#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t1y s SER 2 N 0.00 5.27 0.13 1.61 1.04 -1.26 -4.46 113.70 116.02 1t1y s SER 2 Ca 0.00 1.76 -0.03 0.00 0.48 0.00 0.00 55.95 58.16 1t1y s SER 2 Cb 0.00 -2.52 -0.03 0.00 0.10 0.00 0.00 66.02 63.57 1t1y s SER 2 CO 0.00 -1.52 0.09 -1.00 0.98 0.00 0.00 173.24 171.79 1t1y s HIS 3 N -2.78 0.72 0.08 5.02 0.09 -0.74 -4.98 115.29 112.70 1t1y s HIS 3 Ca 0.61 -1.11 -0.08 0.00 -0.00 0.00 0.00 55.06 54.48 1t1y s HIS 3 Cb -0.16 -0.38 -0.00 0.00 -0.00 0.00 0.00 32.58 32.03 1t1y s HIS 3 CO 0.49 -0.54 0.17 -1.54 -0.00 0.00 0.00 174.74 173.32 1t1y s SER 4 N -3.01 0.14 -0.06 1.40 1.04 -1.26 -0.92 113.70 111.02 1t1y s SER 4 Ca 0.20 -0.63 0.03 0.00 0.48 0.00 0.00 55.95 56.03 1t1y s SER 4 Cb 0.07 0.32 0.01 0.00 0.10 0.00 0.00 66.02 66.51 1t1y s SER 4 CO -0.00 -0.68 -0.14 -0.32 0.98 0.00 0.00 173.24 173.08 1t1y s MET 5 N -3.60 1.81 -0.02 4.02 -2.45 -0.26 -0.94 119.30 117.86 1t1y s MET 5 Ca 0.03 -0.48 -0.02 0.00 -1.25 0.00 0.00 55.69 53.97 1t1y s MET 5 Cb 0.04 -1.49 0.00 0.00 1.25 0.00 0.00 34.83 34.64 1t1y s MET 5 CO -0.10 0.07 0.05 1.03 1.05 0.00 0.00 175.02 177.13 1t1y s ARG 6 N 0.54 0.11 -0.08 4.11 0.52 -0.61 -1.61 118.95 121.93 1t1y s ARG 6 Ca -0.13 0.00 0.04 0.00 -0.52 0.00 0.00 55.73 55.12 1t1y s ARG 6 Cb -0.15 0.05 -0.01 0.00 0.52 0.00 0.00 34.95 35.36 1t1y s ARG 6 CO 0.04 -0.02 -0.22 0.71 0.02 0.00 0.00 175.30 175.84 1t1y s TYR 7 N -0.15 2.57 -0.09 -0.53 1.51 -0.04 -0.89 117.35 119.72 1t1y s TYR 7 Ca -0.02 -0.76 0.05 0.00 -1.01 0.00 0.00 57.07 55.33 1t1y s TYR 7 Cb -0.02 -1.68 -0.00 0.00 -0.11 0.00 0.00 41.96 40.15 1t1y s TYR 7 CO 0.00 -0.24 -0.24 -0.06 -1.11 0.00 0.00 175.55 173.90 1t1y s PHE 8 N 0.03 2.53 -0.04 2.71 0.40 -0.36 -1.78 117.98 121.47 1t1y s PHE 8 Ca -0.08 -0.92 0.04 0.00 -0.60 0.00 0.00 56.93 55.36 1t1y s PHE 8 Cb -0.15 -1.68 0.00 0.00 0.51 0.00 0.00 43.02 41.70 1t1y s PHE 8 CO 0.05 -0.34 -0.15 -0.06 0.70 0.00 0.00 175.22 175.43 1t1y s PHE 9 N 0.16 1.51 -0.06 0.36 0.08 0.40 -1.43 117.98 119.01 1t1y s PHE 9 Ca -0.13 -0.44 0.01 0.00 0.12 0.00 0.00 56.93 56.48 1t1y s PHE 9 Cb -0.16 -1.04 0.02 0.00 -0.57 0.00 0.00 43.02 41.27 1t1y s PHE 9 CO 0.07 -0.17 -0.05 0.99 -0.10 0.00 0.00 175.22 175.97 1t1y s THR 10 N 0.16 0.60 -0.08 0.64 2.01 -0.56 -1.27 115.64 117.14 1t1y s THR 10 Ca -0.05 -0.12 0.02 0.00 0.31 0.00 0.00 61.69 61.85 1t1y s THR 10 Cb -0.11 -0.64 0.01 0.00 0.01 0.00 0.00 72.50 71.77 1t1y s THR 10 CO 0.02 0.26 -0.15 -0.44 -0.69 0.00 0.00 174.62 173.62 1t1y s SER 11 N 1.18 2.18 -0.15 3.53 0.01 -0.42 -1.21 113.70 118.81 1t1y s SER 11 Ca -0.07 -0.38 0.01 0.00 1.31 0.00 0.00 55.95 56.83 1t1y s SER 11 Cb -0.14 -0.99 0.02 0.00 0.21 0.00 0.00 66.02 65.12 1t1y s SER 11 CO -0.01 0.05 -0.18 -0.69 0.41 0.00 0.00 173.24 172.82 1t1y s VAL 12 N 0.69 1.81 0.59 3.43 1.01 -0.02 -1.18 120.40 126.72 1t1y s VAL 12 Ca -0.13 -0.80 -0.18 0.00 0.00 0.00 0.00 61.98 60.87 1t1y s VAL 12 Cb -0.16 -1.66 -0.04 0.00 0.00 0.00 0.00 36.38 34.53 1t1y s VAL 12 CO 0.03 0.50 1.13 -0.94 0.00 0.00 0.00 175.10 175.82 1t1y s SER 13 N 1.26 5.49 -0.53 3.32 1.04 -0.38 -0.87 113.70 123.03 1t1y s SER 13 Ca 0.02 2.12 0.05 0.00 0.48 0.00 0.00 55.95 58.62 1t1y s SER 13 Cb -0.13 -2.57 0.17 0.00 0.10 0.00 0.00 66.02 63.59 1t1y s SER 13 CO -0.09 -1.38 0.42 0.54 0.98 0.00 0.00 173.24 173.71 1t1y n ARG 14 N -1.70 0.91 -0.22 4.02 1.74 -1.26 -4.34 116.66 115.82 1t1y n ARG 14 Ca 0.11 -3.73 0.29 0.00 -0.77 0.00 0.00 57.85 53.75 1t1y n ARG 14 Cb 0.51 -1.91 0.70 0.00 -1.02 0.00 0.00 32.46 30.74 1t1y n ARG 14 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1t1y h PRO 15 N 5.43 0.05 -0.46 5.56 0.13 -1.85 -2.42 132.00 138.44 1t1y h PRO 15 Ca 0.21 -0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.30 1t1y h PRO 15 Cb 0.84 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.94 1t1y h PRO 15 CO 0.52 0.03 0.10 0.78 -0.23 0.00 0.00 178.00 179.21 1t1y h GLY 16 N 0.05 0.75 -5.85 1.56 0.00 -1.92 -3.46 103.07 94.21 1t1y h GLY 16 Ca 0.46 -0.42 0.15 0.00 0.00 0.00 0.00 47.33 47.52 1t1y h GLY 16 CO -0.03 0.40 0.70 -1.60 0.00 0.00 0.00 176.54 176.00 1t1y s ARG 17 N -5.16 0.22 0.93 4.80 3.52 -0.91 -5.18 118.95 117.17 1t1y s ARG 17 Ca -0.09 0.28 0.00 0.00 -0.13 0.00 0.00 55.73 55.79 1t1y s ARG 17 Cb 0.16 0.10 0.00 0.00 -1.56 0.00 0.00 34.95 33.65 1t1y s ARG 17 CO 0.78 -0.03 0.00 0.41 -0.81 0.00 0.00 175.30 175.65 1t1y n GLY 18 N 2.08 -2.11 3.94 8.12 0.00 -1.26 -4.81 105.19 111.15 1t1y n GLY 18 Ca -0.12 -1.45 -0.24 0.00 0.00 0.00 0.00 46.02 44.20 1t1y n GLY 18 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1t1y s GLU 19 N -0.05 2.86 0.70 1.61 2.02 -1.26 -4.65 118.70 119.93 1t1y s GLU 19 Ca 0.00 -0.30 -0.16 0.00 0.02 0.00 0.00 54.97 54.52 1t1y s GLU 19 Cb 0.00 -2.39 0.02 0.00 0.10 0.00 0.00 34.13 31.86 1t1y s GLU 19 CO 0.00 -0.60 1.25 -2.14 0.02 0.00 0.00 175.26 173.80 1t1y s PRO 20 N -4.83 2.29 0.03 0.39 0.02 -1.26 -4.57 135.00 127.07 1t1y s PRO 20 Ca 0.53 1.93 -0.30 0.00 0.02 0.00 0.00 61.00 63.18 1t1y s PRO 20 Cb -0.10 -1.83 -0.04 0.00 0.02 0.00 0.00 34.50 32.55 1t1y s PRO 20 CO 0.42 -1.76 0.96 0.50 -0.33 0.00 0.00 177.00 176.79 1t1y s ARG 21 N -3.64 4.59 -0.07 5.54 6.06 -0.05 -4.83 118.95 126.54 1t1y s ARG 21 Ca 0.79 1.41 0.03 0.00 -2.50 0.00 0.00 55.73 55.45 1t1y s ARG 21 Cb -0.34 -3.44 0.01 0.00 0.06 0.00 0.00 34.95 31.24 1t1y s ARG 21 CO 0.43 0.02 -0.15 0.12 -2.50 0.00 0.00 175.30 173.21 1t1y s PHE 22 N 0.74 1.76 -0.06 5.12 5.36 -1.26 -0.84 117.98 128.79 1t1y s PHE 22 Ca 0.50 -0.67 -0.01 0.00 -0.96 0.00 0.00 56.93 55.80 1t1y s PHE 22 Cb -0.21 -1.24 0.03 0.00 -0.34 0.00 0.00 43.02 41.25 1t1y s PHE 22 CO 0.28 -0.31 -0.01 0.42 -1.46 0.00 0.00 175.22 174.14 1t1y s ILE 23 N 0.56 0.40 -0.00 3.12 1.01 -0.35 -0.75 121.20 125.18 1t1y s ILE 23 Ca -0.15 0.05 0.07 0.00 0.00 0.00 0.00 60.65 60.62 1t1y s ILE 23 Cb -0.16 -0.52 -0.02 0.00 0.01 0.00 0.00 42.46 41.77 1t1y s ILE 23 CO 0.05 0.24 -0.22 0.00 0.00 0.00 0.00 174.94 175.01 1t1y s ALA 24 N 1.60 1.84 0.03 9.38 0.00 0.13 -1.50 121.76 133.23 1t1y s ALA 24 Ca -0.01 -0.98 0.01 0.00 0.00 0.00 0.00 51.96 50.99 1t1y s ALA 24 Cb -0.13 -0.45 -0.02 0.00 0.00 0.00 0.00 23.12 22.53 1t1y s ALA 24 CO -0.04 0.44 -0.06 0.14 0.00 0.00 0.00 175.76 176.25 1t1y s VAL 25 N -0.58 0.38 0.04 0.00 -7.23 -0.52 -0.90 120.40 111.60 1t1y s VAL 25 Ca 0.08 -0.83 0.09 0.00 -1.81 0.00 0.00 61.98 59.52 1t1y s VAL 25 Cb -0.09 -0.44 -0.03 0.00 0.56 0.00 0.00 36.38 36.38 1t1y s VAL 25 CO -0.00 -0.30 -0.25 -0.83 -0.31 0.00 0.00 175.10 173.40 1t1y s GLY 26 N -1.20 1.35 0.05 2.32 0.00 -0.68 -1.22 107.32 107.93 1t1y s GLY 26 Ca -0.09 -1.23 0.03 0.00 0.00 0.00 0.00 44.72 43.43 1t1y s GLY 26 CO -0.00 -1.12 -0.09 -0.19 0.00 0.00 0.00 173.10 171.70 1t1y s TYR 27 N -0.79 0.79 -0.18 1.90 1.51 -0.07 -0.62 117.35 119.88 1t1y s TYR 27 Ca 0.11 -0.48 0.01 0.00 -1.01 0.00 0.00 57.07 55.70 1t1y s TYR 27 Cb -0.10 -0.46 0.02 0.00 -0.11 0.00 0.00 41.96 41.31 1t1y s TYR 27 CO 0.02 -0.05 -0.17 0.08 -1.11 0.00 0.00 175.55 174.31 1t1y s VAL 28 N -1.32 1.93 0.00 0.71 1.01 0.48 -1.57 120.40 121.63 1t1y s VAL 28 Ca -0.08 -0.92 0.00 0.00 0.00 0.00 0.00 61.98 60.98 1t1y s VAL 28 Cb -0.10 -1.79 0.00 0.00 0.00 0.00 0.00 36.38 34.49 1t1y s VAL 28 CO 0.01 0.46 0.00 0.47 0.00 0.00 0.00 175.10 176.03 1t1y n ASP 29 N 4.65 0.00 -1.79 3.32 8.00 -0.12 -0.32 116.55 130.28 1t1y n ASP 29 Ca -0.19 0.00 0.04 0.00 0.71 0.00 0.00 54.79 55.34 1t1y n ASP 29 Cb 0.49 0.00 0.35 0.00 -0.02 0.00 0.00 41.12 41.94 1t1y n ASP 29 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1t1y n ASP 30 N 4.39 5.13 -4.28 -2.24 8.00 -1.26 -4.89 116.55 121.40 1t1y n ASP 30 Ca 0.00 -2.90 -0.35 0.00 0.71 0.00 0.00 54.79 52.25 1t1y n ASP 30 Cb 0.00 -0.68 -0.14 0.00 -0.02 0.00 0.00 41.12 40.28 1t1y n ASP 30 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1t1y s THR 31 N -2.63 3.34 0.19 -3.53 2.01 0.56 -5.02 115.64 110.56 1t1y s THR 31 Ca 0.49 -0.73 -0.30 0.00 0.31 0.00 0.00 61.69 61.47 1t1y s THR 31 Cb 0.38 -2.63 -0.08 0.00 0.01 0.00 0.00 72.50 70.18 1t1y s THR 31 CO 0.14 0.26 1.15 -1.58 -0.69 0.00 0.00 174.62 173.90 1t1y s GLN 32 N 1.43 4.55 0.00 4.92 0.74 -1.26 -0.39 119.66 129.65 1t1y s GLN 32 Ca 0.03 1.80 0.00 0.00 0.05 0.00 0.00 55.36 57.25 1t1y s GLN 32 Cb -0.16 -3.25 0.00 0.00 1.10 0.00 0.00 33.01 30.70 1t1y s GLN 32 CO -0.02 0.01 0.00 1.97 -0.55 0.00 0.00 175.29 176.70 1t1y n PHE 33 N 2.28 0.00 -4.07 1.67 -1.74 0.20 -4.23 117.46 111.57 1t1y n PHE 33 Ca 0.03 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.82 1t1y n PHE 33 Cb 0.45 0.00 -0.09 0.00 1.52 0.00 0.00 39.48 41.36 1t1y n PHE 33 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 1t1y s VAL 34 N -1.67 0.08 0.17 1.97 -7.23 -1.21 -0.18 120.40 112.33 1t1y s VAL 34 Ca 0.00 -1.70 -0.22 0.00 -1.81 0.00 0.00 61.98 58.25 1t1y s VAL 34 Cb 0.00 -1.97 0.06 0.00 0.56 0.00 0.00 36.38 35.02 1t1y s VAL 34 CO 0.00 -0.39 0.59 0.00 -0.31 0.00 0.00 175.10 174.99 1t1y s ARG 35 N -4.02 1.32 -0.11 4.82 1.70 -0.37 -1.68 118.95 120.60 1t1y s ARG 35 Ca 0.22 -0.58 -0.06 0.00 -0.47 0.00 0.00 55.73 54.84 1t1y s ARG 35 Cb 0.06 0.58 0.05 0.00 -0.57 0.00 0.00 34.95 35.06 1t1y s ARG 35 CO 0.01 -0.58 0.26 0.12 -1.08 0.00 0.00 175.30 174.04 1t1y s PHE 36 N -3.78 -0.36 -0.15 5.89 5.36 -0.08 -0.09 117.98 124.76 1t1y s PHE 36 Ca 0.03 0.84 -0.01 0.00 -0.96 0.00 0.00 56.93 56.83 1t1y s PHE 36 Cb -0.01 0.07 0.04 0.00 -0.34 0.00 0.00 43.02 42.78 1t1y s PHE 36 CO -0.10 -0.25 -0.01 0.34 -1.46 0.00 0.00 175.22 173.74 1t1y s ASP 37 N 1.32 2.55 0.58 6.13 -1.08 -1.26 -0.70 116.67 124.21 1t1y s ASP 37 Ca -0.09 -0.57 0.30 0.00 -0.52 0.00 0.00 52.55 51.67 1t1y s ASP 37 Cb -0.10 -0.71 1.62 0.00 -1.46 0.00 0.00 42.92 42.27 1t1y s ASP 37 CO -0.09 -0.22 1.90 0.77 0.52 0.00 0.00 175.17 178.04 1t1y h SER 38 N 8.21 0.00 0.33 -0.34 4.64 -1.34 0.18 113.55 125.23 1t1y h SER 38 Ca -0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.11 1t1y h SER 38 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 1t1y h SER 38 CO 0.35 0.00 -0.32 0.47 -0.87 0.00 0.00 176.83 176.46 1t1y n ASP 39 N -2.74 0.83 -4.86 4.97 8.00 -1.26 -4.92 116.55 116.56 1t1y n ASP 39 Ca -0.02 -0.67 -0.31 0.00 0.71 0.00 0.00 54.79 54.50 1t1y n ASP 39 Cb 0.28 0.15 -0.02 0.00 -0.02 0.00 0.00 41.12 41.51 1t1y n ASP 39 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1t1y s ALA 40 N -2.65 3.16 0.25 2.24 0.00 0.62 -5.00 121.76 120.38 1t1y s ALA 40 Ca 0.20 -0.04 0.04 0.00 0.00 0.00 0.00 51.96 52.16 1t1y s ALA 40 Cb 0.19 -2.97 0.29 0.00 0.00 0.00 0.00 23.12 20.63 1t1y s ALA 40 CO 0.57 -0.33 1.60 0.00 0.00 0.00 0.00 175.76 177.60 1t1y h ALA 41 N 0.57 0.91 -0.38 0.00 0.00 -1.91 -3.30 119.26 115.16 1t1y h ALA 41 Ca -0.46 -0.49 -0.07 0.00 0.00 0.00 0.00 54.91 53.89 1t1y h ALA 41 Cb 1.19 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 1t1y h ALA 41 CO 0.62 0.67 -0.06 0.66 0.00 0.00 0.00 179.25 181.14 1t1y h SER 42 N 0.24 0.60 -3.83 0.00 4.64 -1.94 -3.46 113.55 109.81 1t1y h SER 42 Ca 0.01 -0.15 -0.38 0.00 -0.47 0.00 0.00 61.79 60.80 1t1y h SER 42 Cb 1.00 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 1t1y h SER 42 CO 0.08 0.72 -0.52 0.00 -0.87 0.00 0.00 176.83 176.24 1t1y n GLN 43 N -4.21 -2.96 -4.16 4.77 1.13 -1.24 -4.97 117.38 105.73 1t1y n GLN 43 Ca 0.01 0.87 -0.13 0.00 -1.94 0.00 0.00 57.00 55.81 1t1y n GLN 43 Cb 0.31 -5.59 -0.11 0.00 0.11 0.00 0.00 30.24 24.96 1t1y n GLN 43 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1t1y s ARG 44 N -5.34 0.80 0.28 -1.09 1.81 -1.26 -5.04 118.95 109.11 1t1y s ARG 44 Ca 0.13 -1.14 -0.29 0.00 -1.72 0.00 0.00 55.73 52.70 1t1y s ARG 44 Cb -0.06 -0.43 -0.10 0.00 -0.45 0.00 0.00 34.95 33.91 1t1y s ARG 44 CO 0.16 0.06 1.33 1.41 -0.68 0.00 0.00 175.30 177.58 1t1y s MET 45 N -2.86 4.35 0.10 3.54 -2.45 -1.26 -4.70 119.30 116.02 1t1y s MET 45 Ca 0.05 2.18 0.09 0.00 -1.25 0.00 0.00 55.69 56.75 1t1y s MET 45 Cb -0.02 -3.12 -0.04 0.00 1.25 0.00 0.00 34.83 32.91 1t1y s MET 45 CO -0.01 -0.24 -0.22 -1.21 1.05 0.00 0.00 175.02 174.39 1t1y s GLU 46 N -1.00 1.17 0.42 4.11 2.02 0.87 -4.91 118.70 121.38 1t1y s GLU 46 Ca 0.53 -1.18 -0.23 0.00 0.02 0.00 0.00 54.97 54.12 1t1y s GLU 46 Cb -0.39 -1.46 -0.09 0.00 0.10 0.00 0.00 34.13 32.29 1t1y s GLU 46 CO 0.46 0.34 1.05 -1.25 0.02 0.00 0.00 175.26 175.89 1t1y s PRO 47 N -1.89 4.06 0.00 0.39 0.04 -1.26 -1.24 135.00 135.09 1t1y s PRO 47 Ca 0.07 1.48 0.00 0.00 0.04 0.00 0.00 61.00 62.59 1t1y s PRO 47 Cb -0.10 -2.42 0.00 0.00 0.04 0.00 0.00 34.50 32.02 1t1y s PRO 47 CO 0.04 -0.23 0.49 0.54 0.04 0.00 0.00 177.00 177.89 1t1y n ARG 48 N -0.32 0.54 -3.82 4.56 5.12 0.74 -4.85 116.66 118.63 1t1y n ARG 48 Ca 0.06 -0.60 -0.12 0.00 -1.93 0.00 0.00 57.85 55.26 1t1y n ARG 48 Cb 0.50 -0.68 -0.13 0.00 -1.16 0.00 0.00 32.46 31.00 1t1y n ARG 48 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1t1y s ALA 49 N -0.22 -0.35 0.23 7.54 0.00 -1.22 -4.69 121.76 123.05 1t1y s ALA 49 Ca 0.00 0.42 -0.07 0.00 0.00 0.00 0.00 51.96 52.31 1t1y s ALA 49 Cb 0.00 -0.25 0.38 0.00 0.00 0.00 0.00 23.12 23.25 1t1y s ALA 49 CO 0.00 -0.07 1.70 -1.00 0.00 0.00 0.00 175.76 176.39 1t1y h PRO 50 N 5.98 0.29 0.00 0.00 0.13 -1.95 -2.30 132.00 134.15 1t1y h PRO 50 Ca -0.26 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1t1y h PRO 50 Cb 1.20 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1t1y h PRO 50 CO 0.42 0.19 0.00 0.11 -0.23 0.00 0.00 178.00 178.49 1t1y h TRP 51 N 0.29 0.00 0.00 1.56 5.08 -1.97 -1.68 115.95 119.24 1t1y h TRP 51 Ca 0.37 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.34 1t1y h TRP 51 Cb 0.57 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.73 1t1y h TRP 51 CO -0.24 0.00 -0.76 0.97 -1.28 0.00 0.00 178.44 177.13 1t1y h ILE 52 N 0.00 0.00 0.00 0.12 6.09 -1.75 -3.29 117.51 118.68 1t1y h ILE 52 Ca 0.00 -0.76 0.00 0.00 -1.37 0.00 0.00 64.86 62.73 1t1y h ILE 52 Cb 0.15 1.33 0.00 0.00 0.47 0.00 0.00 36.82 38.77 1t1y h ILE 52 CO 0.00 0.00 0.00 -0.62 -3.07 0.00 0.00 178.15 174.46 1t1y n GLU 53 N -2.45 0.12 0.19 2.19 1.02 -0.63 -1.70 120.64 119.38 1t1y n GLU 53 Ca 0.02 0.50 0.03 0.00 -0.02 0.00 0.00 57.16 57.69 1t1y n GLU 53 Cb 0.50 -1.80 0.37 0.00 -0.02 0.00 0.00 31.44 30.49 1t1y n GLU 53 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 1t1y h GLN 54 N 0.00 0.00 -6.96 3.49 4.20 -1.72 -3.44 115.11 110.68 1t1y h GLN 54 Ca 0.00 0.00 -0.54 0.00 0.06 0.00 0.00 58.65 58.17 1t1y h GLN 54 Cb 0.15 0.00 0.11 0.00 0.30 0.00 0.00 27.48 28.04 1t1y h GLN 54 CO 0.00 0.37 0.72 -1.21 -0.67 0.00 0.00 178.83 178.04 1t1y s GLU 55 N -4.09 3.90 0.90 1.46 0.41 -0.69 -5.01 118.70 115.58 1t1y s GLU 55 Ca -0.02 2.44 -0.12 0.00 -0.41 0.00 0.00 54.97 56.86 1t1y s GLU 55 Cb 0.14 -2.80 0.18 0.00 -1.78 0.00 0.00 34.13 29.87 1t1y s GLU 55 CO 0.71 -0.66 1.23 0.20 -0.49 0.00 0.00 175.26 176.26 1t1y s GLY 56 N -0.39 1.78 0.28 -1.39 0.00 -1.26 -4.89 107.32 101.45 1t1y s GLY 56 Ca 0.57 -1.36 0.03 0.00 0.00 0.00 0.00 44.72 43.95 1t1y s GLY 56 CO 0.58 -0.64 1.72 -2.55 0.00 0.00 0.00 173.10 172.21 1t1y h PRO 57 N -1.34 0.49 -0.24 2.90 0.11 -1.98 -0.69 132.00 131.25 1t1y h PRO 57 Ca -0.42 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.66 1t1y h PRO 57 Cb 1.24 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 1t1y h PRO 57 CO 0.38 0.32 0.12 1.05 -0.21 0.00 0.00 178.00 179.67 1t1y h GLU 58 N 0.50 0.32 0.37 1.05 9.09 -1.99 -0.10 114.58 123.83 1t1y h GLU 58 Ca 0.53 -0.03 -0.02 0.00 0.05 0.00 0.00 59.36 59.90 1t1y h GLU 58 Cb 0.93 -0.07 0.00 0.00 -1.65 0.00 0.00 28.75 27.96 1t1y h GLU 58 CO -0.46 0.25 -0.18 -0.92 0.05 0.00 0.00 179.01 177.74 1t1y h TYR 59 N 0.33 -0.46 -0.64 2.06 3.20 -1.48 -1.69 116.97 118.28 1t1y h TYR 59 Ca 0.09 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.92 1t1y h TYR 59 Cb 0.02 0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.42 1t1y h TYR 59 CO 0.00 -0.15 0.28 -1.49 -1.64 0.00 0.00 178.16 175.17 1t1y h TRP 60 N -0.80 0.91 -0.42 -3.82 4.06 -1.38 0.93 115.95 115.43 1t1y h TRP 60 Ca -0.05 -0.04 -0.08 0.00 2.06 0.00 0.00 58.89 60.78 1t1y h TRP 60 Cb 0.53 -0.28 -0.01 0.00 -1.00 0.00 0.00 29.16 28.39 1t1y h TRP 60 CO 0.01 0.68 -0.04 -0.44 -3.56 0.00 0.00 178.44 175.09 1t1y h ASP 61 N 0.90 0.76 -0.21 -3.49 3.32 -1.03 -1.37 116.42 115.30 1t1y h ASP 61 Ca 0.22 -0.33 -0.02 0.00 0.02 0.00 0.00 57.03 56.92 1t1y h ASP 61 Cb 0.13 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 1t1y h ASP 61 CO -0.03 0.91 0.04 1.23 -1.72 0.00 0.00 179.24 179.68 1t1y h GLY 62 N 0.59 0.36 1.48 2.75 0.00 -0.83 -1.36 103.07 106.07 1t1y h GLY 62 Ca 0.11 -0.23 -0.06 0.00 0.00 0.00 0.00 47.33 47.15 1t1y h GLY 62 CO 0.03 0.22 0.02 0.83 0.00 0.00 0.00 176.54 177.63 1t1y h GLU 63 N 0.14 0.65 -0.22 4.80 4.39 -0.78 -0.78 114.58 122.78 1t1y h GLU 63 Ca 0.06 -0.15 -0.03 0.00 0.34 0.00 0.00 59.36 59.59 1t1y h GLU 63 Cb 0.29 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.84 1t1y h GLU 63 CO 0.00 0.65 0.02 1.15 -1.16 0.00 0.00 179.01 179.68 1t1y h THR 64 N 0.62 1.24 0.02 1.13 2.02 -1.15 0.22 112.91 117.00 1t1y h THR 64 Ca 0.13 -0.80 0.01 0.00 0.77 0.00 0.00 66.41 66.52 1t1y h THR 64 Cb 0.36 1.33 -0.02 0.00 -1.74 0.00 0.00 68.15 68.08 1t1y h THR 64 CO 0.01 0.25 -0.09 -0.09 0.37 0.00 0.00 175.52 175.97 1t1y h ARG 65 N 0.17 -0.17 -0.57 6.66 2.43 -0.90 -0.72 114.38 121.28 1t1y h ARG 65 Ca 0.07 0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.22 1t1y h ARG 65 Cb 0.35 0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.91 1t1y h ARG 65 CO 0.01 -0.11 0.24 0.87 -1.51 0.00 0.00 179.97 179.46 1t1y h LYS 66 N -0.17 0.84 -0.05 0.20 1.57 -1.08 -1.92 116.57 115.96 1t1y h LYS 66 Ca 0.03 -0.15 -0.10 0.00 -1.87 0.00 0.00 60.65 58.57 1t1y h LYS 66 Cb 0.21 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 1t1y h LYS 66 CO -0.08 0.72 -0.41 -0.24 -0.57 0.00 0.00 179.45 178.87 1t1y h VAL 67 N 0.78 1.30 -0.25 0.50 3.04 -0.31 -0.61 116.25 120.70 1t1y h VAL 67 Ca 0.19 -1.46 -0.14 0.00 -1.01 0.00 0.00 66.70 64.28 1t1y h VAL 67 Cb 0.18 1.73 -0.01 0.00 -2.01 0.00 0.00 31.29 31.18 1t1y h VAL 67 CO -0.02 0.43 -0.42 0.11 -1.01 0.00 0.00 177.57 176.66 1t1y h LYS 68 N 0.09 0.61 -0.35 4.17 1.57 -0.90 -1.43 116.57 120.33 1t1y h LYS 68 Ca 0.01 -0.32 -0.06 0.00 -1.87 0.00 0.00 60.65 58.41 1t1y h LYS 68 Cb 0.77 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.07 1t1y h LYS 68 CO 0.06 0.91 -0.05 0.00 -0.57 0.00 0.00 179.45 179.81 1t1y h ALA 69 N 1.04 1.28 -0.34 3.86 0.00 -0.77 -2.23 119.26 122.10 1t1y h ALA 69 Ca 0.04 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1t1y h ALA 69 Cb 0.93 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 1t1y h ALA 69 CO 0.08 0.48 0.18 0.45 0.00 0.00 0.00 179.25 180.44 1t1y h HIS 70 N 0.53 0.48 -0.41 0.00 3.86 -0.57 -2.18 115.15 116.87 1t1y h HIS 70 Ca 0.11 -0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.28 1t1y h HIS 70 Cb 0.41 -0.15 -0.02 0.00 1.06 0.00 0.00 27.41 28.71 1t1y h HIS 70 CO 0.02 0.40 0.17 0.66 0.86 0.00 0.00 177.93 180.04 1t1y h SER 71 N 0.43 0.52 0.01 2.45 4.64 -0.72 -1.93 113.55 118.94 1t1y h SER 71 Ca 0.12 -0.05 -0.15 0.00 -0.47 0.00 0.00 61.79 61.24 1t1y h SER 71 Cb 0.09 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.04 1t1y h SER 71 CO -0.02 0.47 -0.51 1.56 -0.87 0.00 0.00 176.83 177.46 1t1y h GLN 72 N 0.58 0.56 -0.40 4.77 1.08 -1.22 -1.38 115.11 119.11 1t1y h GLN 72 Ca 0.14 -0.34 -0.01 0.00 -1.45 0.00 0.00 58.65 57.00 1t1y h GLN 72 Cb 0.10 0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 27.55 1t1y h GLN 72 CO -0.02 0.94 0.21 1.15 -0.95 0.00 0.00 178.83 180.16 1t1y h THR 73 N 0.44 1.16 -0.69 -0.54 2.02 -0.75 -1.38 112.91 113.16 1t1y h THR 73 Ca 0.02 -0.42 -0.04 0.00 0.77 0.00 0.00 66.41 66.74 1t1y h THR 73 Cb 1.05 0.71 -0.03 0.00 -1.74 0.00 0.00 68.15 68.13 1t1y h THR 73 CO 0.10 0.16 0.28 0.45 0.37 0.00 0.00 175.52 176.88 1t1y h HIS 74 N 0.51 1.01 -0.09 3.16 3.86 -1.19 0.15 115.15 122.56 1t1y h HIS 74 Ca 0.14 -0.06 0.02 0.00 -1.16 0.00 0.00 60.37 59.31 1t1y h HIS 74 Cb 0.07 -0.31 -0.02 0.00 1.06 0.00 0.00 27.41 28.21 1t1y h HIS 74 CO -0.02 0.77 -0.03 -0.09 0.86 0.00 0.00 177.93 179.42 1t1y h ARG 75 N 0.99 -0.01 -0.75 2.45 2.43 -0.87 0.66 114.38 119.28 1t1y h ARG 75 Ca 0.23 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.39 1t1y h ARG 75 Cb 0.18 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.69 1t1y h ARG 75 CO -0.02 -0.01 0.40 0.28 -1.51 0.00 0.00 179.97 179.11 1t1y h VAL 76 N -0.01 1.23 -0.42 0.20 2.07 -0.81 -2.88 116.25 115.63 1t1y h VAL 76 Ca 0.05 -0.60 0.04 0.00 0.82 0.00 0.00 66.70 67.01 1t1y h VAL 76 Cb 0.08 0.25 -0.04 0.00 -1.52 0.00 0.00 31.29 30.06 1t1y h VAL 76 CO -0.10 0.26 0.17 0.44 0.02 0.00 0.00 177.57 178.36 1t1y h ASP 77 N 1.04 0.22 -0.92 0.57 3.32 -0.05 -0.27 116.42 120.32 1t1y h ASP 77 Ca 0.26 0.04 0.12 0.00 0.02 0.00 0.00 57.03 57.47 1t1y h ASP 77 Cb 0.06 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.54 1t1y h ASP 77 CO -0.04 0.16 0.59 -0.07 -1.72 0.00 0.00 179.24 178.16 1t1y h LEU 78 N 0.36 0.80 -0.14 1.55 3.38 -0.67 0.18 115.31 120.76 1t1y h LEU 78 Ca 0.19 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 58.15 1t1y h LEU 78 Cb 0.15 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 1t1y h LEU 78 CO -0.17 0.44 -0.10 1.23 0.09 0.00 0.00 178.44 179.93 1t1y h GLY 79 N 0.86 0.34 0.90 0.83 0.00 -1.21 -2.26 103.07 102.53 1t1y h GLY 79 Ca 0.45 -0.32 0.02 0.00 0.00 0.00 0.00 47.33 47.47 1t1y h GLY 79 CO -0.21 0.29 0.26 -0.84 0.00 0.00 0.00 176.54 176.04 1t1y h THR 80 N -0.05 1.05 -0.43 4.70 2.02 -0.10 -2.73 112.91 117.37 1t1y h THR 80 Ca 0.03 -0.18 -0.08 0.00 0.77 0.00 0.00 66.41 66.95 1t1y h THR 80 Cb 0.59 0.48 -0.02 0.00 -1.74 0.00 0.00 68.15 67.46 1t1y h THR 80 CO 0.03 0.10 -0.05 -0.07 0.37 0.00 0.00 175.52 175.89 1t1y h LEU 81 N 0.52 0.70 -0.96 2.58 3.38 -0.72 -1.10 115.31 119.71 1t1y h LEU 81 Ca 0.17 -0.18 0.06 0.00 0.09 0.00 0.00 57.88 58.03 1t1y h LEU 81 Cb 0.01 -0.19 -0.07 0.00 0.09 0.00 0.00 40.66 40.51 1t1y h LEU 81 CO -0.08 0.81 0.62 -0.09 0.09 0.00 0.00 178.44 179.78 1t1y h ARG 82 N 0.67 1.09 0.19 1.13 2.43 -1.13 -0.31 114.38 118.45 1t1y h ARG 82 Ca 0.13 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 59.22 1t1y h ARG 82 Cb 0.50 -0.25 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 1t1y h ARG 82 CO 0.03 0.72 -0.09 0.78 -1.51 0.00 0.00 179.97 179.89 1t1y h GLY 83 N 1.12 -0.27 -0.19 2.80 0.00 -1.15 0.18 103.07 105.56 1t1y h GLY 83 Ca 0.42 0.10 0.19 0.00 0.00 0.00 0.00 47.33 48.04 1t1y h GLY 83 CO -0.17 -0.10 0.27 -0.97 0.00 0.00 0.00 176.54 175.57 1t1y h TYR 84 N -0.76 0.43 -0.10 5.60 0.05 -0.86 0.35 116.97 121.69 1t1y h TYR 84 Ca -0.03 0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.80 1t1y h TYR 84 Cb 0.51 -0.06 0.00 0.00 1.01 0.00 0.00 36.73 38.19 1t1y h TYR 84 CO 0.06 -0.09 0.00 0.66 -1.05 0.00 0.00 178.16 177.74 1t1y n TYR 85 N -5.13 0.11 -3.70 4.88 4.01 -0.16 -4.94 117.16 112.24 1t1y n TYR 85 Ca 0.18 -0.06 -0.28 0.00 -0.16 0.00 0.00 57.90 57.59 1t1y n TYR 85 Cb 0.57 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.63 1t1y n TYR 85 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1t1y n ASN 86 N 0.13 -3.87 -4.78 7.72 5.15 0.12 -4.97 115.26 114.76 1t1y n ASN 86 Ca 0.17 -0.96 -0.24 0.00 -0.60 0.00 0.00 54.58 52.95 1t1y n ASN 86 Cb 0.31 -3.56 -0.05 0.00 -0.53 0.00 0.00 39.78 35.94 1t1y n ASN 86 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1t1y s GLN 87 N -5.96 2.79 0.84 1.20 -0.21 0.52 -5.03 119.66 113.81 1t1y s GLN 87 Ca 0.32 -1.02 -0.11 0.00 0.02 0.00 0.00 55.36 54.57 1t1y s GLN 87 Cb -0.11 -2.53 0.10 0.00 1.00 0.00 0.00 33.01 31.47 1t1y s GLN 87 CO 0.85 0.44 1.15 0.45 -2.12 0.00 0.00 175.29 176.06 1t1y s SER 88 N -3.41 3.52 0.00 5.90 0.15 -1.26 -4.80 113.70 113.80 1t1y s SER 88 Ca 0.31 2.16 0.26 0.00 0.70 0.00 0.00 55.95 59.39 1t1y s SER 88 Cb -0.09 -2.56 0.76 0.00 -1.71 0.00 0.00 66.02 62.42 1t1y s SER 88 CO 0.23 -2.70 1.57 -0.62 1.20 0.00 0.00 173.24 172.92 1t1y n GLU 89 N -3.74 0.71 0.11 5.44 1.02 -1.26 -3.99 120.64 118.94 1t1y n GLU 89 Ca 0.12 -0.41 0.12 0.00 -0.02 0.00 0.00 57.16 56.97 1t1y n GLU 89 Cb 0.52 -1.49 0.18 0.00 -0.02 0.00 0.00 31.44 30.63 1t1y n GLU 89 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1t1y h ALA 90 N 3.58 0.73 -2.53 0.62 0.00 -1.95 -3.44 119.26 116.27 1t1y h ALA 90 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.37 1t1y h ALA 90 Cb 0.49 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 1t1y h ALA 90 CO 0.00 0.00 -0.18 0.20 0.00 0.00 0.00 179.25 179.27 1t1y s GLY 91 N -3.91 2.07 0.06 0.00 0.00 -1.26 -4.76 107.32 99.52 1t1y s GLY 91 Ca 0.06 -0.48 -0.19 0.00 0.00 0.00 0.00 44.72 44.11 1t1y s GLY 91 CO 0.70 -0.37 0.55 -0.45 0.00 0.00 0.00 173.10 173.53 1t1y s SER 92 N -2.75 7.03 0.22 1.64 0.15 -1.26 -4.70 113.70 114.02 1t1y s SER 92 Ca 0.44 1.22 0.02 0.00 0.70 0.00 0.00 55.95 58.33 1t1y s SER 92 Cb -0.11 -2.35 -0.05 0.00 -1.71 0.00 0.00 66.02 61.80 1t1y s SER 92 CO 0.26 0.27 0.05 -1.00 1.20 0.00 0.00 173.24 174.02 1t1y s HIS 93 N -1.06 1.43 -0.04 3.44 3.76 -1.26 -4.95 115.29 116.60 1t1y s HIS 93 Ca 0.28 -1.08 0.02 0.00 -0.15 0.00 0.00 55.06 54.14 1t1y s HIS 93 Cb -0.19 -0.83 0.01 0.00 1.11 0.00 0.00 32.58 32.68 1t1y s HIS 93 CO 0.18 -0.24 -0.10 0.99 -0.85 0.00 0.00 174.74 174.73 1t1y s THR 94 N -3.66 0.88 -0.07 1.30 2.01 -1.26 -1.25 115.64 113.59 1t1y s THR 94 Ca 0.31 -0.37 0.04 0.00 0.31 0.00 0.00 61.69 61.98 1t1y s THR 94 Cb 0.07 -0.81 -0.02 0.00 0.01 0.00 0.00 72.50 71.75 1t1y s THR 94 CO 0.09 0.29 -0.18 0.68 -0.69 0.00 0.00 174.62 174.81 1t1y s VAL 95 N 0.48 2.67 0.08 3.82 -7.23 -0.32 -0.82 120.40 119.07 1t1y s VAL 95 Ca -0.09 -0.84 0.07 0.00 -1.81 0.00 0.00 61.98 59.31 1t1y s VAL 95 Cb -0.12 -2.04 -0.03 0.00 0.56 0.00 0.00 36.38 34.75 1t1y s VAL 95 CO 0.02 0.57 -0.18 -1.10 -0.31 0.00 0.00 175.10 174.09 1t1y s GLN 96 N -0.27 1.05 -0.01 4.82 -0.21 -0.42 -1.30 119.66 123.32 1t1y s GLN 96 Ca 0.01 -1.02 -0.03 0.00 0.02 0.00 0.00 55.36 54.33 1t1y s GLN 96 Cb -0.13 -1.20 -0.00 0.00 1.00 0.00 0.00 33.01 32.68 1t1y s GLN 96 CO 0.03 0.28 0.06 0.50 -2.12 0.00 0.00 175.29 174.04 1t1y s ARG 97 N -1.67 0.21 -0.05 2.91 3.52 -0.40 -0.95 118.95 122.52 1t1y s ARG 97 Ca 0.04 -0.15 -0.03 0.00 -0.13 0.00 0.00 55.73 55.45 1t1y s ARG 97 Cb -0.10 0.08 0.02 0.00 -1.56 0.00 0.00 34.95 33.40 1t1y s ARG 97 CO 0.03 -0.04 0.12 1.41 -0.81 0.00 0.00 175.30 176.01 1t1y s MET 98 N -0.55 0.11 0.18 5.12 -2.45 -0.52 -0.45 119.30 120.74 1t1y s MET 98 Ca -0.06 0.23 -0.13 0.00 -1.25 0.00 0.00 55.69 54.48 1t1y s MET 98 Cb -0.04 -0.02 0.01 0.00 1.25 0.00 0.00 34.83 36.03 1t1y s MET 98 CO 0.00 -0.07 0.39 1.52 1.05 0.00 0.00 175.02 177.91 1t1y s TYR 99 N 0.44 0.16 -4.72 4.11 -0.85 -0.73 -1.25 117.35 114.51 1t1y s TYR 99 Ca -0.03 -0.52 0.00 0.00 -0.52 0.00 0.00 57.07 56.00 1t1y s TYR 99 Cb -0.05 0.15 0.00 0.00 0.38 0.00 0.00 41.96 42.44 1t1y s TYR 99 CO -0.02 -0.81 0.00 0.41 -1.52 0.00 0.00 175.55 173.61 1t1y n GLY 100 N -0.27 -1.57 3.10 5.49 0.00 -0.69 -0.86 105.19 110.38 1t1y n GLY 100 Ca -0.09 -1.22 -0.08 0.00 0.00 0.00 0.00 46.02 44.64 1t1y n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t1y s ASP 102 N -2.70 2.83 -0.02 0.00 1.01 0.30 -1.10 116.67 117.00 1t1y s ASP 102 Ca 0.03 -0.56 0.05 0.00 0.71 0.00 0.00 52.55 52.79 1t1y s ASP 102 Cb 0.05 -0.25 -0.03 0.00 1.01 0.00 0.00 42.92 43.70 1t1y s ASP 102 CO -0.09 0.21 -0.16 0.68 0.21 0.00 0.00 175.17 176.03 1t1y s VAL 103 N -0.80 2.95 0.51 -1.27 -7.23 -0.10 -0.36 120.40 114.10 1t1y s VAL 103 Ca 0.10 -0.89 -0.08 0.00 -1.81 0.00 0.00 61.98 59.30 1t1y s VAL 103 Cb -0.09 -2.18 0.12 0.00 0.56 0.00 0.00 36.38 34.78 1t1y s VAL 103 CO 0.02 0.50 0.69 0.61 -0.31 0.00 0.00 175.10 176.62 1t1y n GLY 104 N 2.05 -1.13 0.30 2.32 0.00 0.75 -1.78 105.19 107.69 1t1y n GLY 104 Ca -0.17 -1.72 0.11 0.00 0.00 0.00 0.00 46.02 44.25 1t1y n GLY 104 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1t1y h SER 105 N -0.88 0.05 0.00 1.61 4.64 -1.89 0.24 113.55 117.32 1t1y h SER 105 Ca -0.23 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.09 1t1y h SER 105 Cb 0.64 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 1t1y h SER 105 CO 0.16 0.03 0.00 -0.90 -0.87 0.00 0.00 176.83 175.26 1t1y n ASP 106 N -4.49 0.00 -0.36 4.97 5.68 -1.26 -4.84 116.55 116.26 1t1y n ASP 106 Ca 0.02 -0.73 -0.05 0.00 -0.50 0.00 0.00 54.79 53.53 1t1y n ASP 106 Cb 0.25 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 40.21 1t1y n ASP 106 CO 0.00 0.00 0.00 1.87 -1.33 0.00 0.00 177.20 177.74 1t1y n TRP 107 N -0.98 0.00 -4.03 2.11 -0.00 0.84 -5.00 117.44 110.37 1t1y n TRP 107 Ca 0.16 0.00 -0.22 0.00 -0.00 0.00 0.00 57.50 57.44 1t1y n TRP 107 Cb 0.08 -1.55 -0.03 0.00 -0.00 0.00 0.00 31.31 29.80 1t1y n TRP 107 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 177.69 178.72 1t1y s ARG 108 N -1.87 3.20 0.12 5.87 0.52 -1.26 -4.76 118.95 120.77 1t1y s ARG 108 Ca 0.00 -0.87 -0.35 0.00 -0.52 0.00 0.00 55.73 53.99 1t1y s ARG 108 Cb 0.00 -2.75 -0.17 0.00 0.52 0.00 0.00 34.95 32.55 1t1y s ARG 108 CO 0.00 0.43 1.16 0.34 0.02 0.00 0.00 175.30 177.25 1t1y n PHE 109 N -1.17 1.16 -0.04 -0.53 7.35 -1.26 -0.18 117.46 122.79 1t1y n PHE 109 Ca -0.08 0.74 -0.09 0.00 -0.76 0.00 0.00 57.45 57.26 1t1y n PHE 109 Cb 0.57 -2.25 -0.03 0.00 0.35 0.00 0.00 39.48 38.12 1t1y n PHE 109 CO 0.00 0.00 0.00 -0.11 -0.76 0.00 0.00 176.76 175.89 1t1y n LEU 110 N 2.08 0.75 -3.49 -2.13 7.94 0.52 -4.62 117.00 118.06 1t1y n LEU 110 Ca 0.17 0.09 -0.09 0.00 -1.11 0.00 0.00 56.01 55.07 1t1y n LEU 110 Cb 0.21 -0.24 -0.02 0.00 0.53 0.00 0.00 43.42 43.89 1t1y n LEU 110 CO 0.61 0.20 0.62 0.00 -1.11 0.00 0.00 177.39 177.72 1t1y s ARG 111 N -2.15 0.93 0.21 1.96 1.70 -1.14 -4.99 118.95 115.47 1t1y s ARG 111 Ca -0.11 -0.34 0.09 0.00 -0.47 0.00 0.00 55.73 54.89 1t1y s ARG 111 Cb 0.04 0.43 -0.05 0.00 -0.57 0.00 0.00 34.95 34.80 1t1y s ARG 111 CO 0.15 -0.41 -0.17 0.20 -1.08 0.00 0.00 175.30 173.99 1t1y s GLY 112 N -2.55 1.52 0.02 3.88 0.00 -1.26 -0.54 107.32 108.40 1t1y s GLY 112 Ca 0.04 -1.64 -0.02 0.00 0.00 0.00 0.00 44.72 43.10 1t1y s GLY 112 CO -0.10 -1.72 0.01 -0.19 0.00 0.00 0.00 173.10 171.09 1t1y s TYR 113 N -2.52 0.24 -0.32 1.90 1.51 0.23 -4.82 117.35 113.57 1t1y s TYR 113 Ca 0.22 -0.51 0.02 0.00 -1.01 0.00 0.00 57.07 55.78 1t1y s TYR 113 Cb -0.04 -0.18 0.19 0.00 -0.11 0.00 0.00 41.96 41.83 1t1y s TYR 113 CO 0.08 -0.23 0.72 -1.58 -1.11 0.00 0.00 175.55 173.44 1t1y s HIS 114 N -1.73 -1.45 0.14 2.71 2.46 -1.26 -1.70 115.29 114.46 1t1y s HIS 114 Ca -0.13 0.69 0.05 0.00 0.47 0.00 0.00 55.06 56.14 1t1y s HIS 114 Cb -0.08 0.25 -0.04 0.00 -0.13 0.00 0.00 32.58 32.59 1t1y s HIS 114 CO -0.02 -0.88 -0.11 1.14 -2.47 0.00 0.00 174.74 172.41 1t1y s GLN 115 N 2.61 1.05 0.03 2.88 -2.07 -0.38 -0.54 119.66 123.23 1t1y s GLN 115 Ca 0.15 -1.39 0.02 0.00 -1.82 0.00 0.00 55.36 52.32 1t1y s GLN 115 Cb -0.06 -0.69 -0.02 0.00 -1.09 0.00 0.00 33.01 31.15 1t1y s GLN 115 CO -0.21 0.10 -0.07 -0.47 -1.32 0.00 0.00 175.29 173.32 1t1y s TYR 116 N -3.01 0.63 0.04 9.60 6.14 0.28 -1.44 117.35 129.59 1t1y s TYR 116 Ca 0.14 -0.37 0.02 0.00 0.64 0.00 0.00 57.07 57.51 1t1y s TYR 116 Cb 0.01 -0.38 -0.02 0.00 0.42 0.00 0.00 41.96 41.98 1t1y s TYR 116 CO 0.01 -0.06 -0.08 0.00 0.64 0.00 0.00 175.55 176.07 1t1y s ALA 117 N -0.97 0.61 -0.07 3.97 0.00 -0.13 -0.48 121.76 124.69 1t1y s ALA 117 Ca -0.06 -0.78 0.02 0.00 0.00 0.00 0.00 51.96 51.14 1t1y s ALA 117 Cb -0.07 0.04 0.01 0.00 0.00 0.00 0.00 23.12 23.09 1t1y s ALA 117 CO 0.00 -0.01 -0.13 -0.47 0.00 0.00 0.00 175.76 175.15 1t1y s TYR 118 N -1.39 1.56 -1.66 0.00 5.04 -0.65 -1.31 117.35 118.94 1t1y s TYR 118 Ca -0.09 -0.59 -0.14 0.00 -2.44 0.00 0.00 57.07 53.80 1t1y s TYR 118 Cb -0.10 -1.13 0.13 0.00 0.35 0.00 0.00 41.96 41.21 1t1y s TYR 118 CO 0.00 -0.29 0.65 -0.25 -1.34 0.00 0.00 175.55 174.32 1t1y n ASP 119 N 3.80 -2.33 -0.01 4.32 8.00 -0.00 -2.17 116.55 128.15 1t1y n ASP 119 Ca -0.22 -1.05 -0.00 0.00 0.71 0.00 0.00 54.79 54.22 1t1y n ASP 119 Cb 0.52 -2.62 -0.00 0.00 -0.02 0.00 0.00 41.12 39.00 1t1y n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1t1y n GLY 120 N -1.56 0.47 3.20 0.44 0.00 -1.26 -5.03 105.19 101.46 1t1y n GLY 120 Ca -0.02 -0.16 -0.22 0.00 0.00 0.00 0.00 46.02 45.62 1t1y n GLY 120 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1t1y s LYS 121 N -0.42 1.12 0.22 1.61 1.02 -0.92 -5.11 119.74 117.26 1t1y s LYS 121 Ca 0.00 -0.89 -0.30 0.00 0.02 0.00 0.00 55.97 54.80 1t1y s LYS 121 Cb 0.00 -1.20 -0.15 0.00 -0.52 0.00 0.00 37.83 35.95 1t1y s LYS 121 CO 0.00 0.30 0.97 -0.25 -0.92 0.00 0.00 175.35 175.44 1t1y n ASP 122 N 1.75 0.76 0.00 2.83 8.00 -1.26 -1.64 116.55 126.98 1t1y n ASP 122 Ca -0.18 1.16 0.00 0.00 0.71 0.00 0.00 54.79 56.48 1t1y n ASP 122 Cb 0.54 -1.18 0.00 0.00 -0.02 0.00 0.00 41.12 40.46 1t1y n ASP 122 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1t1y n TYR 123 N 0.66 0.00 -3.84 1.24 9.36 0.36 -4.72 117.16 120.22 1t1y n TYR 123 Ca 0.13 0.00 -0.12 0.00 3.32 0.00 0.00 57.90 61.24 1t1y n TYR 123 Cb 0.27 0.00 -0.12 0.00 -0.63 0.00 0.00 39.34 38.86 1t1y n TYR 123 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 1t1y s ILE 124 N -0.99 0.03 -0.01 2.97 2.07 -1.09 -1.59 121.20 122.59 1t1y s ILE 124 Ca 0.00 -0.23 -0.03 0.00 -1.41 0.00 0.00 60.65 58.98 1t1y s ILE 124 Cb 0.00 -0.28 -0.00 0.00 0.13 0.00 0.00 42.46 42.30 1t1y s ILE 124 CO 0.00 -0.13 0.05 0.00 -1.91 0.00 0.00 174.94 172.95 1t1y s ALA 125 N -0.40 -0.11 0.01 1.50 0.00 -0.41 -0.56 121.76 121.78 1t1y s ALA 125 Ca -0.05 -0.12 -0.30 0.00 0.00 0.00 0.00 51.96 51.49 1t1y s ALA 125 Cb -0.03 0.02 -0.04 0.00 0.00 0.00 0.00 23.12 23.07 1t1y s ALA 125 CO 0.01 -0.11 1.06 -1.17 0.00 0.00 0.00 175.76 175.55 1t1y s LEU 126 N -0.72 4.35 0.88 0.00 2.96 0.30 -0.21 118.68 126.24 1t1y s LEU 126 Ca -0.08 1.77 -0.12 0.00 -0.22 0.00 0.00 54.13 55.48 1t1y s LEU 126 Cb -0.05 -3.57 0.12 0.00 0.50 0.00 0.00 46.19 43.19 1t1y s LEU 126 CO 0.00 -0.36 1.10 -0.54 -1.32 0.00 0.00 176.35 175.22 1t1y s LYS 127 N 1.20 1.43 0.53 1.98 1.02 -0.16 -4.58 119.74 121.16 1t1y s LYS 127 Ca 0.54 0.74 0.21 0.00 0.02 0.00 0.00 55.97 57.47 1t1y s LYS 127 Cb -0.24 -1.84 1.37 0.00 -0.52 0.00 0.00 37.83 36.61 1t1y s LYS 127 CO 0.27 -2.10 2.10 1.49 -0.92 0.00 0.00 175.35 176.19 1t1y h GLU 128 N -1.44 0.00 0.00 1.68 4.81 -1.88 0.16 114.58 117.90 1t1y h GLU 128 Ca -0.49 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 1t1y h GLU 128 Cb 1.28 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.66 1t1y h GLU 128 CO 0.56 0.00 0.00 -0.40 -0.73 0.00 0.00 179.01 178.44 1t1y n ASP 129 N -4.40 0.00 -2.39 1.04 3.85 -1.26 -4.78 116.55 108.62 1t1y n ASP 129 Ca 0.02 0.06 -0.17 0.00 -0.71 0.00 0.00 54.79 53.98 1t1y n ASP 129 Cb 0.28 -0.32 -0.01 0.00 -1.35 0.00 0.00 41.12 39.72 1t1y n ASP 129 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 1t1y n LEU 130 N -1.32 -1.61 0.00 -2.12 4.77 0.54 -4.79 117.00 112.47 1t1y n LEU 130 Ca 0.09 0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.15 1t1y n LEU 130 Cb 0.18 -2.62 0.00 0.00 -2.33 0.00 0.00 43.42 38.65 1t1y n LEU 130 CO 0.16 -0.21 -0.24 0.54 -1.33 0.00 0.00 177.39 176.31 1t1y n ARG 131 N -2.91 2.87 -4.43 3.23 1.74 -1.26 -4.65 116.66 111.25 1t1y n ARG 131 Ca -0.21 0.00 -0.22 0.00 -0.77 0.00 0.00 57.85 56.66 1t1y n ARG 131 Cb 0.65 -0.74 -0.10 0.00 -1.02 0.00 0.00 32.46 31.25 1t1y n ARG 131 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1t1y s SER 132 N -1.16 2.98 0.08 0.55 1.04 -1.26 -4.90 113.70 111.02 1t1y s SER 132 Ca 0.00 -1.12 0.08 0.00 0.48 0.00 0.00 55.95 55.39 1t1y s SER 132 Cb 0.00 -0.21 -0.04 0.00 0.10 0.00 0.00 66.02 65.88 1t1y s SER 132 CO 0.00 -0.21 -0.16 0.26 0.98 0.00 0.00 173.24 174.10 1t1y s TRP 133 N -2.86 2.59 -0.33 5.02 0.52 -1.26 -0.99 118.94 121.62 1t1y s TRP 133 Ca 0.28 -0.24 -0.08 0.00 0.02 0.00 0.00 56.10 56.09 1t1y s TRP 133 Cb 0.01 -1.42 0.03 0.00 -1.15 0.00 0.00 33.47 30.93 1t1y s TRP 133 CO 0.12 0.33 0.13 0.99 0.02 0.00 0.00 176.95 178.53 1t1y s THR 134 N -1.05 4.07 -0.22 2.01 2.01 0.71 -4.91 115.64 118.26 1t1y s THR 134 Ca 0.17 -0.91 -0.07 0.00 0.31 0.00 0.00 61.69 61.18 1t1y s THR 134 Cb -0.11 -3.23 -0.03 0.00 0.01 0.00 0.00 72.50 69.14 1t1y s THR 134 CO 0.08 -0.11 0.07 0.00 -0.69 0.00 0.00 174.62 173.97 1t1y s ALA 135 N 1.48 3.26 0.10 7.40 0.00 -1.26 -1.29 121.76 131.44 1t1y s ALA 135 Ca 0.01 -0.98 0.16 0.00 0.00 0.00 0.00 51.96 51.15 1t1y s ALA 135 Cb -0.19 -2.02 0.44 0.00 0.00 0.00 0.00 23.12 21.35 1t1y s ALA 135 CO 0.04 -0.22 1.62 0.00 0.00 0.00 0.00 175.76 177.20 1t1y h ALA 136 N 7.62 0.87 -2.81 0.00 0.00 -1.58 -3.46 119.26 119.90 1t1y h ALA 136 Ca -0.37 -0.43 -0.06 0.00 0.00 0.00 0.00 54.91 54.05 1t1y h ALA 136 Cb 1.18 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 1t1y h ALA 136 CO 0.62 0.60 -0.02 -0.40 0.00 0.00 0.00 179.25 180.05 1t1y n ASP 137 N -3.47 -0.37 0.24 0.00 5.68 -1.26 -5.04 116.55 112.32 1t1y n ASP 137 Ca 0.00 -1.45 0.13 0.00 -0.50 0.00 0.00 54.79 52.97 1t1y n ASP 137 Cb 0.61 0.67 0.47 0.00 -1.14 0.00 0.00 41.12 41.73 1t1y n ASP 137 CO 0.00 0.00 0.00 0.24 -1.33 0.00 0.00 177.20 176.11 1t1y h MET 138 N 0.00 0.00 -0.01 0.11 2.86 -1.99 -0.41 114.93 115.50 1t1y h MET 138 Ca -0.07 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.57 1t1y h MET 138 Cb 0.29 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.95 1t1y h MET 138 CO 0.09 0.11 -0.00 0.00 1.06 0.00 0.00 176.91 178.16 1t1y h ALA 139 N 1.89 0.01 -0.17 6.32 0.00 -1.97 -2.88 119.26 122.47 1t1y h ALA 139 Ca -0.00 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 1t1y h ALA 139 Cb 0.73 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1t1y h ALA 139 CO 0.01 -0.26 0.08 0.00 0.00 0.00 0.00 179.25 179.09 1t1y h ALA 140 N 0.55 1.83 -0.78 0.00 0.00 -1.78 -1.95 119.26 117.13 1t1y h ALA 140 Ca 0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1t1y h ALA 140 Cb 0.46 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 1t1y h ALA 140 CO 0.00 0.14 0.39 1.96 0.00 0.00 0.00 179.25 181.74 1t1y h GLN 141 N 0.23 1.10 -0.47 0.00 1.08 -0.94 0.12 115.11 116.22 1t1y h GLN 141 Ca 0.06 -0.14 -0.11 0.00 -1.45 0.00 0.00 58.65 57.00 1t1y h GLN 141 Cb 0.03 -0.21 -0.02 0.00 -0.05 0.00 0.00 27.48 27.23 1t1y h GLN 141 CO -0.01 0.83 -0.16 1.79 -0.95 0.00 0.00 178.83 180.33 1t1y h THR 142 N 1.09 1.27 -0.39 -0.54 1.35 -1.15 -1.01 112.91 113.54 1t1y h THR 142 Ca 0.27 -1.29 -0.02 0.00 -0.55 0.00 0.00 66.41 64.81 1t1y h THR 142 Cb 0.08 1.07 -0.02 0.00 -1.73 0.00 0.00 68.15 67.56 1t1y h THR 142 CO -0.04 0.45 0.16 0.74 -0.25 0.00 0.00 175.52 176.58 1t1y h THR 143 N 0.80 1.19 -0.32 6.82 2.02 -1.22 -2.21 112.91 119.99 1t1y h THR 143 Ca 0.12 -0.58 0.04 0.00 0.77 0.00 0.00 66.41 66.77 1t1y h THR 143 Cb 0.70 0.85 -0.04 0.00 -1.74 0.00 0.00 68.15 67.92 1t1y h THR 143 CO 0.05 0.21 0.07 0.50 0.37 0.00 0.00 175.52 176.72 1t1y h LYS 144 N 0.48 0.18 -0.98 6.66 3.64 -0.45 -0.16 116.57 125.95 1t1y h LYS 144 Ca 0.13 -0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.54 1t1y h LYS 144 Cb 0.18 -0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 31.90 1t1y h LYS 144 CO -0.01 0.12 0.64 0.45 -2.27 0.00 0.00 179.45 178.38 1t1y h HIS 145 N 0.18 1.20 -0.54 1.91 3.86 -0.99 -0.89 115.15 119.88 1t1y h HIS 145 Ca 0.15 0.03 -0.09 0.00 -1.16 0.00 0.00 60.37 59.30 1t1y h HIS 145 Cb 0.16 -0.40 -0.02 0.00 1.06 0.00 0.00 27.41 28.21 1t1y h HIS 145 CO -0.17 0.69 -0.02 -0.22 0.86 0.00 0.00 177.93 179.07 1t1y h LYS 146 N 1.24 0.97 0.00 2.45 3.64 -0.77 -2.66 116.57 121.44 1t1y h LYS 146 Ca 0.39 -0.32 -0.11 0.00 -1.27 0.00 0.00 60.65 59.34 1t1y h LYS 146 Cb 0.01 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.73 1t1y h LYS 146 CO -0.13 0.99 -0.50 -1.49 -2.27 0.00 0.00 179.45 176.05 1t1y h TRP 147 N 0.85 0.00 -0.21 1.91 4.06 -0.55 -1.87 115.95 120.15 1t1y h TRP 147 Ca 0.15 0.00 -0.10 0.00 2.06 0.00 0.00 58.89 61.00 1t1y h TRP 147 Cb 0.57 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.72 1t1y h TRP 147 CO 0.04 0.50 -0.26 0.93 -3.56 0.00 0.00 178.44 176.09 1t1y h GLU 148 N 0.00 0.54 -0.43 0.49 5.08 -1.07 -0.53 114.58 118.66 1t1y h GLU 148 Ca -0.01 -0.31 -0.07 0.00 -1.00 0.00 0.00 59.36 57.98 1t1y h GLU 148 Cb 1.04 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.29 1t1y h GLU 148 CO 0.07 0.90 -0.01 0.00 -1.00 0.00 0.00 179.01 178.97 1t1y h ALA 149 N 0.63 1.19 -0.01 3.43 0.00 -1.38 -2.00 119.26 121.13 1t1y h ALA 149 Ca 0.03 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1t1y h ALA 149 Cb 0.83 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1t1y h ALA 149 CO 0.06 0.53 -0.12 0.00 0.00 0.00 0.00 179.25 179.73 1t1y n ALA 150 N -2.47 2.79 -3.64 0.00 0.00 -0.71 -4.94 120.51 111.54 1t1y n ALA 150 Ca 0.02 -0.32 -0.24 0.00 0.00 0.00 0.00 53.44 52.90 1t1y n ALA 150 Cb 0.28 -1.28 0.07 0.00 0.00 0.00 0.00 19.45 18.52 1t1y n ALA 150 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1t1y n HIS 151 N -0.73 -2.69 -0.12 0.00 -0.00 -0.39 -4.91 115.22 106.37 1t1y n HIS 151 Ca 0.15 0.99 0.01 0.00 -0.00 0.00 0.00 57.72 58.87 1t1y n HIS 151 Cb 0.29 -4.85 0.29 0.00 -0.00 0.00 0.00 29.99 25.72 1t1y n HIS 151 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.34 176.62 1t1y h VAL 152 N -2.50 1.17 -0.52 1.59 2.07 -1.43 -2.82 116.25 113.82 1t1y h VAL 152 Ca -0.58 -0.42 0.03 0.00 0.82 0.00 0.00 66.70 66.56 1t1y h VAL 152 Cb 1.37 0.38 -0.04 0.00 -1.52 0.00 0.00 31.29 31.48 1t1y h VAL 152 CO 0.57 0.19 0.29 0.00 0.02 0.00 0.00 177.57 178.64 1t1y h ALA 153 N 1.56 0.67 -0.48 1.67 0.00 -1.90 -1.23 119.26 119.55 1t1y h ALA 153 Ca 0.21 0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.16 1t1y h ALA 153 Cb 0.01 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 1t1y h ALA 153 CO -0.04 -0.03 0.23 0.93 0.00 0.00 0.00 179.25 180.35 1t1y h GLU 154 N 0.57 0.45 -0.59 0.00 5.08 -1.76 0.17 114.58 118.50 1t1y h GLU 154 Ca 0.22 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.54 1t1y h GLU 154 Cb 0.07 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 1t1y h GLU 154 CO -0.12 0.30 0.34 1.96 -1.00 0.00 0.00 179.01 180.48 1t1y h GLN 155 N 0.46 0.81 -0.29 2.33 4.20 -1.38 -2.20 115.11 119.04 1t1y h GLN 155 Ca 0.21 -0.08 -0.06 0.00 0.06 0.00 0.00 58.65 58.78 1t1y h GLN 155 Cb 0.13 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.74 1t1y h GLN 155 CO -0.16 0.60 -0.05 -0.07 -0.67 0.00 0.00 178.83 178.49 1t1y h LEU 156 N 0.80 0.55 -0.71 1.46 3.38 -0.78 -2.93 115.31 117.07 1t1y h LEU 156 Ca 0.21 -0.35 0.10 0.00 0.09 0.00 0.00 57.88 57.93 1t1y h LEU 156 Cb 0.01 -0.15 -0.08 0.00 0.09 0.00 0.00 40.66 40.54 1t1y h LEU 156 CO -0.04 0.77 0.34 -0.09 0.09 0.00 0.00 178.44 179.51 1t1y h ARG 157 N 0.32 0.55 -0.80 1.13 2.43 -0.50 0.24 114.38 117.75 1t1y h ARG 157 Ca 0.08 -0.03 0.04 0.00 -0.81 0.00 0.00 59.98 59.25 1t1y h ARG 157 Cb 0.52 -0.12 -0.05 0.00 -0.42 0.00 0.00 29.97 29.89 1t1y h ARG 157 CO 0.02 0.36 0.51 0.00 -1.51 0.00 0.00 179.97 179.36 1t1y h ALA 158 N 1.45 1.06 0.15 2.80 0.00 -1.30 -0.39 119.26 123.03 1t1y h ALA 158 Ca 0.36 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 1t1y h ALA 158 Cb 0.41 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1t1y h ALA 158 CO -0.29 0.31 -0.07 -0.92 0.00 0.00 0.00 179.25 178.28 1t1y h TYR 159 N 0.98 -0.19 -0.83 0.00 3.20 -0.99 -2.07 116.97 117.06 1t1y h TYR 159 Ca 0.33 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.20 1t1y h TYR 159 Cb 0.04 0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.33 1t1y h TYR 159 CO -0.03 0.22 0.55 -0.07 -1.64 0.00 0.00 178.16 177.19 1t1y h LEU 160 N -0.67 0.94 0.00 2.82 3.38 -0.43 0.17 115.31 121.52 1t1y h LEU 160 Ca -0.02 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 1t1y h LEU 160 Cb 0.49 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 1t1y h LEU 160 CO 0.03 0.68 -0.68 -0.33 0.09 0.00 0.00 178.44 178.23 1t1y h GLU 161 N 1.11 0.00 0.00 1.13 5.08 -1.17 -3.35 114.58 117.38 1t1y h GLU 161 Ca 0.31 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.67 1t1y h GLU 161 Cb -0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.15 1t1y h GLU 161 CO -0.07 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.35 1t1y n GLY 162 N 1.16 0.28 0.26 -3.84 0.00 -0.78 -4.66 105.19 97.60 1t1y n GLY 162 Ca 0.01 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.04 1t1y n GLY 162 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1t1y h THR 163 N 0.00 0.33 -0.01 2.61 2.02 -1.57 -0.58 112.91 115.72 1t1y h THR 163 Ca 0.00 -0.01 0.03 0.00 0.77 0.00 0.00 66.41 67.21 1t1y h THR 163 Cb 0.00 0.31 -0.05 0.00 -1.74 0.00 0.00 68.15 66.67 1t1y h THR 163 CO 0.00 0.00 -0.31 0.00 0.37 0.00 0.00 175.52 175.59 1t1y h VAL 165 N -0.45 1.23 -0.45 0.00 2.07 -1.53 -0.76 116.25 116.36 1t1y h VAL 165 Ca 0.06 -0.73 -0.02 0.00 0.82 0.00 0.00 66.70 66.83 1t1y h VAL 165 Cb 0.54 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.72 1t1y h VAL 165 CO -0.26 0.29 0.19 -0.33 0.02 0.00 0.00 177.57 177.49 1t1y h GLU 166 N 0.97 0.66 -0.18 1.57 5.08 -0.69 -1.72 114.58 120.27 1t1y h GLU 166 Ca 0.23 -0.11 -0.17 0.00 -1.00 0.00 0.00 59.36 58.30 1t1y h GLU 166 Cb 0.19 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.32 1t1y h GLU 166 CO -0.02 0.59 -0.60 -1.49 -1.00 0.00 0.00 179.01 176.48 1t1y h TRP 167 N 0.58 0.78 -0.44 4.33 4.06 -1.05 -2.00 115.95 122.21 1t1y h TRP 167 Ca 0.15 -0.29 0.04 0.00 2.06 0.00 0.00 58.89 60.85 1t1y h TRP 167 Cb 0.16 -0.14 -0.04 0.00 -1.00 0.00 0.00 29.16 28.14 1t1y h TRP 167 CO -0.00 1.06 0.19 1.25 -3.56 0.00 0.00 178.44 177.38 1t1y h LEU 168 N 0.45 0.25 -0.84 -4.49 5.85 -0.93 0.11 115.31 115.72 1t1y h LEU 168 Ca -0.00 0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.72 1t1y h LEU 168 Cb 1.17 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 42.15 1t1y h LEU 168 CO 0.12 0.18 0.38 0.03 -0.34 0.00 0.00 178.44 178.81 1t1y h ARG 169 N 0.39 1.22 -0.15 1.25 3.08 -1.25 -0.37 114.38 118.54 1t1y h ARG 169 Ca 0.20 -0.19 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 1t1y h ARG 169 Cb 0.14 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 1t1y h ARG 169 CO -0.17 0.95 0.08 -0.09 -1.07 0.00 0.00 179.97 179.68 1t1y h ARG 170 N 1.20 0.22 -0.69 0.04 2.43 -0.54 -1.98 114.38 115.04 1t1y h ARG 170 Ca 0.28 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.41 1t1y h ARG 170 Cb 0.15 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.62 1t1y h ARG 170 CO -0.03 0.23 0.37 1.88 -1.51 0.00 0.00 179.97 180.91 1t1y h TYR 171 N 0.15 0.96 -0.90 2.20 0.05 -0.53 -1.02 116.97 117.87 1t1y h TYR 171 Ca 0.05 -0.03 0.05 0.00 0.05 0.00 0.00 58.73 58.86 1t1y h TYR 171 Cb 0.07 -0.31 -0.06 0.00 1.01 0.00 0.00 36.73 37.45 1t1y h TYR 171 CO -0.04 0.68 0.59 -0.07 -1.05 0.00 0.00 178.16 178.27 1t1y h LEU 172 N 0.95 0.93 0.01 3.88 3.38 -0.84 -0.13 115.31 123.49 1t1y h LEU 172 Ca 0.24 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.21 1t1y h LEU 172 Cb 0.05 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.60 1t1y h LEU 172 CO -0.04 0.61 -0.00 -0.08 0.09 0.00 0.00 178.44 179.02 1t1y h GLU 173 N 1.06 -0.01 -0.90 1.13 4.81 -0.94 -1.70 114.58 118.02 1t1y h GLU 173 Ca 0.38 0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.66 1t1y h GLU 173 Cb 0.14 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.46 1t1y h GLU 173 CO -0.13 0.57 0.59 -0.91 -0.73 0.00 0.00 179.01 178.39 1t1y h ASN 174 N -0.60 0.93 -0.52 1.04 2.35 -0.85 -2.21 115.58 115.71 1t1y h ASN 174 Ca -0.00 0.00 -0.21 0.00 -0.55 0.00 0.00 56.30 55.54 1t1y h ASN 174 Cb 0.58 -0.20 -0.13 0.00 0.05 0.00 0.00 38.32 38.63 1t1y h ASN 174 CO 0.00 0.61 0.14 0.61 -1.65 0.00 0.00 177.43 177.14 1t1y n GLY 175 N -1.40 4.41 0.46 2.83 0.00 -0.09 -4.74 105.19 106.65 1t1y n GLY 175 Ca 0.13 -1.12 0.27 0.00 0.00 0.00 0.00 46.02 45.30 1t1y n GLY 175 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1t1y h LYS 176 N 1.50 0.08 -0.50 1.61 2.10 -0.64 0.27 116.57 120.97 1t1y h LYS 176 Ca 0.26 -0.00 0.10 0.00 -2.00 0.00 0.00 60.65 59.01 1t1y h LYS 176 Cb 1.97 -0.02 -0.03 0.00 -0.90 0.00 0.00 32.23 33.25 1t1y h LYS 176 CO 0.55 0.05 0.35 0.93 -2.00 0.00 0.00 179.45 179.33 1t1y h GLU 177 N 0.08 0.23 0.00 0.07 4.39 -1.85 -2.13 114.58 115.37 1t1y h GLU 177 Ca 0.45 -0.01 -0.20 0.00 0.34 0.00 0.00 59.36 59.93 1t1y h GLU 177 Cb 1.65 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 30.22 1t1y h GLU 177 CO -0.04 0.15 -1.64 0.25 -1.16 0.00 0.00 179.01 176.57 1t1y n THR 178 N -4.45 0.71 0.26 1.13 -2.24 -0.66 -4.44 114.28 104.59 1t1y n THR 178 Ca 0.08 -0.15 0.09 0.00 -2.27 0.00 0.00 64.05 61.80 1t1y n THR 178 Cb 0.40 -1.68 0.68 0.00 -2.10 0.00 0.00 70.33 67.63 1t1y n THR 178 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1t1y h LEU 179 N -0.45 0.00 -3.24 3.22 3.38 -1.07 -2.14 115.31 115.02 1t1y h LEU 179 Ca -0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1t1y h LEU 179 Cb 1.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.99 1t1y h LEU 179 CO -0.18 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.35 1t1y n GLN 180 N -4.44 3.53 -4.74 1.13 6.02 -0.80 -4.91 117.38 113.16 1t1y n GLN 180 Ca -0.03 -2.81 -0.33 0.00 -0.01 0.00 0.00 57.00 53.82 1t1y n GLN 180 Cb 0.11 -1.86 -0.12 0.00 1.02 0.00 0.00 30.24 29.38 1t1y n GLN 180 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 1t1y s ARG 181 N -2.32 2.77 -0.08 -1.09 3.52 -0.80 -5.02 118.95 115.93 1t1y s ARG 181 Ca 0.44 -0.62 -0.02 0.00 -0.13 0.00 0.00 55.73 55.40 1t1y s ARG 181 Cb 0.32 -2.52 -0.03 0.00 -1.56 0.00 0.00 34.95 31.15 1t1y s ARG 181 CO 0.15 0.57 0.02 0.95 -0.81 0.00 0.00 175.30 176.18 1t1y s THR 182 N -0.58 4.43 -0.33 4.11 -4.23 -1.26 -4.83 115.64 112.94 1t1y s THR 182 Ca 0.08 -0.23 -0.07 0.00 -1.18 0.00 0.00 61.69 60.30 1t1y s THR 182 Cb -0.12 -2.88 0.03 0.00 1.34 0.00 0.00 72.50 70.88 1t1y s THR 182 CO 0.02 0.59 0.11 -1.81 -0.54 0.00 0.00 174.62 172.98 1t1y s ASP 183 N -0.97 5.31 0.38 3.99 1.01 0.59 -4.95 116.67 122.03 1t1y s ASP 183 Ca 0.14 -1.08 -0.27 0.00 0.71 0.00 0.00 52.55 52.06 1t1y s ASP 183 Cb -0.11 -1.88 -0.09 0.00 1.01 0.00 0.00 42.92 41.85 1t1y s ASP 183 CO 0.03 -0.31 1.26 0.00 0.21 0.00 0.00 175.17 176.37 1t1y s ALA 184 N 1.42 3.31 0.37 5.23 0.00 -1.26 -1.14 121.76 129.69 1t1y s ALA 184 Ca -0.01 1.17 -0.28 0.00 0.00 0.00 0.00 51.96 52.84 1t1y s ALA 184 Cb -0.19 -3.45 -0.10 0.00 0.00 0.00 0.00 23.12 19.37 1t1y s ALA 184 CO 0.03 -0.67 1.41 -1.25 0.00 0.00 0.00 175.76 175.27 1t1y s PRO 185 N -2.08 4.12 -0.27 0.00 0.04 -1.26 -4.59 135.00 130.95 1t1y s PRO 185 Ca 0.54 2.41 -0.18 0.00 0.04 0.00 0.00 61.00 63.81 1t1y s PRO 185 Cb -0.37 -2.94 -0.02 0.00 0.04 0.00 0.00 34.50 31.21 1t1y s PRO 185 CO 0.47 -0.46 0.53 0.15 0.04 0.00 0.00 177.00 177.73 1t1y s LYS 186 N -2.06 4.02 0.16 4.56 1.02 0.15 -4.82 119.74 122.78 1t1y s LYS 186 Ca 0.53 0.29 0.10 0.00 0.02 0.00 0.00 55.97 56.91 1t1y s LYS 186 Cb -0.43 -3.67 -0.04 0.00 -0.52 0.00 0.00 37.83 33.17 1t1y s LYS 186 CO 0.58 -0.39 -0.17 0.95 -0.92 0.00 0.00 175.35 175.40 1t1y s THR 187 N 2.35 2.80 0.19 2.17 -4.23 -1.26 -0.76 115.64 116.90 1t1y s THR 187 Ca 0.21 -1.73 -0.24 0.00 -1.18 0.00 0.00 61.69 58.76 1t1y s THR 187 Cb -0.16 -2.34 0.05 0.00 1.34 0.00 0.00 72.50 71.39 1t1y s THR 187 CO 0.10 -0.04 0.84 -1.38 -0.54 0.00 0.00 174.62 173.60 1t1y s HIS 188 N -1.50 -0.19 0.04 3.99 -3.43 -1.08 -5.01 115.29 108.12 1t1y s HIS 188 Ca 0.21 -0.16 0.07 0.00 -0.80 0.00 0.00 55.06 54.38 1t1y s HIS 188 Cb -0.09 0.66 -0.02 0.00 -1.43 0.00 0.00 32.58 31.69 1t1y s HIS 188 CO 0.12 -0.97 -0.19 1.41 -2.00 0.00 0.00 174.74 173.11 1t1y s MET 189 N -3.54 1.27 0.22 -0.38 1.75 -1.26 -0.53 119.30 116.83 1t1y s MET 189 Ca 0.11 -0.89 0.11 0.00 -1.25 0.00 0.00 55.69 53.77 1t1y s MET 189 Cb -0.03 -1.36 -0.05 0.00 2.84 0.00 0.00 34.83 36.23 1t1y s MET 189 CO 0.03 0.35 -0.22 0.95 -0.65 0.00 0.00 175.02 175.47 1t1y s THR 190 N -0.81 2.44 -0.08 10.11 -4.23 -0.07 -4.96 115.64 118.03 1t1y s THR 190 Ca 0.06 -2.11 0.04 0.00 -1.18 0.00 0.00 61.69 58.50 1t1y s THR 190 Cb -0.09 -2.20 0.00 0.00 1.34 0.00 0.00 72.50 71.56 1t1y s THR 190 CO 0.02 -0.19 -0.20 -2.28 -0.54 0.00 0.00 174.62 171.42 1t1y s HIS 191 N -1.89 2.19 -0.14 3.99 2.46 -1.26 -1.16 115.29 119.49 1t1y s HIS 191 Ca 0.23 -0.86 -0.03 0.00 0.47 0.00 0.00 55.06 54.88 1t1y s HIS 191 Cb -0.07 -1.49 0.05 0.00 -0.13 0.00 0.00 32.58 30.93 1t1y s HIS 191 CO 0.11 -0.36 0.03 -1.01 -2.47 0.00 0.00 174.74 171.05 1t1y s HIS 192 N 0.39 0.73 -0.03 3.88 3.76 0.00 -4.97 115.29 119.05 1t1y s HIS 192 Ca -0.16 -0.47 -0.30 0.00 -0.15 0.00 0.00 55.06 53.98 1t1y s HIS 192 Cb -0.17 -0.87 -0.05 0.00 1.11 0.00 0.00 32.58 32.61 1t1y s HIS 192 CO 0.07 -0.47 1.36 0.00 -0.85 0.00 0.00 174.74 174.84 1t1y s ALA 193 N 1.96 3.57 -0.51 -1.40 0.00 -1.26 0.24 121.76 124.36 1t1y s ALA 193 Ca 0.02 0.78 0.22 0.00 0.00 0.00 0.00 51.96 52.98 1t1y s ALA 193 Cb -0.15 -3.59 -0.27 0.00 0.00 0.00 0.00 23.12 19.11 1t1y s ALA 193 CO -0.07 -0.94 0.70 1.33 0.00 0.00 0.00 175.76 176.79 1t1y n VAL 194 N 4.78 0.01 -3.56 0.00 0.24 -0.55 -4.92 118.33 114.32 1t1y n VAL 194 Ca 0.13 -0.25 -0.02 0.00 -2.04 0.00 0.00 64.34 62.15 1t1y n VAL 194 Cb 0.44 0.48 0.01 0.00 -1.47 0.00 0.00 33.84 33.30 1t1y n VAL 194 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 1t1y n SER 195 N -1.89 -0.92 0.23 -1.34 3.41 -0.99 -4.96 113.62 107.15 1t1y n SER 195 Ca 0.00 -1.55 0.10 0.00 -0.26 0.00 0.00 58.87 57.17 1t1y n SER 195 Cb 0.45 1.52 0.50 0.00 -0.26 0.00 0.00 64.21 66.42 1t1y n SER 195 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1t1y h ASP 196 N 0.95 0.00 0.00 4.04 5.19 -2.04 -3.30 116.42 121.26 1t1y h ASP 196 Ca -0.14 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.27 1t1y h ASP 196 Cb 0.58 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.09 1t1y h ASP 196 CO 0.18 0.21 0.00 1.41 -3.12 0.00 0.00 179.24 177.92 1t1y n HIS 197 N -3.41 0.00 -4.07 4.55 8.25 -1.26 -4.91 115.22 114.37 1t1y n HIS 197 Ca -0.00 -0.16 -0.13 0.00 -0.26 0.00 0.00 57.72 57.17 1t1y n HIS 197 Cb 0.40 -0.02 -0.12 0.00 1.12 0.00 0.00 29.99 31.38 1t1y n HIS 197 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1t1y s GLU 198 N -0.32 0.50 0.04 -0.41 8.01 -1.25 -1.23 118.70 124.05 1t1y s GLU 198 Ca 0.00 -0.66 -0.02 0.00 0.01 0.00 0.00 54.97 54.31 1t1y s GLU 198 Cb 0.00 -0.29 -0.03 0.00 -4.31 0.00 0.00 34.13 29.50 1t1y s GLU 198 CO 0.00 0.06 -0.01 0.00 0.01 0.00 0.00 175.26 175.32 1t1y s ALA 199 N -1.18 0.30 -0.17 5.21 0.00 -0.35 -1.49 121.76 124.09 1t1y s ALA 199 Ca -0.08 -0.93 -0.03 0.00 0.00 0.00 0.00 51.96 50.92 1t1y s ALA 199 Cb -0.09 0.24 -0.02 0.00 0.00 0.00 0.00 23.12 23.25 1t1y s ALA 199 CO 0.00 -0.31 -0.06 0.99 0.00 0.00 0.00 175.76 176.39 1t1y s THR 200 N -3.04 3.57 -0.19 0.00 2.01 0.14 -0.82 115.64 117.30 1t1y s THR 200 Ca -0.01 -0.46 -0.07 0.00 0.31 0.00 0.00 61.69 61.45 1t1y s THR 200 Cb 0.02 -2.57 -0.04 0.00 0.01 0.00 0.00 72.50 69.92 1t1y s THR 200 CO -0.07 0.48 0.06 -0.76 -0.69 0.00 0.00 174.62 173.64 1t1y s LEU 201 N 0.67 3.77 -0.13 4.42 1.43 -0.21 -0.82 118.68 127.82 1t1y s LEU 201 Ca -0.03 0.05 0.03 0.00 -1.03 0.00 0.00 54.13 53.14 1t1y s LEU 201 Cb -0.15 -1.96 0.01 0.00 0.03 0.00 0.00 46.19 44.12 1t1y s LEU 201 CO 0.02 0.15 -0.21 -0.60 0.23 0.00 0.00 176.35 175.95 1t1y s ARG 202 N 0.51 2.83 -0.30 1.70 3.52 -0.30 -1.16 118.95 125.75 1t1y s ARG 202 Ca 0.03 -0.79 -0.11 0.00 -0.13 0.00 0.00 55.73 54.73 1t1y s ARG 202 Cb -0.13 -2.28 -0.03 0.00 -1.56 0.00 0.00 34.95 30.95 1t1y s ARG 202 CO 0.01 0.01 0.19 0.00 -0.81 0.00 0.00 175.30 174.69 1t1y s TRP 204 N 1.71 3.48 -0.18 0.00 0.52 0.31 -1.68 118.94 123.10 1t1y s TRP 204 Ca 0.06 0.38 -0.02 0.00 0.02 0.00 0.00 56.10 56.54 1t1y s TRP 204 Cb -0.17 -1.85 0.05 0.00 -1.15 0.00 0.00 33.47 30.36 1t1y s TRP 204 CO 0.09 0.65 -0.00 0.00 0.02 0.00 0.00 176.95 177.71 1t1y s ALA 205 N -1.15 1.22 0.22 0.98 0.00 -0.47 -2.62 121.76 119.95 1t1y s ALA 205 Ca 0.20 -0.76 0.10 0.00 0.00 0.00 0.00 51.96 51.50 1t1y s ALA 205 Cb -0.12 -1.16 -0.05 0.00 0.00 0.00 0.00 23.12 21.79 1t1y s ALA 205 CO 0.11 -1.01 -0.18 -0.51 0.00 0.00 0.00 175.76 174.16 1t1y s LEU 206 N 1.75 2.53 -1.55 0.00 1.43 0.06 -1.79 118.68 121.11 1t1y s LEU 206 Ca -0.01 -0.97 -0.14 0.00 -1.03 0.00 0.00 54.13 51.98 1t1y s LEU 206 Cb -0.16 -0.92 0.10 0.00 0.03 0.00 0.00 46.19 45.24 1t1y s LEU 206 CO -0.07 -0.03 0.85 -0.24 0.23 0.00 0.00 176.35 177.09 1t1y n SER 207 N -0.25 -4.31 -4.94 2.29 2.88 -0.80 -0.68 113.62 107.81 1t1y n SER 207 Ca -0.08 -0.77 -0.21 0.00 -1.33 0.00 0.00 58.87 56.47 1t1y n SER 207 Cb 0.59 -3.48 -0.02 0.00 -0.75 0.00 0.00 64.21 60.55 1t1y n SER 207 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 1t1y s PHE 208 N -3.23 3.37 -0.26 0.66 -0.12 -0.88 -4.73 117.98 112.79 1t1y s PHE 208 Ca 0.64 -0.04 -0.17 0.00 -0.05 0.00 0.00 56.93 57.31 1t1y s PHE 208 Cb -0.33 -1.54 0.07 0.00 -0.63 0.00 0.00 43.02 40.59 1t1y s PHE 208 CO 0.79 0.45 0.66 -0.47 -0.05 0.00 0.00 175.22 176.60 1t1y s TYR 209 N -2.02 -0.94 1.09 3.49 5.04 -0.29 -0.84 117.35 122.88 1t1y s TYR 209 Ca 0.34 1.98 -0.18 0.00 -2.44 0.00 0.00 57.07 56.77 1t1y s TYR 209 Cb -0.09 0.50 0.27 0.00 0.35 0.00 0.00 41.96 43.00 1t1y s TYR 209 CO 0.28 -0.47 0.99 -0.35 -1.34 0.00 0.00 175.55 174.66 1t1y n PRO 210 N 3.89 -2.86 0.12 4.97 -0.04 -1.26 -0.30 135.00 139.52 1t1y n PRO 210 Ca -0.19 -1.58 -0.01 0.00 -0.04 0.00 0.00 63.50 61.69 1t1y n PRO 210 Cb 0.58 -1.46 0.26 0.00 -0.04 0.00 0.00 33.50 32.84 1t1y n PRO 210 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1t1y h ALA 211 N -2.63 1.19 -2.39 0.55 0.00 -1.96 -3.45 119.26 110.57 1t1y h ALA 211 Ca -0.37 -0.39 -0.56 0.00 0.00 0.00 0.00 54.91 53.59 1t1y h ALA 211 Cb 1.12 -0.08 0.05 0.00 0.00 0.00 0.00 17.79 18.88 1t1y h ALA 211 CO 0.24 0.55 0.93 -1.91 0.00 0.00 0.00 179.25 179.06 1t1y n GLU 212 N -4.05 2.43 -3.47 0.00 4.07 -1.26 -4.97 120.64 113.39 1t1y n GLU 212 Ca -0.01 0.88 -0.10 0.00 -0.06 0.00 0.00 57.16 57.86 1t1y n GLU 212 Cb 0.45 -2.69 -0.02 0.00 -0.06 0.00 0.00 31.44 29.12 1t1y n GLU 212 CO 0.00 0.00 0.00 -1.50 -0.06 0.00 0.00 177.13 175.57 1t1y s ILE 213 N 1.49 0.00 -0.05 6.31 2.07 -1.26 -4.65 121.20 125.11 1t1y s ILE 213 Ca 0.79 -0.02 0.00 0.00 -1.41 0.00 0.00 60.65 60.01 1t1y s ILE 213 Cb -0.60 -1.03 0.02 0.00 0.13 0.00 0.00 42.46 40.99 1t1y s ILE 213 CO 0.37 0.00 -0.02 -0.89 -1.91 0.00 0.00 174.94 172.49 1t1y s THR 214 N -3.45 0.38 -0.11 4.00 2.01 -0.76 -5.01 115.64 112.70 1t1y s THR 214 Ca 0.03 0.01 0.03 0.00 0.31 0.00 0.00 61.69 62.08 1t1y s THR 214 Cb -0.01 -0.47 -0.00 0.00 0.01 0.00 0.00 72.50 72.03 1t1y s THR 214 CO -0.11 0.21 -0.23 -0.76 -0.69 0.00 0.00 174.62 173.05 1t1y s LEU 215 N 1.26 2.16 0.01 4.42 1.43 -1.26 -1.64 118.68 125.07 1t1y s LEU 215 Ca -0.06 -0.53 0.02 0.00 -1.03 0.00 0.00 54.13 52.52 1t1y s LEU 215 Cb -0.13 -1.44 -0.01 0.00 0.03 0.00 0.00 46.19 44.64 1t1y s LEU 215 CO -0.02 0.16 -0.06 -0.89 0.23 0.00 0.00 176.35 175.77 1t1y s THR 216 N 0.36 0.44 -0.04 5.49 2.01 -0.49 -4.97 115.64 118.44 1t1y s THR 216 Ca -0.18 -0.54 -0.02 0.00 0.31 0.00 0.00 61.69 61.27 1t1y s THR 216 Cb -0.18 -0.43 -0.04 0.00 0.01 0.00 0.00 72.50 71.87 1t1y s THR 216 CO 0.08 -0.08 0.07 0.26 -0.69 0.00 0.00 174.62 174.26 1t1y s TRP 217 N -0.60 3.30 0.05 4.92 0.52 -1.26 -0.05 118.94 125.81 1t1y s TRP 217 Ca -0.03 0.25 0.05 0.00 0.02 0.00 0.00 56.10 56.39 1t1y s TRP 217 Cb -0.05 -1.78 -0.02 0.00 -1.15 0.00 0.00 33.47 30.47 1t1y s TRP 217 CO 0.00 0.56 -0.15 -0.65 0.02 0.00 0.00 176.95 176.73 1t1y s GLN 218 N -1.45 0.95 -0.15 4.98 -0.21 -0.30 -0.87 119.66 122.61 1t1y s GLN 218 Ca 0.20 -0.81 0.01 0.00 0.02 0.00 0.00 55.36 54.78 1t1y s GLN 218 Cb -0.12 -0.98 0.02 0.00 1.00 0.00 0.00 33.01 32.93 1t1y s GLN 218 CO 0.10 0.24 -0.16 0.50 -2.12 0.00 0.00 175.29 173.85 1t1y s ARG 219 N -1.25 2.47 -1.38 2.91 3.52 0.74 -1.44 118.95 124.52 1t1y s ARG 219 Ca 0.02 -0.64 -0.02 0.00 -0.13 0.00 0.00 55.73 54.96 1t1y s ARG 219 Cb -0.08 -2.18 0.01 0.00 -1.56 0.00 0.00 34.95 31.14 1t1y s ARG 219 CO 0.01 -0.18 0.61 -0.25 -0.81 0.00 0.00 175.30 174.68 1t1y n ASP 220 N 4.56 -1.17 -0.08 -2.12 8.00 0.10 -1.82 116.55 124.03 1t1y n ASP 220 Ca -0.18 -0.90 -0.01 0.00 0.71 0.00 0.00 54.79 54.40 1t1y n ASP 220 Cb 0.50 -3.57 -0.00 0.00 -0.02 0.00 0.00 41.12 38.03 1t1y n ASP 220 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1t1y n GLY 221 N -1.75 0.41 3.04 0.44 0.00 -1.26 -5.02 105.19 101.05 1t1y n GLY 221 Ca -0.26 -0.10 -0.20 0.00 0.00 0.00 0.00 46.02 45.46 1t1y n GLY 221 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1t1y s GLU 222 N -0.98 0.95 0.17 1.61 2.56 -0.75 -5.07 118.70 117.18 1t1y s GLU 222 Ca 0.00 -0.38 -0.33 0.00 0.00 0.00 0.00 54.97 54.26 1t1y s GLU 222 Cb 0.00 -0.90 -0.15 0.00 2.00 0.00 0.00 34.13 35.08 1t1y s GLU 222 CO 0.00 0.20 1.28 -0.25 -0.56 0.00 0.00 175.26 175.94 1t1y n ASP 223 N 2.97 1.85 -4.03 -1.70 9.92 -1.26 -0.19 116.55 124.11 1t1y n ASP 223 Ca -0.15 1.13 -0.26 0.00 -0.53 0.00 0.00 54.79 54.98 1t1y n ASP 223 Cb 0.55 -1.27 -0.17 0.00 -0.64 0.00 0.00 41.12 39.59 1t1y n ASP 223 CO 0.00 0.00 0.00 -1.58 0.13 0.00 0.00 177.20 175.75 1t1y s GLN 224 N -0.11 1.83 -0.04 -1.24 0.74 -0.05 -4.79 119.66 115.99 1t1y s GLN 224 Ca 0.75 -0.44 0.06 0.00 0.05 0.00 0.00 55.36 55.78 1t1y s GLN 224 Cb -0.81 -1.54 -0.09 0.00 1.10 0.00 0.00 33.01 31.67 1t1y s GLN 224 CO 0.49 -0.01 0.07 0.25 -0.55 0.00 0.00 175.29 175.55 1t1y n THR 225 N 3.97 0.25 -1.59 -0.34 -2.24 -1.26 -4.37 114.28 108.71 1t1y n THR 225 Ca -0.21 -0.22 -0.33 0.00 -2.27 0.00 0.00 64.05 61.02 1t1y n THR 225 Cb 0.52 -0.34 0.07 0.00 -2.10 0.00 0.00 70.33 68.47 1t1y n THR 225 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1t1y s GLN 226 N -2.29 2.55 -1.64 -0.78 -0.21 -1.26 -2.89 119.66 113.15 1t1y s GLN 226 Ca -0.03 1.40 0.00 0.00 0.02 0.00 0.00 55.36 56.75 1t1y s GLN 226 Cb 0.03 -1.92 0.00 0.00 1.00 0.00 0.00 33.01 32.12 1t1y s GLN 226 CO 0.27 -1.44 0.00 -0.25 -2.12 0.00 0.00 175.29 171.74 1t1y n ASP 227 N -2.72 -5.58 -4.67 5.90 8.00 -1.26 -4.91 116.55 111.31 1t1y n ASP 227 Ca 0.11 0.38 -0.27 0.00 0.71 0.00 0.00 54.79 55.72 1t1y n ASP 227 Cb 0.52 -4.44 -0.09 0.00 -0.02 0.00 0.00 41.12 37.09 1t1y n ASP 227 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1t1y s THR 228 N -2.33 2.08 -0.22 -3.53 -4.23 -1.14 -1.67 115.64 104.60 1t1y s THR 228 Ca 0.00 -1.88 -0.12 0.00 -1.18 0.00 0.00 61.69 58.51 1t1y s THR 228 Cb 0.00 -2.95 0.07 0.00 1.34 0.00 0.00 72.50 70.95 1t1y s THR 228 CO 0.00 0.00 0.53 -0.70 -0.54 0.00 0.00 174.62 173.91 1t1y s GLU 229 N -3.80 0.53 -0.08 3.99 2.12 -0.17 -4.97 118.70 116.32 1t1y s GLU 229 Ca 0.36 0.97 0.02 0.00 0.36 0.00 0.00 54.97 56.67 1t1y s GLU 229 Cb 0.07 0.06 0.02 0.00 0.26 0.00 0.00 34.13 34.54 1t1y s GLU 229 CO 0.19 -0.15 -0.12 -0.48 -0.54 0.00 0.00 175.26 174.16 1t1y s LEU 230 N 1.44 1.56 0.43 2.70 2.34 -1.26 -0.52 118.68 125.38 1t1y s LEU 230 Ca -0.09 -0.32 -0.11 0.00 0.06 0.00 0.00 54.13 53.67 1t1y s LEU 230 Cb -0.07 -0.87 -0.06 0.00 -0.56 0.00 0.00 46.19 44.63 1t1y s LEU 230 CO -0.15 -0.00 0.80 0.68 -1.06 0.00 0.00 176.35 176.62 1t1y s VAL 231 N 0.93 4.76 0.42 1.48 -7.23 -0.98 -5.03 120.40 114.76 1t1y s VAL 231 Ca -0.09 0.66 -0.25 0.00 -1.81 0.00 0.00 61.98 60.49 1t1y s VAL 231 Cb -0.15 -3.75 -0.08 0.00 0.56 0.00 0.00 36.38 32.96 1t1y s VAL 231 CO 0.00 -0.59 1.26 -1.61 -0.31 0.00 0.00 175.10 173.85 1t1y s GLU 232 N -3.99 3.91 0.32 4.82 0.41 -1.26 -4.57 118.70 118.34 1t1y s GLU 232 Ca 0.52 2.05 -0.29 0.00 -0.41 0.00 0.00 54.97 56.83 1t1y s GLU 232 Cb -0.10 -2.67 -0.12 0.00 -1.78 0.00 0.00 34.13 29.46 1t1y s GLU 232 CO 0.33 -0.50 1.53 2.41 -0.49 0.00 0.00 175.26 178.54 1t1y n THR 233 N -0.02 1.39 -4.12 3.63 -1.04 -1.26 -4.85 114.28 108.01 1t1y n THR 233 Ca 0.05 -0.35 -0.15 0.00 -2.04 0.00 0.00 64.05 61.55 1t1y n THR 233 Cb 0.45 -1.91 -0.12 0.00 -1.82 0.00 0.00 70.33 66.93 1t1y n THR 233 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1t1y s ARG 234 N -1.09 0.67 0.18 -2.82 1.70 -0.37 -4.97 118.95 112.25 1t1y s ARG 234 Ca 0.60 -0.87 -0.30 0.00 -0.47 0.00 0.00 55.73 54.70 1t1y s ARG 234 Cb -0.50 -0.54 -0.08 0.00 -0.57 0.00 0.00 34.95 33.26 1t1y s ARG 234 CO 0.54 0.11 1.09 -1.25 -1.08 0.00 0.00 175.30 174.71 1t1y s PRO 235 N -1.71 4.61 0.31 3.89 0.04 -1.26 -0.42 135.00 140.45 1t1y s PRO 235 Ca -0.06 1.71 0.16 0.00 0.04 0.00 0.00 61.00 62.85 1t1y s PRO 235 Cb -0.10 -3.28 0.25 0.00 0.04 0.00 0.00 34.50 31.41 1t1y s PRO 235 CO 0.01 0.10 1.53 0.00 0.04 0.00 0.00 177.00 178.68 1t1y h ALA 236 N 5.02 0.76 0.00 8.56 0.00 -0.97 -3.46 119.26 129.16 1t1y h ALA 236 Ca -0.44 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.05 1t1y h ALA 236 Cb 1.21 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1t1y h ALA 236 CO 0.72 0.58 0.00 0.41 0.00 0.00 0.00 179.25 180.96 1t1y n GLY 237 N 0.96 1.47 1.16 0.00 0.00 -1.26 -4.91 105.19 102.61 1t1y n GLY 237 Ca 0.01 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.09 1t1y n GLY 237 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1t1y n ASP 238 N 0.00 4.02 0.00 1.61 5.68 -1.26 -4.92 116.55 121.67 1t1y n ASP 238 Ca 0.00 -3.13 0.00 0.00 -0.50 0.00 0.00 54.79 51.16 1t1y n ASP 238 Cb 0.00 -0.60 0.00 0.00 -1.14 0.00 0.00 41.12 39.38 1t1y n ASP 238 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1t1y n GLY 239 N -0.43 1.38 3.98 6.12 0.00 -1.26 -5.05 105.19 109.92 1t1y n GLY 239 Ca 0.26 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.07 1t1y n GLY 239 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1t1y s THR 240 N -2.31 2.17 0.28 2.61 -4.23 -1.26 -4.93 115.64 107.97 1t1y s THR 240 Ca 0.00 -1.16 0.06 0.00 -1.18 0.00 0.00 61.69 59.41 1t1y s THR 240 Cb 0.00 -2.34 -0.06 0.00 1.34 0.00 0.00 72.50 71.45 1t1y s THR 240 CO 0.00 0.00 -0.05 -0.36 -0.54 0.00 0.00 174.62 173.67 1t1y s PHE 241 N -2.64 1.91 0.08 3.99 0.08 -0.02 -0.31 117.98 121.07 1t1y s PHE 241 Ca 0.52 -0.73 0.02 0.00 0.12 0.00 0.00 56.93 56.86 1t1y s PHE 241 Cb -0.05 -1.10 -0.04 0.00 -0.57 0.00 0.00 43.02 41.27 1t1y s PHE 241 CO 0.32 0.24 -0.07 -0.65 -0.10 0.00 0.00 175.22 174.97 1t1y s GLN 242 N -3.75 0.72 -0.05 0.44 -0.21 0.44 -1.90 119.66 115.35 1t1y s GLN 242 Ca 0.30 -1.12 -0.29 0.00 0.02 0.00 0.00 55.36 54.26 1t1y s GLN 242 Cb 0.04 -0.23 0.10 0.00 1.00 0.00 0.00 33.01 33.92 1t1y s GLN 242 CO 0.12 0.01 0.84 0.21 -2.12 0.00 0.00 175.29 174.34 1t1y s LYS 243 N -3.00 0.85 0.05 2.91 2.20 -0.74 -1.24 119.74 120.78 1t1y s LYS 243 Ca 0.04 -0.04 -0.12 0.00 -0.36 0.00 0.00 55.97 55.49 1t1y s LYS 243 Cb -0.00 0.40 0.01 0.00 -1.51 0.00 0.00 37.83 36.73 1t1y s LYS 243 CO -0.03 -0.32 0.26 1.67 -0.36 0.00 0.00 175.35 176.57 1t1y s TRP 244 N -2.08 -0.02 -0.01 4.03 1.48 -1.26 -1.37 118.94 119.71 1t1y s TRP 244 Ca -0.01 -0.20 0.01 0.00 -1.06 0.00 0.00 56.10 54.84 1t1y s TRP 244 Cb -0.01 0.04 -0.00 0.00 -1.16 0.00 0.00 33.47 32.34 1t1y s TRP 244 CO -0.02 -0.50 -0.05 0.00 -4.06 0.00 0.00 176.95 172.33 1t1y s ALA 245 N -2.82 0.41 0.16 2.67 0.00 -0.67 -2.31 121.76 119.19 1t1y s ALA 245 Ca -0.03 -0.19 0.05 0.00 0.00 0.00 0.00 51.96 51.80 1t1y s ALA 245 Cb 0.00 -0.12 -0.04 0.00 0.00 0.00 0.00 23.12 22.96 1t1y s ALA 245 CO -0.05 0.09 -0.12 0.00 0.00 0.00 0.00 175.76 175.68 1t1y s ALA 246 N -0.04 1.59 -0.01 0.00 0.00 0.32 -0.24 121.76 123.39 1t1y s ALA 246 Ca 0.01 -1.51 -0.04 0.00 0.00 0.00 0.00 51.96 50.41 1t1y s ALA 246 Cb -0.03 0.00 -0.00 0.00 0.00 0.00 0.00 23.12 23.10 1t1y s ALA 246 CO -0.00 -0.04 0.09 0.54 0.00 0.00 0.00 175.76 176.35 1t1y s VAL 247 N -3.12 0.06 -0.17 0.00 0.11 -0.31 -1.00 120.40 115.96 1t1y s VAL 247 Ca 0.17 -0.50 -0.10 0.00 -2.93 0.00 0.00 61.98 58.62 1t1y s VAL 247 Cb 0.01 -0.30 -0.05 0.00 -1.53 0.00 0.00 36.38 34.51 1t1y s VAL 247 CO 0.02 -0.28 0.17 -0.69 -3.33 0.00 0.00 175.10 171.00 1t1y s VAL 248 N -0.90 5.39 0.10 2.04 1.01 -0.67 -1.05 120.40 126.33 1t1y s VAL 248 Ca -0.10 0.29 0.01 0.00 0.00 0.00 0.00 61.98 62.17 1t1y s VAL 248 Cb -0.06 -3.50 -0.04 0.00 0.00 0.00 0.00 36.38 32.78 1t1y s VAL 248 CO 0.01 0.46 -0.03 0.68 0.00 0.00 0.00 175.10 176.22 1t1y s VAL 249 N 0.14 0.47 0.09 2.92 -7.23 0.00 -4.95 120.40 111.85 1t1y s VAL 249 Ca 0.11 -1.91 -0.31 0.00 -1.81 0.00 0.00 61.98 58.07 1t1y s VAL 249 Cb -0.12 -1.77 -0.07 0.00 0.56 0.00 0.00 36.38 34.98 1t1y s VAL 249 CO 0.01 -0.77 1.35 -2.84 -0.31 0.00 0.00 175.10 172.53 1t1y s PRO 250 N -3.90 4.34 0.19 4.82 0.02 -1.26 -1.21 135.00 138.00 1t1y s PRO 250 Ca 0.15 2.00 -0.33 0.00 0.02 0.00 0.00 61.00 62.83 1t1y s PRO 250 Cb 0.06 -3.30 -0.14 0.00 0.02 0.00 0.00 34.50 31.14 1t1y s PRO 250 CO -0.04 -0.41 1.44 0.43 -0.33 0.00 0.00 177.00 178.09 1t1y n SER 251 N 4.10 2.64 0.00 2.53 7.64 -0.37 -0.98 113.62 129.18 1t1y n SER 251 Ca 0.11 1.12 0.00 0.00 1.01 0.00 0.00 58.87 61.11 1t1y n SER 251 Cb 0.43 -1.39 0.00 0.00 -1.01 0.00 0.00 64.21 62.25 1t1y n SER 251 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1t1y n GLY 252 N 2.63 2.48 1.18 0.23 0.00 -1.26 -4.88 105.19 105.58 1t1y n GLY 252 Ca 0.14 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.26 1t1y n GLY 252 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1t1y n GLN 253 N -2.00 3.09 -0.31 1.61 1.13 -0.16 -4.69 117.38 116.05 1t1y n GLN 253 Ca 0.00 -2.57 0.20 0.00 -1.94 0.00 0.00 57.00 52.69 1t1y n GLN 253 Cb 0.00 -1.60 0.48 0.00 0.11 0.00 0.00 30.24 29.23 1t1y n GLN 253 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 1t1y h GLU 254 N 3.39 0.45 -0.05 -1.09 3.07 -1.90 -2.27 114.58 116.18 1t1y h GLU 254 Ca 0.00 -0.03 0.01 0.00 -0.50 0.00 0.00 59.36 58.85 1t1y h GLU 254 Cb 1.09 -0.10 -0.00 0.00 -0.84 0.00 0.00 28.75 28.89 1t1y h GLU 254 CO 0.09 0.30 0.08 1.96 -1.40 0.00 0.00 179.01 180.03 1t1y h GLN 255 N 0.46 0.00 0.00 2.33 1.08 -1.85 -2.33 115.11 114.81 1t1y h GLN 255 Ca 0.56 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.76 1t1y h GLN 255 Cb 1.31 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.74 1t1y h GLN 255 CO -0.28 0.00 0.00 0.00 -0.95 0.00 0.00 178.83 177.60 1t1y h ARG 256 N 0.00 0.00 -5.63 1.46 3.08 -1.79 -3.45 114.38 108.04 1t1y h ARG 256 Ca 0.02 0.00 -0.63 0.00 0.07 0.00 0.00 59.98 59.44 1t1y h ARG 256 Cb 0.18 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.15 1t1y h ARG 256 CO -0.00 0.00 -0.40 0.71 -1.07 0.00 0.00 179.97 179.21 1t1y s TYR 257 N -3.37 3.57 -0.00 3.04 1.51 -0.88 -0.72 117.35 120.50 1t1y s TYR 257 Ca 0.05 0.61 0.03 0.00 -1.01 0.00 0.00 57.07 56.75 1t1y s TYR 257 Cb 0.09 -2.12 -0.01 0.00 -0.11 0.00 0.00 41.96 39.81 1t1y s TYR 257 CO 0.56 0.56 -0.10 0.95 -1.11 0.00 0.00 175.55 176.41 1t1y s THR 258 N -0.55 0.79 -0.18 -0.71 -4.23 -0.52 -4.37 115.64 105.87 1t1y s THR 258 Ca 0.16 -0.49 -0.08 0.00 -1.18 0.00 0.00 61.69 60.10 1t1y s THR 258 Cb -0.13 -0.67 -0.04 0.00 1.34 0.00 0.00 72.50 73.00 1t1y s THR 258 CO 0.05 0.18 0.10 0.00 -0.54 0.00 0.00 174.62 174.41 1t1y s HIS 260 N 0.17 2.81 -0.18 0.00 3.76 0.93 -0.17 115.29 122.61 1t1y s HIS 260 Ca 0.07 -0.64 0.01 0.00 -0.15 0.00 0.00 55.06 54.35 1t1y s HIS 260 Cb -0.12 -1.84 0.02 0.00 1.11 0.00 0.00 32.58 31.75 1t1y s HIS 260 CO -0.00 -0.21 -0.19 0.08 -0.85 0.00 0.00 174.74 173.56 1t1y s VAL 261 N 0.34 2.02 -0.12 -0.90 1.01 -0.17 -1.40 120.40 121.19 1t1y s VAL 261 Ca -0.11 -0.94 0.00 0.00 0.00 0.00 0.00 61.98 60.93 1t1y s VAL 261 Cb -0.16 -1.84 -0.02 0.00 0.00 0.00 0.00 36.38 34.36 1t1y s VAL 261 CO 0.06 0.51 -0.13 -1.10 0.00 0.00 0.00 175.10 174.44 1t1y s GLN 262 N 1.30 3.26 -0.10 2.72 -0.21 -0.65 -1.25 119.66 124.73 1t1y s GLN 262 Ca 0.04 -0.68 -0.30 0.00 0.02 0.00 0.00 55.36 54.45 1t1y s GLN 262 Cb -0.13 -2.60 0.07 0.00 1.00 0.00 0.00 33.01 31.35 1t1y s GLN 262 CO -0.12 0.28 0.69 -1.58 -2.12 0.00 0.00 175.29 172.44 1t1y s HIS 263 N 0.18 -0.69 0.54 0.91 2.46 -1.26 -1.83 115.29 115.60 1t1y s HIS 263 Ca -0.07 1.30 0.24 0.00 0.47 0.00 0.00 55.06 56.99 1t1y s HIS 263 Cb -0.15 0.38 1.42 0.00 -0.13 0.00 0.00 32.58 34.10 1t1y s HIS 263 CO 0.05 -0.56 2.05 1.49 -2.47 0.00 0.00 174.74 175.31 1t1y h GLU 264 N 3.43 0.00 0.00 2.88 4.81 -1.95 -1.05 114.58 122.71 1t1y h GLU 264 Ca -0.27 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.96 1t1y h GLU 264 Cb 1.14 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.52 1t1y h GLU 264 CO 0.31 0.00 0.00 0.41 -0.73 0.00 0.00 179.01 179.00 1t1y n GLY 265 N -1.56 -1.14 3.25 1.92 0.00 -1.26 -4.68 105.19 101.72 1t1y n GLY 265 Ca 0.05 -0.16 -0.37 0.00 0.00 0.00 0.00 46.02 45.54 1t1y n GLY 265 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1t1y s LEU 266 N -2.34 4.19 0.40 0.99 1.43 -0.40 -4.54 118.68 118.41 1t1y s LEU 266 Ca 0.35 -1.16 0.20 0.00 -1.03 0.00 0.00 54.13 52.49 1t1y s LEU 266 Cb 0.20 -1.83 1.16 0.00 0.03 0.00 0.00 46.19 45.75 1t1y s LEU 266 CO 0.41 -0.31 1.73 -0.65 0.23 0.00 0.00 176.35 177.76 1t1y h PRO 267 N 8.16 0.32 -3.96 1.29 0.11 -1.84 -3.39 132.00 132.69 1t1y h PRO 267 Ca -0.23 -0.02 -0.24 0.00 0.11 0.00 0.00 66.00 65.62 1t1y h PRO 267 Cb 1.08 -0.07 -0.26 0.00 0.11 0.00 0.00 31.00 31.85 1t1y h PRO 267 CO 0.58 0.21 -0.72 0.21 -0.21 0.00 0.00 178.00 178.07 1t1y s LYS 268 N -5.48 0.19 0.58 1.05 2.20 -1.26 -5.13 119.74 111.89 1t1y s LYS 268 Ca -0.09 -0.21 -0.20 0.00 -0.36 0.00 0.00 55.97 55.12 1t1y s LYS 268 Cb 0.27 -0.09 -0.04 0.00 -1.51 0.00 0.00 37.83 36.45 1t1y s LYS 268 CO 0.80 0.02 1.16 -0.35 -0.36 0.00 0.00 175.35 176.62 1t1y n PRO 269 N 2.66 1.21 -3.49 4.03 -0.04 -1.26 -4.98 135.00 133.13 1t1y n PRO 269 Ca -0.15 0.46 -0.31 0.00 -0.04 0.00 0.00 63.50 63.46 1t1y n PRO 269 Cb 0.58 -2.36 -0.05 0.00 -0.04 0.00 0.00 33.50 31.64 1t1y n PRO 269 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1t1y s LEU 270 N -2.84 4.17 -0.10 1.53 1.43 -0.38 -4.91 118.68 117.58 1t1y s LEU 270 Ca 0.75 0.75 0.01 0.00 -1.03 0.00 0.00 54.13 54.61 1t1y s LEU 270 Cb -0.42 -3.51 0.02 0.00 0.03 0.00 0.00 46.19 42.31 1t1y s LEU 270 CO 0.47 -0.06 -0.11 -0.89 0.23 0.00 0.00 176.35 175.98 1t1y s THR 271 N -1.83 1.23 0.08 5.49 2.01 -1.26 -1.00 115.64 120.36 1t1y s THR 271 Ca 0.44 -0.46 0.07 0.00 0.31 0.00 0.00 61.69 62.05 1t1y s THR 271 Cb -0.11 -1.17 -0.04 0.00 0.01 0.00 0.00 72.50 71.19 1t1y s THR 271 CO 0.25 0.39 -0.13 -0.76 -0.69 0.00 0.00 174.62 173.67 1t1y s LEU 272 N 1.21 2.87 -0.02 4.42 1.02 0.76 -4.93 118.68 124.02 1t1y s LEU 272 Ca -0.03 -0.40 -0.04 0.00 0.02 0.00 0.00 54.13 53.68 1t1y s LEU 272 Cb -0.14 -1.69 0.00 0.00 0.02 0.00 0.00 46.19 44.39 1t1y s LEU 272 CO -0.04 0.21 0.09 -0.60 0.02 0.00 0.00 176.35 176.03 1t1y s ARG 273 N -1.90 0.19 0.32 1.70 3.52 -1.26 -0.33 118.95 121.19 1t1y s ARG 273 Ca 0.18 -0.03 -0.29 0.00 -0.13 0.00 0.00 55.73 55.47 1t1y s ARG 273 Cb -0.11 0.08 -0.10 0.00 -1.56 0.00 0.00 34.95 33.26 1t1y s ARG 273 CO 0.10 -0.03 1.41 -0.46 -0.81 0.00 0.00 175.30 175.51 1t1y s TRP 274 N -0.33 2.89 -0.58 5.12 -0.11 -1.26 -5.04 118.94 119.63 1t1y s TRP 274 Ca -0.04 1.20 0.00 0.00 1.22 0.00 0.00 56.10 58.48 1t1y s TRP 274 Cb -0.03 -3.84 0.00 0.00 -1.50 0.00 0.00 33.47 28.10 1t1y s TRP 274 CO 0.00 -2.50 0.15 0.39 -4.62 0.00 0.00 176.95 170.37