55.60 1bd2 s SER 195 Cb 0.00 0.22 0.33 0.00 -1.71 0.00 0.00 66.02 64.86 1bd2 s SER 195 CO 0.00 -0.63 1.73 0.47 1.20 0.00 0.00 173.24 176.01 1bd2 n ASP 196 N 0.04 4.76 0.00 5.45 9.92 -1.26 -3.96 116.55 131.50 1bd2 n ASP 196 Ca -0.11 -3.03 0.00 0.00 -0.53 0.00 0.00 54.79 51.11 1bd2 n ASP 196 Cb 0.62 -0.84 0.00 0.00 -0.64 0.00 0.00 41.12 40.26 1bd2 n ASP 196 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1bd2 n HIS 197 N -0.22 0.00 -4.41 1.24 1.44 -1.26 -4.95 115.22 107.06 1bd2 n HIS 197 Ca 0.35 0.00 -0.22 0.00 -2.01 0.00 0.00 57.72 55.84 1bd2 n HIS 197 Cb 0.94 0.00 -0.16 0.00 0.12 0.00 0.00 29.99 30.89 1bd2 n HIS 197 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 1bd2 s GLU 198 N 0.00 1.18 -0.04 -1.40 2.02 -1.25 0.04 118.70 119.25 1bd2 s GLU 198 Ca 0.00 -0.30 0.02 0.00 0.02 0.00 0.00 54.97 54.71 1bd2 s GLU 198 Cb 0.00 -1.06 0.01 0.00 0.10 0.00 0.00 34.13 33.18 1bd2 s GLU 198 CO 0.00 0.04 -0.07 0.00 0.02 0.00 0.00 175.26 175.26 1bd2 s ALA 199 N 0.51 0.79 -0.11 5.21 0.00 0.55 -3.99 121.76 124.72 1bd2 s ALA 199 Ca -0.09 -0.18 -0.21 0.00 0.00 0.00 0.00 51.96 51.47 1bd2 s ALA 199 Cb -0.12 -0.39 -0.04 0.00 0.00 0.00 0.00 23.12 22.57 1bd2 s ALA 199 CO 0.01 0.06 0.62 0.99 0.00 0.00 0.00 175.76 177.45 1bd2 s THR 200 N 0.60 5.08 -0.32 0.00 2.01 0.44 -0.45 115.64 123.01 1bd2 s THR 200 Ca -0.09 1.26 -0.07 0.00 0.31 0.00 0.00 61.69 63.10 1bd2 s THR 200 Cb -0.12 -3.96 0.02 0.00 0.01 0.00 0.00 72.50 68.45 1bd2 s THR 200 CO 0.01 0.24 0.10 -0.22 -0.69 0.00 0.00 174.62 174.06 1bd2 s LEU 201 N 0.97 4.08 -0.19 4.42 2.96 0.10 0.22 118.68 131.24 1bd2 s LEU 201 Ca 0.33 -0.86 -0.06 0.00 -0.22 0.00 0.00 54.13 53.32 1bd2 s LEU 201 Cb -0.17 -1.89 -0.03 0.00 0.50 0.00 0.00 46.19 44.60 1bd2 s LEU 201 CO 0.14 -0.25 0.01 -0.60 -1.32 0.00 0.00 176.35 174.34 1bd2 s ARG 202 N 1.48 3.71 -0.19 1.98 3.52 -0.81 -1.71 118.95 126.93 1bd2 s ARG 202 Ca 0.01 -0.48 -0.06 0.00 -0.13 0.00 0.00 55.73 55.08 1bd2 s ARG 202 Cb -0.18 -3.11 -0.03 0.00 -1.56 0.00 0.00 34.95 30.08 1bd2 s ARG 202 CO 0.03 0.09 0.01 0.00 -0.81 0.00 0.00 175.30 174.62 1bd2 s TRP 204 N 0.80 3.09 -0.16 0.00 0.52 -0.54 -2.28 118.94 120.36 1bd2 s TRP 204 Ca 0.01 -0.07 -0.04 0.00 0.02 0.00 0.00 56.10 56.02 1bd2 s TRP 204 Cb -0.14 -1.45 0.07 0.00 -1.15 0.00 0.00 33.47 30.80 1bd2 s TRP 204 CO 0.02 0.52 0.18 0.00 0.02 0.00 0.00 176.95 177.70 1bd2 s ALA 205 N -1.90 -0.13 0.27 0.98 0.00 -0.72 -3.26 121.76 117.00 1bd2 s ALA 205 Ca 0.31 0.25 0.05 0.00 0.00 0.00 0.00 51.96 52.57 1bd2 s ALA 205 Cb -0.09 -1.13 -0.06 0.00 0.00 0.00 0.00 23.12 21.84 1bd2 s ALA 205 CO 0.23 -1.02 -0.00 -0.51 0.00 0.00 0.00 175.76 174.46 1bd2 s LEU 206 N 2.29 2.27 -1.57 0.00 1.43 -1.08 -1.39 118.68 120.63 1bd2 s LEU 206 Ca 0.05 -1.26 -0.16 0.00 -1.03 0.00 0.00 54.13 51.73 1bd2 s LEU 206 Cb -0.15 -0.42 0.13 0.00 0.03 0.00 0.00 46.19 45.79 1bd2 s LEU 206 CO -0.10 -0.49 0.75 -1.20 0.23 0.00 0.00 176.35 175.55 1bd2 n SER 207 N -0.55 -3.65 -4.74 2.29 7.64 -0.97 -1.29 113.62 112.35 1bd2 n SER 207 Ca -0.04 -0.82 -0.30 0.00 1.01 0.00 0.00 58.87 58.72 1bd2 n SER 207 Cb 0.65 -2.98 -0.07 0.00 -1.01 0.00 0.00 64.21 60.79 1bd2 n SER 207 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1bd2 s PHE 208 N -3.19 3.09 -0.23 1.43 -0.12 -1.17 -4.61 117.98 113.18 1bd2 s PHE 208 Ca 0.66 0.02 -0.19 0.00 -0.05 0.00 0.00 56.93 57.37 1bd2 s PHE 208 Cb -0.35 -1.57 0.06 0.00 -0.63 0.00 0.00 43.02 40.53 1bd2 s PHE 208 CO 0.81 0.50 0.61 -0.47 -0.05 0.00 0.00 175.22 176.62 1bd2 s TYR 209 N -1.39 -0.75 0.00 3.49 5.04 -0.04 -0.42 117.35 123.28 1bd2 s TYR 209 Ca 0.28 1.71 0.00 0.00 -2.44 0.00 0.00 57.07 56.62 1bd2 s TYR 209 Cb -0.12 0.32 0.00 0.00 0.35 0.00 0.00 41.96 42.51 1bd2 s TYR 209 CO 0.20 -0.37 0.00 -0.35 -1.34 0.00 0.00 175.55 173.70 1bd2 n PRO 210 N 3.24 -1.46 0.00 4.97 -0.04 -1.26 -0.96 135.00 139.49 1bd2 n PRO 210 Ca -0.16 0.00 0.14 0.00 -0.04 0.00 0.00 63.50 63.43 1bd2 n PRO 210 Cb 0.56 0.00 0.54 0.00 -0.04 0.00 0.00 33.50 34.56 1bd2 n PRO 210 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1bd2 n ALA 211 N -3.00 2.65 -2.21 0.55 0.00 -1.26 -4.85 120.51 112.39 1bd2 n ALA 211 Ca 0.00 -0.17 -0.42 0.00 0.00 0.00 0.00 53.44 52.85 1bd2 n ALA 211 Cb 0.00 -1.38 -0.03 0.00 0.00 0.00 0.00 19.45 18.04 1bd2 n ALA 211 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1bd2 s GLU 212 N -2.96 4.22 -0.06 0.00 -6.30 -1.26 -4.99 118.70 107.36 1bd2 s GLU 212 Ca 0.15 1.94 -0.24 0.00 -2.50 0.00 0.00 54.97 54.31 1bd2 s GLU 212 Cb 0.19 -3.83 0.05 0.00 0.00 0.00 0.00 34.13 30.54 1bd2 s GLU 212 CO 0.57 -0.74 0.55 -1.50 0.02 0.00 0.00 175.26 174.15 1bd2 s ILE 213 N 3.54 0.02 -0.17 -3.70 2.07 -1.26 -4.54 121.20 117.16 1bd2 s ILE 213 Ca 0.64 -0.16 0.00 0.00 -1.41 0.00 0.00 60.65 59.73 1bd2 s ILE 213 Cb -0.28 -0.85 0.03 0.00 0.13 0.00 0.00 42.46 41.49 1bd2 s ILE 213 CO 0.23 -0.09 -0.10 -0.89 -1.91 0.00 0.00 174.94 172.18 1bd2 s THR 214 N -1.08 1.46 -0.18 4.00 2.01 -0.64 -4.98 115.64 116.22 1bd2 s THR 214 Ca -0.11 -0.74 -0.00 0.00 0.31 0.00 0.00 61.69 61.15 1bd2 s THR 214 Cb -0.02 -1.49 0.01 0.00 0.01 0.00 0.00 72.50 71.01 1bd2 s THR 214 CO 0.07 0.28 -0.15 -0.22 -0.69 0.00 0.00 174.62 173.92 1bd2 s LEU 215 N 1.50 2.42 -0.02 4.42 2.96 -1.26 -0.35 118.68 128.35 1bd2 s LEU 215 Ca 0.02 -0.54 -0.01 0.00 -0.22 0.00 0.00 54.13 53.38 1bd2 s LEU 215 Cb -0.14 -1.57 0.02 0.00 0.50 0.00 0.00 46.19 44.99 1bd2 s LEU 215 CO -0.09 0.02 0.05 -0.89 -1.32 0.00 0.00 176.35 174.11 1bd2 s THR 216 N 1.21 -0.03 -0.08 3.68 2.01 0.14 -4.95 115.64 117.63 1bd2 s THR 216 Ca 0.02 0.09 -0.08 0.00 0.31 0.00 0.00 61.69 62.03 1bd2 s THR 216 Cb -0.14 -0.09 -0.04 0.00 0.01 0.00 0.00 72.50 72.24 1bd2 s THR 216 CO -0.07 0.04 0.21 0.26 -0.69 0.00 0.00 174.62 174.37 1bd2 s TRP 217 N 0.50 3.62 0.05 4.92 0.52 -1.26 0.59 118.94 127.87 1bd2 s TRP 217 Ca -0.04 0.62 0.02 0.00 0.02 0.00 0.00 56.10 56.72 1bd2 s TRP 217 Cb -0.06 -2.01 -0.03 0.00 -1.15 0.00 0.00 33.47 30.22 1bd2 s TRP 217 CO -0.02 0.70 -0.08 -0.65 0.02 0.00 0.00 176.95 176.93 1bd2 s GLN 218 N -1.16 0.55 -0.15 4.98 -0.21 -0.32 -0.38 119.66 122.96 1bd2 s GLN 218 Ca 0.19 -0.81 0.01 0.00 0.02 0.00 0.00 55.36 54.77 1bd2 s GLN 218 Cb -0.13 -0.27 0.02 0.00 1.00 0.00 0.00 33.01 33.63 1bd2 s GLN 218 CO 0.08 0.04 -0.16 0.50 -2.12 0.00 0.00 175.29 173.63 1bd2 s ARG 219 N -1.78 2.48 0.00 2.91 3.52 -0.51 -0.78 118.95 124.77 1bd2 s ARG 219 Ca -0.08 -0.63 0.00 0.00 -0.13 0.00 0.00 55.73 54.89 1bd2 s ARG 219 Cb -0.09 -2.22 0.00 0.00 -1.56 0.00 0.00 34.95 31.09 1bd2 s ARG 219 CO -0.00 -0.22 0.00 -0.25 -0.81 0.00 0.00 175.30 174.02 1bd2 n ASP 220 N 4.70 -3.94 0.00 -2.12 8.00 -0.49 -0.26 116.55 122.44 1bd2 n ASP 220 Ca -0.18 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.32 1bd2 n ASP 220 Cb 0.50 -3.07 0.00 0.00 -0.02 0.00 0.00 41.12 38.53 1bd2 n ASP 220 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1bd2 n GLY 221 N 0.06 1.11 3.57 0.44 0.00 -1.26 -5.10 105.19 104.00 1bd2 n GLY 221 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1bd2 n GLY 221 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1bd2 s GLU 222 N -0.56 3.85 0.14 1.61 4.04 0.64 -5.06 118.70 123.37 1bd2 s GLU 222 Ca 0.00 -0.41 -0.34 0.00 0.04 0.00 0.00 54.97 54.27 1bd2 s GLU 222 Cb 0.00 -3.18 -0.16 0.00 0.02 0.00 0.00 34.13 30.80 1bd2 s GLU 222 CO 0.00 0.17 1.17 -0.40 -1.84 0.00 0.00 175.26 174.35 1bd2 n ASP 223 N 3.83 1.20 -1.31 0.83 5.75 -1.26 -1.43 116.55 124.16 1bd2 n ASP 223 Ca -0.17 1.14 0.08 0.00 -0.01 0.00 0.00 54.79 55.83 1bd2 n ASP 223 Cb 0.52 -1.18 0.31 0.00 -1.03 0.00 0.00 41.12 39.75 1bd2 n ASP 223 CO 0.00 0.00 0.00 1.67 -0.11 0.00 0.00 177.20 178.76 1bd2 n GLN 224 N 1.86 3.67 -0.05 0.11 -0.06 0.49 -4.81 117.38 118.59 1bd2 n GLN 224 Ca 0.16 -2.86 -0.01 0.00 -2.00 0.00 0.00 57.00 52.29 1bd2 n GLN 224 Cb 0.22 -1.91 -0.01 0.00 -4.06 0.00 0.00 30.24 24.48 1bd2 n GLN 224 CO 0.00 0.00 0.00 0.25 -0.20 0.00 0.00 177.06 177.11 1bd2 n THR 225 N 0.30 -0.09 0.38 1.69 -2.24 -1.26 -0.76 114.28 112.30 1bd2 n THR 225 Ca 0.23 0.63 0.09 0.00 -2.27 0.00 0.00 64.05 62.73 1bd2 n THR 225 Cb 0.93 -0.81 0.39 0.00 -2.10 0.00 0.00 70.33 68.74 1bd2 n THR 225 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bd2 n GLN 226 N -3.11 0.10 -0.31 -0.78 3.00 -1.26 -2.59 117.38 112.42 1bd2 n GLN 226 Ca 0.00 0.38 0.07 0.00 -0.01 0.00 0.00 57.00 57.45 1bd2 n GLN 226 Cb 0.03 -1.71 0.21 0.00 0.00 0.00 0.00 30.24 28.78 1bd2 n GLN 226 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 1bd2 n ASP 227 N -1.90 3.46 -4.38 1.08 9.92 0.06 -4.98 116.55 119.81 1bd2 n ASP 227 Ca 0.02 -2.34 -0.33 0.00 -0.53 0.00 0.00 54.79 51.61 1bd2 n ASP 227 Cb 0.17 -0.37 -0.14 0.00 -0.64 0.00 0.00 41.12 40.14 1bd2 n ASP 227 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1bd2 s THR 228 N -1.61 3.11 -0.50 -3.53 2.01 -1.07 -4.45 115.64 109.60 1bd2 s THR 228 Ca 0.33 -0.64 -0.23 0.00 0.31 0.00 0.00 61.69 61.46 1bd2 s THR 228 Cb 0.21 -2.31 0.04 0.00 0.01 0.00 0.00 72.50 70.45 1bd2 s THR 228 CO 0.16 0.52 0.85 -0.70 -0.69 0.00 0.00 174.62 174.75 1bd2 s GLU 229 N 0.35 3.34 -0.24 4.92 2.12 -0.15 -4.89 118.70 124.15 1bd2 s GLU 229 Ca -0.10 -0.26 -0.06 0.00 0.36 0.00 0.00 54.97 54.91 1bd2 s GLU 229 Cb -0.16 -4.01 -0.02 0.00 0.26 0.00 0.00 34.13 30.21 1bd2 s GLU 229 CO 0.05 -1.30 0.02 -1.17 -0.54 0.00 0.00 175.26 172.32 1bd2 s LEU 230 N 3.54 3.22 0.15 2.70 2.96 -1.26 -1.57 118.68 128.42 1bd2 s LEU 230 Ca 0.29 -0.35 -0.18 0.00 -0.22 0.00 0.00 54.13 53.67 1bd2 s LEU 230 Cb -0.13 -1.83 -0.07 0.00 0.50 0.00 0.00 46.19 44.66 1bd2 s LEU 230 CO 0.20 -0.04 0.62 0.68 -1.32 0.00 0.00 176.35 176.49 1bd2 s VAL 231 N 1.54 4.70 0.40 1.68 -7.23 -0.92 -5.03 120.40 115.53 1bd2 s VAL 231 Ca 0.06 1.14 -0.27 0.00 -1.81 0.00 0.00 61.98 61.09 1bd2 s VAL 231 Cb -0.15 -3.85 -0.10 0.00 0.56 0.00 0.00 36.38 32.84 1bd2 s VAL 231 CO 0.00 0.34 1.44 1.21 -0.31 0.00 0.00 175.10 177.78 1bd2 n GLU 232 N 1.10 2.45 -1.61 4.82 2.13 -1.26 -4.47 120.64 123.80 1bd2 n GLU 232 Ca -0.06 0.86 -0.48 0.00 0.66 0.00 0.00 57.16 58.15 1bd2 n GLU 232 Cb 0.51 -2.61 -0.04 0.00 0.27 0.00 0.00 31.44 29.58 1bd2 n GLU 232 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 1bd2 n THR 233 N 0.19 0.80 -4.62 6.31 -1.04 -1.26 -4.86 114.28 109.79 1bd2 n THR 233 Ca 0.03 -0.20 -0.24 0.00 -2.04 0.00 0.00 64.05 61.60 1bd2 n THR 233 Cb 0.39 -1.04 -0.14 0.00 -1.82 0.00 0.00 70.33 67.72 1bd2 n THR 233 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1bd2 s ARG 234 N -0.27 1.28 0.26 -2.82 1.70 -0.63 -4.96 118.95 113.51 1bd2 s ARG 234 Ca 0.73 -0.80 -0.30 0.00 -0.47 0.00 0.00 55.73 54.89 1bd2 s ARG 234 Cb -0.80 -1.32 -0.09 0.00 -0.57 0.00 0.00 34.95 32.17 1bd2 s ARG 234 CO 0.50 0.34 1.07 -1.25 -1.08 0.00 0.00 175.30 174.89 1bd2 s PRO 235 N -0.94 4.67 0.14 3.89 0.04 -1.26 0.41 135.00 141.96 1bd2 s PRO 235 Ca 0.06 1.74 0.06 0.00 0.04 0.00 0.00 61.00 62.90 1bd2 s PRO 235 Cb -0.08 -3.21 -0.12 0.00 0.04 0.00 0.00 34.50 31.13 1bd2 s PRO 235 CO 0.01 0.25 1.32 0.00 0.04 0.00 0.00 177.00 178.62 1bd2 h ALA 236 N 4.02 0.43 0.00 8.56 0.00 -0.87 -3.46 119.26 127.93 1bd2 h ALA 236 Ca -0.46 -0.84 0.00 0.00 0.00 0.00 0.00 54.91 53.61 1bd2 h ALA 236 Cb 1.21 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1bd2 h ALA 236 CO 0.68 1.11 0.00 0.41 0.00 0.00 0.00 179.25 181.45 1bd2 n GLY 237 N 1.16 0.71 0.33 0.00 0.00 -1.26 -4.94 105.19 101.19 1bd2 n GLY 237 Ca -0.01 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.06 1bd2 n GLY 237 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1bd2 n ASP 238 N 0.00 2.64 0.00 1.61 5.68 -1.26 -4.94 116.55 120.28 1bd2 n ASP 238 Ca 0.00 -2.46 0.00 0.00 -0.50 0.00 0.00 54.79 51.83 1bd2 n ASP 238 Cb 0.00 -0.26 0.00 0.00 -1.14 0.00 0.00 41.12 39.72 1bd2 n ASP 238 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1bd2 n GLY 239 N -0.51 0.97 3.41 6.12 0.00 -1.26 -5.09 105.19 108.82 1bd2 n GLY 239 Ca 0.11 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.93 1bd2 n GLY 239 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1bd2 s THR 240 N -2.00 1.08 0.40 2.61 -4.23 -1.26 -4.86 115.64 107.39 1bd2 s THR 240 Ca 0.00 -2.01 0.07 0.00 -1.18 0.00 0.00 61.69 58.57 1bd2 s THR 240 Cb 0.00 -2.70 -0.07 0.00 1.34 0.00 0.00 72.50 71.08 1bd2 s THR 240 CO 0.00 -0.06 0.08 -0.36 -0.54 0.00 0.00 174.62 173.74 1bd2 s PHE 241 N -3.38 2.55 0.20 3.99 0.40 0.44 -0.19 117.98 121.99 1bd2 s PHE 241 Ca 0.35 -0.62 0.01 0.00 -0.60 0.00 0.00 56.93 56.08 1bd2 s PHE 241 Cb 0.08 -1.83 -0.05 0.00 0.51 0.00 0.00 43.02 41.74 1bd2 s PHE 241 CO 0.14 0.35 0.04 -0.65 0.70 0.00 0.00 175.22 175.80 1bd2 s GLN 242 N -3.79 1.20 -0.29 0.44 -0.21 0.17 -2.29 119.66 114.89 1bd2 s GLN 242 Ca 0.37 -1.61 -0.33 0.00 0.02 0.00 0.00 55.36 53.82 1bd2 s GLN 242 Cb 0.07 -0.22 0.18 0.00 1.00 0.00 0.00 33.01 34.04 1bd2 s GLN 242 CO 0.20 -0.20 1.39 0.21 -2.12 0.00 0.00 175.29 174.77 1bd2 s LYS 243 N -3.97 0.02 -0.10 2.91 2.20 -0.49 -1.61 119.74 118.70 1bd2 s LYS 243 Ca 0.29 -0.00 -0.28 0.00 -0.36 0.00 0.00 55.97 55.62 1bd2 s LYS 243 Cb 0.07 0.01 0.07 0.00 -1.51 0.00 0.00 37.83 36.46 1bd2 s LYS 243 CO 0.07 -0.01 0.66 1.67 -0.36 0.00 0.00 175.35 177.39 1bd2 s TRP 244 N -1.44 -0.66 -0.02 4.03 1.48 -1.26 -1.75 118.94 119.32 1bd2 s TRP 244 Ca 0.11 1.27 0.08 0.00 -1.06 0.00 0.00 56.10 56.50 1bd2 s TRP 244 Cb -0.01 0.35 -0.02 0.00 -1.16 0.00 0.00 33.47 32.63 1bd2 s TRP 244 CO -0.06 -0.53 -0.26 0.00 -4.06 0.00 0.00 176.95 172.04 1bd2 s ALA 245 N -0.79 2.12 -0.01 2.67 0.00 -0.97 -2.17 121.76 122.62 1bd2 s ALA 245 Ca -0.08 -1.10 0.00 0.00 0.00 0.00 0.00 51.96 50.78 1bd2 s ALA 245 Cb -0.02 -0.54 0.01 0.00 0.00 0.00 0.00 23.12 22.58 1bd2 s ALA 245 CO 0.07 0.52 0.00 0.00 0.00 0.00 0.00 175.76 176.36 1bd2 s ALA 246 N -0.60 0.11 0.10 0.00 0.00 -0.61 -0.88 121.76 119.88 1bd2 s ALA 246 Ca 0.10 0.07 0.08 0.00 0.00 0.00 0.00 51.96 52.22 1bd2 s ALA 246 Cb -0.10 -0.11 -0.03 0.00 0.00 0.00 0.00 23.12 22.87 1bd2 s ALA 246 CO -0.01 -0.02 -0.22 0.14 0.00 0.00 0.00 175.76 175.65 1bd2 s VAL 247 N 0.38 1.77 -0.20 0.00 -7.23 -0.69 -0.98 120.40 113.46 1bd2 s VAL 247 Ca -0.03 -1.55 -0.17 0.00 -1.81 0.00 0.00 61.98 58.42 1bd2 s VAL 247 Cb -0.05 -1.60 -0.04 0.00 0.56 0.00 0.00 36.38 35.25 1bd2 s VAL 247 CO -0.01 -0.03 0.44 -0.69 -0.31 0.00 0.00 175.10 174.51 1bd2 s VAL 248 N -1.13 5.16 -0.07 1.32 1.01 -1.26 0.02 120.40 125.45 1bd2 s VAL 248 Ca 0.07 0.80 0.05 0.00 0.00 0.00 0.00 61.98 62.90 1bd2 s VAL 248 Cb -0.10 -3.77 -0.01 0.00 0.00 0.00 0.00 36.38 32.50 1bd2 s VAL 248 CO 0.04 0.23 -0.22 -0.69 0.00 0.00 0.00 175.10 174.46 1bd2 s VAL 249 N 1.41 2.32 0.20 2.92 1.01 0.41 -4.96 120.40 123.72 1bd2 s VAL 249 Ca 0.21 -0.96 -0.30 0.00 0.00 0.00 0.00 61.98 60.93 1bd2 s VAL 249 Cb -0.15 -1.88 -0.08 0.00 0.00 0.00 0.00 36.38 34.27 1bd2 s VAL 249 CO 0.09 0.56 1.08 -2.84 0.00 0.00 0.00 175.10 173.99 1bd2 s PRO 250 N -0.07 4.63 0.25 2.72 0.02 -1.26 -0.33 135.00 140.97 1bd2 s PRO 250 Ca -0.06 1.71 -0.27 0.00 0.02 0.00 0.00 61.00 62.40 1bd2 s PRO 250 Cb -0.14 -3.26 -0.16 0.00 0.02 0.00 0.00 34.50 30.96 1bd2 s PRO 250 CO 0.05 0.15 0.66 -1.13 -0.33 0.00 0.00 177.00 176.39 1bd2 n SER 251 N 2.05 -0.50 0.00 2.53 3.41 0.11 -1.65 113.62 119.56 1bd2 n SER 251 Ca 0.01 1.12 0.00 0.00 -0.26 0.00 0.00 58.87 59.74 1bd2 n SER 251 Cb 0.46 -1.06 0.00 0.00 -0.26 0.00 0.00 64.21 63.35 1bd2 n SER 251 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1bd2 n GLY 252 N 1.76 2.89 0.00 5.00 0.00 -1.26 -4.85 105.19 108.72 1bd2 n GLY 252 Ca 0.15 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.32 1bd2 n GLY 252 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1bd2 n GLN 253 N -0.10 0.56 -0.31 1.61 6.02 -0.66 -4.36 117.38 120.14 1bd2 n GLN 253 Ca 0.00 0.00 0.15 0.00 -0.01 0.00 0.00 57.00 57.15 1bd2 n GLN 253 Cb 0.00 -1.50 0.32 0.00 1.02 0.00 0.00 30.24 30.08 1bd2 n GLN 253 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1bd2 h GLU 254 N 0.00 0.13 0.00 -1.09 3.07 -1.89 0.53 114.58 115.33 1bd2 h GLU 254 Ca 0.00 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.85 1bd2 h GLU 254 Cb 0.21 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 28.10 1bd2 h GLU 254 CO 0.00 0.09 0.00 1.04 -1.40 0.00 0.00 179.01 178.74 1bd2 n GLN 255 N -5.30 0.04 0.07 2.33 1.13 -1.26 -3.00 117.38 111.39 1bd2 n GLN 255 Ca 0.23 0.35 -0.11 0.00 -1.94 0.00 0.00 57.00 55.53 1bd2 n GLN 255 Cb 0.76 -1.59 -0.13 0.00 0.11 0.00 0.00 30.24 29.39 1bd2 n GLN 255 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1bd2 h ARG 256 N 0.00 0.12 -6.62 -1.09 -0.00 -1.21 -3.47 114.38 102.11 1bd2 h ARG 256 Ca 0.00 -0.20 -0.51 0.00 -0.50 0.00 0.00 59.98 58.77 1bd2 h ARG 256 Cb 0.22 0.08 -0.03 0.00 0.00 0.00 0.00 29.97 30.23 1bd2 h ARG 256 CO 0.00 1.04 0.19 0.71 0.00 0.00 0.00 179.97 181.91 1bd2 s TYR 257 N -2.67 3.78 -0.02 3.04 1.51 -1.16 -1.40 117.35 120.43 1bd2 s TYR 257 Ca -0.02 1.59 0.01 0.00 -1.01 0.00 0.00 57.07 57.64 1bd2 s TYR 257 Cb 0.08 -2.75 0.01 0.00 -0.11 0.00 0.00 41.96 39.19 1bd2 s TYR 257 CO 0.84 0.39 -0.03 0.95 -1.11 0.00 0.00 175.55 176.60 1bd2 s THR 258 N -1.37 0.33 -0.04 -0.71 -4.23 0.04 -4.50 115.64 105.16 1bd2 s THR 258 Ca 0.41 -0.07 -0.12 0.00 -1.18 0.00 0.00 61.69 60.72 1bd2 s THR 258 Cb -0.20 -0.35 -0.05 0.00 1.34 0.00 0.00 72.50 73.24 1bd2 s THR 258 CO 0.24 0.14 0.33 0.00 -0.54 0.00 0.00 174.62 174.79 1bd2 s HIS 260 N -1.00 2.12 -0.20 0.00 3.76 0.20 -0.39 115.29 119.77 1bd2 s HIS 260 Ca 0.21 -1.38 -0.06 0.00 -0.15 0.00 0.00 55.06 53.67 1bd2 s HIS 260 Cb -0.15 -1.50 -0.03 0.00 1.11 0.00 0.00 32.58 32.00 1bd2 s HIS 260 CO 0.10 -0.69 0.04 0.08 -0.85 0.00 0.00 174.74 173.42 1bd2 s VAL 261 N 1.50 4.38 -0.09 -0.90 1.01 -0.90 -0.69 120.40 124.70 1bd2 s VAL 261 Ca -0.01 -0.17 0.04 0.00 0.00 0.00 0.00 61.98 61.84 1bd2 s VAL 261 Cb -0.16 -2.99 0.00 0.00 0.00 0.00 0.00 36.38 33.23 1bd2 s VAL 261 CO -0.08 0.42 -0.22 -1.58 0.00 0.00 0.00 175.10 173.64 1bd2 s GLN 262 N 0.89 2.79 -0.16 2.72 0.74 0.52 -1.95 119.66 125.22 1bd2 s GLN 262 Ca 0.03 -0.79 -0.29 0.00 0.05 0.00 0.00 55.36 54.36 1bd2 s GLN 262 Cb -0.14 -2.13 0.10 0.00 1.10 0.00 0.00 33.01 31.93 1bd2 s GLN 262 CO 0.02 0.15 0.84 -1.58 -0.55 0.00 0.00 175.29 174.17 1bd2 s HIS 263 N 0.42 -0.56 0.48 1.67 2.46 -1.26 -1.63 115.29 116.87 1bd2 s HIS 263 Ca -0.18 1.10 0.24 0.00 0.47 0.00 0.00 55.06 56.70 1bd2 s HIS 263 Cb -0.18 0.39 1.28 0.00 -0.13 0.00 0.00 32.58 33.95 1bd2 s HIS 263 CO 0.08 -0.43 1.88 1.05 -2.47 0.00 0.00 174.74 174.85 1bd2 h GLU 264 N 3.37 0.19 0.00 2.88 9.09 -1.95 0.80 114.58 128.97 1bd2 h GLU 264 Ca -0.25 -0.01 -0.01 0.00 0.05 0.00 0.00 59.36 59.14 1bd2 h GLU 264 Cb 1.16 -0.04 -0.00 0.00 -1.65 0.00 0.00 28.75 28.21 1bd2 h GLU 264 CO 0.27 0.13 -0.05 0.78 0.05 0.00 0.00 179.01 180.19 1bd2 h GLY 265 N 0.20 0.00 -6.17 1.06 0.00 -1.88 -3.43 103.07 92.86 1bd2 h GLY 265 Ca 0.43 0.00 -0.60 0.00 0.00 0.00 0.00 47.33 47.16 1bd2 h GLY 265 CO -0.09 0.00 0.32 1.08 0.00 0.00 0.00 176.54 177.85 1bd2 s LEU 266 N -6.28 4.08 0.07 3.11 1.43 0.27 -4.72 118.68 116.64 1bd2 s LEU 266 Ca 0.03 0.82 -0.23 0.00 -1.03 0.00 0.00 54.13 53.71 1bd2 s LEU 266 Cb 0.08 -3.02 -0.15 0.00 0.03 0.00 0.00 46.19 43.13 1bd2 s LEU 266 CO 0.59 -0.47 1.66 -0.65 0.23 0.00 0.00 176.35 177.71 1bd2 h PRO 267 N 7.86 0.03 -6.31 1.29 0.11 -1.84 -3.42 132.00 129.72 1bd2 h PRO 267 Ca -0.25 -0.00 -0.67 0.00 0.11 0.00 0.00 66.00 65.19 1bd2 h PRO 267 Cb 1.11 -0.01 -0.30 0.00 0.11 0.00 0.00 31.00 31.91 1bd2 h PRO 267 CO 0.83 0.11 -0.88 -1.59 -0.21 0.00 0.00 178.00 176.26 1bd2 s LYS 268 N -5.83 2.04 0.31 1.05 0.00 -1.26 -5.11 119.74 110.94 1bd2 s LYS 268 Ca -0.14 -0.86 -0.29 0.00 0.00 0.00 0.00 55.97 54.68 1bd2 s LYS 268 Cb 0.05 -1.92 -0.12 0.00 0.00 0.00 0.00 37.83 35.84 1bd2 s LYS 268 CO 0.67 0.49 1.45 -2.30 0.00 0.00 0.00 175.35 175.66 1bd2 n PRO 269 N 2.58 2.40 -2.75 1.78 -0.02 -1.26 -4.99 135.00 132.74 1bd2 n PRO 269 Ca -0.16 0.85 -0.27 0.00 -2.02 0.00 0.00 63.50 61.90 1bd2 n PRO 269 Cb 0.52 -2.54 -0.00 0.00 -0.02 0.00 0.00 33.50 31.45 1bd2 n PRO 269 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1bd2 s LEU 270 N -0.83 3.69 -0.07 2.45 1.43 -0.82 -4.95 118.68 119.57 1bd2 s LEU 270 Ca 0.60 0.86 -0.03 0.00 -1.03 0.00 0.00 54.13 54.53 1bd2 s LEU 270 Cb -0.54 -3.80 0.04 0.00 0.03 0.00 0.00 46.19 41.92 1bd2 s LEU 270 CO 0.56 -0.53 0.11 -0.89 0.23 0.00 0.00 176.35 175.83 1bd2 s THR 271 N -2.67 -0.19 -0.14 5.49 2.01 -1.25 -2.12 115.64 116.76 1bd2 s THR 271 Ca 0.46 0.38 -0.04 0.00 0.31 0.00 0.00 61.69 62.80 1bd2 s THR 271 Cb -0.10 -0.24 -0.03 0.00 0.01 0.00 0.00 72.50 72.14 1bd2 s THR 271 CO 0.43 0.15 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.75 1bd2 s LEU 272 N 2.23 3.45 0.12 4.42 1.43 0.48 -4.92 118.68 125.90 1bd2 s LEU 272 Ca 0.04 -0.01 0.09 0.00 -1.03 0.00 0.00 54.13 53.22 1bd2 s LEU 272 Cb -0.12 -1.83 -0.04 0.00 0.03 0.00 0.00 46.19 44.23 1bd2 s LEU 272 CO -0.05 0.23 -0.18 -0.13 0.23 0.00 0.00 176.35 176.46 1bd2 s ARG 273 N -0.02 1.78 -1.36 1.70 3.00 -1.26 -1.19 118.95 121.59 1bd2 s ARG 273 Ca 0.03 -1.18 -0.13 0.00 0.00 0.00 0.00 55.73 54.45 1bd2 s ARG 273 Cb -0.13 -2.11 0.10 0.00 0.00 0.00 0.00 34.95 32.81 1bd2 s ARG 273 CO 0.02 0.48 1.99 1.87 0.00 0.00 0.00 175.30 179.66 1bd2 n TRP 274 N 0.81 3.60 0.40 -0.53 -0.00 -1.26 -5.02 117.44 115.45 1bd2 n TRP 274 Ca -0.16 -2.93 0.05 0.00 -0.00 0.00 0.00 57.50 54.46 1bd2 n TRP 274 Cb 0.53 -2.34 0.04 0.00 -0.00 0.00 0.00 31.31 29.54 1bd2 n TRP 274 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 177.69 178.08