#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a1m s SER 2 N 0.00 6.44 0.07 1.61 1.04 -1.26 -4.37 113.70 117.23 1a1m s SER 2 Ca 0.00 0.90 -0.00 0.00 0.48 0.00 0.00 55.95 57.33 1a1m s SER 2 Cb 0.00 -2.22 -0.04 0.00 0.10 0.00 0.00 66.02 63.85 1a1m s SER 2 CO 0.00 -0.34 -0.03 -1.00 0.98 0.00 0.00 173.24 172.85 1a1m s HIS 3 N -2.30 0.68 0.00 5.02 4.02 -1.20 -5.01 115.29 116.50 1a1m s HIS 3 Ca 0.47 -1.03 -0.20 0.00 1.02 0.00 0.00 55.06 55.32 1a1m s HIS 3 Cb -0.10 -0.45 0.04 0.00 -1.02 0.00 0.00 32.58 31.05 1a1m s HIS 3 CO 0.33 -0.31 0.43 -1.54 1.02 0.00 0.00 174.74 174.67 1a1m s SER 4 N -2.98 -0.33 -0.08 1.40 1.04 -1.26 -0.67 113.70 110.82 1a1m s SER 4 Ca 0.10 0.19 0.05 0.00 0.48 0.00 0.00 55.95 56.77 1a1m s SER 4 Cb 0.07 0.41 -0.01 0.00 0.10 0.00 0.00 66.02 66.59 1a1m s SER 4 CO -0.07 -0.57 -0.24 -0.32 0.98 0.00 0.00 173.24 173.01 1a1m s MET 5 N -1.77 2.82 -0.02 4.02 0.00 -0.81 -0.55 119.30 122.99 1a1m s MET 5 Ca -0.10 -0.89 0.00 0.00 0.00 0.00 0.00 55.69 54.71 1a1m s MET 5 Cb -0.02 -2.24 0.03 0.00 0.00 0.00 0.00 34.83 32.60 1a1m s MET 5 CO 0.03 0.27 0.02 0.50 0.00 0.00 0.00 175.02 175.84 1a1m s ARG 6 N 0.11 0.08 -0.14 4.11 6.06 -0.40 -2.42 118.95 126.34 1a1m s ARG 6 Ca -0.12 0.15 -0.04 0.00 -2.50 0.00 0.00 55.73 53.22 1a1m s ARG 6 Cb -0.16 -0.32 -0.03 0.00 0.06 0.00 0.00 34.95 34.49 1a1m s ARG 6 CO 0.07 -0.15 -0.02 0.71 -2.50 0.00 0.00 175.30 173.41 1a1m s TYR 7 N 1.04 3.08 -0.20 5.12 2.02 0.73 -0.75 117.35 128.40 1a1m s TYR 7 Ca -0.09 -0.10 0.01 0.00 -0.37 0.00 0.00 57.07 56.52 1a1m s TYR 7 Cb -0.13 -1.92 0.03 0.00 -0.40 0.00 0.00 41.96 39.54 1a1m s TYR 7 CO -0.03 0.14 -0.18 -0.06 -1.57 0.00 0.00 175.55 173.85 1a1m s PHE 8 N -0.01 2.88 -0.08 2.71 0.40 -0.66 -1.68 117.98 121.54 1a1m s PHE 8 Ca 0.02 -1.80 -0.02 0.00 -0.60 0.00 0.00 56.93 54.54 1a1m s PHE 8 Cb -0.13 -1.92 -0.03 0.00 0.51 0.00 0.00 43.02 41.45 1a1m s PHE 8 CO 0.02 -0.82 -0.00 0.71 0.70 0.00 0.00 175.22 175.82 1a1m s TYR 9 N 1.25 3.14 -0.03 0.36 2.02 0.19 -2.05 117.35 122.23 1a1m s TYR 9 Ca 0.02 0.18 0.01 0.00 -0.37 0.00 0.00 57.07 56.90 1a1m s TYR 9 Cb -0.15 -1.78 0.03 0.00 -0.40 0.00 0.00 41.96 39.66 1a1m s TYR 9 CO -0.11 0.46 -0.01 0.99 -1.57 0.00 0.00 175.55 175.31 1a1m s THR 10 N -0.89 0.26 -0.13 -0.71 2.01 -0.55 -1.91 115.64 113.73 1a1m s THR 10 Ca 0.13 0.04 -0.00 0.00 0.31 0.00 0.00 61.69 62.17 1a1m s THR 10 Cb -0.11 -0.34 0.02 0.00 0.01 0.00 0.00 72.50 72.09 1a1m s THR 10 CO 0.03 0.16 -0.10 0.00 -0.69 0.00 0.00 174.62 174.02 1a1m s ALA 11 N 0.99 1.55 -0.11 7.40 0.00 -0.30 -1.37 121.76 129.92 1a1m s ALA 11 Ca -0.10 -0.71 0.03 0.00 0.00 0.00 0.00 51.96 51.18 1a1m s ALA 11 Cb -0.14 -0.98 0.01 0.00 0.00 0.00 0.00 23.12 22.01 1a1m s ALA 11 CO -0.01 -0.42 -0.22 -1.64 0.00 0.00 0.00 175.76 173.46 1a1m s MET 12 N 1.61 2.93 0.30 0.00 -1.94 -0.18 -1.33 119.30 120.68 1a1m s MET 12 Ca 0.05 -0.83 -0.07 0.00 -1.71 0.00 0.00 55.69 53.12 1a1m s MET 12 Cb -0.13 -2.29 -0.06 0.00 2.01 0.00 0.00 34.83 34.36 1a1m s MET 12 CO -0.09 0.08 0.60 -1.54 -0.01 0.00 0.00 175.02 174.06 1a1m s SER 13 N 0.58 6.52 -0.47 3.03 1.04 -0.18 -0.93 113.70 123.28 1a1m s SER 13 Ca -0.13 0.86 0.06 0.00 0.48 0.00 0.00 55.95 57.22 1a1m s SER 13 Cb -0.17 -2.20 0.18 0.00 0.10 0.00 0.00 66.02 63.93 1a1m s SER 13 CO 0.04 -0.20 0.57 0.00 0.98 0.00 0.00 173.24 174.63 1a1m s ARG 14 N -3.39 1.01 0.17 4.02 1.70 -1.26 -3.91 118.95 117.28 1a1m s ARG 14 Ca 0.46 -1.49 -0.34 0.00 -0.47 0.00 0.00 55.73 53.90 1a1m s ARG 14 Cb -0.11 -0.60 -0.14 0.00 -0.57 0.00 0.00 34.95 33.53 1a1m s ARG 14 CO 0.27 -1.35 1.54 -2.30 -1.08 0.00 0.00 175.30 172.38 1a1m n PRO 15 N 2.91 2.07 -0.81 3.89 -0.02 -1.26 -1.42 135.00 140.35 1a1m n PRO 15 Ca 0.23 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.45 1a1m n PRO 15 Cb 0.53 -2.49 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 1a1m n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1a1m n GLY 16 N 3.17 0.76 2.22 -1.23 0.00 -1.26 -4.89 105.19 103.97 1a1m n GLY 16 Ca 0.16 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.16 1a1m n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a1m n ARG 17 N -2.37 1.58 0.00 1.61 1.74 -0.51 -5.12 116.66 113.59 1a1m n ARG 17 Ca 0.00 -3.22 0.00 0.00 -0.77 0.00 0.00 57.85 53.86 1a1m n ARG 17 Cb 0.00 -1.31 0.00 0.00 -1.02 0.00 0.00 32.46 30.13 1a1m n ARG 17 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1a1m n GLY 18 N -0.38 -3.21 3.83 -0.13 0.00 -1.25 -4.91 105.19 99.14 1a1m n GLY 18 Ca 0.13 -1.97 -0.31 0.00 0.00 0.00 0.00 46.02 43.86 1a1m n GLY 18 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1a1m s GLU 19 N -0.65 3.29 0.50 1.61 0.41 -1.26 -4.60 118.70 117.99 1a1m s GLU 19 Ca 0.00 0.95 -0.23 0.00 -0.41 0.00 0.00 54.97 55.28 1a1m s GLU 19 Cb 0.00 -2.04 -0.06 0.00 -1.78 0.00 0.00 34.13 30.25 1a1m s GLU 19 CO 0.00 -0.82 1.34 -2.14 -0.49 0.00 0.00 175.26 173.15 1a1m s PRO 20 N -4.78 3.42 0.02 0.39 0.02 -1.26 -4.77 135.00 128.03 1a1m s PRO 20 Ca 0.58 2.21 -0.21 0.00 0.02 0.00 0.00 61.00 63.60 1a1m s PRO 20 Cb -0.13 -2.41 -0.06 0.00 0.02 0.00 0.00 34.50 31.92 1a1m s PRO 20 CO 0.49 -0.96 0.63 0.50 -0.33 0.00 0.00 177.00 177.33 1a1m s ARG 21 N -2.72 4.35 -0.18 5.54 3.52 -0.11 -4.89 118.95 124.46 1a1m s ARG 21 Ca 0.67 0.81 0.01 0.00 -0.13 0.00 0.00 55.73 57.09 1a1m s ARG 21 Cb -0.39 -3.34 0.02 0.00 -1.56 0.00 0.00 34.95 29.68 1a1m s ARG 21 CO 0.48 0.38 -0.19 0.12 -0.81 0.00 0.00 175.30 175.28 1a1m s PHE 22 N -0.27 2.80 -0.04 5.12 5.36 -1.26 -1.01 117.98 128.69 1a1m s PHE 22 Ca 0.32 -1.66 0.07 0.00 -0.96 0.00 0.00 56.93 54.70 1a1m s PHE 22 Cb -0.19 -1.92 -0.01 0.00 -0.34 0.00 0.00 43.02 40.55 1a1m s PHE 22 CO 0.19 -0.81 -0.25 0.42 -1.46 0.00 0.00 175.22 173.31 1a1m s ILE 23 N 1.29 2.02 -0.08 3.12 1.09 -0.47 -1.44 121.20 126.73 1a1m s ILE 23 Ca 0.04 -1.07 0.01 0.00 -1.10 0.00 0.00 60.65 58.54 1a1m s ILE 23 Cb -0.13 -1.70 0.02 0.00 -1.06 0.00 0.00 42.46 39.59 1a1m s ILE 23 CO -0.12 0.57 -0.10 0.00 -0.10 0.00 0.00 174.94 175.18 1a1m s ALA 24 N -0.35 1.23 0.09 9.38 0.00 -0.39 -1.47 121.76 130.24 1a1m s ALA 24 Ca 0.02 -0.42 0.09 0.00 0.00 0.00 0.00 51.96 51.65 1a1m s ALA 24 Cb -0.12 -0.65 -0.03 0.00 0.00 0.00 0.00 23.12 22.31 1a1m s ALA 24 CO 0.02 -0.05 -0.23 0.14 0.00 0.00 0.00 175.76 175.64 1a1m s VAL 25 N 0.98 1.92 0.06 0.00 -7.23 -0.87 -0.51 120.40 114.74 1a1m s VAL 25 Ca -0.09 -1.52 0.09 0.00 -1.81 0.00 0.00 61.98 58.65 1a1m s VAL 25 Cb -0.15 -1.70 -0.03 0.00 0.56 0.00 0.00 36.38 35.06 1a1m s VAL 25 CO 0.00 0.09 -0.25 -0.83 -0.31 0.00 0.00 175.10 173.80 1a1m s GLY 26 N -1.73 1.34 0.09 2.32 0.00 -1.06 -1.65 107.32 106.63 1a1m s GLY 26 Ca 0.09 -1.23 0.01 0.00 0.00 0.00 0.00 44.72 43.59 1a1m s GLY 26 CO 0.04 -1.14 -0.05 -0.19 0.00 0.00 0.00 173.10 171.76 1a1m s TYR 27 N -0.84 0.80 -0.15 1.90 1.51 0.07 -1.22 117.35 119.43 1a1m s TYR 27 Ca 0.11 -0.98 -0.02 0.00 -1.01 0.00 0.00 57.07 55.16 1a1m s TYR 27 Cb -0.10 -0.49 0.05 0.00 -0.11 0.00 0.00 41.96 41.31 1a1m s TYR 27 CO 0.02 -0.23 0.03 0.08 -1.11 0.00 0.00 175.55 174.34 1a1m s VAL 28 N -3.73 0.44 0.00 0.71 1.01 -0.88 -1.28 120.40 116.68 1a1m s VAL 28 Ca 0.12 -0.31 0.00 0.00 0.00 0.00 0.00 61.98 61.79 1a1m s VAL 28 Cb 0.06 -0.84 0.00 0.00 0.00 0.00 0.00 36.38 35.60 1a1m s VAL 28 CO -0.05 -0.05 0.00 0.47 0.00 0.00 0.00 175.10 175.46 1a1m n ASP 29 N 5.10 0.00 -2.17 3.32 8.00 0.29 -1.24 116.55 129.84 1a1m n ASP 29 Ca -0.08 0.00 -0.23 0.00 0.71 0.00 0.00 54.79 55.19 1a1m n ASP 29 Cb 0.48 0.00 0.17 0.00 -0.02 0.00 0.00 41.12 41.75 1a1m n ASP 29 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1a1m n ASP 30 N 2.59 3.79 -4.24 -2.24 8.00 -1.26 -4.88 116.55 118.31 1a1m n ASP 30 Ca 0.00 -3.53 -0.35 0.00 0.71 0.00 0.00 54.79 51.62 1a1m n ASP 30 Cb 0.00 -0.83 -0.14 0.00 -0.02 0.00 0.00 41.12 40.13 1a1m n ASP 30 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1a1m s THR 31 N -3.16 3.00 0.34 -3.53 2.01 -0.37 -5.03 115.64 108.89 1a1m s THR 31 Ca 0.54 -0.78 -0.26 0.00 0.31 0.00 0.00 61.69 61.50 1a1m s THR 31 Cb 0.46 -2.42 -0.10 0.00 0.01 0.00 0.00 72.50 70.45 1a1m s THR 31 CO 0.10 0.34 0.99 -1.58 -0.69 0.00 0.00 174.62 173.78 1a1m s GLN 32 N 1.39 4.47 0.00 4.92 0.74 -1.26 -2.07 119.66 127.85 1a1m s GLN 32 Ca 0.03 1.45 0.00 0.00 0.05 0.00 0.00 55.36 56.89 1a1m s GLN 32 Cb -0.15 -2.78 0.00 0.00 1.10 0.00 0.00 33.01 31.17 1a1m s GLN 32 CO -0.05 0.15 0.00 1.97 -0.55 0.00 0.00 175.29 176.81 1a1m n PHE 33 N 0.47 0.00 -4.12 1.67 -1.74 -0.35 -4.10 117.46 109.28 1a1m n PHE 33 Ca 0.02 0.00 -0.09 0.00 -0.56 0.00 0.00 57.45 56.83 1a1m n PHE 33 Cb 0.49 0.00 -0.10 0.00 1.52 0.00 0.00 39.48 41.39 1a1m n PHE 33 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 1a1m s VAL 34 N -0.57 0.17 -0.01 1.97 -7.23 -1.22 -1.31 120.40 112.19 1a1m s VAL 34 Ca 0.00 -1.87 -0.21 0.00 -1.81 0.00 0.00 61.98 58.09 1a1m s VAL 34 Cb 0.00 -1.81 0.04 0.00 0.56 0.00 0.00 36.38 35.17 1a1m s VAL 34 CO 0.00 -0.70 0.46 0.00 -0.31 0.00 0.00 175.10 174.55 1a1m s ARG 35 N -3.99 0.86 -0.17 4.82 1.70 -0.95 -2.55 118.95 118.68 1a1m s ARG 35 Ca 0.17 -0.07 -0.10 0.00 -0.47 0.00 0.00 55.73 55.25 1a1m s ARG 35 Cb 0.08 0.39 0.05 0.00 -0.57 0.00 0.00 34.95 34.90 1a1m s ARG 35 CO -0.03 -0.27 0.41 0.12 -1.08 0.00 0.00 175.30 174.45 1a1m s PHE 36 N -1.53 -0.57 -0.05 5.89 2.19 0.33 -0.66 117.98 123.58 1a1m s PHE 36 Ca -0.11 1.25 -0.02 0.00 0.33 0.00 0.00 56.93 58.38 1a1m s PHE 36 Cb -0.02 0.24 0.03 0.00 -1.31 0.00 0.00 43.02 41.96 1a1m s PHE 36 CO 0.05 -0.31 0.04 0.34 1.83 0.00 0.00 175.22 177.16 1a1m s ASP 37 N 1.12 1.27 0.48 6.13 -1.08 -1.26 -1.27 116.67 122.06 1a1m s ASP 37 Ca -0.07 0.02 0.30 0.00 -0.52 0.00 0.00 52.55 52.28 1a1m s ASP 37 Cb -0.07 -0.24 1.16 0.00 -1.46 0.00 0.00 42.92 42.31 1a1m s ASP 37 CO -0.10 -0.23 1.89 0.77 0.52 0.00 0.00 175.17 178.02 1a1m h SER 38 N 8.37 0.00 -0.15 -0.34 4.64 -1.64 -3.05 113.55 121.38 1a1m h SER 38 Ca -0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 1a1m h SER 38 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 1a1m h SER 38 CO 0.20 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 176.63 1a1m n ASP 39 N -2.91 1.40 -4.84 4.97 9.92 -1.26 -4.82 116.55 119.01 1a1m n ASP 39 Ca 0.01 -2.09 -0.32 0.00 -0.53 0.00 0.00 54.79 51.87 1a1m n ASP 39 Cb 0.32 -0.30 -0.06 0.00 -0.64 0.00 0.00 41.12 40.45 1a1m n ASP 39 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1a1m s ALA 40 N -1.62 3.76 0.03 2.24 0.00 -1.15 -5.05 121.76 119.97 1a1m s ALA 40 Ca 0.12 -0.89 -0.30 0.00 0.00 0.00 0.00 51.96 50.88 1a1m s ALA 40 Cb 0.07 -1.65 -0.06 0.00 0.00 0.00 0.00 23.12 21.49 1a1m s ALA 40 CO 0.06 0.76 1.33 0.00 0.00 0.00 0.00 175.76 177.91 1a1m s ALA 41 N -1.37 3.54 -0.71 0.00 0.00 -1.26 -3.24 121.76 118.72 1a1m s ALA 41 Ca 0.29 0.89 -0.00 0.00 0.00 0.00 0.00 51.96 53.14 1a1m s ALA 41 Cb -0.12 -3.54 -0.00 0.00 0.00 0.00 0.00 23.12 19.45 1a1m s ALA 41 CO 0.21 -0.74 0.67 0.45 0.00 0.00 0.00 175.76 176.35 1a1m n SER 42 N 4.79 -7.40 -4.70 0.00 2.88 -1.26 -4.92 113.62 103.02 1a1m n SER 42 Ca 0.12 -0.10 -0.42 0.00 -1.33 0.00 0.00 58.87 57.14 1a1m n SER 42 Cb 0.44 -5.05 -0.03 0.00 -0.75 0.00 0.00 64.21 58.83 1a1m n SER 42 CO 0.00 0.00 0.00 -2.84 -1.23 0.00 0.00 175.04 170.97 1a1m s PRO 43 N -3.06 4.29 0.16 -1.46 0.02 -1.20 -5.00 135.00 128.75 1a1m s PRO 43 Ca 0.02 2.05 -0.16 0.00 0.02 0.00 0.00 61.00 62.93 1a1m s PRO 43 Cb -0.00 -3.46 0.03 0.00 0.02 0.00 0.00 34.50 31.09 1a1m s PRO 43 CO 0.70 -0.54 0.46 -0.98 -0.33 0.00 0.00 177.00 176.31 1a1m s ARG 44 N 1.96 1.23 -0.02 5.54 1.70 -1.26 -5.03 118.95 123.07 1a1m s ARG 44 Ca 0.65 -0.81 -0.29 0.00 -0.47 0.00 0.00 55.73 54.81 1a1m s ARG 44 Cb -0.34 0.49 -0.03 0.00 -0.57 0.00 0.00 34.95 34.50 1a1m s ARG 44 CO 0.29 -0.50 0.94 0.95 -1.08 0.00 0.00 175.30 175.89 1a1m s THR 45 N -3.85 4.89 0.14 4.99 -4.23 -1.26 -4.58 115.64 111.74 1a1m s THR 45 Ca 0.07 1.95 0.08 0.00 -1.18 0.00 0.00 61.69 62.61 1a1m s THR 45 Cb 0.00 -4.27 -0.04 0.00 1.34 0.00 0.00 72.50 69.53 1a1m s THR 45 CO -0.07 0.16 -0.09 -1.61 -0.54 0.00 0.00 174.62 172.48 1a1m s GLU 46 N 1.08 2.13 0.18 3.99 2.02 0.16 -4.93 118.70 123.34 1a1m s GLU 46 Ca 0.49 -1.13 -0.30 0.00 0.02 0.00 0.00 54.97 54.05 1a1m s GLU 46 Cb -0.20 -2.26 -0.07 0.00 0.10 0.00 0.00 34.13 31.70 1a1m s GLU 46 CO 0.25 0.47 1.00 -1.25 0.02 0.00 0.00 175.26 175.76 1a1m s PRO 47 N -2.53 4.71 0.00 0.39 0.04 -1.26 -2.23 135.00 134.12 1a1m s PRO 47 Ca 0.23 1.56 0.01 0.00 0.04 0.00 0.00 61.00 62.84 1a1m s PRO 47 Cb -0.10 -3.31 0.01 0.00 0.04 0.00 0.00 34.50 31.14 1a1m s PRO 47 CO 0.15 0.27 0.65 0.54 0.04 0.00 0.00 177.00 178.65 1a1m n ARG 48 N 2.19 0.14 -3.85 4.56 5.12 -0.43 -4.93 116.66 119.46 1a1m n ARG 48 Ca 0.01 -0.81 -0.11 0.00 -1.93 0.00 0.00 57.85 55.01 1a1m n ARG 48 Cb 0.47 -1.01 -0.09 0.00 -1.16 0.00 0.00 32.46 30.67 1a1m n ARG 48 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1a1m s PRO 49 N -0.31 0.59 0.26 5.56 0.04 -1.26 -4.63 135.00 135.25 1a1m s PRO 49 Ca 0.01 -0.48 -0.02 0.00 0.04 0.00 0.00 61.00 60.55 1a1m s PRO 49 Cb 0.01 0.24 0.50 0.00 0.04 0.00 0.00 34.50 35.29 1a1m s PRO 49 CO 0.01 -0.15 1.77 -1.35 0.04 0.00 0.00 177.00 177.32 1a1m h PRO 50 N 3.89 0.64 0.00 0.56 0.11 -1.97 -3.10 132.00 132.14 1a1m h PRO 50 Ca -0.31 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1a1m h PRO 50 Cb 1.19 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1a1m h PRO 50 CO 0.44 0.42 0.00 0.11 -0.21 0.00 0.00 178.00 178.76 1a1m h TRP 51 N 0.66 0.00 0.00 0.65 5.08 -1.98 -3.17 115.95 117.19 1a1m h TRP 51 Ca 0.45 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.42 1a1m h TRP 51 Cb 0.58 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.74 1a1m h TRP 51 CO -0.08 0.00 -0.77 0.97 -1.28 0.00 0.00 178.44 177.28 1a1m h ILE 52 N 0.00 0.00 0.00 0.12 6.09 -1.89 -3.36 117.51 118.46 1a1m h ILE 52 Ca 0.00 -0.83 -0.00 0.00 -1.37 0.00 0.00 64.86 62.66 1a1m h ILE 52 Cb 0.41 1.41 -0.00 0.00 0.47 0.00 0.00 36.82 39.12 1a1m h ILE 52 CO 0.00 0.00 -0.00 -0.33 -3.07 0.00 0.00 178.15 174.75 1a1m h GLU 53 N 0.00 0.00 0.00 2.19 5.08 -1.69 -1.19 114.58 118.97 1a1m h GLU 53 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1a1m h GLU 53 Cb 0.92 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.17 1a1m h GLU 53 CO 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.01 1a1m n GLN 54 N -4.36 0.01 -2.06 2.33 10.64 -1.26 -4.80 117.38 117.88 1a1m n GLN 54 Ca -0.03 0.24 -0.41 0.00 -1.83 0.00 0.00 57.00 54.97 1a1m n GLN 54 Cb 0.09 -1.52 -0.02 0.00 -0.86 0.00 0.00 30.24 27.93 1a1m n GLN 54 CO 0.00 0.00 0.00 -1.21 -1.83 0.00 0.00 177.06 174.02 1a1m s GLU 55 N -3.02 4.31 1.23 2.61 0.41 -0.45 -4.99 118.70 118.79 1a1m s GLU 55 Ca 0.07 2.27 -0.15 0.00 -0.41 0.00 0.00 54.97 56.75 1a1m s GLU 55 Cb 0.10 -3.08 0.30 0.00 -1.78 0.00 0.00 34.13 29.67 1a1m s GLU 55 CO 0.29 -0.30 1.01 0.20 -0.49 0.00 0.00 175.26 175.97 1a1m s GLY 56 N -0.12 1.51 0.21 -1.39 0.00 -1.26 -4.87 107.32 101.40 1a1m s GLY 56 Ca 0.53 -0.38 -0.09 0.00 0.00 0.00 0.00 44.72 44.78 1a1m s GLY 56 CO 0.50 0.42 1.84 -0.56 0.00 0.00 0.00 173.10 175.30 1a1m h PRO 57 N -2.79 1.11 0.00 2.90 0.13 -1.98 -2.26 132.00 129.10 1a1m h PRO 57 Ca -0.57 -0.12 -0.01 0.00 -0.87 0.00 0.00 66.00 64.43 1a1m h PRO 57 Cb 1.34 -0.22 -0.00 0.00 0.13 0.00 0.00 31.00 32.25 1a1m h PRO 57 CO 0.46 0.81 -0.03 0.93 -0.23 0.00 0.00 178.00 179.93 1a1m h GLU 58 N 1.11 0.00 -0.07 0.86 5.08 -1.99 -1.50 114.58 118.06 1a1m h GLU 58 Ca 0.28 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.60 1a1m h GLU 58 Cb 0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.26 1a1m h GLU 58 CO -0.05 0.03 -0.13 -0.92 -1.00 0.00 0.00 179.01 176.94 1a1m h TYR 59 N 0.00 0.27 -0.10 4.33 5.03 -1.75 -1.02 116.97 123.73 1a1m h TYR 59 Ca -0.00 -0.09 -0.07 0.00 2.58 0.00 0.00 58.73 61.14 1a1m h TYR 59 Cb 0.10 -0.05 -0.01 0.00 1.55 0.00 0.00 36.73 38.32 1a1m h TYR 59 CO 0.00 0.72 -0.27 -1.49 -1.32 0.00 0.00 178.16 175.80 1a1m h TRP 60 N -0.26 0.20 -0.01 -3.82 4.06 -1.32 -0.56 115.95 114.24 1a1m h TRP 60 Ca 0.00 -0.04 -0.09 0.00 2.06 0.00 0.00 58.89 60.83 1a1m h TRP 60 Cb 0.70 -0.05 0.01 0.00 -1.00 0.00 0.00 29.16 28.82 1a1m h TRP 60 CO 0.11 0.44 -0.33 -0.44 -3.56 0.00 0.00 178.44 174.66 1a1m h ASP 61 N 0.16 0.31 -0.54 -3.49 3.32 -1.32 -1.01 116.42 113.85 1a1m h ASP 61 Ca 0.03 -0.75 0.10 0.00 0.02 0.00 0.00 57.03 56.43 1a1m h ASP 61 Cb 0.56 -0.09 -0.08 0.00 0.22 0.00 0.00 39.33 39.94 1a1m h ASP 61 CO 0.04 1.01 0.08 -0.09 -1.72 0.00 0.00 179.24 178.56 1a1m h ARG 62 N -0.36 0.20 0.52 3.56 1.12 -0.90 0.27 114.38 118.80 1a1m h ARG 62 Ca -0.04 -0.01 -0.03 0.00 -1.11 0.00 0.00 59.98 58.80 1a1m h ARG 62 Cb 1.05 -0.05 0.01 0.00 -0.01 0.00 0.00 29.97 30.97 1a1m h ARG 62 CO 0.06 0.13 -0.25 -0.91 -3.11 0.00 0.00 179.97 175.90 1a1m h ASN 63 N 0.21 -0.60 -0.58 -3.80 2.35 -1.09 -2.48 115.58 109.60 1a1m h ASN 63 Ca 0.28 -0.03 0.09 0.00 -0.55 0.00 0.00 56.30 56.09 1a1m h ASN 63 Cb 0.41 0.15 -0.07 0.00 0.05 0.00 0.00 38.32 38.86 1a1m h ASN 63 CO -0.39 -0.34 0.18 0.74 -1.65 0.00 0.00 177.43 175.97 1a1m h THR 64 N -0.83 0.75 0.00 2.81 2.02 -0.80 -1.36 112.91 115.50 1a1m h THR 64 Ca -0.07 -0.12 -0.02 0.00 0.77 0.00 0.00 66.41 66.97 1a1m h THR 64 Cb 0.59 0.37 -0.00 0.00 -1.74 0.00 0.00 68.15 67.37 1a1m h THR 64 CO 0.12 0.06 -0.10 -0.61 0.37 0.00 0.00 175.52 175.36 1a1m h GLN 65 N 0.35 0.00 0.01 6.66 5.75 -0.86 0.92 115.11 127.92 1a1m h GLN 65 Ca 0.29 0.00 -0.09 0.00 -0.15 0.00 0.00 58.65 58.70 1a1m h GLN 65 Cb 0.37 0.00 0.01 0.00 1.07 0.00 0.00 27.48 28.93 1a1m h GLN 65 CO -0.32 0.10 -0.36 0.82 -2.65 0.00 0.00 178.83 176.42 1a1m h ILE 66 N 0.00 1.52 -0.05 2.39 2.04 -0.81 -2.84 117.51 119.76 1a1m h ILE 66 Ca -0.00 -2.02 -0.10 0.00 1.00 0.00 0.00 64.86 63.73 1a1m h ILE 66 Cb 0.19 2.77 -0.01 0.00 -0.74 0.00 0.00 36.82 39.02 1a1m h ILE 66 CO 0.01 0.56 -0.45 -0.26 0.00 0.00 0.00 178.15 178.02 1a1m h PHE 67 N -0.41 0.13 -0.17 1.37 0.04 -0.94 0.61 116.94 117.57 1a1m h PHE 67 Ca -0.05 -0.04 -0.04 0.00 2.80 0.00 0.00 57.97 60.64 1a1m h PHE 67 Cb 1.12 -0.03 -0.00 0.00 2.20 0.00 0.00 35.95 39.23 1a1m h PHE 67 CO 0.18 0.55 -0.06 0.87 -0.60 0.00 0.00 178.31 179.24 1a1m h LYS 68 N 0.09 0.34 -0.74 1.51 1.57 -0.92 -1.15 116.57 117.29 1a1m h LYS 68 Ca 0.00 -0.14 -0.00 0.00 -1.87 0.00 0.00 60.65 58.64 1a1m h LYS 68 Cb 0.83 -0.02 -0.04 0.00 0.08 0.00 0.00 32.23 33.09 1a1m h LYS 68 CO 0.06 0.63 0.45 1.15 -0.57 0.00 0.00 179.45 181.17 1a1m h THR 69 N 0.04 1.21 0.00 -0.16 2.02 -1.22 -0.54 112.91 114.25 1a1m h THR 69 Ca 0.04 -0.45 -0.06 0.00 0.77 0.00 0.00 66.41 66.71 1a1m h THR 69 Cb 0.51 0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 67.07 1a1m h THR 69 CO 0.02 0.21 -0.29 0.78 0.37 0.00 0.00 175.52 176.61 1a1m h ASN 70 N 1.02 0.00 -0.17 4.18 -0.26 -0.64 -2.30 115.58 117.41 1a1m h ASN 70 Ca 0.27 0.00 -0.02 0.00 -0.56 0.00 0.00 56.30 55.99 1a1m h ASN 70 Cb -0.05 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.21 1a1m h ASN 70 CO -0.05 0.29 0.05 0.74 -1.06 0.00 0.00 177.43 177.40 1a1m h THR 71 N 0.00 1.19 -0.44 2.81 2.02 0.19 -0.48 112.91 118.21 1a1m h THR 71 Ca -0.00 -0.61 -0.02 0.00 0.77 0.00 0.00 66.41 66.55 1a1m h THR 71 Cb 0.66 1.28 -0.02 0.00 -1.74 0.00 0.00 68.15 68.33 1a1m h THR 71 CO 0.04 0.19 0.21 1.56 0.37 0.00 0.00 175.52 177.88 1a1m h GLN 72 N 0.09 0.64 0.04 6.66 1.08 -1.23 -2.56 115.11 119.84 1a1m h GLN 72 Ca 0.05 -0.10 -0.00 0.00 -1.45 0.00 0.00 58.65 57.15 1a1m h GLN 72 Cb 0.25 -0.11 0.00 0.00 -0.05 0.00 0.00 27.48 27.56 1a1m h GLN 72 CO -0.00 0.56 -0.02 1.15 -0.95 0.00 0.00 178.83 179.57 1a1m h THR 73 N 0.57 1.05 0.00 -0.54 2.02 -1.38 -2.33 112.91 112.29 1a1m h THR 73 Ca 0.15 -0.28 0.00 0.00 0.77 0.00 0.00 66.41 67.05 1a1m h THR 73 Cb 0.13 1.23 0.00 0.00 -1.74 0.00 0.00 68.15 67.78 1a1m h THR 73 CO -0.02 0.07 0.00 1.88 0.37 0.00 0.00 175.52 177.82 1a1m h TYR 74 N -0.18 0.00 -0.11 3.16 -1.99 -1.05 0.45 116.97 117.26 1a1m h TYR 74 Ca -0.01 0.00 -0.19 0.00 2.00 0.00 0.00 58.73 60.53 1a1m h TYR 74 Cb 0.16 0.00 0.01 0.00 2.00 0.00 0.00 36.73 38.90 1a1m h TYR 74 CO -0.03 0.00 -0.69 0.00 -0.00 0.00 0.00 178.16 177.43 1a1m h ARG 75 N 0.00 0.66 -0.35 4.88 3.08 -1.02 -1.88 114.38 119.75 1a1m h ARG 75 Ca 0.00 -0.57 -0.05 0.00 0.07 0.00 0.00 59.98 59.43 1a1m h ARG 75 Cb 0.28 0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 1a1m h ARG 75 CO 0.00 1.18 0.02 0.93 -1.07 0.00 0.00 179.97 181.03 1a1m h GLU 76 N 0.32 0.60 -0.61 0.04 5.08 -0.80 -2.91 114.58 116.30 1a1m h GLU 76 Ca -0.06 -0.18 0.02 0.00 -1.00 0.00 0.00 59.36 58.14 1a1m h GLU 76 Cb 1.34 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.50 1a1m h GLU 76 CO 0.14 0.71 0.40 -0.91 -1.00 0.00 0.00 179.01 178.35 1a1m h ASN 77 N 0.42 0.67 0.15 1.42 2.35 -0.87 0.13 115.58 119.86 1a1m h ASN 77 Ca 0.10 -0.01 -0.08 0.00 -0.55 0.00 0.00 56.30 55.75 1a1m h ASN 77 Cb 0.42 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.62 1a1m h ASN 77 CO 0.01 0.47 -0.30 -0.07 -1.65 0.00 0.00 177.43 175.90 1a1m h LEU 78 N 0.78 0.23 -0.01 1.61 3.38 -1.18 0.70 115.31 120.83 1a1m h LEU 78 Ca 0.23 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.11 1a1m h LEU 78 Cb -0.02 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.67 1a1m h LEU 78 CO -0.06 0.53 -0.08 0.03 0.09 0.00 0.00 178.44 178.96 1a1m h ARG 79 N 0.21 0.07 -0.31 1.13 3.08 -1.12 -3.15 114.38 114.29 1a1m h ARG 79 Ca 0.03 -0.06 0.06 0.00 0.07 0.00 0.00 59.98 60.08 1a1m h ARG 79 Cb 0.64 0.01 -0.06 0.00 0.08 0.00 0.00 29.97 30.64 1a1m h ARG 79 CO 0.05 0.75 -0.07 0.82 -1.07 0.00 0.00 179.97 180.45 1a1m h ILE 80 N -0.59 0.70 -0.20 2.04 2.04 -0.92 -1.31 117.51 119.27 1a1m h ILE 80 Ca -0.01 -0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.91 1a1m h ILE 80 Cb 0.77 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 37.53 1a1m h ILE 80 CO 0.02 0.00 0.32 0.00 0.00 0.00 0.00 178.15 178.49 1a1m h ALA 81 N 1.31 1.72 -0.01 1.87 0.00 -0.90 0.27 119.26 123.52 1a1m h ALA 81 Ca 0.15 -0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.86 1a1m h ALA 81 Cb 0.23 0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.05 1a1m h ALA 81 CO -0.31 -0.42 -0.76 -0.07 0.00 0.00 0.00 179.25 177.69 1a1m h LEU 82 N 0.00 0.68 0.78 0.00 3.38 -1.19 -3.00 115.31 115.96 1a1m h LEU 82 Ca 0.09 -0.75 -0.03 0.00 0.09 0.00 0.00 57.88 57.28 1a1m h LEU 82 Cb 0.73 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 1a1m h LEU 82 CO -0.00 1.34 -0.50 0.03 0.09 0.00 0.00 178.44 179.40 1a1m h ARG 83 N 0.09 -1.16 -1.42 1.13 3.08 -0.85 0.75 114.38 116.01 1a1m h ARG 83 Ca -0.09 0.08 0.42 0.00 0.07 0.00 0.00 59.98 60.45 1a1m h ARG 83 Cb 1.45 0.26 -0.08 0.00 0.08 0.00 0.00 29.97 31.68 1a1m h ARG 83 CO 0.15 -0.77 0.99 1.88 -1.07 0.00 0.00 179.97 181.15 1a1m h TYR 84 N -1.21 0.17 -0.20 3.04 -1.99 -1.47 0.18 116.97 115.50 1a1m h TYR 84 Ca -0.10 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.63 1a1m h TYR 84 Cb 0.97 -0.05 0.00 0.00 2.00 0.00 0.00 36.73 39.66 1a1m h TYR 84 CO -0.12 -0.03 0.00 0.66 -0.00 0.00 0.00 178.16 178.67 1a1m n TYR 85 N -4.26 0.30 -3.72 4.88 4.01 -1.11 -4.74 117.16 112.52 1a1m n TYR 85 Ca 0.33 -0.53 -0.25 0.00 -0.16 0.00 0.00 57.90 57.29 1a1m n TYR 85 Cb 1.46 -0.05 0.05 0.00 -0.31 0.00 0.00 39.34 40.48 1a1m n TYR 85 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1a1m n ASN 86 N 0.04 -3.86 -4.90 7.72 3.02 0.63 -4.97 115.26 112.94 1a1m n ASN 86 Ca 0.08 -0.71 -0.31 0.00 -0.03 0.00 0.00 54.58 53.60 1a1m n ASN 86 Cb 0.39 -4.36 -0.04 0.00 -0.61 0.00 0.00 39.78 35.15 1a1m n ASN 86 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1a1m s GLN 87 N -6.22 3.37 0.78 3.52 -0.21 -0.06 -5.03 119.66 115.81 1a1m s GLN 87 Ca 0.39 -0.45 -0.11 0.00 0.02 0.00 0.00 55.36 55.20 1a1m s GLN 87 Cb -0.19 -3.01 0.07 0.00 1.00 0.00 0.00 33.01 30.88 1a1m s GLN 87 CO 0.79 0.61 1.12 0.45 -2.12 0.00 0.00 175.29 176.14 1a1m s SER 88 N -2.41 4.22 -0.05 5.90 0.15 -1.26 -4.72 113.70 115.53 1a1m s SER 88 Ca 0.33 1.97 0.08 0.00 0.70 0.00 0.00 55.95 59.04 1a1m s SER 88 Cb -0.13 -2.54 0.32 0.00 -1.71 0.00 0.00 66.02 61.96 1a1m s SER 88 CO 0.26 -2.23 1.14 -0.62 1.20 0.00 0.00 173.24 172.99 1a1m n GLU 89 N -3.44 2.22 -0.04 5.44 1.02 -1.26 -3.89 120.64 120.68 1a1m n GLU 89 Ca 0.10 -1.27 0.02 0.00 -0.02 0.00 0.00 57.16 56.00 1a1m n GLU 89 Cb 0.52 -1.54 -0.14 0.00 -0.02 0.00 0.00 31.44 30.26 1a1m n GLU 89 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1a1m n ALA 90 N 0.36 2.24 -2.04 0.62 0.00 -1.26 -4.85 120.51 115.58 1a1m n ALA 90 Ca 0.11 -0.75 -0.30 0.00 0.00 0.00 0.00 53.44 52.51 1a1m n ALA 90 Cb 0.46 -0.44 -0.01 0.00 0.00 0.00 0.00 19.45 19.46 1a1m n ALA 90 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1a1m s GLY 91 N -4.60 1.76 -0.13 0.00 0.00 -1.25 -4.75 107.32 98.36 1a1m s GLY 91 Ca -0.08 -0.17 -0.13 0.00 0.00 0.00 0.00 44.72 44.34 1a1m s GLY 91 CO 0.77 0.05 0.28 -0.45 0.00 0.00 0.00 173.10 173.75 1a1m s SER 92 N -3.71 6.48 0.08 1.64 0.15 -1.26 -4.66 113.70 112.42 1a1m s SER 92 Ca 0.53 0.57 0.01 0.00 0.70 0.00 0.00 55.95 57.76 1a1m s SER 92 Cb -0.10 -2.17 -0.04 0.00 -1.71 0.00 0.00 66.02 61.99 1a1m s SER 92 CO 0.42 0.19 -0.06 -1.00 1.20 0.00 0.00 173.24 174.00 1a1m s HIS 93 N -0.05 0.77 -0.04 3.44 3.76 -1.25 -4.96 115.29 116.96 1a1m s HIS 93 Ca 0.17 -0.93 0.03 0.00 -0.15 0.00 0.00 55.06 54.18 1a1m s HIS 93 Cb -0.13 -0.47 0.00 0.00 1.11 0.00 0.00 32.58 33.09 1a1m s HIS 93 CO 0.05 -0.21 -0.12 0.42 -0.85 0.00 0.00 174.74 174.03 1a1m s ILE 94 N -3.55 1.09 -0.10 0.60 1.01 -1.26 -1.01 121.20 117.97 1a1m s ILE 94 Ca 0.09 -0.50 0.01 0.00 0.00 0.00 0.00 60.65 60.25 1a1m s ILE 94 Cb 0.05 -0.96 -0.02 0.00 0.01 0.00 0.00 42.46 41.54 1a1m s ILE 94 CO -0.06 0.33 -0.15 -0.63 0.00 0.00 0.00 174.94 174.44 1a1m s ILE 95 N 0.29 2.94 0.02 2.92 1.01 -0.45 -0.40 121.20 127.53 1a1m s ILE 95 Ca -0.07 -0.72 0.06 0.00 0.00 0.00 0.00 60.65 59.92 1a1m s ILE 95 Cb -0.12 -2.20 -0.02 0.00 0.01 0.00 0.00 42.46 40.13 1a1m s ILE 95 CO 0.02 0.55 -0.19 -1.10 0.00 0.00 0.00 174.94 174.22 1a1m s GLN 96 N 0.06 1.37 -0.03 2.79 -0.21 -1.03 -1.15 119.66 121.46 1a1m s GLN 96 Ca -0.06 -0.80 0.01 0.00 0.02 0.00 0.00 55.36 54.53 1a1m s GLN 96 Cb -0.15 -1.41 0.02 0.00 1.00 0.00 0.00 33.01 32.47 1a1m s GLN 96 CO 0.05 0.37 -0.05 0.50 -2.12 0.00 0.00 175.29 174.04 1a1m s ARG 97 N -0.87 0.71 -0.13 2.91 3.52 -0.80 -1.01 118.95 123.28 1a1m s ARG 97 Ca 0.07 -0.12 0.03 0.00 -0.13 0.00 0.00 55.73 55.57 1a1m s ARG 97 Cb -0.08 -0.73 0.01 0.00 -1.56 0.00 0.00 34.95 32.59 1a1m s ARG 97 CO 0.01 -0.03 -0.21 -1.64 -0.81 0.00 0.00 175.30 172.61 1a1m s MET 98 N 0.67 2.92 0.08 5.12 -1.94 -0.67 -0.64 119.30 124.85 1a1m s MET 98 Ca -0.09 -0.82 -0.19 0.00 -1.71 0.00 0.00 55.69 52.88 1a1m s MET 98 Cb -0.12 -2.36 0.04 0.00 2.01 0.00 0.00 34.83 34.41 1a1m s MET 98 CO 0.00 -0.00 0.46 1.52 -0.01 0.00 0.00 175.02 176.98 1a1m s TYR 99 N 0.80 -0.31 -5.00 -0.03 -0.85 -0.68 -1.41 117.35 109.86 1a1m s TYR 99 Ca -0.08 0.19 0.00 0.00 -0.52 0.00 0.00 57.07 56.66 1a1m s TYR 99 Cb -0.16 0.30 0.00 0.00 0.38 0.00 0.00 41.96 42.48 1a1m s TYR 99 CO -0.01 -0.66 0.00 0.41 -1.52 0.00 0.00 175.55 173.77 1a1m n GLY 100 N 0.15 -2.06 3.43 5.49 0.00 -0.77 -0.19 105.19 111.24 1a1m n GLY 100 Ca -0.17 -1.43 -0.28 0.00 0.00 0.00 0.00 46.02 44.14 1a1m n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a1m s ASP 102 N -2.35 4.75 -0.17 0.00 1.01 0.18 -1.92 116.67 118.18 1a1m s ASP 102 Ca 0.18 -0.02 -0.04 0.00 0.71 0.00 0.00 52.55 53.37 1a1m s ASP 102 Cb -0.09 -1.35 -0.03 0.00 1.01 0.00 0.00 42.92 42.46 1a1m s ASP 102 CO 0.09 0.32 -0.02 -0.22 0.21 0.00 0.00 175.17 175.56 1a1m s LEU 103 N -0.57 3.35 0.35 1.23 2.96 0.16 -0.61 118.68 125.55 1a1m s LEU 103 Ca 0.09 -0.10 -0.26 0.00 -0.22 0.00 0.00 54.13 53.64 1a1m s LEU 103 Cb -0.12 -1.82 -0.09 0.00 0.50 0.00 0.00 46.19 44.66 1a1m s LEU 103 CO 0.02 0.16 1.02 -0.83 -1.32 0.00 0.00 176.35 175.40 1a1m s GLY 104 N 0.44 2.82 0.00 7.98 0.00 -0.23 -3.23 107.32 115.10 1a1m s GLY 104 Ca -0.02 0.68 -0.05 0.00 0.00 0.00 0.00 44.72 45.32 1a1m s GLY 104 CO 0.02 1.15 0.77 -1.55 0.00 0.00 0.00 173.10 173.49 1a1m n PRO 105 N 0.38 0.00 0.00 2.90 -0.04 -1.26 0.36 135.00 137.34 1a1m n PRO 105 Ca 0.03 -0.39 0.00 0.00 -0.04 0.00 0.00 63.50 63.10 1a1m n PRO 105 Cb 0.49 -1.70 0.00 0.00 -0.04 0.00 0.00 33.50 32.25 1a1m n PRO 105 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1a1m n ASP 106 N 4.81 0.00 0.00 3.54 5.75 -1.26 -5.00 116.55 124.39 1a1m n ASP 106 Ca 0.08 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.86 1a1m n ASP 106 Cb 0.09 0.19 0.00 0.00 -1.03 0.00 0.00 41.12 40.38 1a1m n ASP 106 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1a1m n GLY 107 N -1.21 1.03 3.46 6.12 0.00 0.16 -5.16 105.19 109.60 1a1m n GLY 107 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1a1m n GLY 107 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1a1m s ARG 108 N 0.00 1.67 -0.21 1.61 0.52 -1.25 -4.90 118.95 116.38 1a1m s ARG 108 Ca 0.00 -1.49 -0.34 0.00 -0.52 0.00 0.00 55.73 53.39 1a1m s ARG 108 Cb 0.00 -1.92 -0.11 0.00 0.52 0.00 0.00 34.95 33.45 1a1m s ARG 108 CO 0.00 0.40 2.04 -0.11 0.02 0.00 0.00 175.30 177.65 1a1m n LEU 109 N 0.12 2.90 0.05 2.53 7.94 -1.26 -1.07 117.00 128.22 1a1m n LEU 109 Ca -0.11 0.65 -0.21 0.00 -1.11 0.00 0.00 56.01 55.22 1a1m n LEU 109 Cb 0.56 -1.35 -0.15 0.00 0.53 0.00 0.00 43.42 43.01 1a1m n LEU 109 CO 0.32 -0.42 -0.59 0.25 -1.11 0.00 0.00 177.39 175.84 1a1m h LEU 110 N 11.22 0.52 -7.00 -1.96 5.85 -1.17 -3.45 115.31 119.32 1a1m h LEU 110 Ca -0.40 -0.87 0.18 0.00 0.84 0.00 0.00 57.88 57.63 1a1m h LEU 110 Cb 1.29 -0.17 -0.28 0.00 0.37 0.00 0.00 40.66 41.87 1a1m h LEU 110 CO 0.98 1.75 0.80 0.00 -0.34 0.00 0.00 178.44 181.62 1a1m s ARG 111 N -2.58 0.21 0.26 1.25 1.70 -1.20 -5.00 118.95 113.60 1a1m s ARG 111 Ca -0.16 0.11 0.04 0.00 -0.47 0.00 0.00 55.73 55.25 1a1m s ARG 111 Cb 0.06 0.10 -0.03 0.00 -0.57 0.00 0.00 34.95 34.51 1a1m s ARG 111 CO 0.83 -0.05 0.40 0.20 -1.08 0.00 0.00 175.30 175.60 1a1m s GLY 112 N -0.64 1.26 -0.00 3.88 0.00 -1.26 -0.64 107.32 109.90 1a1m s GLY 112 Ca 0.06 -1.19 -0.06 0.00 0.00 0.00 0.00 44.72 43.53 1a1m s GLY 112 CO -0.08 -1.19 0.11 0.30 0.00 0.00 0.00 173.10 172.24 1a1m s HIS 113 N -2.05 0.04 -0.30 1.90 3.76 0.05 -4.84 115.29 113.86 1a1m s HIS 113 Ca 0.36 -0.10 -0.09 0.00 -0.15 0.00 0.00 55.06 55.07 1a1m s HIS 113 Cb -0.09 -0.05 0.19 0.00 1.11 0.00 0.00 32.58 33.73 1a1m s HIS 113 CO 0.30 -0.23 1.01 0.34 -0.85 0.00 0.00 174.74 175.31 1a1m s ASP 114 N -1.12 -0.49 0.16 1.40 -1.08 -1.25 -1.85 116.67 112.44 1a1m s ASP 114 Ca -0.12 0.00 0.10 0.00 -0.52 0.00 0.00 52.55 52.01 1a1m s ASP 114 Cb -0.07 1.18 -0.04 0.00 -1.46 0.00 0.00 42.92 42.53 1a1m s ASP 114 CO 0.01 -0.08 -0.20 -1.10 0.52 0.00 0.00 175.17 174.32 1a1m s GLN 115 N 2.76 1.69 0.08 4.34 -0.21 -0.50 0.07 119.66 127.88 1a1m s GLN 115 Ca 0.24 -1.35 0.04 0.00 0.02 0.00 0.00 55.36 54.32 1a1m s GLN 115 Cb -0.01 -2.00 -0.03 0.00 1.00 0.00 0.00 33.01 31.97 1a1m s GLN 115 CO -0.21 0.44 -0.11 -1.12 -2.12 0.00 0.00 175.29 172.16 1a1m s SER 116 N -2.47 1.45 0.05 5.90 0.01 0.10 -1.66 113.70 117.06 1a1m s SER 116 Ca 0.20 -0.69 0.01 0.00 1.31 0.00 0.00 55.95 56.78 1a1m s SER 116 Cb -0.09 -0.01 -0.03 0.00 0.21 0.00 0.00 66.02 66.10 1a1m s SER 116 CO 0.11 -0.18 -0.06 0.00 0.41 0.00 0.00 173.24 173.52 1a1m s ALA 117 N -1.78 0.51 -0.14 1.44 0.00 -0.18 -1.44 121.76 120.17 1a1m s ALA 117 Ca -0.00 -0.85 0.00 0.00 0.00 0.00 0.00 51.96 51.11 1a1m s ALA 117 Cb -0.07 0.11 0.02 0.00 0.00 0.00 0.00 23.12 23.18 1a1m s ALA 117 CO 0.01 -0.12 -0.13 -0.47 0.00 0.00 0.00 175.76 175.05 1a1m s TYR 118 N -1.99 2.01 -1.49 0.00 5.04 0.11 -2.47 117.35 118.56 1a1m s TYR 118 Ca -0.07 -1.08 -0.13 0.00 -2.44 0.00 0.00 57.07 53.35 1a1m s TYR 118 Cb -0.06 -1.50 0.09 0.00 0.35 0.00 0.00 41.96 40.84 1a1m s TYR 118 CO -0.02 -0.61 0.76 -0.25 -1.34 0.00 0.00 175.55 174.10 1a1m n ASP 119 N 4.70 -4.27 0.00 4.32 8.00 0.46 -1.56 116.55 128.20 1a1m n ASP 119 Ca -0.17 -0.67 0.00 0.00 0.71 0.00 0.00 54.79 54.67 1a1m n ASP 119 Cb 0.50 -3.46 0.00 0.00 -0.02 0.00 0.00 41.12 38.14 1a1m n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1a1m n GLY 120 N -1.45 0.69 3.35 0.44 0.00 -1.26 -5.02 105.19 101.94 1a1m n GLY 120 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 1a1m n GLY 120 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a1m s LYS 121 N -0.17 1.93 0.41 1.61 1.02 -0.60 -5.10 119.74 118.84 1a1m s LYS 121 Ca 0.00 -1.04 -0.25 0.00 0.02 0.00 0.00 55.97 54.70 1a1m s LYS 121 Cb 0.00 -2.03 -0.10 0.00 -0.52 0.00 0.00 37.83 35.18 1a1m s LYS 121 CO 0.00 0.53 1.17 -0.25 -0.92 0.00 0.00 175.35 175.88 1a1m n ASP 122 N 1.96 2.08 0.00 2.83 8.00 -1.26 0.08 116.55 130.24 1a1m n ASP 122 Ca -0.17 1.10 0.00 0.00 0.71 0.00 0.00 54.79 56.43 1a1m n ASP 122 Cb 0.52 -1.44 0.00 0.00 -0.02 0.00 0.00 41.12 40.18 1a1m n ASP 122 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1a1m n TYR 123 N -0.23 0.00 -4.24 1.24 9.36 -0.52 -4.66 117.16 118.11 1a1m n TYR 123 Ca 0.08 0.00 -0.17 0.00 3.32 0.00 0.00 57.90 61.12 1a1m n TYR 123 Cb 0.39 0.01 -0.13 0.00 -0.63 0.00 0.00 39.34 38.97 1a1m n TYR 123 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 1a1m s ILE 124 N -0.51 0.82 -0.02 2.97 2.07 -1.22 -0.06 121.20 125.26 1a1m s ILE 124 Ca 0.00 -0.86 -0.01 0.00 -1.41 0.00 0.00 60.65 58.37 1a1m s ILE 124 Cb 0.00 -0.77 0.02 0.00 0.13 0.00 0.00 42.46 41.83 1a1m s ILE 124 CO 0.00 -0.07 0.03 0.00 -1.91 0.00 0.00 174.94 172.99 1a1m s ALA 125 N -0.84 -0.01 0.13 1.50 0.00 -0.75 0.01 121.76 121.79 1a1m s ALA 125 Ca -0.01 0.21 -0.30 0.00 0.00 0.00 0.00 51.96 51.85 1a1m s ALA 125 Cb -0.07 -0.15 -0.07 0.00 0.00 0.00 0.00 23.12 22.83 1a1m s ALA 125 CO 0.01 -0.06 1.14 -1.17 0.00 0.00 0.00 175.76 175.67 1a1m s LEU 126 N 0.54 4.44 0.76 0.00 2.96 0.11 -1.32 118.68 126.16 1a1m s LEU 126 Ca -0.04 2.06 -0.11 0.00 -0.22 0.00 0.00 54.13 55.81 1a1m s LEU 126 Cb -0.06 -3.59 0.05 0.00 0.50 0.00 0.00 46.19 43.08 1a1m s LEU 126 CO -0.02 -0.32 1.08 0.20 -1.32 0.00 0.00 176.35 175.98 1a1m s ASN 127 N 0.35 4.83 0.66 3.68 0.01 -0.59 -4.60 114.94 119.29 1a1m s ASN 127 Ca 0.53 1.43 0.44 0.00 -0.71 0.00 0.00 52.86 54.55 1a1m s ASN 127 Cb -0.29 -2.22 2.40 0.00 0.41 0.00 0.00 41.25 41.55 1a1m s ASN 127 CO 0.33 -1.77 2.37 -0.08 -1.51 0.00 0.00 177.10 176.44 1a1m h GLU 128 N -0.95 0.00 0.00 -0.60 4.81 -1.90 0.68 114.58 116.63 1a1m h GLU 128 Ca -0.46 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 1a1m h GLU 128 Cb 1.25 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.63 1a1m h GLU 128 CO 0.58 0.00 0.00 -0.40 -0.73 0.00 0.00 179.01 178.46 1a1m n ASP 129 N -3.12 0.00 -2.97 1.04 5.68 -1.26 -4.76 116.55 111.16 1a1m n ASP 129 Ca -0.03 0.21 -0.21 0.00 -0.50 0.00 0.00 54.79 54.26 1a1m n ASP 129 Cb 0.07 -0.38 0.01 0.00 -1.14 0.00 0.00 41.12 39.68 1a1m n ASP 129 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1a1m n LEU 130 N -1.38 -2.05 0.00 -2.12 4.77 0.23 -4.78 117.00 111.67 1a1m n LEU 130 Ca 0.08 -0.22 0.00 0.00 -0.03 0.00 0.00 56.01 55.84 1a1m n LEU 130 Cb 0.20 -2.61 0.00 0.00 -2.33 0.00 0.00 43.42 38.68 1a1m n LEU 130 CO 0.18 0.11 0.00 -1.20 -1.33 0.00 0.00 177.39 175.14 1a1m n SER 131 N -2.30 0.00 -4.08 -1.43 7.64 -1.26 -4.49 113.62 107.70 1a1m n SER 131 Ca -0.11 0.00 -0.20 0.00 1.01 0.00 0.00 58.87 59.57 1a1m n SER 131 Cb 0.60 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.71 1a1m n SER 131 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1a1m s SER 132 N 0.00 1.89 0.13 6.43 1.04 -1.26 -4.91 113.70 117.01 1a1m s SER 132 Ca 0.00 -1.56 0.07 0.00 0.48 0.00 0.00 55.95 54.94 1a1m s SER 132 Cb 0.00 0.35 -0.04 0.00 0.10 0.00 0.00 66.02 66.43 1a1m s SER 132 CO 0.00 -0.86 -0.15 0.26 0.98 0.00 0.00 173.24 173.47 1a1m s TRP 133 N -3.49 1.50 -0.32 5.02 0.52 -1.26 -1.54 118.94 119.37 1a1m s TRP 133 Ca 0.33 -0.53 0.03 0.00 0.02 0.00 0.00 56.10 55.95 1a1m s TRP 133 Cb 0.05 -0.78 0.09 0.00 -1.15 0.00 0.00 33.47 31.69 1a1m s TRP 133 CO 0.17 0.19 0.04 0.99 0.02 0.00 0.00 176.95 178.35 1a1m s THR 134 N -2.10 1.90 -0.02 2.01 2.01 -0.44 -4.89 115.64 114.11 1a1m s THR 134 Ca 0.10 -1.98 -0.22 0.00 0.31 0.00 0.00 61.69 59.90 1a1m s THR 134 Cb -0.05 -2.35 -0.05 0.00 0.01 0.00 0.00 72.50 70.06 1a1m s THR 134 CO 0.04 -0.52 0.66 0.00 -0.69 0.00 0.00 174.62 174.11 1a1m s ALA 135 N 1.12 3.40 -0.54 7.40 0.00 -1.26 -1.81 121.76 130.06 1a1m s ALA 135 Ca 0.08 0.11 0.26 0.00 0.00 0.00 0.00 51.96 52.40 1a1m s ALA 135 Cb -0.19 -2.87 0.77 0.00 0.00 0.00 0.00 23.12 20.84 1a1m s ALA 135 CO -0.11 0.04 1.74 0.00 0.00 0.00 0.00 175.76 177.43 1a1m h ALA 136 N 6.12 1.00 -2.71 0.00 0.00 -0.76 -3.47 119.26 119.44 1a1m h ALA 136 Ca -0.43 0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.50 1a1m h ALA 136 Cb 1.20 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 1a1m h ALA 136 CO 0.72 0.00 0.31 -0.40 0.00 0.00 0.00 179.25 179.88 1a1m n ASP 137 N -2.54 -1.81 0.27 0.00 5.68 -1.26 -5.02 116.55 111.87 1a1m n ASP 137 Ca 0.04 -2.18 0.13 0.00 -0.50 0.00 0.00 54.79 52.28 1a1m n ASP 137 Cb 0.41 2.99 0.78 0.00 -1.14 0.00 0.00 41.12 44.16 1a1m n ASP 137 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 1a1m h THR 138 N 1.83 0.62 0.01 2.12 1.35 -1.98 -1.93 112.91 114.93 1a1m h THR 138 Ca -0.27 -0.30 -0.17 0.00 -0.55 0.00 0.00 66.41 65.12 1a1m h THR 138 Cb 1.03 1.19 0.01 0.00 -1.73 0.00 0.00 68.15 68.66 1a1m h THR 138 CO 0.34 0.07 -0.66 0.00 -0.25 0.00 0.00 175.52 175.02 1a1m h ALA 139 N 1.93 0.06 0.00 6.62 0.00 -1.97 -3.16 119.26 122.74 1a1m h ALA 139 Ca -0.00 -0.59 -0.03 0.00 0.00 0.00 0.00 54.91 54.28 1a1m h ALA 139 Cb 0.18 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1a1m h ALA 139 CO 0.01 0.38 -0.16 0.00 0.00 0.00 0.00 179.25 179.48 1a1m h ALA 140 N 0.31 1.35 -0.12 0.00 0.00 -1.69 -1.55 119.26 117.56 1a1m h ALA 140 Ca -0.09 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.59 1a1m h ALA 140 Cb 1.38 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 1a1m h ALA 140 CO 0.13 0.21 -0.30 1.96 0.00 0.00 0.00 179.25 181.25 1a1m h GLN 141 N 0.00 0.23 -0.17 0.00 4.20 -1.35 0.45 115.11 118.47 1a1m h GLN 141 Ca -0.00 -0.08 -0.01 0.00 0.06 0.00 0.00 58.65 58.62 1a1m h GLN 141 Cb 0.39 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.15 1a1m h GLN 141 CO 0.02 0.51 0.07 0.82 -0.67 0.00 0.00 178.83 179.58 1a1m h ILE 142 N 0.20 1.15 -0.72 2.54 1.08 -1.26 -1.91 117.51 118.59 1a1m h ILE 142 Ca 0.03 -0.45 -0.05 0.00 -0.39 0.00 0.00 64.86 64.01 1a1m h ILE 142 Cb 0.63 1.12 -0.03 0.00 -3.07 0.00 0.00 36.82 35.47 1a1m h ILE 142 CO 0.05 0.14 0.27 0.74 -0.69 0.00 0.00 178.15 178.66 1a1m h THR 143 N 0.14 1.25 0.07 -0.27 2.02 -1.01 -2.48 112.91 112.62 1a1m h THR 143 Ca 0.06 -0.82 0.02 0.00 0.77 0.00 0.00 66.41 66.45 1a1m h THR 143 Cb 0.16 0.44 -0.05 0.00 -1.74 0.00 0.00 68.15 66.96 1a1m h THR 143 CO -0.01 0.32 -0.45 -0.61 0.37 0.00 0.00 175.52 175.15 1a1m h GLN 144 N 1.03 -0.62 0.00 6.66 4.15 0.22 -0.37 115.11 126.18 1a1m h GLN 144 Ca 0.24 0.04 -0.04 0.00 0.77 0.00 0.00 58.65 59.66 1a1m h GLN 144 Cb 0.24 0.14 -0.01 0.00 0.21 0.00 0.00 27.48 28.07 1a1m h GLN 144 CO -0.02 -0.41 -0.19 0.07 -1.93 0.00 0.00 178.83 176.35 1a1m h ARG 145 N -0.65 0.00 -0.58 1.69 0.11 -1.30 0.48 114.38 114.14 1a1m h ARG 145 Ca 0.03 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 60.02 1a1m h ARG 145 Cb 0.69 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.75 1a1m h ARG 145 CO -0.29 0.19 0.00 0.87 0.10 0.00 0.00 179.97 180.84 1a1m h LYS 146 N 0.00 1.00 -0.06 0.08 1.57 -0.95 0.46 116.57 118.67 1a1m h LYS 146 Ca -0.00 -0.30 -0.12 0.00 -1.87 0.00 0.00 60.65 58.35 1a1m h LYS 146 Cb 0.33 -0.10 0.01 0.00 0.08 0.00 0.00 32.23 32.55 1a1m h LYS 146 CO 0.02 0.98 -0.43 -1.49 -0.57 0.00 0.00 179.45 177.96 1a1m h TRP 147 N 0.92 0.55 -0.16 -1.35 4.06 0.68 -2.75 115.95 117.89 1a1m h TRP 147 Ca 0.17 -0.26 0.02 0.00 2.06 0.00 0.00 58.89 60.88 1a1m h TRP 147 Cb 0.53 -0.08 -0.02 0.00 -1.00 0.00 0.00 29.16 28.59 1a1m h TRP 147 CO 0.03 1.03 0.05 0.93 -3.56 0.00 0.00 178.44 176.92 1a1m h GLU 148 N -0.08 0.12 0.00 0.49 5.08 -0.12 0.60 114.58 120.67 1a1m h GLU 148 Ca -0.04 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1a1m h GLU 148 Cb 1.10 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.33 1a1m h GLU 148 CO 0.09 0.08 0.00 0.00 -1.00 0.00 0.00 179.01 178.18 1a1m h ALA 149 N 1.10 1.00 -0.14 3.43 0.00 -0.91 -0.00 119.26 123.74 1a1m h ALA 149 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1a1m h ALA 149 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1a1m h ALA 149 CO -0.08 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.17 1a1m n ALA 150 N -1.80 2.20 -3.83 0.00 0.00 -0.45 -5.00 120.51 111.63 1a1m n ALA 150 Ca -0.01 -0.93 -0.29 0.00 0.00 0.00 0.00 53.44 52.21 1a1m n ALA 150 Cb 0.07 -0.22 0.01 0.00 0.00 0.00 0.00 19.45 19.31 1a1m n ALA 150 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1a1m n ARG 151 N 0.12 -2.23 -0.02 0.00 1.74 0.08 -4.87 116.66 111.47 1a1m n ARG 151 Ca 0.05 0.41 -0.17 0.00 -0.77 0.00 0.00 57.85 57.38 1a1m n ARG 151 Cb 0.29 -4.24 -0.09 0.00 -1.02 0.00 0.00 32.46 27.40 1a1m n ARG 151 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1a1m h VAL 152 N -1.92 1.36 -0.99 1.55 2.07 -1.68 -3.15 116.25 113.48 1a1m h VAL 152 Ca -0.65 -1.92 0.25 0.00 0.82 0.00 0.00 66.70 65.20 1a1m h VAL 152 Cb 1.37 2.24 -0.08 0.00 -1.52 0.00 0.00 31.29 33.30 1a1m h VAL 152 CO 0.55 0.58 0.66 0.00 0.02 0.00 0.00 177.57 179.38 1a1m h ALA 153 N 0.45 2.32 -0.02 1.67 0.00 -1.90 0.24 119.26 122.02 1a1m h ALA 153 Ca -0.05 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1a1m h ALA 153 Cb 1.26 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.06 1a1m h ALA 153 CO 0.12 -0.66 0.01 0.93 0.00 0.00 0.00 179.25 179.65 1a1m h GLU 154 N 0.35 0.03 -0.24 0.00 3.07 -1.82 -1.06 114.58 114.91 1a1m h GLU 154 Ca 0.54 -0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 59.35 1a1m h GLU 154 Cb 1.45 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 29.34 1a1m h GLU 154 CO -0.22 0.10 -0.05 1.96 -1.40 0.00 0.00 179.01 179.41 1a1m h GLN 155 N -0.05 0.37 -0.14 2.33 1.08 -1.05 -2.40 115.11 115.25 1a1m h GLN 155 Ca 0.01 -0.08 -0.13 0.00 -1.45 0.00 0.00 58.65 57.01 1a1m h GLN 155 Cb 0.08 -0.06 0.00 0.00 -0.05 0.00 0.00 27.48 27.45 1a1m h GLN 155 CO -0.00 0.44 -0.41 1.25 -0.95 0.00 0.00 178.83 179.16 1a1m h LEU 156 N 0.36 0.59 -0.78 1.46 5.85 -1.27 -2.08 115.31 119.43 1a1m h LEU 156 Ca 0.08 -0.59 -0.01 0.00 0.84 0.00 0.00 57.88 58.19 1a1m h LEU 156 Cb 0.31 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.13 1a1m h LEU 156 CO 0.01 1.08 0.45 -0.09 -0.34 0.00 0.00 178.44 179.56 1a1m h ARG 157 N 0.13 1.08 -0.50 1.25 2.43 -0.96 0.24 114.38 118.05 1a1m h ARG 157 Ca -0.01 -0.12 -0.08 0.00 -0.81 0.00 0.00 59.98 58.96 1a1m h ARG 157 Cb 1.02 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 30.34 1a1m h ARG 157 CO 0.09 0.79 -0.02 0.00 -1.51 0.00 0.00 179.97 179.32 1a1m h ALA 158 N 1.24 1.03 0.40 2.80 0.00 -1.41 0.90 119.26 124.22 1a1m h ALA 158 Ca 0.28 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1a1m h ALA 158 Cb 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.60 1a1m h ALA 158 CO -0.05 0.60 -0.19 -0.92 0.00 0.00 0.00 179.25 178.69 1a1m h TYR 159 N 0.78 -0.49 -0.83 0.00 3.20 -0.80 -0.34 116.97 118.49 1a1m h TYR 159 Ca 0.15 -0.01 0.16 0.00 3.14 0.00 0.00 58.73 62.17 1a1m h TYR 159 Cb 0.49 0.16 -0.06 0.00 1.54 0.00 0.00 36.73 38.87 1a1m h TYR 159 CO 0.03 -0.20 0.55 -0.07 -1.64 0.00 0.00 178.16 176.82 1a1m h LEU 160 N -1.04 0.45 0.00 2.82 3.38 -0.52 0.04 115.31 120.45 1a1m h LEU 160 Ca -0.05 0.03 -0.24 0.00 0.09 0.00 0.00 57.88 57.71 1a1m h LEU 160 Cb 0.52 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.17 1a1m h LEU 160 CO 0.09 0.22 -1.36 -0.33 0.09 0.00 0.00 178.44 177.15 1a1m h GLU 161 N 0.47 0.00 0.00 1.13 5.08 -0.86 -3.39 114.58 117.01 1a1m h GLU 161 Ca 0.41 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.77 1a1m h GLU 161 Cb 0.91 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.16 1a1m h GLU 161 CO -0.15 0.64 0.00 0.41 -1.00 0.00 0.00 179.01 178.91 1a1m n GLY 162 N 1.45 0.13 0.37 -3.84 0.00 -0.14 -4.71 105.19 98.45 1a1m n GLY 162 Ca -0.09 0.00 0.23 0.00 0.00 0.00 0.00 46.02 46.16 1a1m n GLY 162 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1a1m h LEU 163 N 0.00 0.53 -0.97 0.99 3.38 -1.64 -1.15 115.31 116.44 1a1m h LEU 163 Ca 0.00 0.14 -0.06 0.00 0.09 0.00 0.00 57.88 58.04 1a1m h LEU 163 Cb 0.00 0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1a1m h LEU 163 CO 0.00 0.01 0.04 0.00 0.09 0.00 0.00 178.44 178.58 1a1m h VAL 165 N 0.75 1.53 -0.27 0.00 2.07 -1.44 -2.39 116.25 116.50 1a1m h VAL 165 Ca 0.15 -2.46 0.06 0.00 0.82 0.00 0.00 66.70 65.27 1a1m h VAL 165 Cb 0.39 3.16 -0.08 0.00 -1.52 0.00 0.00 31.29 33.24 1a1m h VAL 165 CO 0.01 0.69 -0.41 -0.33 0.02 0.00 0.00 177.57 177.55 1a1m h GLU 166 N -0.41 -0.38 -0.57 1.57 5.08 -1.20 -0.60 114.58 118.07 1a1m h GLU 166 Ca -0.12 0.03 -0.09 0.00 -1.00 0.00 0.00 59.36 58.18 1a1m h GLU 166 Cb 1.54 0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.85 1a1m h GLU 166 CO 0.13 -0.25 0.01 -1.49 -1.00 0.00 0.00 179.01 176.41 1a1m h TRP 167 N -0.40 1.10 -0.75 4.33 4.06 -1.47 -1.44 115.95 121.38 1a1m h TRP 167 Ca 0.11 -0.19 0.02 0.00 2.06 0.00 0.00 58.89 60.89 1a1m h TRP 167 Cb 0.60 -0.29 -0.04 0.00 -1.00 0.00 0.00 29.16 28.43 1a1m h TRP 167 CO -0.55 0.98 0.49 1.25 -3.56 0.00 0.00 178.44 177.05 1a1m h LEU 168 N 0.90 0.82 -0.96 -4.49 5.85 -1.03 0.26 115.31 116.66 1a1m h LEU 168 Ca 0.16 -0.01 -0.10 0.00 0.84 0.00 0.00 57.88 58.78 1a1m h LEU 168 Cb 0.54 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.36 1a1m h LEU 168 CO 0.03 0.58 -0.30 0.03 -0.34 0.00 0.00 178.44 178.44 1a1m h ARG 169 N 0.97 0.40 -0.23 1.25 3.08 -0.84 0.11 114.38 119.12 1a1m h ARG 169 Ca 0.29 -0.16 -0.07 0.00 0.07 0.00 0.00 59.98 60.11 1a1m h ARG 169 Cb -0.04 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 1a1m h ARG 169 CO -0.09 0.66 -0.15 -0.09 -1.07 0.00 0.00 179.97 179.24 1a1m h ARG 170 N 0.35 0.51 -0.47 0.04 2.43 -0.34 -2.24 114.38 114.66 1a1m h ARG 170 Ca 0.05 -0.24 -0.08 0.00 -0.81 0.00 0.00 59.98 58.90 1a1m h ARG 170 Cb 0.70 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.22 1a1m h ARG 170 CO 0.05 0.80 -0.03 1.88 -1.51 0.00 0.00 179.97 181.16 1a1m h TYR 171 N 0.22 0.87 -0.51 2.20 0.05 -0.17 -2.30 116.97 117.33 1a1m h TYR 171 Ca 0.05 -0.13 -0.03 0.00 0.05 0.00 0.00 58.73 58.66 1a1m h TYR 171 Cb 0.66 -0.23 -0.02 0.00 1.01 0.00 0.00 36.73 38.15 1a1m h TYR 171 CO 0.07 0.82 0.18 -0.07 -1.05 0.00 0.00 178.16 178.10 1a1m h LEU 172 N 0.74 0.68 0.02 3.88 3.38 -0.67 -0.81 115.31 122.53 1a1m h LEU 172 Ca 0.14 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 1a1m h LEU 172 Cb 0.50 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1a1m h LEU 172 CO 0.03 0.64 -0.01 -0.08 0.09 0.00 0.00 178.44 179.10 1a1m h GLU 173 N 0.73 -0.02 -0.15 1.13 4.57 -1.11 -3.07 114.58 116.66 1a1m h GLU 173 Ca 0.17 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.35 1a1m h GLU 173 Cb 0.19 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.78 1a1m h GLU 173 CO -0.01 0.64 0.08 -0.91 -1.18 0.00 0.00 179.01 177.64 1a1m h ASN 174 N -0.73 0.18 -0.65 1.04 4.21 -1.36 -2.63 115.58 115.64 1a1m h ASN 174 Ca -0.00 -0.01 -0.38 0.00 1.21 0.00 0.00 56.30 57.12 1a1m h ASN 174 Cb 0.68 -0.05 -0.22 0.00 -1.12 0.00 0.00 38.32 37.61 1a1m h ASN 174 CO 0.00 0.15 0.14 0.61 -1.29 0.00 0.00 177.43 177.05 1a1m n GLY 175 N -1.46 5.15 0.34 2.83 0.00 -0.32 -4.81 105.19 106.92 1a1m n GLY 175 Ca -0.01 -1.54 -0.06 0.00 0.00 0.00 0.00 46.02 44.42 1a1m n GLY 175 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1a1m h LYS 176 N 1.30 -0.17 -0.59 1.61 1.57 -1.36 0.34 116.57 119.27 1a1m h LYS 176 Ca 0.40 0.01 0.17 0.00 -1.87 0.00 0.00 60.65 59.36 1a1m h LYS 176 Cb 1.80 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 34.12 1a1m h LYS 176 CO 0.79 -0.11 0.46 0.93 -0.57 0.00 0.00 179.45 180.95 1a1m h GLU 177 N -0.17 0.00 0.00 3.15 5.08 -1.87 -2.56 114.58 118.20 1a1m h GLU 177 Ca 0.22 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.47 1a1m h GLU 177 Cb 0.55 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 1a1m h GLU 177 CO -0.66 0.00 -1.31 0.25 -1.00 0.00 0.00 179.01 176.29 1a1m n THR 178 N -4.17 0.50 -0.18 1.13 -2.24 -0.96 -4.45 114.28 103.92 1a1m n THR 178 Ca 0.11 -0.06 -0.04 0.00 -2.27 0.00 0.00 64.05 61.79 1a1m n THR 178 Cb 0.70 -1.62 0.05 0.00 -2.10 0.00 0.00 70.33 67.36 1a1m n THR 178 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1a1m h LEU 179 N -0.27 0.41 -3.10 3.22 3.38 -0.44 -2.43 115.31 116.08 1a1m h LEU 179 Ca -0.17 0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.71 1a1m h LEU 179 Cb 1.08 -0.06 -0.07 0.00 0.09 0.00 0.00 40.66 41.71 1a1m h LEU 179 CO -0.11 0.28 0.14 0.00 0.09 0.00 0.00 178.44 178.85 1a1m n GLN 180 N -4.86 3.39 -4.55 1.13 6.02 -0.97 -4.86 117.38 112.68 1a1m n GLN 180 Ca 0.05 -2.35 -0.29 0.00 -0.01 0.00 0.00 57.00 54.39 1a1m n GLN 180 Cb 0.13 -2.03 -0.17 0.00 1.02 0.00 0.00 30.24 29.19 1a1m n GLN 180 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 1a1m s ARG 181 N -2.38 2.35 -0.16 -1.09 3.52 -0.92 -4.99 118.95 115.29 1a1m s ARG 181 Ca 0.42 -0.61 -0.07 0.00 -0.13 0.00 0.00 55.73 55.33 1a1m s ARG 181 Cb 0.33 -1.96 -0.04 0.00 -1.56 0.00 0.00 34.95 31.72 1a1m s ARG 181 CO 0.11 -0.03 0.08 0.00 -0.81 0.00 0.00 175.30 174.65 1a1m s ALA 182 N 0.89 3.53 -0.36 6.12 0.00 -1.26 -4.80 121.76 125.88 1a1m s ALA 182 Ca -0.08 -0.72 -0.10 0.00 0.00 0.00 0.00 51.96 51.05 1a1m s ALA 182 Cb -0.15 -1.90 0.02 0.00 0.00 0.00 0.00 23.12 21.08 1a1m s ALA 182 CO -0.00 0.33 0.18 -0.51 0.00 0.00 0.00 175.76 175.76 1a1m s ASP 183 N -0.10 5.64 0.90 0.00 1.01 -0.10 -4.86 116.67 119.17 1a1m s ASP 183 Ca 0.08 -0.89 -0.11 0.00 0.71 0.00 0.00 52.55 52.34 1a1m s ASP 183 Cb -0.12 -2.00 0.14 0.00 1.01 0.00 0.00 42.92 41.94 1a1m s ASP 183 CO 0.01 -0.33 1.11 -2.16 0.21 0.00 0.00 175.17 174.00 1a1m s PRO 184 N 1.55 1.15 0.50 8.23 0.04 -1.26 -1.89 135.00 143.33 1a1m s PRO 184 Ca 0.02 1.26 -0.09 0.00 0.04 0.00 0.00 61.00 62.23 1a1m s PRO 184 Cb -0.19 -1.76 -0.05 0.00 0.04 0.00 0.00 34.50 32.54 1a1m s PRO 184 CO 0.06 -2.44 0.87 -1.25 0.04 0.00 0.00 177.00 174.28 1a1m s PRO 185 N -4.74 3.65 -0.15 0.56 0.04 -1.26 -4.22 135.00 128.88 1a1m s PRO 185 Ca 0.65 0.48 -0.14 0.00 0.04 0.00 0.00 61.00 62.03 1a1m s PRO 185 Cb -0.21 -2.28 -0.05 0.00 0.04 0.00 0.00 34.50 32.01 1a1m s PRO 185 CO 0.58 -0.27 0.30 0.15 0.04 0.00 0.00 177.00 177.80 1a1m s LYS 186 N -4.58 4.19 0.18 4.56 1.02 0.34 -4.85 119.74 120.60 1a1m s LYS 186 Ca 0.51 0.11 0.10 0.00 0.02 0.00 0.00 55.97 56.72 1a1m s LYS 186 Cb -0.10 -3.40 -0.04 0.00 -0.52 0.00 0.00 37.83 33.76 1a1m s LYS 186 CO 0.43 0.29 -0.22 0.95 -0.92 0.00 0.00 175.35 175.88 1a1m s THR 187 N 0.29 2.14 -0.22 2.17 -4.23 -1.26 -2.22 115.64 112.32 1a1m s THR 187 Ca 0.17 -1.98 -0.30 0.00 -1.18 0.00 0.00 61.69 58.41 1a1m s THR 187 Cb -0.13 -2.01 0.16 0.00 1.34 0.00 0.00 72.50 71.86 1a1m s THR 187 CO 0.05 -0.18 1.18 -1.38 -0.54 0.00 0.00 174.62 173.74 1a1m s HIS 188 N -1.78 -0.20 -0.20 3.99 -3.43 -1.15 -5.00 115.29 107.53 1a1m s HIS 188 Ca 0.18 0.33 -0.05 0.00 -0.80 0.00 0.00 55.06 54.73 1a1m s HIS 188 Cb -0.07 0.48 -0.02 0.00 -1.43 0.00 0.00 32.58 31.53 1a1m s HIS 188 CO 0.09 -0.19 -0.01 0.08 -2.00 0.00 0.00 174.74 172.70 1a1m s VAL 189 N -1.16 3.90 0.27 -5.38 1.01 -1.26 -1.01 120.40 116.77 1a1m s VAL 189 Ca 0.04 -0.33 0.06 0.00 0.00 0.00 0.00 61.98 61.75 1a1m s VAL 189 Cb -0.01 -2.76 -0.03 0.00 0.00 0.00 0.00 36.38 33.59 1a1m s VAL 189 CO -0.03 0.43 0.33 0.42 0.00 0.00 0.00 175.10 176.25 1a1m s THR 190 N 0.96 4.68 -0.05 3.92 -4.23 0.20 -4.62 115.64 116.51 1a1m s THR 190 Ca 0.01 -1.14 0.00 0.00 -1.18 0.00 0.00 61.69 59.38 1a1m s THR 190 Cb -0.14 -3.60 0.02 0.00 1.34 0.00 0.00 72.50 70.12 1a1m s THR 190 CO 0.02 -0.29 -0.03 -2.28 -0.54 0.00 0.00 174.62 171.50 1a1m s HIS 191 N -2.09 0.66 -0.14 3.99 2.46 -1.26 -0.83 115.29 118.09 1a1m s HIS 191 Ca 0.36 -0.17 -0.02 0.00 0.47 0.00 0.00 55.06 55.70 1a1m s HIS 191 Cb -0.08 -0.65 0.05 0.00 -0.13 0.00 0.00 32.58 31.76 1a1m s HIS 191 CO 0.28 -0.21 0.03 -1.01 -2.47 0.00 0.00 174.74 171.35 1a1m s HIS 192 N 1.15 0.80 0.71 3.88 3.76 -0.64 -4.98 115.29 119.98 1a1m s HIS 192 Ca -0.07 -0.50 -0.16 0.00 -0.15 0.00 0.00 55.06 54.17 1a1m s HIS 192 Cb -0.14 -0.90 0.02 0.00 1.11 0.00 0.00 32.58 32.68 1a1m s HIS 192 CO -0.01 -0.48 1.22 -2.30 -0.85 0.00 0.00 174.74 172.32 1a1m n PRO 193 N 5.11 0.73 -0.01 8.40 -0.02 -1.26 0.11 135.00 148.06 1a1m n PRO 193 Ca -0.08 0.31 0.00 0.00 -2.02 0.00 0.00 63.50 61.71 1a1m n PRO 193 Cb 0.49 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 1a1m n PRO 193 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 1a1m n VAL 194 N -2.45 0.02 -0.53 -1.45 0.24 -0.80 -4.74 118.33 108.63 1a1m n VAL 194 Ca 0.15 -0.02 0.00 0.00 -2.04 0.00 0.00 64.34 62.43 1a1m n VAL 194 Cb 0.49 0.98 0.00 0.00 -1.47 0.00 0.00 33.84 33.84 1a1m n VAL 194 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1a1m n SER 195 N -0.01 0.00 0.06 -1.34 2.88 -1.04 -4.86 113.62 109.31 1a1m n SER 195 Ca 0.00 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.66 1a1m n SER 195 Cb 0.50 0.00 0.23 0.00 -0.75 0.00 0.00 64.21 64.19 1a1m n SER 195 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1a1m n ASP 196 N 1.10 0.66 -0.12 -3.46 8.00 -1.26 -4.16 116.55 117.31 1a1m n ASP 196 Ca 0.00 0.16 0.02 0.00 0.71 0.00 0.00 54.79 55.69 1a1m n ASP 196 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1a1m n ASP 196 CO 0.00 0.00 0.00 1.57 -0.39 0.00 0.00 177.20 178.38 1a1m n HIS 197 N -2.04 0.00 -3.92 1.24 -0.00 -1.26 -4.73 115.22 104.51 1a1m n HIS 197 Ca 0.04 0.00 -0.10 0.00 0.46 0.00 0.00 57.72 58.12 1a1m n HIS 197 Cb 0.42 0.00 -0.10 0.00 -0.12 0.00 0.00 29.99 30.19 1a1m n HIS 197 CO 0.00 0.00 0.00 -1.21 0.46 0.00 0.00 176.34 175.59 1a1m s GLU 198 N -0.86 0.45 0.04 1.57 2.02 -1.26 -0.74 118.70 119.92 1a1m s GLU 198 Ca 0.04 -0.56 -0.07 0.00 0.02 0.00 0.00 54.97 54.40 1a1m s GLU 198 Cb 0.04 0.18 -0.01 0.00 0.10 0.00 0.00 34.13 34.44 1a1m s GLU 198 CO 0.12 -0.10 0.12 0.00 0.02 0.00 0.00 175.26 175.42 1a1m s ALA 199 N -1.73 -0.14 -0.24 5.21 0.00 0.40 -1.90 121.76 123.36 1a1m s ALA 199 Ca -0.13 -0.49 -0.11 0.00 0.00 0.00 0.00 51.96 51.23 1a1m s ALA 199 Cb -0.07 0.27 -0.05 0.00 0.00 0.00 0.00 23.12 23.27 1a1m s ALA 199 CO -0.01 -0.34 0.17 0.99 0.00 0.00 0.00 175.76 176.57 1a1m s THR 200 N -2.67 5.36 -0.18 0.00 2.01 0.12 -0.75 115.64 119.51 1a1m s THR 200 Ca -0.04 0.20 -0.08 0.00 0.31 0.00 0.00 61.69 62.08 1a1m s THR 200 Cb -0.01 -3.51 -0.04 0.00 0.01 0.00 0.00 72.50 68.95 1a1m s THR 200 CO -0.05 0.35 0.07 -0.76 -0.69 0.00 0.00 174.62 173.54 1a1m s LEU 201 N 1.03 3.88 -0.15 4.42 1.43 -0.41 -1.61 118.68 127.27 1a1m s LEU 201 Ca 0.08 0.11 -0.00 0.00 -1.03 0.00 0.00 54.13 53.28 1a1m s LEU 201 Cb -0.13 -1.98 0.03 0.00 0.03 0.00 0.00 46.19 44.14 1a1m s LEU 201 CO 0.04 0.18 -0.07 -0.60 0.23 0.00 0.00 176.35 176.13 1a1m s ARG 202 N 0.35 1.55 -0.14 1.70 3.52 -0.01 -2.04 118.95 123.88 1a1m s ARG 202 Ca 0.04 -0.44 -0.19 0.00 -0.13 0.00 0.00 55.73 55.01 1a1m s ARG 202 Cb -0.12 -1.88 -0.04 0.00 -1.56 0.00 0.00 34.95 31.36 1a1m s ARG 202 CO -0.00 -0.36 0.53 0.00 -0.81 0.00 0.00 175.30 174.66 1a1m s TRP 204 N 1.06 2.90 -0.04 0.00 0.52 -0.18 -1.41 118.94 121.79 1a1m s TRP 204 Ca 0.27 -0.08 -0.01 0.00 0.02 0.00 0.00 56.10 56.30 1a1m s TRP 204 Cb -0.16 -1.48 0.03 0.00 -1.15 0.00 0.00 33.47 30.72 1a1m s TRP 204 CO 0.11 0.47 0.03 0.00 0.02 0.00 0.00 176.95 177.59 1a1m s ALA 205 N -1.37 0.29 0.07 0.98 0.00 -0.79 -2.91 121.76 118.03 1a1m s ALA 205 Ca 0.25 0.16 -0.05 0.00 0.00 0.00 0.00 51.96 52.31 1a1m s ALA 205 Cb -0.11 -0.52 -0.02 0.00 0.00 0.00 0.00 23.12 22.47 1a1m s ALA 205 CO 0.17 -0.34 0.09 -0.51 0.00 0.00 0.00 175.76 175.17 1a1m s LEU 206 N 1.73 1.90 0.00 0.00 1.43 -0.94 -2.08 118.68 120.72 1a1m s LEU 206 Ca -0.00 -0.79 0.00 0.00 -1.03 0.00 0.00 54.13 52.30 1a1m s LEU 206 Cb -0.12 0.66 0.00 0.00 0.03 0.00 0.00 46.19 46.75 1a1m s LEU 206 CO -0.03 -0.66 0.00 0.61 0.23 0.00 0.00 176.35 176.50 1a1m n GLY 207 N 0.06 0.45 3.88 -3.19 0.00 -1.13 -0.50 105.19 104.75 1a1m n GLY 207 Ca -0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.55 1a1m n GLY 207 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1a1m s PHE 208 N -2.13 3.44 -0.14 1.61 -0.12 -1.23 -4.73 117.98 114.68 1a1m s PHE 208 Ca 0.00 0.83 -0.10 0.00 -0.05 0.00 0.00 56.93 57.61 1a1m s PHE 208 Cb 0.00 -2.22 0.05 0.00 -0.63 0.00 0.00 43.02 40.21 1a1m s PHE 208 CO 0.00 0.31 0.36 -0.47 -0.05 0.00 0.00 175.22 175.37 1a1m s TYR 209 N -1.77 -0.47 0.96 3.49 6.14 -0.79 -0.31 117.35 124.60 1a1m s TYR 209 Ca 0.46 1.07 -0.16 0.00 0.64 0.00 0.00 57.07 59.07 1a1m s TYR 209 Cb -0.12 0.17 0.23 0.00 0.42 0.00 0.00 41.96 42.67 1a1m s TYR 209 CO 0.21 -0.26 1.05 -0.35 0.64 0.00 0.00 175.55 176.85 1a1m n PRO 210 N 3.70 -1.99 0.10 4.97 -0.04 -1.26 -0.93 135.00 139.55 1a1m n PRO 210 Ca -0.20 -1.65 0.03 0.00 -0.04 0.00 0.00 63.50 61.64 1a1m n PRO 210 Cb 0.56 -1.30 0.41 0.00 -0.04 0.00 0.00 33.50 33.12 1a1m n PRO 210 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1a1m h ALA 211 N -2.23 1.57 -2.13 0.55 0.00 -1.94 -3.45 119.26 111.64 1a1m h ALA 211 Ca -0.37 -0.16 -0.60 0.00 0.00 0.00 0.00 54.91 53.79 1a1m h ALA 211 Cb 1.06 -0.10 0.03 0.00 0.00 0.00 0.00 17.79 18.78 1a1m h ALA 211 CO 0.25 0.32 1.06 -1.91 0.00 0.00 0.00 179.25 178.96 1a1m n GLU 212 N -4.33 2.27 -3.55 0.00 4.07 -1.26 -4.98 120.64 112.86 1a1m n GLU 212 Ca -0.00 0.83 -0.11 0.00 -0.06 0.00 0.00 57.16 57.82 1a1m n GLU 212 Cb 0.21 -2.67 -0.03 0.00 -0.06 0.00 0.00 31.44 28.89 1a1m n GLU 212 CO 0.00 0.00 0.00 -1.50 -0.06 0.00 0.00 177.13 175.57 1a1m s ILE 213 N 3.48 0.03 -0.06 6.31 2.07 -1.26 -4.70 121.20 127.06 1a1m s ILE 213 Ca 0.89 -0.33 0.01 0.00 -1.41 0.00 0.00 60.65 59.82 1a1m s ILE 213 Cb -0.66 -1.17 0.02 0.00 0.13 0.00 0.00 42.46 40.79 1a1m s ILE 213 CO 0.48 -0.12 -0.06 -0.89 -1.91 0.00 0.00 174.94 172.43 1a1m s THR 214 N -3.79 0.72 -0.04 4.00 2.01 -1.08 -5.01 115.64 112.46 1a1m s THR 214 Ca 0.03 -0.21 0.03 0.00 0.31 0.00 0.00 61.69 61.85 1a1m s THR 214 Cb -0.00 -0.73 0.00 0.00 0.01 0.00 0.00 72.50 71.79 1a1m s THR 214 CO -0.11 0.27 -0.12 -0.76 -0.69 0.00 0.00 174.62 173.22 1a1m s LEU 215 N 0.98 1.79 0.01 4.42 1.43 -1.26 -2.07 118.68 124.00 1a1m s LEU 215 Ca -0.10 -0.25 -0.06 0.00 -1.03 0.00 0.00 54.13 52.69 1a1m s LEU 215 Cb -0.14 -0.72 -0.01 0.00 0.03 0.00 0.00 46.19 45.35 1a1m s LEU 215 CO 0.00 0.09 0.10 -0.89 0.23 0.00 0.00 176.35 175.87 1a1m s THR 216 N 0.23 0.10 -0.05 5.49 2.01 -0.64 -4.96 115.64 117.81 1a1m s THR 216 Ca -0.05 -0.82 0.05 0.00 0.31 0.00 0.00 61.69 61.18 1a1m s THR 216 Cb -0.11 -0.50 -0.02 0.00 0.01 0.00 0.00 72.50 71.88 1a1m s THR 216 CO 0.01 -0.45 -0.21 0.26 -0.69 0.00 0.00 174.62 173.54 1a1m s TRP 217 N -1.67 2.52 -0.01 4.92 0.52 -1.26 -0.25 118.94 123.71 1a1m s TRP 217 Ca -0.13 -0.48 0.07 0.00 0.02 0.00 0.00 56.10 55.58 1a1m s TRP 217 Cb -0.07 -1.61 -0.02 0.00 -1.15 0.00 0.00 33.47 30.63 1a1m s TRP 217 CO -0.00 -0.06 -0.21 -0.65 0.02 0.00 0.00 176.95 176.05 1a1m s GLN 218 N -0.39 1.71 -0.23 4.98 -0.21 0.10 -1.33 119.66 124.29 1a1m s GLN 218 Ca 0.04 -0.78 0.00 0.00 0.02 0.00 0.00 55.36 54.64 1a1m s GLN 218 Cb -0.12 -1.67 0.03 0.00 1.00 0.00 0.00 33.01 32.25 1a1m s GLN 218 CO 0.02 0.46 -0.12 0.50 -2.12 0.00 0.00 175.29 174.03 1a1m s ARG 219 N -0.56 2.77 -1.81 2.91 3.52 0.03 -1.09 118.95 124.72 1a1m s ARG 219 Ca 0.08 -1.00 0.00 0.00 -0.13 0.00 0.00 55.73 54.68 1a1m s ARG 219 Cb -0.08 -2.83 0.00 0.00 -1.56 0.00 0.00 34.95 30.48 1a1m s ARG 219 CO -0.01 -0.37 0.00 -0.25 -0.81 0.00 0.00 175.30 173.86 1a1m n ASP 220 N 4.60 -5.91 0.00 -2.12 8.00 -0.10 -1.27 116.55 119.76 1a1m n ASP 220 Ca -0.17 0.01 0.00 0.00 0.71 0.00 0.00 54.79 55.33 1a1m n ASP 220 Cb 0.47 -4.93 0.00 0.00 -0.02 0.00 0.00 41.12 36.64 1a1m n ASP 220 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1a1m n GLY 221 N -0.99 1.80 3.69 0.44 0.00 -1.26 -5.03 105.19 103.83 1a1m n GLY 221 Ca -0.25 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.39 1a1m n GLY 221 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1a1m s GLU 222 N -0.32 4.24 0.36 1.61 8.01 -0.39 -4.99 118.70 127.21 1a1m s GLU 222 Ca 0.00 0.36 -0.28 0.00 0.01 0.00 0.00 54.97 55.06 1a1m s GLU 222 Cb 0.00 -3.51 -0.12 0.00 -4.31 0.00 0.00 34.13 26.19 1a1m s GLU 222 CO 0.00 -0.01 1.42 -0.25 0.01 0.00 0.00 175.26 176.43 1a1m n ASP 223 N 4.31 3.44 -2.43 -0.19 8.00 -1.26 -0.79 116.55 127.63 1a1m n ASP 223 Ca -0.07 1.22 -0.33 0.00 0.71 0.00 0.00 54.79 56.32 1a1m n ASP 223 Cb 0.51 -1.57 0.05 0.00 -0.02 0.00 0.00 41.12 40.08 1a1m n ASP 223 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1a1m n GLN 224 N 0.55 2.99 -0.32 -1.24 1.13 -0.44 -4.81 117.38 115.25 1a1m n GLN 224 Ca 0.03 -3.69 -0.03 0.00 -1.94 0.00 0.00 57.00 51.37 1a1m n GLN 224 Cb 0.38 -2.28 0.02 0.00 0.11 0.00 0.00 30.24 28.47 1a1m n GLN 224 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 1a1m h THR 225 N 1.70 0.06 0.00 5.09 2.02 -1.91 0.21 112.91 120.08 1a1m h THR 225 Ca 0.51 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.69 1a1m h THR 225 Cb 0.78 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.25 1a1m h THR 225 CO 1.29 0.00 0.00 0.00 0.37 0.00 0.00 175.52 177.18 1a1m n GLN 226 N -5.44 0.50 0.00 6.66 6.02 -1.26 -3.65 117.38 120.20 1a1m n GLN 226 Ca 0.07 0.00 0.03 0.00 -0.01 0.00 0.00 57.00 57.10 1a1m n GLN 226 Cb 0.38 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 30.12 1a1m n GLN 226 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1a1m n ASP 227 N -1.25 0.65 -4.62 1.08 9.92 0.51 -5.00 116.55 117.85 1a1m n ASP 227 Ca 0.15 -0.82 -0.40 0.00 -0.53 0.00 0.00 54.79 53.19 1a1m n ASP 227 Cb 0.22 0.71 -0.07 0.00 -0.64 0.00 0.00 41.12 41.33 1a1m n ASP 227 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1a1m s THR 228 N -1.25 5.05 -0.21 -3.53 2.01 0.19 -4.68 115.64 113.21 1a1m s THR 228 Ca 0.04 0.90 -0.26 0.00 0.31 0.00 0.00 61.69 62.69 1a1m s THR 228 Cb 0.05 -3.86 -0.01 0.00 0.01 0.00 0.00 72.50 68.69 1a1m s THR 228 CO 0.19 0.06 0.87 -0.70 -0.69 0.00 0.00 174.62 174.35 1a1m s GLU 229 N 2.36 4.25 -0.08 4.92 2.12 -0.25 -4.87 118.70 127.15 1a1m s GLU 229 Ca 0.22 1.06 0.02 0.00 0.36 0.00 0.00 54.97 56.63 1a1m s GLU 229 Cb -0.16 -3.61 -0.02 0.00 0.26 0.00 0.00 34.13 30.60 1a1m s GLU 229 CO 0.09 -0.45 -0.14 -0.51 -0.54 0.00 0.00 175.26 173.71 1a1m s LEU 230 N 2.59 2.72 0.27 2.70 1.43 -1.26 -1.05 118.68 126.08 1a1m s LEU 230 Ca 0.38 -0.24 0.01 0.00 -1.03 0.00 0.00 54.13 53.25 1a1m s LEU 230 Cb -0.16 -1.57 -0.04 0.00 0.03 0.00 0.00 46.19 44.46 1a1m s LEU 230 CO 0.10 0.29 0.45 0.68 0.23 0.00 0.00 176.35 178.09 1a1m s VAL 231 N -0.37 5.17 0.28 -1.59 -7.23 -1.06 -5.05 120.40 110.55 1a1m s VAL 231 Ca 0.04 -0.52 -0.29 0.00 -1.81 0.00 0.00 61.98 59.40 1a1m s VAL 231 Cb -0.12 -3.81 -0.10 0.00 0.56 0.00 0.00 36.38 32.91 1a1m s VAL 231 CO 0.02 -0.36 1.22 -0.70 -0.31 0.00 0.00 175.10 174.97 1a1m s GLU 232 N -3.85 4.48 0.05 4.82 2.12 -1.26 -4.58 118.70 120.48 1a1m s GLU 232 Ca 0.38 2.01 -0.33 0.00 0.36 0.00 0.00 54.97 57.39 1a1m s GLU 232 Cb -0.10 -3.14 -0.12 0.00 0.26 0.00 0.00 34.13 31.02 1a1m s GLU 232 CO 0.32 -0.04 1.75 2.41 -0.54 0.00 0.00 175.26 179.16 1a1m n THR 233 N 1.32 0.31 -4.39 -1.70 -1.04 -1.26 -4.85 114.28 102.67 1a1m n THR 233 Ca 0.01 -0.06 -0.27 0.00 -2.04 0.00 0.00 64.05 61.69 1a1m n THR 233 Cb 0.43 -1.78 -0.11 0.00 -1.82 0.00 0.00 70.33 67.05 1a1m n THR 233 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1a1m s ARG 234 N 2.56 1.68 0.01 -2.82 1.70 -0.39 -4.94 118.95 116.75 1a1m s ARG 234 Ca 0.85 -1.46 -0.23 0.00 -0.47 0.00 0.00 55.73 54.42 1a1m s ARG 234 Cb -0.65 -1.93 -0.05 0.00 -0.57 0.00 0.00 34.95 31.75 1a1m s ARG 234 CO 0.43 0.41 0.68 -1.25 -1.08 0.00 0.00 175.30 174.50 1a1m s PRO 235 N -2.74 4.41 0.09 3.89 0.04 -1.26 -0.61 135.00 138.83 1a1m s PRO 235 Ca 0.22 0.90 -0.13 0.00 0.04 0.00 0.00 61.00 62.03 1a1m s PRO 235 Cb -0.08 -3.37 -0.19 0.00 0.04 0.00 0.00 34.50 30.90 1a1m s PRO 235 CO 0.11 0.28 1.24 0.00 0.04 0.00 0.00 177.00 178.68 1a1m h ALA 236 N 5.84 0.21 0.00 8.56 0.00 -1.58 -3.47 119.26 128.82 1a1m h ALA 236 Ca -0.44 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 53.81 1a1m h ALA 236 Cb 1.20 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1a1m h ALA 236 CO 0.71 0.69 0.00 0.41 0.00 0.00 0.00 179.25 181.06 1a1m n GLY 237 N 0.93 1.79 0.99 0.00 0.00 -1.26 -4.94 105.19 102.70 1a1m n GLY 237 Ca -0.09 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.04 1a1m n GLY 237 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1a1m n ASP 238 N 0.00 2.96 0.00 1.61 5.68 -1.26 -4.90 116.55 120.64 1a1m n ASP 238 Ca 0.00 -1.92 0.00 0.00 -0.50 0.00 0.00 54.79 52.37 1a1m n ASP 238 Cb 0.00 -0.22 0.00 0.00 -1.14 0.00 0.00 41.12 39.76 1a1m n ASP 238 CO 0.00 0.00 0.00 -2.11 -1.33 0.00 0.00 177.20 173.76 1a1m n ARG 239 N 1.17 0.00 -2.34 0.11 1.85 -1.26 -5.08 116.66 111.10 1a1m n ARG 239 Ca 0.18 0.00 -0.26 0.00 -1.00 0.00 0.00 57.85 56.78 1a1m n ARG 239 Cb 0.53 0.00 0.13 0.00 -1.05 0.00 0.00 32.46 32.06 1a1m n ARG 239 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 1a1m s THR 240 N -2.48 2.11 0.33 8.89 -4.23 -1.26 -4.86 115.64 114.13 1a1m s THR 240 Ca 0.00 -0.37 0.03 0.00 -1.18 0.00 0.00 61.69 60.17 1a1m s THR 240 Cb 0.00 -2.74 -0.05 0.00 1.34 0.00 0.00 72.50 71.05 1a1m s THR 240 CO 0.00 0.00 0.08 -0.36 -0.54 0.00 0.00 174.62 173.80 1a1m s PHE 241 N -3.39 1.84 0.03 3.99 0.40 0.57 -1.49 117.98 119.94 1a1m s PHE 241 Ca 0.68 -1.07 0.00 0.00 -0.60 0.00 0.00 56.93 55.94 1a1m s PHE 241 Cb -0.05 -1.18 -0.02 0.00 0.51 0.00 0.00 43.02 42.28 1a1m s PHE 241 CO 0.47 -0.13 -0.04 -0.65 0.70 0.00 0.00 175.22 175.57 1a1m s GLN 242 N -3.89 0.40 -0.02 0.44 -0.21 0.22 -2.83 119.66 113.78 1a1m s GLN 242 Ca 0.34 -0.73 -0.29 0.00 0.02 0.00 0.00 55.36 54.71 1a1m s GLN 242 Cb 0.07 0.04 0.09 0.00 1.00 0.00 0.00 33.01 34.21 1a1m s GLN 242 CO 0.15 -0.04 0.78 0.21 -2.12 0.00 0.00 175.29 174.27 1a1m s LYS 243 N -1.83 0.95 0.07 2.91 2.20 -0.88 -1.26 119.74 121.90 1a1m s LYS 243 Ca -0.11 -0.05 -0.09 0.00 -0.36 0.00 0.00 55.97 55.35 1a1m s LYS 243 Cb -0.08 0.44 0.00 0.00 -1.51 0.00 0.00 37.83 36.69 1a1m s LYS 243 CO -0.02 -0.35 0.20 1.67 -0.36 0.00 0.00 175.35 176.49 1a1m s TRP 244 N -2.16 0.09 -0.02 4.03 1.48 -1.26 -1.88 118.94 119.21 1a1m s TRP 244 Ca -0.03 -0.43 0.04 0.00 -1.06 0.00 0.00 56.10 54.62 1a1m s TRP 244 Cb -0.01 -0.03 -0.01 0.00 -1.16 0.00 0.00 33.47 32.27 1a1m s TRP 244 CO -0.01 -0.51 -0.13 0.00 -4.06 0.00 0.00 176.95 172.24 1a1m s ALA 245 N -3.34 1.09 0.07 2.67 0.00 -0.50 -2.58 121.76 119.17 1a1m s ALA 245 Ca 0.01 -0.52 0.02 0.00 0.00 0.00 0.00 51.96 51.47 1a1m s ALA 245 Cb 0.02 -0.32 -0.03 0.00 0.00 0.00 0.00 23.12 22.79 1a1m s ALA 245 CO -0.08 0.24 -0.08 0.00 0.00 0.00 0.00 175.76 175.83 1a1m s ALA 246 N -0.14 0.79 -0.07 0.00 0.00 -0.21 -0.70 121.76 121.43 1a1m s ALA 246 Ca 0.02 -1.00 -0.12 0.00 0.00 0.00 0.00 51.96 50.86 1a1m s ALA 246 Cb -0.07 0.07 0.03 0.00 0.00 0.00 0.00 23.12 23.14 1a1m s ALA 246 CO 0.00 -0.07 0.30 0.54 0.00 0.00 0.00 175.76 176.53 1a1m s VAL 247 N -2.15 0.03 -0.36 0.00 0.11 -0.87 -1.09 120.40 116.07 1a1m s VAL 247 Ca -0.01 -0.23 -0.13 0.00 -2.93 0.00 0.00 61.98 58.68 1a1m s VAL 247 Cb -0.05 -0.51 -0.00 0.00 -1.53 0.00 0.00 36.38 34.29 1a1m s VAL 247 CO -0.01 -0.13 0.24 -0.69 -3.33 0.00 0.00 175.10 171.19 1a1m s VAL 248 N -0.51 5.14 0.12 2.04 1.01 -1.26 -1.29 120.40 125.64 1a1m s VAL 248 Ca -0.06 -0.40 0.03 0.00 0.00 0.00 0.00 61.98 61.55 1a1m s VAL 248 Cb -0.04 -3.71 -0.04 0.00 0.00 0.00 0.00 36.38 32.59 1a1m s VAL 248 CO 0.02 -0.09 0.14 0.68 0.00 0.00 0.00 175.10 175.85 1a1m s VAL 249 N 1.69 4.73 0.30 2.92 -7.23 0.07 -4.89 120.40 117.99 1a1m s VAL 249 Ca 0.05 -0.82 -0.28 0.00 -1.81 0.00 0.00 61.98 59.12 1a1m s VAL 249 Cb -0.18 -3.35 -0.09 0.00 0.56 0.00 0.00 36.38 33.31 1a1m s VAL 249 CO 0.10 0.01 1.07 -2.84 -0.31 0.00 0.00 175.10 173.12 1a1m s PRO 250 N -2.78 4.56 0.17 4.82 0.02 -1.26 -0.45 135.00 140.08 1a1m s PRO 250 Ca 0.31 1.69 -0.34 0.00 0.02 0.00 0.00 61.00 62.69 1a1m s PRO 250 Cb -0.11 -3.05 -0.14 0.00 0.02 0.00 0.00 34.50 31.22 1a1m s PRO 250 CO 0.24 0.17 1.59 0.43 -0.33 0.00 0.00 177.00 179.11 1a1m n SER 251 N 0.94 3.19 0.00 2.53 7.64 0.08 -1.69 113.62 126.31 1a1m n SER 251 Ca 0.00 1.08 0.00 0.00 1.01 0.00 0.00 58.87 60.96 1a1m n SER 251 Cb 0.46 -1.44 0.00 0.00 -1.01 0.00 0.00 64.21 62.22 1a1m n SER 251 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1a1m n GLY 252 N 3.47 0.75 0.50 0.23 0.00 -1.26 -4.92 105.19 103.96 1a1m n GLY 252 Ca 0.17 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.23 1a1m n GLY 252 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1a1m n GLU 253 N -2.00 2.25 0.21 1.61 1.02 -0.68 -4.72 120.64 118.33 1a1m n GLU 253 Ca 0.00 -1.74 0.12 0.00 -0.02 0.00 0.00 57.16 55.52 1a1m n GLU 253 Cb 0.00 -1.21 0.67 0.00 -0.02 0.00 0.00 31.44 30.87 1a1m n GLU 253 CO 0.00 0.00 0.00 1.05 1.18 0.00 0.00 177.13 179.36 1a1m h GLU 254 N 1.74 0.00 0.00 3.49 9.09 -1.92 -1.05 114.58 125.93 1a1m h GLU 254 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1a1m h GLU 254 Cb 0.62 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.72 1a1m h GLU 254 CO 0.00 0.00 -0.15 1.04 0.05 0.00 0.00 179.01 179.95 1a1m n GLN 255 N -2.40 0.26 0.00 1.06 1.13 -1.26 -3.09 117.38 113.08 1a1m n GLN 255 Ca -0.02 0.18 0.15 0.00 -1.94 0.00 0.00 57.00 55.37 1a1m n GLN 255 Cb 0.13 -1.77 0.80 0.00 0.11 0.00 0.00 30.24 29.50 1a1m n GLN 255 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1a1m n ARG 256 N -2.21 0.64 -4.38 -1.09 1.74 -0.40 -4.79 116.66 106.17 1a1m n ARG 256 Ca 0.05 0.01 -0.34 0.00 -0.77 0.00 0.00 57.85 56.80 1a1m n ARG 256 Cb 0.43 -1.50 -0.11 0.00 -1.02 0.00 0.00 32.46 30.26 1a1m n ARG 256 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1a1m s TYR 257 N -2.33 3.08 0.05 -1.55 2.02 -1.18 -0.92 117.35 116.53 1a1m s TYR 257 Ca 0.35 -0.04 0.04 0.00 -0.37 0.00 0.00 57.07 57.04 1a1m s TYR 257 Cb 0.20 -1.88 -0.02 0.00 -0.40 0.00 0.00 41.96 39.86 1a1m s TYR 257 CO 0.40 0.21 -0.11 0.95 -1.57 0.00 0.00 175.55 175.43 1a1m s THR 258 N -0.24 0.83 -0.10 -0.71 -4.23 -0.25 -4.68 115.64 106.26 1a1m s THR 258 Ca 0.05 -1.07 0.01 0.00 -1.18 0.00 0.00 61.69 59.49 1a1m s THR 258 Cb -0.13 -0.82 -0.02 0.00 1.34 0.00 0.00 72.50 72.87 1a1m s THR 258 CO 0.02 -0.22 -0.12 0.00 -0.54 0.00 0.00 174.62 173.77 1a1m s HIS 260 N -0.10 2.65 -0.05 0.00 3.76 0.65 -0.74 115.29 121.46 1a1m s HIS 260 Ca -0.01 -0.62 0.06 0.00 -0.15 0.00 0.00 55.06 54.35 1a1m s HIS 260 Cb -0.14 -1.71 -0.01 0.00 1.11 0.00 0.00 32.58 31.83 1a1m s HIS 260 CO 0.03 -0.16 -0.24 0.08 -0.85 0.00 0.00 174.74 173.61 1a1m s VAL 261 N -0.03 1.95 -0.06 -0.90 1.01 0.14 -1.63 120.40 120.88 1a1m s VAL 261 Ca -0.05 -1.02 -0.01 0.00 0.00 0.00 0.00 61.98 60.90 1a1m s VAL 261 Cb -0.14 -1.64 0.03 0.00 0.00 0.00 0.00 36.38 34.62 1a1m s VAL 261 CO 0.04 0.55 -0.01 -1.10 0.00 0.00 0.00 175.10 174.58 1a1m s GLN 262 N -0.24 0.62 -0.09 2.72 -0.21 -0.88 -1.50 119.66 120.08 1a1m s GLN 262 Ca -0.00 0.05 -0.15 0.00 0.02 0.00 0.00 55.36 55.28 1a1m s GLN 262 Cb -0.12 -0.87 0.03 0.00 1.00 0.00 0.00 33.01 33.05 1a1m s GLN 262 CO 0.02 -0.23 0.37 -1.58 -2.12 0.00 0.00 175.29 171.76 1a1m s HIS 263 N 1.58 -0.34 -1.92 0.91 2.46 -1.26 -2.64 115.29 114.07 1a1m s HIS 263 Ca -0.01 0.75 0.09 0.00 0.47 0.00 0.00 55.06 56.36 1a1m s HIS 263 Cb -0.13 0.14 0.53 0.00 -0.13 0.00 0.00 32.58 32.99 1a1m s HIS 263 CO -0.03 -0.29 1.02 -0.85 -2.47 0.00 0.00 174.74 172.11 1a1m n GLU 264 N 2.18 0.27 0.03 2.88 0.28 -1.26 -1.37 120.64 123.65 1a1m n GLU 264 Ca -0.17 0.03 0.11 0.00 -0.16 0.00 0.00 57.16 56.97 1a1m n GLU 264 Cb 0.57 -1.50 0.02 0.00 1.43 0.00 0.00 31.44 31.95 1a1m n GLU 264 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1a1m n GLY 265 N -0.44 -1.24 3.82 -1.84 0.00 -1.26 -4.87 105.19 99.36 1a1m n GLY 265 Ca 0.07 -0.38 -0.37 0.00 0.00 0.00 0.00 46.02 45.33 1a1m n GLY 265 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1a1m s LEU 266 N -4.14 4.35 0.13 0.99 1.43 -0.47 -4.44 118.68 116.54 1a1m s LEU 266 Ca 0.03 0.53 -0.12 0.00 -1.03 0.00 0.00 54.13 53.54 1a1m s LEU 266 Cb 0.14 -2.22 -0.04 0.00 0.03 0.00 0.00 46.19 44.09 1a1m s LEU 266 CO 0.80 0.30 1.49 -0.65 0.23 0.00 0.00 176.35 178.52 1a1m h PRO 267 N 5.49 0.86 -5.24 1.29 0.11 -1.89 -3.45 132.00 129.16 1a1m h PRO 267 Ca -0.50 -0.41 -0.39 0.00 0.11 0.00 0.00 66.00 64.82 1a1m h PRO 267 Cb 1.20 -0.01 -0.20 0.00 0.11 0.00 0.00 31.00 32.10 1a1m h PRO 267 CO 0.65 1.05 -0.77 -1.59 -0.21 0.00 0.00 178.00 177.13 1a1m s LYS 268 N -4.53 0.83 0.34 1.05 0.00 -1.26 -5.14 119.74 111.03 1a1m s LYS 268 Ca -0.12 -1.01 -0.29 0.00 0.00 0.00 0.00 55.97 54.55 1a1m s LYS 268 Cb 0.11 -0.76 -0.10 0.00 0.00 0.00 0.00 37.83 37.08 1a1m s LYS 268 CO 0.85 0.16 1.35 -2.14 0.00 0.00 0.00 175.35 175.57 1a1m s PRO 269 N -2.02 4.30 0.03 1.78 0.02 -1.26 -4.95 135.00 132.89 1a1m s PRO 269 Ca 0.00 2.30 -0.10 0.00 0.02 0.00 0.00 61.00 63.22 1a1m s PRO 269 Cb -0.08 -3.05 -0.05 0.00 0.02 0.00 0.00 34.50 31.33 1a1m s PRO 269 CO 0.02 -0.28 0.36 -0.51 -0.33 0.00 0.00 177.00 176.27 1a1m s LEU 270 N -1.77 4.39 -0.07 -5.54 1.43 -0.56 -4.92 118.68 111.64 1a1m s LEU 270 Ca 0.50 0.78 0.05 0.00 -1.03 0.00 0.00 54.13 54.44 1a1m s LEU 270 Cb -0.41 -2.76 -0.01 0.00 0.03 0.00 0.00 46.19 43.04 1a1m s LEU 270 CO 0.55 0.24 -0.24 -0.89 0.23 0.00 0.00 176.35 176.24 1a1m s THR 271 N -1.27 2.11 0.14 5.49 2.01 -1.26 -0.69 115.64 122.18 1a1m s THR 271 Ca 0.28 -1.04 0.01 0.00 0.31 0.00 0.00 61.69 61.26 1a1m s THR 271 Cb -0.14 -1.78 -0.04 0.00 0.01 0.00 0.00 72.50 70.55 1a1m s THR 271 CO 0.15 0.57 -0.00 -0.76 -0.69 0.00 0.00 174.62 173.89 1a1m s LEU 272 N -0.06 2.14 0.16 4.42 1.02 0.08 -4.93 118.68 121.51 1a1m s LEU 272 Ca -0.07 -1.14 -0.06 0.00 0.02 0.00 0.00 54.13 52.88 1a1m s LEU 272 Cb -0.15 0.04 -0.02 0.00 0.02 0.00 0.00 46.19 46.08 1a1m s LEU 272 CO 0.05 -0.59 0.22 0.00 0.02 0.00 0.00 176.35 176.05 1a1m s ARG 273 N -3.93 1.10 0.29 1.70 1.70 -1.26 -0.33 118.95 118.22 1a1m s ARG 273 Ca 0.20 -1.27 -0.29 0.00 -0.47 0.00 0.00 55.73 53.90 1a1m s ARG 273 Cb 0.06 0.34 -0.10 0.00 -0.57 0.00 0.00 34.95 34.68 1a1m s ARG 273 CO 0.01 -0.38 1.38 -0.46 -1.08 0.00 0.00 175.30 174.77 1a1m s TRP 274 N -4.00 3.02 -0.80 5.89 -0.00 -1.26 -4.64 118.94 117.15 1a1m s TRP 274 Ca 0.20 1.20 0.02 0.00 -0.00 0.00 0.00 56.10 57.52 1a1m s TRP 274 Cb 0.04 -3.76 0.24 0.00 -0.00 0.00 0.00 33.47 29.99 1a1m s TRP 274 CO 0.01 -2.31 0.84 0.39 -0.00 0.00 0.00 176.95 175.89 1a1m n GLU 275 N 1.64 2.78 -1.84 5.86 -0.58 -1.26 -5.03 120.64 122.21 1a1m n GLU 275 Ca 0.04 -4.57 -0.41 0.00 -0.42 0.00 0.00 57.16 51.79 1a1m n GLU 275 Cb 0.41 -2.35 -0.03 0.00 -0.57 0.00 0.00 31.44 28.90 1a1m n GLU 275 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 1a1m s PRO 276 N -2.06 3.01 -0.85 3.49 0.04 -1.26 -4.83 135.00 132.53 1a1m s PRO 276 Ca 0.33 1.47 -0.23 0.00 0.04 0.00 0.00 61.00 62.60 1a1m s PRO 276 Cb 0.04 -4.32 -0.15 0.00 0.04 0.00 0.00 34.50 30.10 1a1m s PRO 276 CO -0.05 -2.25 1.91 0.72 0.04 0.00 0.00 177.00 177.37 1a1m n HIS 277 N 11.80 1.99 -0.75 0.56 8.25 -1.26 -5.31 115.22 130.50 1a1m n HIS 277 Ca 0.26 -1.59 0.00 0.00 -0.26 0.00 0.00 57.72 56.14 1a1m n HIS 277 Cb 0.48 -1.93 0.00 0.00 1.12 0.00 0.00 29.99 29.66 1a1m n HIS 277 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70