#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i1m n ALA 5 N 0.00 -0.03 0.02 3.14 0.00 -1.26 -4.71 120.51 117.67 1i1m n ALA 5 Ca 0.00 -0.57 -0.17 0.00 0.00 0.00 0.00 53.44 52.71 1i1m n ALA 5 Cb 0.00 0.46 -0.14 0.00 0.00 0.00 0.00 19.45 19.77 1i1m n ALA 5 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1i1m h ASP 6 N 0.66 0.31 -4.08 0.00 3.45 -1.90 -3.42 116.42 111.44 1i1m h ASP 6 Ca -0.09 -0.57 -0.33 0.00 0.43 0.00 0.00 57.03 56.48 1i1m h ASP 6 Cb 0.40 -0.10 -0.15 0.00 -0.56 0.00 0.00 39.33 38.91 1i1m h ASP 6 CO 0.12 1.50 -0.72 -0.31 -1.57 0.00 0.00 179.24 178.26 1i1m s TYR 7 N -2.59 1.22 -0.03 4.55 1.51 -1.26 -1.06 117.35 119.68 1i1m s TYR 7 Ca -0.13 -0.73 0.00 0.00 -1.01 0.00 0.00 57.07 55.20 1i1m s TYR 7 Cb 0.07 -0.63 0.03 0.00 -0.11 0.00 0.00 41.96 41.32 1i1m s TYR 7 CO 0.82 0.06 0.02 0.42 -1.11 0.00 0.00 175.55 175.75 1i1m s ILE 8 N -3.10 0.07 -0.14 2.71 1.01 0.48 -4.68 121.20 117.56 1i1m s ILE 8 Ca 0.14 0.16 -0.29 0.00 0.00 0.00 0.00 60.65 60.65 1i1m s ILE 8 Cb 0.01 -0.19 -0.02 0.00 0.01 0.00 0.00 42.46 42.27 1i1m s ILE 8 CO 0.00 0.13 1.28 0.86 0.00 0.00 0.00 174.94 177.21 1i1m s TRP 9 N 1.12 2.86 -0.24 3.97 -0.00 -0.85 -1.06 118.94 124.74 1i1m s TRP 9 Ca -0.09 1.00 -0.01 0.00 -0.00 0.00 0.00 56.10 57.00 1i1m s TRP 9 Cb -0.13 -3.52 0.07 0.00 -0.00 0.00 0.00 33.47 29.89 1i1m s TRP 9 CO -0.02 -1.77 0.04 0.12 -0.00 0.00 0.00 176.95 175.32 1i1m s PHE 10 N 3.26 1.54 -1.51 5.86 5.99 -0.59 -1.42 117.98 131.11 1i1m s PHE 10 Ca 0.56 -1.33 -0.12 0.00 0.00 0.00 0.00 56.93 56.03 1i1m s PHE 10 Cb -0.23 -1.37 0.08 0.00 0.00 0.00 0.00 43.02 41.50 1i1m s PHE 10 CO 0.17 -0.73 0.97 0.09 -0.00 0.00 0.00 175.22 175.72 1i1m n ASN 11 N 4.90 -4.56 0.00 6.13 3.02 -0.77 -2.76 115.26 121.23 1i1m n ASN 11 Ca -0.07 -0.78 0.00 0.00 -0.03 0.00 0.00 54.58 53.70 1i1m n ASN 11 Cb 0.45 -3.94 0.00 0.00 -0.61 0.00 0.00 39.78 35.68 1i1m n ASN 11 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1i1m n GLY 12 N -1.70 2.49 3.12 7.41 0.00 -1.26 -5.06 105.19 110.19 1i1m n GLY 12 Ca 0.01 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.85 1i1m n GLY 12 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1i1m s GLU 13 N -0.85 0.82 -0.08 1.61 -1.05 -1.11 -5.11 118.70 112.93 1i1m s GLU 13 Ca 0.00 -0.74 -0.30 0.00 -0.15 0.00 0.00 54.97 53.79 1i1m s GLU 13 Cb 0.00 -0.79 -0.04 0.00 -0.44 0.00 0.00 34.13 32.86 1i1m s GLU 13 CO 0.00 0.19 1.39 -1.64 0.95 0.00 0.00 175.26 176.15 1i1m s MET 14 N -1.19 4.25 0.07 -4.83 -1.94 -1.26 -1.54 119.30 112.86 1i1m s MET 14 Ca -0.00 1.88 0.09 0.00 -1.71 0.00 0.00 55.69 55.94 1i1m s MET 14 Cb -0.08 -3.74 -0.03 0.00 2.01 0.00 0.00 34.83 32.98 1i1m s MET 14 CO 0.01 -0.68 -0.22 0.08 -0.01 0.00 0.00 175.02 174.20 1i1m s VAL 15 N 3.18 2.50 0.34 -6.03 1.01 -0.22 -4.93 120.40 116.25 1i1m s VAL 15 Ca 0.62 -1.42 -0.29 0.00 0.00 0.00 0.00 61.98 60.90 1i1m s VAL 15 Cb -0.28 -2.06 -0.11 0.00 0.00 0.00 0.00 36.38 33.94 1i1m s VAL 15 CO 0.22 0.26 1.46 -0.13 0.00 0.00 0.00 175.10 176.91 1i1m s ARG 16 N -1.62 4.18 0.22 2.72 0.52 -1.26 -0.39 118.95 123.32 1i1m s ARG 16 Ca 0.14 2.47 -0.13 0.00 -0.52 0.00 0.00 55.73 57.69 1i1m s ARG 16 Cb -0.10 -3.01 0.27 0.00 0.52 0.00 0.00 34.95 32.63 1i1m s ARG 16 CO 0.05 -0.46 1.61 2.35 0.02 0.00 0.00 175.30 178.87 1i1m h TRP 17 N 3.59 -0.41 0.00 -0.53 2.91 -1.35 -0.21 115.95 119.94 1i1m h TRP 17 Ca -0.49 0.06 0.00 0.00 1.13 0.00 0.00 58.89 59.59 1i1m h TRP 17 Cb 1.23 0.29 0.00 0.00 -0.51 0.00 0.00 29.16 30.17 1i1m h TRP 17 CO 0.55 -0.31 0.00 0.93 -1.03 0.00 0.00 178.44 178.58 1i1m h GLU 18 N -0.01 0.00 -0.02 2.65 3.07 -1.90 -2.38 114.58 115.99 1i1m h GLU 18 Ca 0.33 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.19 1i1m h GLU 18 Cb 0.52 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.43 1i1m h GLU 18 CO -0.73 0.00 -0.09 -0.25 -1.40 0.00 0.00 179.01 176.54 1i1m n ASP 19 N -3.09 2.06 -4.05 1.42 8.00 -0.11 -4.70 116.55 116.09 1i1m n ASP 19 Ca -0.01 -1.61 -0.41 0.00 0.71 0.00 0.00 54.79 53.47 1i1m n ASP 19 Cb 0.19 0.08 -0.01 0.00 -0.02 0.00 0.00 41.12 41.35 1i1m n ASP 19 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1i1m n ALA 20 N 0.48 4.30 -2.65 2.24 0.00 -0.90 -4.91 120.51 119.08 1i1m n ALA 20 Ca 0.15 -3.72 -0.23 0.00 0.00 0.00 0.00 53.44 49.65 1i1m n ALA 20 Cb 0.46 -3.57 -0.07 0.00 0.00 0.00 0.00 19.45 16.27 1i1m n ALA 20 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1i1m s LYS 21 N 4.05 2.42 0.01 0.00 1.02 -1.26 -5.09 119.74 120.89 1i1m s LYS 21 Ca 0.52 -1.38 -0.08 0.00 0.02 0.00 0.00 55.97 55.05 1i1m s LYS 21 Cb 0.10 -2.23 0.00 0.00 -0.52 0.00 0.00 37.83 35.18 1i1m s LYS 21 CO 0.01 0.32 0.16 0.54 -0.92 0.00 0.00 175.35 175.46 1i1m s VAL 22 N -2.31 0.09 0.49 3.17 0.11 -1.26 -5.14 120.40 115.54 1i1m s VAL 22 Ca 0.33 -0.72 -0.23 0.00 -2.93 0.00 0.00 61.98 58.42 1i1m s VAL 22 Cb -0.06 -0.55 -0.07 0.00 -1.53 0.00 0.00 36.38 34.17 1i1m s VAL 22 CO 0.21 -0.40 1.34 -2.28 -3.33 0.00 0.00 175.10 170.65 1i1m s HIS 23 N -1.63 2.49 -1.06 1.54 2.46 -1.26 -4.88 115.29 112.95 1i1m s HIS 23 Ca -0.13 1.37 0.12 0.00 0.47 0.00 0.00 55.06 56.89 1i1m s HIS 23 Cb -0.06 -3.76 0.54 0.00 -0.13 0.00 0.00 32.58 29.17 1i1m s HIS 23 CO 0.01 -2.61 1.38 1.55 -2.47 0.00 0.00 174.74 172.60 1i1m n VAL 24 N -0.56 1.09 -0.95 0.89 3.14 -1.26 -1.84 118.33 118.85 1i1m n VAL 24 Ca 0.08 0.27 0.05 0.00 -2.96 0.00 0.00 64.34 61.78 1i1m n VAL 24 Cb 0.44 -1.06 0.37 0.00 -1.06 0.00 0.00 33.84 32.53 1i1m n VAL 24 CO 0.00 0.00 0.00 0.23 -6.46 0.00 0.00 176.83 170.60 1i1m n MET 25 N -1.47 4.48 -2.11 1.45 2.81 -1.26 -4.90 117.12 116.12 1i1m n MET 25 Ca 0.03 -3.12 -0.42 0.00 -1.81 0.00 0.00 57.70 52.38 1i1m n MET 25 Cb 0.14 -2.21 -0.03 0.00 -0.71 0.00 0.00 33.22 30.41 1i1m n MET 25 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 1i1m s SER 26 N -0.99 6.77 0.24 7.83 0.01 -0.77 -4.54 113.70 122.25 1i1m s SER 26 Ca 0.53 2.49 -0.08 0.00 1.31 0.00 0.00 55.95 60.20 1i1m s SER 26 Cb 0.41 -2.61 0.42 0.00 0.21 0.00 0.00 66.02 64.46 1i1m s SER 26 CO 0.15 -0.65 1.63 -0.74 0.41 0.00 0.00 173.24 174.04 1i1m h HIS 27 N 5.81 -0.11 -0.10 2.43 2.76 -1.07 -1.34 115.15 123.53 1i1m h HIS 27 Ca -0.44 0.06 0.03 0.00 -2.20 0.00 0.00 60.37 57.82 1i1m h HIS 27 Cb 1.21 0.17 -0.00 0.00 1.55 0.00 0.00 27.41 30.34 1i1m h HIS 27 CO 0.63 -0.26 0.09 0.00 -1.30 0.00 0.00 177.93 177.09 1i1m h ALA 28 N 1.72 1.85 -0.05 5.26 0.00 -1.47 0.37 119.26 126.94 1i1m h ALA 28 Ca 0.41 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 55.17 1i1m h ALA 28 Cb 0.71 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1i1m h ALA 28 CO -0.69 -0.14 -0.60 -0.07 0.00 0.00 0.00 179.25 177.74 1i1m h LEU 29 N 0.00 0.19 0.03 0.00 3.38 -1.54 -2.45 115.31 114.92 1i1m h LEU 29 Ca 0.05 -0.11 -0.34 0.00 0.09 0.00 0.00 57.88 57.57 1i1m h LEU 29 Cb 0.23 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 40.88 1i1m h LEU 29 CO -0.00 0.74 -2.03 1.41 0.09 0.00 0.00 178.44 178.65 1i1m n HIS 30 N -3.86 0.72 -0.14 1.13 8.25 -0.70 -4.66 115.22 115.96 1i1m n HIS 30 Ca -0.02 0.21 0.02 0.00 -0.26 0.00 0.00 57.72 57.67 1i1m n HIS 30 Cb 0.61 -1.12 0.03 0.00 1.12 0.00 0.00 29.99 30.64 1i1m n HIS 30 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1i1m n TYR 31 N -3.12 0.06 -1.47 4.41 4.02 0.04 -4.99 117.16 116.10 1i1m n TYR 31 Ca -0.28 -0.55 -0.16 0.00 -0.01 0.00 0.00 57.90 56.89 1i1m n TYR 31 Cb 1.07 -0.06 -0.07 0.00 -0.02 0.00 0.00 39.34 40.26 1i1m n TYR 31 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1i1m n GLY 32 N -0.49 1.58 3.20 2.72 0.00 -0.92 -4.88 105.19 106.41 1i1m n GLY 32 Ca 0.03 -0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.56 1i1m n GLY 32 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1i1m n THR 33 N -2.37 3.77 -3.70 2.61 -2.24 -1.26 -2.47 114.28 108.62 1i1m n THR 33 Ca -0.16 -3.70 -0.10 0.00 -2.27 0.00 0.00 64.05 57.82 1i1m n THR 33 Cb 0.61 -2.46 -0.05 0.00 -2.10 0.00 0.00 70.33 66.33 1i1m n THR 33 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1i1m s SER 34 N 3.64 -0.13 -0.01 3.42 1.04 -1.26 -2.25 113.70 118.15 1i1m s SER 34 Ca 0.50 -0.40 0.03 0.00 0.48 0.00 0.00 55.95 56.56 1i1m s SER 34 Cb 0.08 0.43 -0.01 0.00 0.10 0.00 0.00 66.02 66.62 1i1m s SER 34 CO 0.01 -0.80 -0.09 -0.69 0.98 0.00 0.00 173.24 172.64 1i1m s VAL 35 N -3.74 0.75 0.23 5.02 1.01 0.09 -0.64 120.40 123.13 1i1m s VAL 35 Ca 0.03 -0.40 -0.02 0.00 0.00 0.00 0.00 61.98 61.59 1i1m s VAL 35 Cb 0.03 -0.64 -0.03 0.00 0.00 0.00 0.00 36.38 35.74 1i1m s VAL 35 CO -0.11 0.22 0.21 0.72 0.00 0.00 0.00 175.10 176.14 1i1m s PHE 36 N -0.18 1.13 0.15 5.22 -0.12 -0.79 -1.08 117.98 122.30 1i1m s PHE 36 Ca 0.03 -1.32 0.02 0.00 -0.05 0.00 0.00 56.93 55.60 1i1m s PHE 36 Cb -0.04 -0.46 -0.04 0.00 -0.63 0.00 0.00 43.02 41.85 1i1m s PHE 36 CO -0.00 -0.74 -0.02 -1.21 -0.05 0.00 0.00 175.22 173.20 1i1m s GLU 37 N -4.00 1.01 -0.17 1.99 0.41 -0.78 -4.77 118.70 112.39 1i1m s GLU 37 Ca 0.37 -1.47 -0.01 0.00 -0.41 0.00 0.00 54.97 53.45 1i1m s GLU 37 Cb 0.05 -0.23 0.04 0.00 -1.78 0.00 0.00 34.13 32.22 1i1m s GLU 37 CO 0.14 -0.10 -0.04 0.20 -0.49 0.00 0.00 175.26 174.97 1i1m s GLY 38 N -3.13 0.95 0.09 -1.39 0.00 -1.26 -3.77 107.32 98.82 1i1m s GLY 38 Ca 0.20 -0.85 0.07 0.00 0.00 0.00 0.00 44.72 44.14 1i1m s GLY 38 CO 0.01 0.99 -0.19 -0.42 0.00 0.00 0.00 173.10 173.49 1i1m s ILE 39 N 1.64 1.54 -0.02 0.90 1.01 -0.62 -4.84 121.20 120.80 1i1m s ILE 39 Ca 0.00 -1.45 0.07 0.00 0.00 0.00 0.00 60.65 59.27 1i1m s ILE 39 Cb -0.16 -1.41 -0.02 0.00 0.01 0.00 0.00 42.46 40.89 1i1m s ILE 39 CO -0.08 -0.09 -0.23 -0.13 0.00 0.00 0.00 174.94 174.41 1i1m s ARG 40 N -1.81 1.96 -0.22 2.79 0.52 -1.26 0.05 118.95 120.98 1i1m s ARG 40 Ca 0.04 -0.84 -0.05 0.00 -0.52 0.00 0.00 55.73 54.36 1i1m s ARG 40 Cb -0.10 -1.87 -0.02 0.00 0.52 0.00 0.00 34.95 33.49 1i1m s ARG 40 CO 0.04 0.49 0.00 0.00 0.02 0.00 0.00 175.30 175.84 1i1m s TYR 42 N 1.39 2.85 -0.16 0.00 1.51 0.58 -1.45 117.35 122.09 1i1m s TYR 42 Ca 0.05 -0.06 -0.27 0.00 -1.01 0.00 0.00 57.07 55.78 1i1m s TYR 42 Cb -0.15 -1.61 -0.01 0.00 -0.11 0.00 0.00 41.96 40.09 1i1m s TYR 42 CO 0.00 0.35 0.90 0.34 -1.11 0.00 0.00 175.55 176.03 1i1m s ASP 43 N -1.33 7.05 0.04 2.29 2.15 -1.22 -0.49 116.67 125.16 1i1m s ASP 43 Ca 0.16 1.29 0.00 0.00 0.43 0.00 0.00 52.55 54.44 1i1m s ASP 43 Cb -0.11 -2.49 -0.00 0.00 -0.30 0.00 0.00 42.92 40.02 1i1m s ASP 43 CO 0.06 -0.44 0.02 -1.54 -0.17 0.00 0.00 175.17 173.10 1i1m n SER 44 N 5.28 0.83 0.11 -0.34 3.41 -0.88 -4.95 113.62 117.09 1i1m n SER 44 Ca 0.06 -1.22 0.10 0.00 -0.26 0.00 0.00 58.87 57.56 1i1m n SER 44 Cb 0.48 0.11 0.45 0.00 -0.26 0.00 0.00 64.21 65.00 1i1m n SER 44 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1i1m n HIS 45 N -0.09 0.63 -0.65 7.33 1.44 -0.94 -1.28 115.22 121.66 1i1m n HIS 45 Ca -0.00 0.26 0.07 0.00 -2.01 0.00 0.00 57.72 56.04 1i1m n HIS 45 Cb 0.06 -0.92 0.18 0.00 0.12 0.00 0.00 29.99 29.43 1i1m n HIS 45 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 1i1m n LYS 46 N -2.09 2.68 0.00 -1.40 5.02 -1.26 -5.10 118.16 116.01 1i1m n LYS 46 Ca 0.02 -2.42 0.00 0.00 -2.02 0.00 0.00 58.31 53.89 1i1m n LYS 46 Cb 0.18 -1.53 0.00 0.00 -0.02 0.00 0.00 35.03 33.67 1i1m n LYS 46 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1i1m n GLY 47 N -0.34 -2.08 3.68 0.72 0.00 -0.40 -4.89 105.19 101.87 1i1m n GLY 47 Ca 0.15 -1.65 -0.45 0.00 0.00 0.00 0.00 46.02 44.08 1i1m n GLY 47 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1i1m n PRO 48 N -0.08 2.12 -3.77 1.61 -0.04 -1.26 -2.07 135.00 131.52 1i1m n PRO 48 Ca 0.00 0.76 -0.13 0.00 -0.04 0.00 0.00 63.50 64.09 1i1m n PRO 48 Cb 0.00 -2.46 -0.14 0.00 -0.04 0.00 0.00 33.50 30.86 1i1m n PRO 48 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1i1m s VAL 49 N 0.25 -0.03 -0.24 0.52 0.11 0.36 -2.70 120.40 118.66 1i1m s VAL 49 Ca 0.71 0.12 -0.20 0.00 -2.93 0.00 0.00 61.98 59.68 1i1m s VAL 49 Cb -0.65 -0.25 -0.02 0.00 -1.53 0.00 0.00 36.38 33.93 1i1m s VAL 49 CO 0.46 0.05 0.59 -0.69 -3.33 0.00 0.00 175.10 172.18 1i1m s VAL 50 N 0.83 5.02 -0.08 2.04 1.01 0.01 -0.30 120.40 128.93 1i1m s VAL 50 Ca -0.06 1.07 -0.30 0.00 0.00 0.00 0.00 61.98 62.69 1i1m s VAL 50 Cb -0.08 -3.90 -0.03 0.00 0.00 0.00 0.00 36.38 32.36 1i1m s VAL 50 CO -0.04 0.07 1.29 0.12 0.00 0.00 0.00 175.10 176.53 1i1m s PHE 51 N 2.30 2.94 -1.40 5.22 5.36 -0.57 -1.85 117.98 129.97 1i1m s PHE 51 Ca 0.25 1.00 -0.08 0.00 -0.96 0.00 0.00 56.93 57.14 1i1m s PHE 51 Cb -0.16 -3.53 0.01 0.00 -0.34 0.00 0.00 43.02 39.00 1i1m s PHE 51 CO 0.09 -1.83 0.33 0.54 -1.46 0.00 0.00 175.22 172.89 1i1m n ARG 52 N 5.78 -1.61 0.19 10.12 1.74 0.11 -4.62 116.66 128.38 1i1m n ARG 52 Ca 0.13 0.22 -0.14 0.00 -0.77 0.00 0.00 57.85 57.29 1i1m n ARG 52 Cb 0.45 -3.75 -0.07 0.00 -1.02 0.00 0.00 32.46 28.07 1i1m n ARG 52 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1i1m h HIS 53 N -1.97 -0.72 -0.85 -1.55 2.76 -1.76 -2.82 115.15 108.23 1i1m h HIS 53 Ca -0.66 0.00 0.02 0.00 -2.20 0.00 0.00 60.37 57.53 1i1m h HIS 53 Cb 1.39 0.28 -0.05 0.00 1.55 0.00 0.00 27.41 30.58 1i1m h HIS 53 CO 0.46 -0.40 0.56 -0.09 -1.30 0.00 0.00 177.93 177.16 1i1m h ARG 54 N -0.58 1.07 -0.95 5.26 2.43 -1.93 -2.45 114.38 117.24 1i1m h ARG 54 Ca -0.01 -0.06 0.02 0.00 -0.81 0.00 0.00 59.98 59.11 1i1m h ARG 54 Cb 0.53 -0.24 -0.05 0.00 -0.42 0.00 0.00 29.97 29.79 1i1m h ARG 54 CO -0.05 0.71 0.62 0.93 -1.51 0.00 0.00 179.97 180.67 1i1m h GLU 55 N 1.11 1.21 -0.35 0.20 3.07 -1.93 0.21 114.58 118.11 1i1m h GLU 55 Ca 0.33 -0.07 -0.14 0.00 -0.50 0.00 0.00 59.36 58.97 1i1m h GLU 55 Cb -0.06 -0.27 -0.01 0.00 -0.84 0.00 0.00 28.75 27.57 1i1m h GLU 55 CO -0.09 0.80 -0.32 0.45 -1.40 0.00 0.00 179.01 178.45 1i1m h HIS 56 N 1.25 1.00 0.00 4.33 3.86 -1.22 -1.49 115.15 122.88 1i1m h HIS 56 Ca 0.36 -0.29 -0.11 0.00 -1.16 0.00 0.00 60.37 59.16 1i1m h HIS 56 Cb -0.10 -0.21 -0.02 0.00 1.06 0.00 0.00 27.41 28.15 1i1m h HIS 56 CO -0.00 1.08 -0.52 0.52 0.86 0.00 0.00 177.93 179.88 1i1m h MET 57 N 0.63 0.00 -0.31 2.45 2.86 -0.98 -1.62 114.93 117.96 1i1m h MET 57 Ca 0.06 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.55 1i1m h MET 57 Cb 0.90 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.55 1i1m h MET 57 CO 0.08 0.52 -0.39 0.37 1.06 0.00 0.00 176.91 178.54 1i1m h GLN 58 N 0.00 0.74 0.00 1.72 5.75 -0.44 -2.55 115.11 120.32 1i1m h GLN 58 Ca -0.01 -0.38 -0.07 0.00 -0.15 0.00 0.00 58.65 58.04 1i1m h GLN 58 Cb 0.93 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 29.48 1i1m h GLN 58 CO 0.07 1.00 -0.34 -0.09 -2.65 0.00 0.00 178.83 176.82 1i1m h ARG 59 N 0.61 0.00 -0.36 1.69 2.43 -0.85 -1.71 114.38 116.18 1i1m h ARG 59 Ca 0.05 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.16 1i1m h ARG 59 Cb 0.94 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.48 1i1m h ARG 59 CO 0.09 0.34 -0.03 1.25 -1.51 0.00 0.00 179.97 180.10 1i1m h LEU 60 N 0.00 0.65 -0.90 3.80 6.46 -1.02 -0.62 115.31 123.69 1i1m h LEU 60 Ca -0.00 -0.33 -0.09 0.00 -0.12 0.00 0.00 57.88 57.34 1i1m h LEU 60 Cb 0.90 -0.18 -0.02 0.00 -0.73 0.00 0.00 40.66 40.64 1i1m h LEU 60 CO 0.04 0.82 -0.19 0.45 -0.62 0.00 0.00 178.44 178.94 1i1m h HIS 61 N 0.47 0.65 -0.44 1.25 3.86 -1.19 -2.48 115.15 117.26 1i1m h HIS 61 Ca 0.10 -0.13 -0.14 0.00 -1.16 0.00 0.00 60.37 59.04 1i1m h HIS 61 Cb 0.51 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.80 1i1m h HIS 61 CO 0.04 0.74 -0.26 -0.44 0.86 0.00 0.00 177.93 178.87 1i1m h ASP 62 N 0.53 0.98 -0.38 2.45 3.32 -1.04 -0.80 116.42 121.48 1i1m h ASP 62 Ca 0.08 -0.39 -0.14 0.00 0.02 0.00 0.00 57.03 56.61 1i1m h ASP 62 Cb 0.63 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.90 1i1m h ASP 62 CO 0.04 1.18 -0.27 0.28 -1.72 0.00 0.00 179.24 178.75 1i1m h SER 63 N 0.81 0.93 -0.08 6.45 0.02 -1.02 -2.34 113.55 118.32 1i1m h SER 63 Ca 0.10 -0.37 -0.12 0.00 -0.84 0.00 0.00 61.79 60.56 1i1m h SER 63 Cb 0.84 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 63.10 1i1m h SER 63 CO 0.07 1.14 -0.32 0.00 -1.14 0.00 0.00 176.83 176.59 1i1m h ALA 64 N 0.91 0.95 -0.72 3.77 0.00 -1.37 -3.04 119.26 119.76 1i1m h ALA 64 Ca 0.09 -0.39 -0.06 0.00 0.00 0.00 0.00 54.91 54.55 1i1m h ALA 64 Cb 0.84 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 1i1m h ALA 64 CO 0.07 0.61 0.22 -0.22 0.00 0.00 0.00 179.25 179.93 1i1m h LYS 65 N 0.48 1.12 -0.52 0.00 3.64 -0.88 0.23 116.57 120.64 1i1m h LYS 65 Ca 0.06 -0.25 -0.05 0.00 -1.27 0.00 0.00 60.65 59.14 1i1m h LYS 65 Cb 0.79 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.43 1i1m h LYS 65 CO 0.06 0.97 0.14 0.82 -2.27 0.00 0.00 179.45 179.17 1i1m h ILE 66 N 1.07 1.22 -0.01 2.00 2.04 -1.32 -2.23 117.51 120.27 1i1m h ILE 66 Ca 0.23 -0.76 0.00 0.00 1.00 0.00 0.00 64.86 65.33 1i1m h ILE 66 Cb 0.31 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 37.07 1i1m h ILE 66 CO -0.01 0.28 -0.30 -1.22 0.00 0.00 0.00 178.15 176.90 1i1m n TYR 67 N -4.29 0.00 -2.40 1.37 4.02 -1.08 -4.96 117.16 109.82 1i1m n TYR 67 Ca 0.04 0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.80 1i1m n TYR 67 Cb 0.21 -0.09 0.00 0.00 -0.02 0.00 0.00 39.34 39.45 1i1m n TYR 67 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1i1m n ARG 68 N -0.46 -1.67 -2.69 -0.72 1.74 0.58 -5.00 116.66 108.45 1i1m n ARG 68 Ca 0.12 0.59 -0.42 0.00 -0.77 0.00 0.00 57.85 57.37 1i1m n ARG 68 Cb 0.38 -4.76 -0.03 0.00 -1.02 0.00 0.00 32.46 27.03 1i1m n ARG 68 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1i1m s PHE 69 N -2.73 3.59 0.12 -1.55 0.08 0.17 -5.00 117.98 112.67 1i1m s PHE 69 Ca 0.06 1.64 -0.30 0.00 0.12 0.00 0.00 56.93 58.45 1i1m s PHE 69 Cb -0.03 -3.16 -0.06 0.00 -0.57 0.00 0.00 43.02 39.20 1i1m s PHE 69 CO 0.08 -0.15 1.13 -1.25 -0.10 0.00 0.00 175.22 174.92 1i1m s PRO 70 N 1.37 4.53 -0.19 0.24 0.04 -1.26 -4.58 135.00 135.14 1i1m s PRO 70 Ca 0.51 1.72 0.00 0.00 0.04 0.00 0.00 61.00 63.27 1i1m s PRO 70 Cb -0.20 -3.32 0.02 0.00 0.04 0.00 0.00 34.50 31.03 1i1m s PRO 70 CO 0.25 -0.07 -0.17 0.08 0.04 0.00 0.00 177.00 177.13 1i1m s VAL 71 N 0.36 2.31 0.10 -0.36 1.01 -1.26 -3.75 120.40 118.81 1i1m s VAL 71 Ca 0.53 -0.88 -0.08 0.00 0.00 0.00 0.00 61.98 61.55 1i1m s VAL 71 Cb -0.29 -2.00 -0.22 0.00 0.00 0.00 0.00 36.38 33.87 1i1m s VAL 71 CO 0.32 0.50 1.23 0.28 0.00 0.00 0.00 175.10 177.43 1i1m h SER 72 N 7.97 0.66 -3.74 3.32 0.02 -1.95 -3.46 113.55 116.37 1i1m h SER 72 Ca -0.44 -0.56 -0.49 0.00 -0.84 0.00 0.00 61.79 59.46 1i1m h SER 72 Cb 1.14 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 63.46 1i1m h SER 72 CO 0.63 1.37 0.36 -1.10 -1.14 0.00 0.00 176.83 176.94 1i1m s GLN 73 N -3.17 4.84 0.68 3.45 1.11 -1.26 -5.07 119.66 120.24 1i1m s GLN 73 Ca -0.07 1.50 -0.07 0.00 0.01 0.00 0.00 55.36 56.73 1i1m s GLN 73 Cb 0.08 -3.28 0.05 0.00 -1.01 0.00 0.00 33.01 28.84 1i1m s GLN 73 CO 0.89 0.49 1.00 -1.54 0.01 0.00 0.00 175.29 176.14 1i1m s SER 74 N -1.10 5.03 0.32 5.90 1.04 -1.26 -4.89 113.70 118.74 1i1m s SER 74 Ca 0.42 0.58 -0.00 0.00 0.48 0.00 0.00 55.95 57.43 1i1m s SER 74 Cb -0.26 -1.32 0.52 0.00 0.10 0.00 0.00 66.02 65.06 1i1m s SER 74 CO 0.32 -1.47 1.98 0.40 0.98 0.00 0.00 173.24 175.45 1i1m h ILE 75 N -0.53 1.18 -0.35 -1.02 2.04 -1.97 -1.77 117.51 115.08 1i1m h ILE 75 Ca -0.45 -0.35 -0.15 0.00 1.00 0.00 0.00 64.86 64.91 1i1m h ILE 75 Cb 1.30 0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.44 1i1m h ILE 75 CO 0.61 0.19 -0.38 0.44 0.00 0.00 0.00 178.15 179.00 1i1m h ASP 76 N 1.02 0.90 -0.36 1.72 3.32 -1.99 -1.78 116.42 119.25 1i1m h ASP 76 Ca 0.29 -0.41 -0.01 0.00 0.02 0.00 0.00 57.03 56.92 1i1m h ASP 76 Cb -0.08 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.20 1i1m h ASP 76 CO -0.07 1.18 0.19 -0.33 -1.72 0.00 0.00 179.24 178.48 1i1m h GLU 77 N 0.69 0.50 -0.55 3.56 5.08 -1.82 -0.62 114.58 121.43 1i1m h GLU 77 Ca 0.06 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 1i1m h GLU 77 Cb 0.95 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 30.08 1i1m h GLU 77 CO 0.09 0.43 0.25 -0.07 -1.00 0.00 0.00 179.01 178.71 1i1m h LEU 78 N 0.44 0.70 -0.33 1.33 3.38 -1.27 -0.36 115.31 119.20 1i1m h LEU 78 Ca 0.12 -0.07 -0.12 0.00 0.09 0.00 0.00 57.88 57.90 1i1m h LEU 78 Cb 0.08 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1i1m h LEU 78 CO -0.02 0.61 -0.28 0.24 0.09 0.00 0.00 178.44 179.08 1i1m h MET 79 N 0.78 0.77 -0.64 1.13 2.86 -0.96 -1.54 114.93 117.33 1i1m h MET 79 Ca 0.19 -0.39 -0.09 0.00 -2.06 0.00 0.00 59.70 57.36 1i1m h MET 79 Cb 0.11 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.75 1i1m h MET 79 CO -0.02 1.01 0.06 1.49 1.06 0.00 0.00 176.91 180.51 1i1m h GLU 80 N 0.54 1.08 -0.45 1.72 4.57 -0.74 -2.11 114.58 119.18 1i1m h GLU 80 Ca 0.06 -0.31 -0.07 0.00 -1.18 0.00 0.00 59.36 57.86 1i1m h GLU 80 Cb 0.85 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 29.30 1i1m h GLU 80 CO 0.07 1.01 -0.03 0.00 -1.18 0.00 0.00 179.01 178.89 1i1m h ALA 81 N 1.06 1.11 -0.00 2.92 0.00 -1.00 -1.34 119.26 122.00 1i1m h ALA 81 Ca 0.19 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1i1m h ALA 81 Cb 0.49 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 1i1m h ALA 81 CO 0.02 0.56 0.00 0.00 0.00 0.00 0.00 179.25 179.83 1i1m h ARG 83 N -0.17 1.13 -0.48 0.00 3.08 -1.22 -2.34 114.38 114.38 1i1m h ARG 83 Ca 0.00 -0.07 0.04 0.00 0.07 0.00 0.00 59.98 60.02 1i1m h ARG 83 Cb 0.18 -0.26 -0.04 0.00 0.08 0.00 0.00 29.97 29.93 1i1m h ARG 83 CO -0.00 0.75 0.25 -0.44 -1.07 0.00 0.00 179.97 179.46 1i1m h ASP 84 N 1.17 0.37 -0.65 7.04 5.19 -0.95 -1.72 116.42 126.86 1i1m h ASP 84 Ca 0.37 0.02 -0.01 0.00 -0.62 0.00 0.00 57.03 56.79 1i1m h ASP 84 Cb -0.01 -0.05 -0.03 0.00 0.18 0.00 0.00 39.33 39.42 1i1m h ASP 84 CO -0.12 0.26 0.37 0.58 -3.12 0.00 0.00 179.24 177.21 1i1m h VAL 85 N 0.49 1.20 -0.17 -1.35 2.07 -0.79 0.44 116.25 118.15 1i1m h VAL 85 Ca 0.20 -0.49 -0.07 0.00 0.82 0.00 0.00 66.70 67.16 1i1m h VAL 85 Cb 0.10 0.29 -0.00 0.00 -1.52 0.00 0.00 31.29 30.15 1i1m h VAL 85 CO -0.13 0.22 -0.16 0.40 0.02 0.00 0.00 177.57 177.91 1i1m h ILE 86 N 0.93 1.34 0.15 4.57 2.04 -1.13 -2.34 117.51 123.07 1i1m h ILE 86 Ca 0.24 -1.32 -0.01 0.00 1.00 0.00 0.00 64.86 64.77 1i1m h ILE 86 Cb 0.02 1.83 0.00 0.00 -0.74 0.00 0.00 36.82 37.93 1i1m h ILE 86 CO -0.04 0.39 -0.07 0.03 0.00 0.00 0.00 178.15 178.46 1i1m h ARG 87 N 0.05 -0.20 -0.89 2.37 3.08 -1.08 -1.71 114.38 116.00 1i1m h ARG 87 Ca 0.03 0.01 0.21 0.00 0.07 0.00 0.00 59.98 60.30 1i1m h ARG 87 Cb 0.70 0.04 -0.06 0.00 0.08 0.00 0.00 29.97 30.73 1i1m h ARG 87 CO 0.04 0.06 0.59 -0.22 -1.07 0.00 0.00 179.97 179.38 1i1m h LYS 88 N -0.44 0.36 -0.18 0.04 1.63 -0.96 0.12 116.57 117.13 1i1m h LYS 88 Ca -0.02 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.76 1i1m h LYS 88 Cb 0.35 -0.08 0.00 0.00 -0.60 0.00 0.00 32.23 31.90 1i1m h LYS 88 CO 0.03 0.24 0.00 0.09 -3.45 0.00 0.00 179.45 176.36 1i1m n ASN 89 N -4.49 2.39 -3.72 4.20 3.02 -0.88 -4.91 115.26 110.87 1i1m n ASN 89 Ca 0.19 -1.81 -0.25 0.00 -0.03 0.00 0.00 54.58 52.68 1i1m n ASN 89 Cb 0.71 -0.11 0.05 0.00 -0.61 0.00 0.00 39.78 39.82 1i1m n ASN 89 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1i1m n ASN 90 N 0.82 -4.45 -4.88 6.41 4.13 0.40 -4.89 115.26 112.79 1i1m n ASN 90 Ca 0.17 -0.69 -0.36 0.00 1.68 0.00 0.00 54.58 55.38 1i1m n ASN 90 Cb 0.46 -4.44 -0.06 0.00 -1.54 0.00 0.00 39.78 34.20 1i1m n ASN 90 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1i1m s LEU 91 N -7.10 4.39 -0.13 3.41 1.43 -0.69 -4.97 118.68 115.02 1i1m s LEU 91 Ca 0.46 0.51 0.13 0.00 -1.03 0.00 0.00 54.13 54.19 1i1m s LEU 91 Cb -0.22 -2.22 -0.18 0.00 0.03 0.00 0.00 46.19 43.60 1i1m s LEU 91 CO 0.78 0.37 0.06 0.35 0.23 0.00 0.00 176.35 178.15 1i1m n THR 92 N 1.78 0.93 -3.83 5.49 -2.24 -1.26 -4.72 114.28 110.43 1i1m n THR 92 Ca -0.18 -0.59 -0.12 0.00 -2.27 0.00 0.00 64.05 60.89 1i1m n THR 92 Cb 0.54 -0.58 -0.13 0.00 -2.10 0.00 0.00 70.33 68.06 1i1m n THR 92 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1i1m s SER 93 N -4.70 -0.08 0.12 3.42 1.04 -1.26 -3.40 113.70 108.83 1i1m s SER 93 Ca -0.07 0.18 -0.25 0.00 0.48 0.00 0.00 55.95 56.29 1i1m s SER 93 Cb 0.05 0.17 0.08 0.00 0.10 0.00 0.00 66.02 66.41 1i1m s SER 93 CO 0.59 -0.04 1.09 0.00 0.98 0.00 0.00 173.24 175.86 1i1m s ALA 94 N 0.18 -1.83 -0.18 5.32 0.00 -0.53 -4.57 121.76 120.14 1i1m s ALA 94 Ca -0.01 -0.02 -0.03 0.00 0.00 0.00 0.00 51.96 51.91 1i1m s ALA 94 Cb -0.02 0.69 -0.01 0.00 0.00 0.00 0.00 23.12 23.78 1i1m s ALA 94 CO -0.00 -1.07 -0.07 -0.47 0.00 0.00 0.00 175.76 174.14 1i1m s TYR 95 N -2.44 2.92 -0.11 0.00 5.04 0.82 -0.77 117.35 122.80 1i1m s TYR 95 Ca 0.19 -0.79 -0.05 0.00 -2.44 0.00 0.00 57.07 53.99 1i1m s TYR 95 Cb -0.01 -2.00 -0.04 0.00 0.35 0.00 0.00 41.96 40.26 1i1m s TYR 95 CO 0.02 -0.39 0.07 0.42 -1.34 0.00 0.00 175.55 174.34 1i1m s ILE 96 N 0.99 4.94 -0.40 3.14 1.09 0.11 -1.81 121.20 129.26 1i1m s ILE 96 Ca -0.00 -0.00 0.02 0.00 -1.10 0.00 0.00 60.65 59.56 1i1m s ILE 96 Cb -0.15 -3.13 0.12 0.00 -1.06 0.00 0.00 42.46 38.24 1i1m s ILE 96 CO -0.00 0.60 0.19 -0.60 -0.10 0.00 0.00 174.94 175.02 1i1m s ARG 97 N -0.83 1.17 0.13 2.79 6.06 0.10 -1.58 118.95 126.79 1i1m s ARG 97 Ca 0.13 -1.77 -0.30 0.00 -2.50 0.00 0.00 55.73 51.29 1i1m s ARG 97 Cb -0.12 -2.34 -0.06 0.00 0.06 0.00 0.00 34.95 32.49 1i1m s ARG 97 CO 0.03 -1.10 0.95 -2.14 -2.50 0.00 0.00 175.30 170.55 1i1m s PRO 98 N 0.70 4.72 -0.06 5.12 0.02 -1.25 -2.30 135.00 141.96 1i1m s PRO 98 Ca 0.15 1.45 -0.03 0.00 0.02 0.00 0.00 61.00 62.59 1i1m s PRO 98 Cb -0.22 -3.36 0.04 0.00 0.02 0.00 0.00 34.50 30.97 1i1m s PRO 98 CO -0.07 0.26 0.10 -1.17 -0.33 0.00 0.00 177.00 175.79 1i1m s LEU 99 N -0.18 0.06 -0.20 -5.54 1.98 0.11 -1.87 118.68 113.04 1i1m s LEU 99 Ca 0.46 0.18 -0.05 0.00 -2.89 0.00 0.00 54.13 51.83 1i1m s LEU 99 Cb -0.24 0.02 -0.03 0.00 0.66 0.00 0.00 46.19 46.61 1i1m s LEU 99 CO 0.30 -0.25 0.00 -0.63 -1.89 0.00 0.00 176.35 173.89 1i1m s ILE 100 N 2.22 4.00 0.03 6.68 1.01 -0.24 -0.55 121.20 134.34 1i1m s ILE 100 Ca 0.04 -0.30 -0.05 0.00 0.00 0.00 0.00 60.65 60.35 1i1m s ILE 100 Cb -0.12 -2.81 -0.01 0.00 0.01 0.00 0.00 42.46 39.53 1i1m s ILE 100 CO -0.04 0.43 0.08 0.72 0.00 0.00 0.00 174.94 176.13 1i1m s PHE 101 N 0.94 0.20 -0.33 3.97 -0.12 -0.24 -0.73 117.98 121.67 1i1m s PHE 101 Ca 0.01 -0.48 -0.28 0.00 -0.05 0.00 0.00 56.93 56.14 1i1m s PHE 101 Cb -0.14 -0.15 0.02 0.00 -0.63 0.00 0.00 43.02 42.11 1i1m s PHE 101 CO 0.02 -0.33 1.02 0.08 -0.05 0.00 0.00 175.22 175.96 1i1m s VAL 102 N -2.30 4.55 0.00 -2.49 1.01 -0.95 -1.18 120.40 119.04 1i1m s VAL 102 Ca -0.08 1.57 0.00 0.00 0.00 0.00 0.00 61.98 63.47 1i1m s VAL 102 Cb -0.03 -4.38 0.00 0.00 0.00 0.00 0.00 36.38 31.97 1i1m s VAL 102 CO -0.03 -0.48 0.00 0.61 0.00 0.00 0.00 175.10 175.20 1i1m n GLY 103 N 4.03 1.13 3.48 4.51 0.00 -1.26 -1.49 105.19 115.59 1i1m n GLY 103 Ca 0.10 -1.56 -0.29 0.00 0.00 0.00 0.00 46.02 44.27 1i1m n GLY 103 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1i1m n ASP 104 N 0.00 2.13 -1.35 1.61 4.64 -1.26 -1.56 116.55 120.76 1i1m n ASP 104 Ca 0.00 -2.60 0.00 0.00 -1.38 0.00 0.00 54.79 50.81 1i1m n ASP 104 Cb 0.00 -1.44 0.00 0.00 -1.04 0.00 0.00 41.12 38.64 1i1m n ASP 104 CO 0.00 0.00 0.00 0.55 -0.82 0.00 0.00 177.20 176.93 1i1m n VAL 105 N 7.76 0.00 -0.16 5.18 3.14 -1.26 -5.01 118.33 127.97 1i1m n VAL 105 Ca 0.45 0.00 -0.23 0.00 -2.96 0.00 0.00 64.34 61.60 1i1m n VAL 105 Cb 0.45 -0.07 0.22 0.00 -1.06 0.00 0.00 33.84 33.38 1i1m n VAL 105 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1i1m n GLY 106 N 5.00 -3.90 0.98 7.55 0.00 -1.26 -4.80 105.19 108.76 1i1m n GLY 106 Ca 0.00 -1.27 0.12 0.00 0.00 0.00 0.00 46.02 44.87 1i1m n GLY 106 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1i1m n MET 107 N -4.82 2.35 -2.38 1.61 2.81 -1.26 -4.77 117.12 110.65 1i1m n MET 107 Ca 0.10 -1.96 -0.37 0.00 -1.81 0.00 0.00 57.70 53.66 1i1m n MET 107 Cb 0.45 -1.47 -0.02 0.00 -0.71 0.00 0.00 33.22 31.46 1i1m n MET 107 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1i1m s GLY 108 N -1.94 2.78 0.26 3.03 0.00 -1.26 -4.93 107.32 105.26 1i1m s GLY 108 Ca 0.29 0.85 -0.04 0.00 0.00 0.00 0.00 44.72 45.82 1i1m s GLY 108 CO 0.30 1.31 1.87 -2.08 0.00 0.00 0.00 173.10 174.50 1i1m h VAL 109 N 2.12 1.06 -3.60 1.40 2.07 -2.03 -3.38 116.25 113.90 1i1m h VAL 109 Ca -0.49 -0.37 -0.64 0.00 0.82 0.00 0.00 66.70 66.02 1i1m h VAL 109 Cb 1.23 -0.11 -0.14 0.00 -1.52 0.00 0.00 31.29 30.74 1i1m h VAL 109 CO 0.62 0.20 -0.02 0.20 0.02 0.00 0.00 177.57 178.58 1i1m s ASN 110 N -5.83 6.35 0.54 0.57 -0.87 -1.26 -5.05 114.94 109.39 1i1m s ASN 110 Ca -0.12 0.10 -0.22 0.00 -1.57 0.00 0.00 52.86 51.05 1i1m s ASN 110 Cb 0.19 -2.28 -0.05 0.00 -0.02 0.00 0.00 41.25 39.10 1i1m s ASN 110 CO 0.80 -0.45 1.34 -2.65 -2.57 0.00 0.00 177.10 173.57 1i1m n PRO 111 N 5.73 1.67 -2.12 -0.60 -0.02 -1.26 -4.95 135.00 133.46 1i1m n PRO 111 Ca -0.04 0.61 -0.38 0.00 -2.02 0.00 0.00 63.50 61.67 1i1m n PRO 111 Cb 0.49 -2.55 -0.00 0.00 -0.02 0.00 0.00 33.50 31.42 1i1m n PRO 111 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1i1m s PRO 112 N -2.84 3.78 0.41 0.52 0.04 -1.26 -4.95 135.00 130.70 1i1m s PRO 112 Ca 0.71 1.99 -0.25 0.00 0.04 0.00 0.00 61.00 63.49 1i1m s PRO 112 Cb -0.42 -2.55 -0.11 0.00 0.04 0.00 0.00 34.50 31.46 1i1m s PRO 112 CO 0.50 -0.60 1.13 0.00 0.04 0.00 0.00 177.00 178.07 1i1m n ALA 113 N -0.27 0.64 -0.74 8.56 0.00 -1.26 -2.52 120.51 124.93 1i1m n ALA 113 Ca 0.06 0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.76 1i1m n ALA 113 Cb 0.46 -2.16 0.00 0.00 0.00 0.00 0.00 19.45 17.75 1i1m n ALA 113 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i1m n GLY 114 N 1.02 0.80 3.81 0.00 0.00 -1.26 -5.05 105.19 104.51 1i1m n GLY 114 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 1i1m n GLY 114 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1i1m s TYR 115 N -3.05 2.78 0.07 1.61 -0.85 -1.05 -5.09 117.35 111.77 1i1m s TYR 115 Ca 0.00 1.03 0.01 0.00 -0.52 0.00 0.00 57.07 57.60 1i1m s TYR 115 Cb 0.00 -3.22 -0.03 0.00 0.38 0.00 0.00 41.96 39.09 1i1m s TYR 115 CO 0.00 -1.91 -0.06 -1.54 -1.52 0.00 0.00 175.55 170.52 1i1m s SER 116 N -4.01 0.88 0.42 -0.18 1.04 -1.26 -4.85 113.70 105.74 1i1m s SER 116 Ca 0.62 -0.83 -0.00 0.00 0.48 0.00 0.00 55.95 56.22 1i1m s SER 116 Cb -0.14 0.10 -0.02 0.00 0.10 0.00 0.00 66.02 66.06 1i1m s SER 116 CO 0.53 -0.40 0.64 0.42 0.98 0.00 0.00 173.24 175.42 1i1m s THR 117 N -2.83 4.45 -0.11 2.02 -4.23 -1.25 -4.63 115.64 109.06 1i1m s THR 117 Ca 0.02 -0.42 -0.06 0.00 -1.18 0.00 0.00 61.69 60.06 1i1m s THR 117 Cb -0.00 -3.64 -0.04 0.00 1.34 0.00 0.00 72.50 70.16 1i1m s THR 117 CO -0.04 -0.46 0.10 -1.81 -0.54 0.00 0.00 174.62 171.88 1i1m s ASP 118 N -4.15 6.07 0.01 3.99 1.01 -0.32 -4.93 116.67 118.35 1i1m s ASP 118 Ca 0.45 0.37 0.08 0.00 0.71 0.00 0.00 52.55 54.16 1i1m s ASP 118 Cb -0.10 -1.91 -0.03 0.00 1.01 0.00 0.00 42.92 41.89 1i1m s ASP 118 CO 0.38 0.39 -0.22 -0.69 0.21 0.00 0.00 175.17 175.24 1i1m s VAL 119 N -0.94 2.41 -0.00 -1.27 1.01 -1.26 -1.08 120.40 119.27 1i1m s VAL 119 Ca 0.14 -1.16 0.01 0.00 0.00 0.00 0.00 61.98 60.97 1i1m s VAL 119 Cb -0.12 -1.93 0.00 0.00 0.00 0.00 0.00 36.38 34.33 1i1m s VAL 119 CO 0.03 0.46 -0.02 -0.63 0.00 0.00 0.00 175.10 174.95 1i1m s ILE 120 N -0.76 0.14 -0.17 2.22 -1.09 0.28 -1.85 121.20 119.97 1i1m s ILE 120 Ca 0.12 -0.06 -0.03 0.00 -2.23 0.00 0.00 60.65 58.45 1i1m s ILE 120 Cb -0.10 -0.14 0.05 0.00 -1.58 0.00 0.00 42.46 40.70 1i1m s ILE 120 CO 0.02 0.05 0.04 -0.63 -1.23 0.00 0.00 174.94 173.18 1i1m s ILE 121 N 0.06 0.39 -0.04 2.92 1.01 -0.51 0.08 121.20 125.12 1i1m s ILE 121 Ca -0.00 -0.38 0.05 0.00 0.00 0.00 0.00 60.65 60.32 1i1m s ILE 121 Cb -0.02 -0.87 -0.02 0.00 0.01 0.00 0.00 42.46 41.56 1i1m s ILE 121 CO -0.00 -0.14 -0.18 0.00 0.00 0.00 0.00 174.94 174.62 1i1m s ALA 122 N 1.93 2.51 0.01 9.38 0.00 -0.97 -2.01 121.76 132.60 1i1m s ALA 122 Ca 0.01 -1.02 0.05 0.00 0.00 0.00 0.00 51.96 51.00 1i1m s ALA 122 Cb -0.16 -0.84 -0.02 0.00 0.00 0.00 0.00 23.12 22.10 1i1m s ALA 122 CO -0.08 0.54 -0.16 0.00 0.00 0.00 0.00 175.76 176.06 1i1m s ALA 123 N -0.66 1.33 -0.05 0.00 0.00 -1.26 0.02 121.76 121.13 1i1m s ALA 123 Ca 0.10 -0.77 -0.29 0.00 0.00 0.00 0.00 51.96 51.00 1i1m s ALA 123 Cb -0.11 -0.29 0.11 0.00 0.00 0.00 0.00 23.12 22.83 1i1m s ALA 123 CO 0.00 0.30 0.91 -0.59 0.00 0.00 0.00 175.76 176.39 1i1m s PHE 124 N -0.56 -0.36 0.31 0.00 -0.12 -0.75 -4.57 117.98 111.93 1i1m s PHE 124 Ca 0.05 0.37 -0.29 0.00 -0.05 0.00 0.00 56.93 57.01 1i1m s PHE 124 Cb -0.07 0.51 -0.10 0.00 -0.63 0.00 0.00 43.02 42.73 1i1m s PHE 124 CO 0.00 -0.49 1.28 -2.14 -0.05 0.00 0.00 175.22 173.83 1i1m s PRO 125 N -2.46 4.40 -0.19 1.99 0.02 -1.26 -0.13 135.00 137.37 1i1m s PRO 125 Ca 0.02 2.14 -0.08 0.00 0.02 0.00 0.00 61.00 63.10 1i1m s PRO 125 Cb -0.01 -3.10 0.08 0.00 0.02 0.00 0.00 34.50 31.49 1i1m s PRO 125 CO -0.05 -0.14 0.43 -0.46 -0.33 0.00 0.00 177.00 176.45 1i1m s TRP 126 N -1.01 -0.73 0.00 6.54 -0.00 -1.26 -4.77 118.94 117.70 1i1m s TRP 126 Ca 0.49 1.46 0.00 0.00 -0.00 0.00 0.00 56.10 58.05 1i1m s TRP 126 Cb -0.38 0.31 0.00 0.00 -0.00 0.00 0.00 33.47 33.40 1i1m s TRP 126 CO 0.50 -0.43 0.00 0.41 -0.00 0.00 0.00 176.95 177.43 1i1m n GLY 127 N 4.87 -1.31 3.70 5.86 0.00 -1.26 -4.83 105.19 112.22 1i1m n GLY 127 Ca -0.15 -1.54 -0.42 0.00 0.00 0.00 0.00 46.02 43.90 1i1m n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i1m s ALA 128 N -3.60 3.66 0.17 4.61 0.00 -1.26 -4.93 121.76 120.41 1i1m s ALA 128 Ca 0.00 1.15 -0.14 0.00 0.00 0.00 0.00 51.96 52.97 1i1m s ALA 128 Cb 0.00 -3.62 0.10 0.00 0.00 0.00 0.00 23.12 19.60 1i1m s ALA 128 CO 0.00 -0.89 1.79 -0.92 0.00 0.00 0.00 175.76 175.74 1i1m h TYR 129 N 7.58 0.45 -0.27 0.00 3.20 -1.85 -2.72 116.97 123.35 1i1m h TYR 129 Ca -0.41 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.47 1i1m h TYR 129 Cb 1.20 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 39.34 1i1m h TYR 129 CO 0.72 0.23 0.00 1.28 -1.64 0.00 0.00 178.16 178.75 1i1m n LEU 130 N -4.89 2.14 0.00 2.82 4.77 -1.26 -5.02 117.00 115.57 1i1m n LEU 130 Ca 0.03 -0.94 0.00 0.00 -0.03 0.00 0.00 56.01 55.07 1i1m n LEU 130 Cb 0.11 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 1i1m n LEU 130 CO 0.30 0.47 0.00 0.61 -1.33 0.00 0.00 177.39 177.44 1i1m n GLY 131 N 1.21 3.88 0.20 -0.72 0.00 -1.03 -4.67 105.19 104.06 1i1m n GLY 131 Ca 0.16 -1.57 -0.07 0.00 0.00 0.00 0.00 46.02 44.55 1i1m n GLY 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i1m h ALA 132 N 0.00 0.59 -0.16 4.61 0.00 -1.96 -2.45 119.26 119.89 1i1m h ALA 132 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1i1m h ALA 132 Cb 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1i1m h ALA 132 CO 0.00 -0.01 0.00 0.39 0.00 0.00 0.00 179.25 179.63 1i1m n GLU 133 N -4.80 1.78 -0.31 0.00 -0.58 -1.26 -4.33 120.64 111.14 1i1m n GLU 133 Ca 0.02 -1.17 -0.04 0.00 -0.42 0.00 0.00 57.16 55.54 1i1m n GLU 133 Cb 0.05 -1.41 0.08 0.00 -0.57 0.00 0.00 31.44 29.58 1i1m n GLU 133 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1i1m h ALA 134 N 4.13 1.08 -0.12 0.62 0.00 -1.71 0.05 119.26 123.31 1i1m h ALA 134 Ca 0.00 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 1i1m h ALA 134 Cb 0.53 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1i1m h ALA 134 CO 0.00 0.58 -0.16 -0.07 0.00 0.00 0.00 179.25 179.61 1i1m h LEU 135 N 1.17 0.17 0.00 0.00 3.38 -1.75 -0.55 115.31 117.72 1i1m h LEU 135 Ca 0.30 -0.04 -0.18 0.00 0.09 0.00 0.00 57.88 58.05 1i1m h LEU 135 Cb 0.03 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 1i1m h LEU 135 CO -0.05 0.35 -1.17 -0.62 0.09 0.00 0.00 178.44 177.04 1i1m n GLU 136 N -4.27 0.53 0.06 1.13 1.02 -1.08 -4.61 120.64 113.43 1i1m n GLU 136 Ca -0.01 0.51 -0.04 0.00 -0.02 0.00 0.00 57.16 57.60 1i1m n GLU 136 Cb 0.28 -1.69 -0.08 0.00 -0.02 0.00 0.00 31.44 29.92 1i1m n GLU 136 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 1i1m h GLN 137 N -1.00 0.00 0.00 3.49 4.20 -1.10 -3.38 115.11 117.32 1i1m h GLN 137 Ca -0.27 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.44 1i1m h GLN 137 Cb 1.09 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.87 1i1m h GLN 137 CO -0.16 0.73 0.00 0.41 -0.67 0.00 0.00 178.83 179.14 1i1m n GLY 138 N 1.36 0.16 3.48 3.46 0.00 -0.22 -4.41 105.19 109.02 1i1m n GLY 138 Ca -0.03 -1.87 -0.23 0.00 0.00 0.00 0.00 46.02 43.89 1i1m n GLY 138 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1i1m s ILE 139 N -1.66 1.31 -0.26 -0.61 -4.36 -0.32 -4.69 121.20 110.60 1i1m s ILE 139 Ca 0.00 -2.00 -0.07 0.00 -0.26 0.00 0.00 60.65 58.32 1i1m s ILE 139 Cb 0.00 -2.82 -0.02 0.00 1.25 0.00 0.00 42.46 40.88 1i1m s ILE 139 CO 0.00 0.00 0.07 -1.81 0.24 0.00 0.00 174.94 173.44 1i1m s ASP 140 N -3.53 5.11 0.32 4.36 1.01 -1.26 -0.77 116.67 121.91 1i1m s ASP 140 Ca 0.36 -0.34 0.08 0.00 0.71 0.00 0.00 52.55 53.36 1i1m s ASP 140 Cb 0.09 -1.91 -0.03 0.00 1.01 0.00 0.00 42.92 42.07 1i1m s ASP 140 CO 0.16 -0.08 0.23 0.00 0.21 0.00 0.00 175.17 175.69 1i1m s ALA 141 N 1.59 3.69 -0.01 5.23 0.00 -0.19 -1.19 121.76 130.87 1i1m s ALA 141 Ca 0.06 -1.64 0.01 0.00 0.00 0.00 0.00 51.96 50.38 1i1m s ALA 141 Cb -0.16 -1.09 0.00 0.00 0.00 0.00 0.00 23.12 21.88 1i1m s ALA 141 CO 0.03 0.07 -0.03 1.41 0.00 0.00 0.00 175.76 177.24 1i1m s MET 142 N -3.92 0.36 -0.21 0.00 1.75 -0.85 -1.02 119.30 115.40 1i1m s MET 142 Ca 0.38 -0.10 -0.29 0.00 -1.25 0.00 0.00 55.69 54.43 1i1m s MET 142 Cb -0.06 -0.38 -0.00 0.00 2.84 0.00 0.00 34.83 37.23 1i1m s MET 142 CO 0.25 0.03 1.15 0.08 -0.65 0.00 0.00 175.02 175.89 1i1m s VAL 143 N 0.19 4.47 0.67 10.11 1.01 -1.26 -0.39 120.40 135.19 1i1m s VAL 143 Ca -0.02 1.76 -0.14 0.00 0.00 0.00 0.00 61.98 63.59 1i1m s VAL 143 Cb -0.05 -4.17 0.00 0.00 0.00 0.00 0.00 36.38 32.16 1i1m s VAL 143 CO -0.00 -0.20 1.09 -0.55 0.00 0.00 0.00 175.10 175.44 1i1m s SER 144 N 1.65 5.18 0.00 3.32 0.15 -0.13 -4.89 113.70 118.98 1i1m s SER 144 Ca 0.49 1.90 0.27 0.00 0.70 0.00 0.00 55.95 59.31 1i1m s SER 144 Cb -0.18 -2.54 0.93 0.00 -1.71 0.00 0.00 66.02 62.53 1i1m s SER 144 CO 0.11 -1.58 1.68 -1.54 1.20 0.00 0.00 173.24 173.11 1i1m n SER 145 N -2.58 0.76 -4.74 5.45 3.41 -1.26 -4.73 113.62 109.94 1i1m n SER 145 Ca 0.10 -0.71 -0.35 0.00 -0.26 0.00 0.00 58.87 57.65 1i1m n SER 145 Cb 0.52 0.05 -0.08 0.00 -0.26 0.00 0.00 64.21 64.44 1i1m n SER 145 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 1i1m s TRP 146 N -2.53 3.37 0.24 7.33 0.52 -1.26 -5.11 118.94 121.51 1i1m s TRP 146 Ca 0.25 0.29 0.02 0.00 0.02 0.00 0.00 56.10 56.67 1i1m s TRP 146 Cb 0.19 -2.00 -0.04 0.00 -1.15 0.00 0.00 33.47 30.48 1i1m s TRP 146 CO 0.51 0.42 0.41 -0.80 0.02 0.00 0.00 176.95 177.51 1i1m s ASN 147 N -0.31 6.34 0.45 2.95 0.02 -1.26 -4.39 114.94 118.75 1i1m s ASN 147 Ca 0.10 0.30 -0.13 0.00 -1.02 0.00 0.00 52.86 52.10 1i1m s ASN 147 Cb -0.12 -1.96 -0.07 0.00 0.02 0.00 0.00 41.25 39.12 1i1m s ASN 147 CO 0.01 -0.10 0.86 -0.13 0.02 0.00 0.00 177.10 177.76 1i1m s ARG 148 N -3.74 3.84 0.15 -0.60 0.52 -0.71 -4.98 118.95 113.43 1i1m s ARG 148 Ca 0.37 0.67 -0.32 0.00 -0.52 0.00 0.00 55.73 55.94 1i1m s ARG 148 Cb -0.10 -2.28 -0.17 0.00 0.52 0.00 0.00 34.95 32.91 1i1m s ARG 148 CO 0.31 -0.14 0.76 0.00 0.02 0.00 0.00 175.30 176.24 1i1m n ALA 149 N -1.44 -2.73 -1.70 2.13 0.00 -1.26 -4.07 120.51 111.43 1i1m n ALA 149 Ca 0.04 0.48 -0.35 0.00 0.00 0.00 0.00 53.44 53.62 1i1m n ALA 149 Cb 0.54 -1.71 0.02 0.00 0.00 0.00 0.00 19.45 18.29 1i1m n ALA 149 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1i1m s ALA 150 N -0.66 2.63 0.27 0.00 0.00 -1.26 -4.79 121.76 117.94 1i1m s ALA 150 Ca 0.72 0.76 -0.09 0.00 0.00 0.00 0.00 51.96 53.34 1i1m s ALA 150 Cb -1.00 -3.35 0.41 0.00 0.00 0.00 0.00 23.12 19.18 1i1m s ALA 150 CO 0.56 -0.92 1.53 -2.30 0.00 0.00 0.00 175.76 174.63 1i1m n PRO 151 N -1.61 -0.11 -2.14 0.00 -0.02 -1.26 -2.95 135.00 126.90 1i1m n PRO 151 Ca 0.11 1.53 -0.30 0.00 -2.02 0.00 0.00 63.50 62.82 1i1m n PRO 151 Cb 0.51 -2.28 0.02 0.00 -0.02 0.00 0.00 33.50 31.73 1i1m n PRO 151 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1i1m n ASN 152 N -5.57 5.68 0.00 2.55 5.15 -1.26 -4.71 115.26 117.10 1i1m n ASN 152 Ca 0.15 -3.76 0.00 0.00 -0.60 0.00 0.00 54.58 50.37 1i1m n ASN 152 Cb 0.47 -0.62 0.00 0.00 -0.53 0.00 0.00 39.78 39.10 1i1m n ASN 152 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1i1m n THR 153 N -0.59 0.00 -3.93 -0.44 -2.24 -1.15 -4.99 114.28 100.94 1i1m n THR 153 Ca 0.46 0.04 -0.31 0.00 -2.27 0.00 0.00 64.05 61.98 1i1m n THR 153 Cb 0.63 -0.91 -0.15 0.00 -2.10 0.00 0.00 70.33 67.80 1i1m n THR 153 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1i1m s ILE 154 N -0.69 1.66 -0.43 2.28 1.01 -1.26 -5.08 121.20 118.69 1i1m s ILE 154 Ca 0.00 -1.64 -0.42 0.00 0.00 0.00 0.00 60.65 58.59 1i1m s ILE 154 Cb 0.00 -2.08 -0.17 0.00 0.01 0.00 0.00 42.46 40.22 1i1m s ILE 154 CO 0.00 -0.38 1.97 -0.81 0.00 0.00 0.00 174.94 175.71 1i1m n PRO 155 N 4.56 0.41 0.01 2.79 -0.04 -1.26 -4.86 135.00 136.61 1i1m n PRO 155 Ca -0.05 0.13 0.13 0.00 -0.04 0.00 0.00 63.50 63.67 1i1m n PRO 155 Cb 0.43 -1.80 0.56 0.00 -0.04 0.00 0.00 33.50 32.65 1i1m n PRO 155 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1i1m n THR 156 N 5.78 0.20 0.55 0.52 -2.24 -1.26 -3.15 114.28 114.68 1i1m n THR 156 Ca 0.42 0.03 0.13 0.00 -2.27 0.00 0.00 64.05 62.36 1i1m n THR 156 Cb 0.04 -0.59 0.36 0.00 -2.10 0.00 0.00 70.33 68.04 1i1m n THR 156 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1i1m h ALA 157 N 2.89 1.00 -2.89 6.98 0.00 -1.89 -3.37 119.26 121.98 1i1m h ALA 157 Ca 0.00 0.00 -0.61 0.00 0.00 0.00 0.00 54.91 54.30 1i1m h ALA 157 Cb 0.47 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.18 1i1m h ALA 157 CO 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 179.25 178.94 1i1m s ALA 158 N -3.12 3.67 -1.19 0.00 0.00 -1.19 -4.75 121.76 115.19 1i1m s ALA 158 Ca 0.10 -0.41 -0.11 0.00 0.00 0.00 0.00 51.96 51.53 1i1m s ALA 158 Cb 0.11 -2.32 0.21 0.00 0.00 0.00 0.00 23.12 21.12 1i1m s ALA 158 CO 0.61 0.30 1.41 1.17 0.00 0.00 0.00 175.76 179.24 1i1m n LYS 159 N 2.78 3.51 -4.09 0.00 4.81 -1.26 -4.99 118.16 118.91 1i1m n LYS 159 Ca -0.14 -4.02 -0.28 0.00 -0.87 0.00 0.00 58.31 53.01 1i1m n LYS 159 Cb 0.53 -2.87 -0.06 0.00 0.02 0.00 0.00 35.03 32.65 1i1m n LYS 159 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1i1m s ALA 160 N 0.43 3.52 0.13 3.14 0.00 -1.26 -1.88 121.76 125.83 1i1m s ALA 160 Ca 0.39 -1.16 -0.24 0.00 0.00 0.00 0.00 51.96 50.94 1i1m s ALA 160 Cb -0.03 -1.34 -0.04 0.00 0.00 0.00 0.00 23.12 21.71 1i1m s ALA 160 CO -0.01 0.59 1.65 0.78 0.00 0.00 0.00 175.76 178.76 1i1m h GLY 161 N 2.77 -0.27 0.89 0.00 0.00 -1.04 -2.57 103.07 102.85 1i1m h GLY 161 Ca -0.47 0.26 0.12 0.00 0.00 0.00 0.00 47.33 47.23 1i1m h GLY 161 CO 0.63 -0.19 0.44 -1.33 0.00 0.00 0.00 176.54 176.10 1i1m h GLY 162 N -0.31 0.00 0.92 4.60 0.00 -1.73 -1.90 103.07 104.64 1i1m h GLY 162 Ca 0.07 0.00 0.07 0.00 0.00 0.00 0.00 47.33 47.47 1i1m h GLY 162 CO -0.23 0.00 0.54 3.43 0.00 0.00 0.00 176.54 180.28 1i1m h ASN 163 N 0.00 0.79 0.05 0.19 2.35 -1.79 -3.14 115.58 114.02 1i1m h ASN 163 Ca 0.20 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.95 1i1m h ASN 163 Cb 1.08 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 39.28 1i1m h ASN 163 CO -0.00 0.50 0.00 -1.22 -1.65 0.00 0.00 177.43 175.06 1i1m n TYR 164 N -4.49 0.00 0.05 1.19 4.02 -0.72 -2.08 117.16 115.13 1i1m n TYR 164 Ca 0.13 0.00 -0.03 0.00 -0.01 0.00 0.00 57.90 57.98 1i1m n TYR 164 Cb 0.23 -0.12 0.20 0.00 -0.02 0.00 0.00 39.34 39.63 1i1m n TYR 164 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 1i1m h LEU 165 N 0.00 0.40 -0.10 7.72 3.38 -1.77 -1.42 115.31 123.52 1i1m h LEU 165 Ca 0.00 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.79 1i1m h LEU 165 Cb 0.02 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 1i1m h LEU 165 CO 0.00 0.72 -0.04 -1.28 0.09 0.00 0.00 178.44 177.93 1i1m h SER 166 N 0.34 0.21 -0.21 -0.43 0.87 -1.68 -2.26 113.55 110.37 1i1m h SER 166 Ca 0.04 -0.40 -0.03 0.00 -1.23 0.00 0.00 61.79 60.18 1i1m h SER 166 Cb 0.76 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 62.65 1i1m h SER 166 CO 0.06 0.56 0.06 0.28 -0.53 0.00 0.00 176.83 177.26 1i1m h SER 167 N -0.15 0.37 -0.06 6.23 0.02 -1.66 -1.04 113.55 117.26 1i1m h SER 167 Ca 0.02 -0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 60.92 1i1m h SER 167 Cb 0.47 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 62.92 1i1m h SER 167 CO 0.01 0.39 0.02 0.25 -1.14 0.00 0.00 176.83 176.36 1i1m h LEU 168 N 0.41 0.10 -0.29 5.07 7.12 -1.15 -0.10 115.31 126.46 1i1m h LEU 168 Ca 0.10 -0.22 -0.01 0.00 0.13 0.00 0.00 57.88 57.88 1i1m h LEU 168 Cb 0.17 -0.03 -0.01 0.00 -0.53 0.00 0.00 40.66 40.26 1i1m h LEU 168 CO -0.00 0.30 0.16 -0.07 -0.13 0.00 0.00 178.44 178.69 1i1m h LEU 169 N -0.10 0.37 -0.02 2.25 3.38 -0.93 -0.63 115.31 119.63 1i1m h LEU 169 Ca 0.02 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 1i1m h LEU 169 Cb 0.24 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 1i1m h LEU 169 CO 0.00 0.35 0.00 0.58 0.09 0.00 0.00 178.44 179.47 1i1m h VAL 170 N 0.35 1.17 -0.31 1.22 2.07 -1.17 -2.94 116.25 116.64 1i1m h VAL 170 Ca 0.10 -0.50 -0.07 0.00 0.82 0.00 0.00 66.70 67.05 1i1m h VAL 170 Cb 0.07 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 1i1m h VAL 170 CO -0.02 0.13 -0.09 1.23 0.02 0.00 0.00 177.57 178.85 1i1m h GLY 171 N -0.18 0.66 1.64 2.17 0.00 -0.97 -3.11 103.07 103.28 1i1m h GLY 171 Ca 0.01 -0.56 -0.05 0.00 0.00 0.00 0.00 47.33 46.73 1i1m h GLY 171 CO -0.00 0.51 -0.02 1.48 0.00 0.00 0.00 176.54 178.51 1i1m h SER 172 N 0.38 0.42 -0.68 0.19 4.64 -1.20 -2.04 113.55 115.26 1i1m h SER 172 Ca 0.08 -0.08 -0.07 0.00 -0.47 0.00 0.00 61.79 61.25 1i1m h SER 172 Cb 0.59 -0.11 -0.03 0.00 -0.31 0.00 0.00 62.40 62.54 1i1m h SER 172 CO 0.03 0.51 0.15 -0.08 -0.87 0.00 0.00 176.83 176.57 1i1m h GLU 173 N 0.43 1.10 -0.21 4.77 4.81 -1.50 -0.40 114.58 123.59 1i1m h GLU 173 Ca 0.09 -0.28 -0.04 0.00 -0.13 0.00 0.00 59.36 59.01 1i1m h GLU 173 Cb 0.33 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 1i1m h GLU 173 CO 0.01 0.99 -0.01 0.00 -0.73 0.00 0.00 179.01 179.27 1i1m h ALA 174 N 1.07 0.28 0.00 2.92 0.00 -1.40 -2.98 119.26 119.15 1i1m h ALA 174 Ca 0.21 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 1i1m h ALA 174 Cb 0.40 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1i1m h ALA 174 CO 0.01 0.01 -0.31 0.00 0.00 0.00 0.00 179.25 178.96 1i1m h ARG 175 N 0.13 0.00 0.00 0.00 3.08 -1.26 -0.51 114.38 115.81 1i1m h ARG 175 Ca 0.06 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.07 1i1m h ARG 175 Cb 0.42 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.46 1i1m h ARG 175 CO 0.01 0.31 -0.16 -0.09 -1.07 0.00 0.00 179.97 178.98 1i1m h ARG 176 N 0.00 0.00 -0.53 0.04 2.43 -0.92 -2.76 114.38 112.64 1i1m h ARG 176 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1i1m h ARG 176 Cb 0.59 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.14 1i1m h ARG 176 CO 0.04 0.16 0.00 0.72 -1.51 0.00 0.00 179.97 179.38 1i1m n HIS 177 N -3.35 1.24 -0.44 2.20 8.25 -0.89 -4.95 115.22 117.27 1i1m n HIS 177 Ca -0.00 -0.64 0.00 0.00 -0.26 0.00 0.00 57.72 56.81 1i1m n HIS 177 Cb 0.37 -0.23 0.00 0.00 1.12 0.00 0.00 29.99 31.25 1i1m n HIS 177 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1i1m n GLY 178 N 0.72 0.74 3.95 -1.41 0.00 -1.04 -5.07 105.19 103.07 1i1m n GLY 178 Ca 0.23 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.01 1i1m n GLY 178 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1i1m s TYR 179 N -2.60 3.47 -0.03 1.61 1.51 -0.25 -4.99 117.35 116.07 1i1m s TYR 179 Ca 0.00 0.29 0.12 0.00 -1.01 0.00 0.00 57.07 56.47 1i1m s TYR 179 Cb 0.00 -1.89 -0.14 0.00 -0.11 0.00 0.00 41.96 39.82 1i1m s TYR 179 CO 0.00 0.12 1.08 1.96 -1.11 0.00 0.00 175.55 177.59 1i1m h GLN 180 N 0.77 0.00 -2.67 -0.62 7.50 -1.42 -3.22 115.11 115.45 1i1m h GLN 180 Ca -0.50 0.00 -0.05 0.00 0.50 0.00 0.00 58.65 58.61 1i1m h GLN 180 Cb 1.22 0.00 -0.15 0.00 0.05 0.00 0.00 27.48 28.60 1i1m h GLN 180 CO 0.61 0.62 0.12 -2.00 -1.50 0.00 0.00 178.83 176.68 1i1m s GLU 181 N -2.79 1.12 -0.01 1.46 2.56 -1.24 -4.84 118.70 114.96 1i1m s GLU 181 Ca -0.00 -0.20 0.03 0.00 0.00 0.00 0.00 54.97 54.80 1i1m s GLU 181 Cb 0.09 0.52 -0.03 0.00 2.00 0.00 0.00 34.13 36.70 1i1m s GLU 181 CO 0.80 -0.42 -0.07 0.20 -0.56 0.00 0.00 175.26 175.21 1i1m s GLY 182 N -2.04 1.73 -0.20 -1.50 0.00 -1.26 -2.00 107.32 102.04 1i1m s GLY 182 Ca -0.04 -1.01 -0.06 0.00 0.00 0.00 0.00 44.72 43.61 1i1m s GLY 182 CO -0.03 -0.86 0.02 -0.42 0.00 0.00 0.00 173.10 171.81 1i1m s ILE 183 N -0.96 4.16 -0.01 0.90 1.01 0.47 -1.52 121.20 125.25 1i1m s ILE 183 Ca 0.16 -0.24 -0.04 0.00 0.00 0.00 0.00 60.65 60.53 1i1m s ILE 183 Cb -0.11 -2.88 -0.04 0.00 0.01 0.00 0.00 42.46 39.43 1i1m s ILE 183 CO 0.06 0.43 0.21 0.00 0.00 0.00 0.00 174.94 175.64 1i1m s ALA 184 N 0.89 3.92 0.19 9.38 0.00 0.12 -0.95 121.76 135.30 1i1m s ALA 184 Ca 0.02 -0.69 0.04 0.00 0.00 0.00 0.00 51.96 51.33 1i1m s ALA 184 Cb -0.14 -1.95 -0.03 0.00 0.00 0.00 0.00 23.12 20.99 1i1m s ALA 184 CO 0.02 0.71 0.25 -0.51 0.00 0.00 0.00 175.76 176.23 1i1m s LEU 185 N -1.83 4.11 0.00 0.00 1.43 -1.26 -1.24 118.68 119.89 1i1m s LEU 185 Ca 0.27 0.01 -0.09 0.00 -1.03 0.00 0.00 54.13 53.28 1i1m s LEU 185 Cb -0.13 -2.68 0.15 0.00 0.03 0.00 0.00 46.19 43.56 1i1m s LEU 185 CO 0.17 0.02 0.92 -0.90 0.23 0.00 0.00 176.35 176.79 1i1m n ASP 186 N -0.76 0.29 0.23 2.29 5.75 0.53 -1.75 116.55 123.15 1i1m n ASP 186 Ca -0.08 -1.47 0.16 0.00 -0.01 0.00 0.00 54.79 53.39 1i1m n ASP 186 Cb 0.55 -0.68 0.78 0.00 -1.03 0.00 0.00 41.12 40.74 1i1m n ASP 186 CO 0.00 0.00 0.00 -0.37 -0.11 0.00 0.00 177.20 176.72 1i1m h VAL 187 N -1.32 0.00 0.00 2.12 -1.51 -1.88 -2.11 116.25 111.54 1i1m h VAL 187 Ca -0.30 -0.16 0.00 0.00 -1.23 0.00 0.00 66.70 65.01 1i1m h VAL 187 Cb 0.88 0.96 0.00 0.00 -2.13 0.00 0.00 31.29 30.99 1i1m h VAL 187 CO 0.23 0.00 -0.55 0.59 -1.23 0.00 0.00 177.57 176.61 1i1m n ASN 188 N -2.68 0.71 0.00 4.19 3.02 -1.26 -4.95 115.26 114.30 1i1m n ASN 188 Ca -0.01 0.17 0.00 0.00 -0.03 0.00 0.00 54.58 54.71 1i1m n ASN 188 Cb 0.14 0.05 0.00 0.00 -0.61 0.00 0.00 39.78 39.36 1i1m n ASN 188 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1i1m n GLY 189 N 1.34 0.92 3.89 7.41 0.00 -0.79 -5.09 105.19 112.87 1i1m n GLY 189 Ca 0.04 -0.08 -0.21 0.00 0.00 0.00 0.00 46.02 45.77 1i1m n GLY 189 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1i1m s TYR 190 N -2.00 3.16 0.14 1.61 4.12 -1.26 -4.29 117.35 118.84 1i1m s TYR 190 Ca 0.00 -0.14 -0.31 0.00 0.02 0.00 0.00 57.07 56.64 1i1m s TYR 190 Cb 0.00 -1.61 -0.09 0.00 -1.52 0.00 0.00 41.96 38.74 1i1m s TYR 190 CO 0.00 0.36 1.45 0.42 0.02 0.00 0.00 175.55 177.80 1i1m s ILE 191 N -2.13 3.03 0.00 2.71 1.01 -0.21 -0.34 121.20 125.27 1i1m s ILE 191 Ca 0.36 0.75 0.00 0.00 0.00 0.00 0.00 60.65 61.77 1i1m s ILE 191 Cb -0.08 -3.48 0.00 0.00 0.01 0.00 0.00 42.46 38.91 1i1m s ILE 191 CO 0.27 0.06 0.00 -0.24 0.00 0.00 0.00 174.94 175.04 1i1m n SER 192 N 3.84 0.00 0.00 3.58 2.88 -0.37 -4.68 113.62 118.87 1i1m n SER 192 Ca 0.12 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.66 1i1m n SER 192 Cb 0.41 -0.43 0.00 0.00 -0.75 0.00 0.00 64.21 63.44 1i1m n SER 192 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 1i1m n GLU 193 N -2.42 -2.28 -1.31 -1.46 0.28 -1.13 -4.65 120.64 107.67 1i1m n GLU 193 Ca 0.00 0.00 -0.30 0.00 -0.16 0.00 0.00 57.16 56.70 1i1m n GLU 193 Cb 0.00 0.00 0.20 0.00 1.43 0.00 0.00 31.44 33.07 1i1m n GLU 193 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 1i1m s GLY 194 N 0.00 1.61 0.44 -1.84 0.00 0.39 -0.70 107.32 107.22 1i1m s GLY 194 Ca 0.00 -0.82 0.15 0.00 0.00 0.00 0.00 44.72 44.06 1i1m s GLY 194 CO 0.00 -0.05 1.96 0.00 0.00 0.00 0.00 173.10 175.01 1i1m h ALA 195 N -2.13 2.09 0.00 3.20 0.00 -1.61 -3.28 119.26 117.52 1i1m h ALA 195 Ca -0.48 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.28 1i1m h ALA 195 Cb 1.30 -0.07 -0.24 0.00 0.00 0.00 0.00 17.79 18.78 1i1m h ALA 195 CO 0.44 -0.24 -0.64 0.41 0.00 0.00 0.00 179.25 179.21 1i1m n GLY 196 N -1.53 0.75 3.45 0.00 0.00 -1.26 -4.55 105.19 102.06 1i1m n GLY 196 Ca 0.11 -0.40 -0.14 0.00 0.00 0.00 0.00 46.02 45.59 1i1m n GLY 196 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1i1m s GLU 197 N 0.00 0.72 0.79 1.61 1.03 -1.24 -4.86 118.70 116.75 1i1m s GLU 197 Ca 0.16 0.61 -0.11 0.00 0.03 0.00 0.00 54.97 55.66 1i1m s GLU 197 Cb 0.18 0.35 0.07 0.00 -0.80 0.00 0.00 34.13 33.93 1i1m s GLU 197 CO -0.08 -0.13 1.11 -0.80 -1.33 0.00 0.00 175.26 174.03 1i1m s ASN 198 N -0.08 4.24 -0.08 0.83 0.01 0.36 -0.46 114.94 119.76 1i1m s ASN 198 Ca -0.03 1.94 0.05 0.00 -0.71 0.00 0.00 52.86 54.11 1i1m s ASN 198 Cb -0.03 -2.54 -0.01 0.00 0.41 0.00 0.00 41.25 39.08 1i1m s ASN 198 CO 0.02 -2.22 -0.24 -0.22 -1.51 0.00 0.00 177.10 172.93 1i1m s LEU 199 N -5.90 2.07 0.09 0.60 1.98 -1.26 -1.24 118.68 115.01 1i1m s LEU 199 Ca 0.64 -0.53 0.08 0.00 -2.89 0.00 0.00 54.13 51.42 1i1m s LEU 199 Cb -0.19 -1.38 -0.03 0.00 0.66 0.00 0.00 46.19 45.25 1i1m s LEU 199 CO 0.54 0.21 -0.20 -0.36 -1.89 0.00 0.00 176.35 174.65 1i1m s PHE 200 N 0.06 1.74 0.05 5.38 0.40 -0.14 -4.31 117.98 121.16 1i1m s PHE 200 Ca -0.10 -0.41 0.05 0.00 -0.60 0.00 0.00 56.93 55.86 1i1m s PHE 200 Cb -0.16 -0.97 -0.02 0.00 0.51 0.00 0.00 43.02 42.38 1i1m s PHE 200 CO 0.06 0.17 -0.13 -1.21 0.70 0.00 0.00 175.22 174.80 1i1m s GLU 201 N -1.72 0.83 -0.11 0.44 2.02 -0.35 -1.46 118.70 118.36 1i1m s GLU 201 Ca 0.06 -0.80 0.03 0.00 0.02 0.00 0.00 54.97 54.28 1i1m s GLU 201 Cb -0.10 -0.82 0.01 0.00 0.10 0.00 0.00 34.13 33.32 1i1m s GLU 201 CO 0.03 0.19 -0.21 0.08 0.02 0.00 0.00 175.26 175.38 1i1m s VAL 202 N -1.02 1.88 -0.12 2.63 1.01 0.59 -0.42 120.40 124.94 1i1m s VAL 202 Ca -0.01 -0.89 -0.04 0.00 0.00 0.00 0.00 61.98 61.04 1i1m s VAL 202 Cb -0.09 -1.65 0.06 0.00 0.00 0.00 0.00 36.38 34.71 1i1m s VAL 202 CO 0.01 0.52 0.18 -0.75 0.00 0.00 0.00 175.10 175.07 1i1m s LYS 203 N 0.61 0.09 -1.38 2.72 2.47 -0.57 -0.39 119.74 123.29 1i1m s LYS 203 Ca -0.13 0.46 -0.08 0.00 -1.56 0.00 0.00 55.97 54.66 1i1m s LYS 203 Cb -0.17 -0.56 0.03 0.00 -1.46 0.00 0.00 37.83 35.67 1i1m s LYS 203 CO 0.04 -0.41 1.07 -0.25 0.16 0.00 0.00 175.35 175.96 1i1m n ASP 204 N 5.32 -4.93 0.00 1.43 8.00 -1.26 -1.88 116.55 123.23 1i1m n ASP 204 Ca -0.05 -0.63 0.00 0.00 0.71 0.00 0.00 54.79 54.81 1i1m n ASP 204 Cb 0.50 -4.69 0.00 0.00 -0.02 0.00 0.00 41.12 36.91 1i1m n ASP 204 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1i1m n GLY 205 N -1.77 0.64 3.63 0.44 0.00 -1.26 -5.02 105.19 101.85 1i1m n GLY 205 Ca -0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.62 1i1m n GLY 205 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1i1m s VAL 206 N -2.75 4.17 -0.05 1.61 1.01 -0.79 -4.43 120.40 119.18 1i1m s VAL 206 Ca 0.00 -0.29 -0.19 0.00 0.00 0.00 0.00 61.98 61.50 1i1m s VAL 206 Cb 0.00 -2.77 -0.05 0.00 0.00 0.00 0.00 36.38 33.56 1i1m s VAL 206 CO 0.00 0.57 0.54 -0.76 0.00 0.00 0.00 175.10 175.46 1i1m s LEU 207 N -0.54 4.37 -0.00 3.92 1.43 -0.10 -1.51 118.68 126.25 1i1m s LEU 207 Ca 0.09 1.03 0.06 0.00 -1.03 0.00 0.00 54.13 54.27 1i1m s LEU 207 Cb -0.12 -2.82 -0.02 0.00 0.03 0.00 0.00 46.19 43.26 1i1m s LEU 207 CO 0.02 0.07 -0.18 -0.36 0.23 0.00 0.00 176.35 176.13 1i1m s PHE 208 N 0.07 1.61 -0.09 0.29 0.40 0.44 0.09 117.98 120.79 1i1m s PHE 208 Ca 0.29 -0.32 -0.14 0.00 -0.60 0.00 0.00 56.93 56.16 1i1m s PHE 208 Cb -0.17 -1.02 0.03 0.00 0.51 0.00 0.00 43.02 42.37 1i1m s PHE 208 CO 0.15 -0.00 0.35 0.99 0.70 0.00 0.00 175.22 177.41 1i1m s THR 209 N -0.52 0.02 0.49 0.64 2.01 -0.79 -1.21 115.64 116.29 1i1m s THR 209 Ca 0.07 -0.17 -0.21 0.00 0.31 0.00 0.00 61.69 61.68 1i1m s THR 209 Cb -0.07 -0.56 -0.07 0.00 0.01 0.00 0.00 72.50 71.80 1i1m s THR 209 CO -0.00 -0.09 1.12 -2.84 -0.69 0.00 0.00 174.62 172.11 1i1m s PRO 210 N -0.39 3.64 0.88 4.92 0.02 -1.24 -1.25 135.00 141.57 1i1m s PRO 210 Ca -0.05 1.60 -0.13 0.00 0.02 0.00 0.00 61.00 62.44 1i1m s PRO 210 Cb -0.03 -2.19 0.13 0.00 0.02 0.00 0.00 34.50 32.42 1i1m s PRO 210 CO 0.02 -0.61 1.19 -1.25 -0.33 0.00 0.00 177.00 176.02 1i1m s PRO 211 N -3.02 1.38 0.54 5.54 0.04 -1.26 -4.80 135.00 133.42 1i1m s PRO 211 Ca 0.68 0.06 0.25 0.00 0.04 0.00 0.00 61.00 62.02 1i1m s PRO 211 Cb -0.24 -1.89 1.54 0.00 0.04 0.00 0.00 34.50 33.96 1i1m s PRO 211 CO 0.28 -1.99 2.16 0.74 0.04 0.00 0.00 177.00 178.23 1i1m h PHE 212 N -1.34 0.00 0.00 0.56 0.04 -1.95 -1.75 116.94 112.49 1i1m h PHE 212 Ca -0.47 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.30 1i1m h PHE 212 Cb 1.31 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.46 1i1m h PHE 212 CO -0.05 0.05 0.00 0.25 -0.60 0.00 0.00 178.31 177.96 1i1m n THR 213 N -3.97 0.39 -0.79 -1.55 -2.24 -1.26 -2.07 114.28 102.79 1i1m n THR 213 Ca -0.03 0.10 -0.13 0.00 -2.27 0.00 0.00 64.05 61.73 1i1m n THR 213 Cb 0.14 -0.85 0.21 0.00 -2.10 0.00 0.00 70.33 67.73 1i1m n THR 213 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1i1m n SER 214 N -1.20 4.02 -2.23 3.42 7.64 -0.66 -4.86 113.62 119.76 1i1m n SER 214 Ca 0.09 -3.18 -0.19 0.00 1.01 0.00 0.00 58.87 56.59 1i1m n SER 214 Cb 0.10 -0.75 -0.00 0.00 -1.01 0.00 0.00 64.21 62.55 1i1m n SER 214 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1i1m n SER 215 N -0.48 -5.45 -4.65 6.43 7.64 -0.88 -4.34 113.62 111.90 1i1m n SER 215 Ca 0.42 -0.06 -0.35 0.00 1.01 0.00 0.00 58.87 59.90 1i1m n SER 215 Cb 1.36 -4.47 -0.10 0.00 -1.01 0.00 0.00 64.21 60.00 1i1m n SER 215 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1i1m s ALA 216 N -2.96 3.44 0.30 -0.43 0.00 -1.11 -4.87 121.76 116.13 1i1m s ALA 216 Ca 0.04 -0.74 -0.29 0.00 0.00 0.00 0.00 51.96 50.98 1i1m s ALA 216 Cb -0.02 -1.94 -0.10 0.00 0.00 0.00 0.00 23.12 21.06 1i1m s ALA 216 CO 0.05 0.18 1.26 -1.17 0.00 0.00 0.00 175.76 176.09 1i1m s LEU 217 N 0.36 4.45 -1.12 0.00 0.20 -1.26 -4.45 118.68 116.86 1i1m s LEU 217 Ca 0.04 2.57 -0.23 0.00 0.69 0.00 0.00 54.13 57.19 1i1m s LEU 217 Cb -0.12 -3.64 -0.12 0.00 -0.43 0.00 0.00 46.19 41.87 1i1m s LEU 217 CO -0.00 -0.45 1.96 -2.65 -0.29 0.00 0.00 176.35 174.92 1i1m n PRO 218 N 1.11 1.31 -1.82 0.98 -0.02 -1.26 -4.94 135.00 130.36 1i1m n PRO 218 Ca 0.01 -2.27 -0.41 0.00 -2.02 0.00 0.00 63.50 58.80 1i1m n PRO 218 Cb 0.42 -3.69 -0.01 0.00 -0.02 0.00 0.00 33.50 30.21 1i1m n PRO 218 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1i1m s GLY 219 N 6.73 2.80 0.17 -1.23 0.00 -1.26 -4.92 107.32 109.61 1i1m s GLY 219 Ca 0.70 1.55 0.09 0.00 0.00 0.00 0.00 44.72 47.06 1i1m s GLY 219 CO 0.15 2.29 1.37 -2.22 0.00 0.00 0.00 173.10 174.69 1i1m h ILE 220 N 3.05 1.55 -0.02 0.90 2.04 -1.99 -1.46 117.51 121.58 1i1m h ILE 220 Ca -0.50 -3.01 -0.24 0.00 1.00 0.00 0.00 64.86 62.12 1i1m h ILE 220 Cb 1.23 2.65 0.01 0.00 -0.74 0.00 0.00 36.82 39.98 1i1m h ILE 220 CO 0.67 0.84 -0.94 0.74 0.00 0.00 0.00 178.15 179.46 1i1m h THR 221 N 0.00 1.35 -0.44 -0.27 2.02 -1.91 -1.90 112.91 111.76 1i1m h THR 221 Ca -0.01 -2.31 0.02 0.00 0.77 0.00 0.00 66.41 64.87 1i1m h THR 221 Cb 1.58 2.34 -0.03 0.00 -1.74 0.00 0.00 68.15 70.30 1i1m h THR 221 CO 0.11 0.70 0.27 -0.09 0.37 0.00 0.00 175.52 176.88 1i1m h ARG 222 N 0.32 0.52 -0.35 6.66 2.43 -1.88 -0.40 114.38 121.68 1i1m h ARG 222 Ca -0.09 -0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 58.97 1i1m h ARG 222 Cb 1.58 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.99 1i1m h ARG 222 CO 0.17 0.35 -0.12 0.22 -1.51 0.00 0.00 179.97 179.08 1i1m h ASP 223 N 0.54 0.60 -0.40 -3.80 3.58 -1.18 -2.19 116.42 113.56 1i1m h ASP 223 Ca 0.17 -0.17 -0.10 0.00 0.42 0.00 0.00 57.03 57.35 1i1m h ASP 223 Cb -0.01 -0.16 -0.01 0.00 1.72 0.00 0.00 39.33 40.87 1i1m h ASP 223 CO -0.07 0.75 -0.15 0.00 -2.88 0.00 0.00 179.24 176.89 1i1m h ALA 224 N 1.31 0.56 -0.72 -0.78 0.00 -0.81 -2.47 119.26 116.35 1i1m h ALA 224 Ca 0.10 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.62 1i1m h ALA 224 Cb 0.54 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 1i1m h ALA 224 CO 0.03 0.48 0.26 0.82 0.00 0.00 0.00 179.25 180.84 1i1m h ILE 225 N 0.62 1.25 -0.74 0.00 2.04 -0.87 0.66 117.51 120.47 1i1m h ILE 225 Ca 0.09 -0.83 -0.06 0.00 1.00 0.00 0.00 64.86 65.07 1i1m h ILE 225 Cb 0.70 0.44 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 1i1m h ILE 225 CO 0.05 0.33 0.23 0.40 0.00 0.00 0.00 178.15 179.16 1i1m h ILE 226 N 1.04 1.26 -0.28 -0.67 2.04 -1.34 0.79 117.51 120.35 1i1m h ILE 226 Ca 0.24 -0.91 -0.17 0.00 1.00 0.00 0.00 64.86 65.01 1i1m h ILE 226 Cb 0.25 0.46 -0.00 0.00 -0.74 0.00 0.00 36.82 36.78 1i1m h ILE 226 CO -0.01 0.36 -0.52 0.11 0.00 0.00 0.00 178.15 178.09 1i1m h LYS 227 N 1.09 0.81 -0.47 2.37 1.57 -1.05 -2.35 116.57 118.55 1i1m h LYS 227 Ca 0.24 -0.50 -0.13 0.00 -1.87 0.00 0.00 60.65 58.39 1i1m h LYS 227 Cb 0.31 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 1i1m h LYS 227 CO -0.01 1.13 -0.22 -0.07 -0.57 0.00 0.00 179.45 179.71 1i1m h LEU 228 N 0.63 0.99 -0.88 2.94 3.38 -0.68 -2.70 115.31 118.99 1i1m h LEU 228 Ca 0.02 -0.38 0.01 0.00 0.09 0.00 0.00 57.88 57.62 1i1m h LEU 228 Cb 1.11 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 41.54 1i1m h LEU 228 CO 0.11 1.17 0.58 0.00 0.09 0.00 0.00 178.44 180.39 1i1m h ALA 229 N 0.90 1.11 0.00 1.53 0.00 -0.76 -1.37 119.26 120.68 1i1m h ALA 229 Ca 0.11 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1i1m h ALA 229 Cb 0.80 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1i1m h ALA 229 CO 0.07 0.52 -0.33 0.87 0.00 0.00 0.00 179.25 180.38 1i1m h LYS 230 N 1.19 0.00 -0.16 0.00 1.57 -1.26 -0.62 116.57 117.30 1i1m h LYS 230 Ca 0.32 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.98 1i1m h LYS 230 Cb -0.14 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.16 1i1m h LYS 230 CO -0.07 0.33 -0.44 0.93 -0.57 0.00 0.00 179.45 179.62 1i1m h GLU 231 N 0.00 0.38 -0.00 3.15 4.39 -0.95 -2.75 114.58 118.79 1i1m h GLU 231 Ca -0.00 -0.20 0.00 0.00 0.34 0.00 0.00 59.36 59.50 1i1m h GLU 231 Cb 0.58 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.23 1i1m h GLU 231 CO 0.04 0.75 -0.04 1.28 -1.16 0.00 0.00 179.01 179.89 1i1m n LEU 232 N -4.00 0.22 -0.30 1.33 4.77 -0.75 -4.91 117.00 113.35 1i1m n LEU 232 Ca -0.02 0.10 -0.02 0.00 -0.03 0.00 0.00 56.01 56.04 1i1m n LEU 232 Cb 0.52 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 1i1m n LEU 232 CO 0.44 0.04 -0.02 0.61 -1.33 0.00 0.00 177.39 177.13 1i1m n GLY 233 N 1.22 0.36 3.60 -0.72 0.00 -0.94 -5.04 105.19 103.66 1i1m n GLY 233 Ca 0.17 -0.78 -0.35 0.00 0.00 0.00 0.00 46.02 45.06 1i1m n GLY 233 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1i1m s ILE 234 N -2.22 4.63 0.16 -0.61 1.01 -0.29 -5.03 121.20 118.84 1i1m s ILE 234 Ca 0.01 -0.09 -0.30 0.00 0.00 0.00 0.00 60.65 60.26 1i1m s ILE 234 Cb -0.00 -3.09 -0.08 0.00 0.01 0.00 0.00 42.46 39.30 1i1m s ILE 234 CO 0.01 0.45 1.28 -0.70 0.00 0.00 0.00 174.94 175.98 1i1m s GLU 235 N 0.52 4.41 -0.09 2.79 2.12 -1.26 -4.14 118.70 123.05 1i1m s GLU 235 Ca 0.02 1.97 0.03 0.00 0.36 0.00 0.00 54.97 57.35 1i1m s GLU 235 Cb -0.13 -3.24 -0.02 0.00 0.26 0.00 0.00 34.13 31.00 1i1m s GLU 235 CO 0.01 -0.25 -0.17 0.08 -0.54 0.00 0.00 175.26 174.39 1i1m s VAL 236 N 0.43 2.77 -0.15 3.70 1.01 -1.26 -0.93 120.40 125.97 1i1m s VAL 236 Ca 0.58 -0.80 0.00 0.00 0.00 0.00 0.00 61.98 61.76 1i1m s VAL 236 Cb -0.34 -2.10 0.03 0.00 0.00 0.00 0.00 36.38 33.97 1i1m s VAL 236 CO 0.35 0.56 -0.10 -0.13 0.00 0.00 0.00 175.10 175.78 1i1m s ARG 237 N -0.11 1.87 -0.52 2.72 0.52 0.11 -4.96 118.95 118.58 1i1m s ARG 237 Ca -0.03 -0.51 -0.17 0.00 -0.52 0.00 0.00 55.73 54.50 1i1m s ARG 237 Cb -0.14 -2.00 0.10 0.00 0.52 0.00 0.00 34.95 33.44 1i1m s ARG 237 CO 0.04 -0.31 0.51 -2.00 0.02 0.00 0.00 175.30 173.55 1i1m s GLU 238 N 1.56 3.01 0.18 3.54 2.12 -1.26 -1.89 118.70 125.96 1i1m s GLU 238 Ca 0.03 -1.47 -0.13 0.00 0.36 0.00 0.00 54.97 53.76 1i1m s GLU 238 Cb -0.14 -4.23 0.01 0.00 0.26 0.00 0.00 34.13 30.03 1i1m s GLU 238 CO -0.09 -1.26 0.40 1.14 -0.54 0.00 0.00 175.26 174.91 1i1m s GLN 239 N 1.86 1.28 0.31 4.30 -2.07 -0.38 -4.80 119.66 120.17 1i1m s GLN 239 Ca 0.06 -1.05 -0.29 0.00 -1.82 0.00 0.00 55.36 52.26 1i1m s GLN 239 Cb -0.26 0.45 -0.10 0.00 -1.09 0.00 0.00 33.01 32.00 1i1m s GLN 239 CO 0.05 -0.51 1.33 0.08 -1.32 0.00 0.00 175.29 174.93 1i1m s VAL 240 N -3.93 2.73 -0.04 3.63 1.01 -1.26 -3.71 120.40 118.83 1i1m s VAL 240 Ca 0.14 0.70 0.06 0.00 0.00 0.00 0.00 61.98 62.88 1i1m s VAL 240 Cb 0.01 -3.45 -0.01 0.00 0.00 0.00 0.00 36.38 32.94 1i1m s VAL 240 CO -0.00 0.15 -0.21 -0.76 0.00 0.00 0.00 175.10 174.28 1i1m s LEU 241 N -1.44 2.01 0.67 3.92 1.43 -1.26 -5.03 118.68 118.98 1i1m s LEU 241 Ca 0.51 -0.42 -0.11 0.00 -1.03 0.00 0.00 54.13 53.08 1i1m s LEU 241 Cb -0.40 -1.15 -0.01 0.00 0.03 0.00 0.00 46.19 44.66 1i1m s LEU 241 CO 0.50 0.22 1.06 -0.94 0.23 0.00 0.00 176.35 177.43 1i1m s SER 242 N -0.22 5.75 0.20 2.29 1.04 -1.26 -1.04 113.70 120.46 1i1m s SER 242 Ca 0.00 1.31 -0.09 0.00 0.48 0.00 0.00 55.95 57.66 1i1m s SER 242 Cb -0.11 -2.23 0.13 0.00 0.10 0.00 0.00 66.02 63.91 1i1m s SER 242 CO 0.02 -1.16 1.77 -0.09 0.98 0.00 0.00 173.24 174.75 1i1m h ARG 243 N -0.53 1.09 0.00 4.02 2.43 -1.93 -2.79 114.38 116.67 1i1m h ARG 243 Ca -0.45 -0.19 -0.00 0.00 -0.81 0.00 0.00 59.98 58.53 1i1m h ARG 243 Cb 1.22 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 30.59 1i1m h ARG 243 CO 0.62 0.88 -0.02 0.93 -1.51 0.00 0.00 179.97 180.87 1i1m h GLU 244 N 1.05 0.00 -0.15 0.20 3.07 -1.95 -2.43 114.58 114.37 1i1m h GLU 244 Ca 0.25 0.00 0.04 0.00 -0.50 0.00 0.00 59.36 59.15 1i1m h GLU 244 Cb 0.18 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.09 1i1m h GLU 244 CO -0.02 0.02 0.15 0.66 -1.40 0.00 0.00 179.01 178.42 1i1m h SER 245 N 0.00 0.00 0.40 1.42 4.64 -1.88 -0.62 113.55 117.51 1i1m h SER 245 Ca -0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 1i1m h SER 245 Cb 0.06 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.14 1i1m h SER 245 CO 0.00 0.00 -0.24 -0.07 -0.87 0.00 0.00 176.83 175.65 1i1m h LEU 246 N 0.00 0.00 0.00 5.97 3.38 -1.62 -1.36 115.31 121.69 1i1m h LEU 246 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1i1m h LEU 246 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1i1m h LEU 246 CO -0.00 0.24 -0.97 1.88 0.09 0.00 0.00 178.44 179.68 1i1m h TYR 247 N 0.00 0.00 -0.00 1.13 0.99 -1.31 -3.36 116.97 114.42 1i1m h TYR 247 Ca -0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 1i1m h TYR 247 Cb 0.50 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.23 1i1m h TYR 247 CO 0.00 0.00 -0.80 1.28 -0.00 0.00 0.00 178.16 178.64 1i1m n LEU 248 N -2.65 1.26 -4.77 3.88 4.77 -1.03 -4.96 117.00 113.50 1i1m n LEU 248 Ca 0.00 -0.58 -0.38 0.00 -0.03 0.00 0.00 56.01 55.02 1i1m n LEU 248 Cb 0.54 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.60 1i1m n LEU 248 CO 0.40 0.28 0.80 0.00 -1.33 0.00 0.00 177.39 177.53 1i1m s ALA 249 N -2.74 3.18 0.20 -1.18 0.00 -0.54 -4.95 121.76 115.73 1i1m s ALA 249 Ca 0.11 0.87 -0.01 0.00 0.00 0.00 0.00 51.96 52.93 1i1m s ALA 249 Cb 0.16 -3.34 0.15 0.00 0.00 0.00 0.00 23.12 20.09 1i1m s ALA 249 CO 0.74 -0.37 1.51 -0.44 0.00 0.00 0.00 175.76 177.20 1i1m h ASP 250 N 2.79 0.50 -5.09 0.00 3.32 -1.08 -3.37 116.42 113.50 1i1m h ASP 250 Ca -0.48 -0.28 -0.08 0.00 0.02 0.00 0.00 57.03 56.20 1i1m h ASP 250 Cb 1.22 -0.14 -0.15 0.00 0.22 0.00 0.00 39.33 40.48 1i1m h ASP 250 CO 0.63 0.97 -0.26 -1.61 -1.72 0.00 0.00 179.24 177.26 1i1m s GLU 251 N -3.89 0.86 -0.19 3.56 2.02 -0.91 -3.89 118.70 116.27 1i1m s GLU 251 Ca -0.06 -0.68 -0.14 0.00 0.02 0.00 0.00 54.97 54.11 1i1m s GLU 251 Cb 0.11 0.37 0.06 0.00 0.10 0.00 0.00 34.13 34.77 1i1m s GLU 251 CO 0.83 -0.29 0.47 0.54 0.02 0.00 0.00 175.26 176.83 1i1m s VAL 252 N -3.17 -0.01 0.12 2.63 0.11 -1.26 -0.30 120.40 118.52 1i1m s VAL 252 Ca -0.01 0.04 -0.06 0.00 -2.93 0.00 0.00 61.98 59.02 1i1m s VAL 252 Cb 0.01 -0.68 -0.02 0.00 -1.53 0.00 0.00 36.38 34.16 1i1m s VAL 252 CO -0.07 0.02 0.17 0.72 -3.33 0.00 0.00 175.10 172.60 1i1m s PHE 253 N 0.86 0.46 0.14 1.54 -0.71 -0.53 -0.50 117.98 119.24 1i1m s PHE 253 Ca -0.05 -0.86 0.07 0.00 -1.04 0.00 0.00 56.93 55.05 1i1m s PHE 253 Cb -0.06 -0.20 -0.04 0.00 -1.21 0.00 0.00 43.02 41.51 1i1m s PHE 253 CO -0.07 -0.58 -0.08 -1.64 -1.34 0.00 0.00 175.22 171.51 1i1m s MET 254 N -3.95 2.17 0.05 1.99 -1.94 0.25 -0.97 119.30 116.90 1i1m s MET 254 Ca 0.14 -1.09 0.03 0.00 -1.71 0.00 0.00 55.69 53.06 1i1m s MET 254 Cb 0.05 -2.29 -0.02 0.00 2.01 0.00 0.00 34.83 34.58 1i1m s MET 254 CO -0.04 0.48 -0.10 -1.54 -0.01 0.00 0.00 175.02 173.82 1i1m s SER 255 N -2.50 1.10 0.00 3.03 1.04 -0.37 -1.31 113.70 114.68 1i1m s SER 255 Ca 0.23 -0.53 0.00 0.00 0.48 0.00 0.00 55.95 56.13 1i1m s SER 255 Cb -0.10 -0.00 0.00 0.00 0.10 0.00 0.00 66.02 66.02 1i1m s SER 255 CO 0.15 -0.14 0.00 0.61 0.98 0.00 0.00 173.24 174.84 1i1m n GLY 256 N 1.54 0.84 0.14 7.32 0.00 -0.73 -0.48 105.19 113.81 1i1m n GLY 256 Ca -0.21 -0.82 -0.13 0.00 0.00 0.00 0.00 46.02 44.85 1i1m n GLY 256 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1i1m h THR 257 N 0.21 0.92 -0.24 2.61 2.02 -1.88 0.40 112.91 116.95 1i1m h THR 257 Ca 0.00 -0.54 -0.18 0.00 0.77 0.00 0.00 66.41 66.46 1i1m h THR 257 Cb 0.00 1.24 -0.00 0.00 -1.74 0.00 0.00 68.15 67.65 1i1m h THR 257 CO 0.00 0.12 -0.56 0.00 0.37 0.00 0.00 175.52 175.46 1i1m h ALA 258 N 0.24 0.56 0.00 6.16 0.00 -1.93 -3.20 119.26 121.08 1i1m h ALA 258 Ca -0.03 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1i1m h ALA 258 Cb 0.39 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1i1m h ALA 258 CO 0.04 0.69 -0.32 0.00 0.00 0.00 0.00 179.25 179.66 1i1m h ALA 259 N 0.80 0.79 -0.75 0.00 0.00 -1.91 -3.05 119.26 115.14 1i1m h ALA 259 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1i1m h ALA 259 Cb 1.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1i1m h ALA 259 CO 0.12 0.00 0.00 0.39 0.00 0.00 0.00 179.25 179.76 1i1m n GLU 260 N -2.23 0.00 -3.84 0.00 1.02 0.14 -3.73 120.64 111.99 1i1m n GLU 260 Ca 0.04 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.88 1i1m n GLU 260 Cb 0.44 0.00 -0.15 0.00 -0.02 0.00 0.00 31.44 31.72 1i1m n GLU 260 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1i1m s ILE 261 N 0.00 1.56 -0.24 -3.67 1.01 -1.26 -1.78 121.20 116.82 1i1m s ILE 261 Ca 0.00 -2.04 -0.07 0.00 0.00 0.00 0.00 60.65 58.54 1i1m s ILE 261 Cb 0.00 -2.15 -0.03 0.00 0.01 0.00 0.00 42.46 40.29 1i1m s ILE 261 CO 0.00 -0.69 0.06 -0.89 0.00 0.00 0.00 174.94 173.42 1i1m s THR 262 N 1.04 4.28 0.56 2.92 2.01 -0.43 -4.78 115.64 121.24 1i1m s THR 262 Ca 0.12 -0.18 -0.19 0.00 0.31 0.00 0.00 61.69 61.75 1i1m s THR 262 Cb -0.20 -2.99 -0.05 0.00 0.01 0.00 0.00 72.50 69.27 1i1m s THR 262 CO -0.14 0.35 1.13 -2.84 -0.69 0.00 0.00 174.62 172.44 1i1m s PRO 263 N 1.51 3.26 -0.30 4.92 0.02 -1.26 -0.58 135.00 142.57 1i1m s PRO 263 Ca 0.06 1.60 -0.01 0.00 0.02 0.00 0.00 61.00 62.67 1i1m s PRO 263 Cb -0.15 -1.99 0.05 0.00 0.02 0.00 0.00 34.50 32.43 1i1m s PRO 263 CO 0.03 -0.92 -0.01 0.08 -0.33 0.00 0.00 177.00 175.85 1i1m s VAL 264 N -1.82 2.93 -0.67 3.83 1.01 0.35 -1.17 120.40 124.86 1i1m s VAL 264 Ca 0.72 -1.39 0.25 0.00 0.00 0.00 0.00 61.98 61.56 1i1m s VAL 264 Cb -0.24 -2.68 0.17 0.00 0.00 0.00 0.00 36.38 33.62 1i1m s VAL 264 CO 0.29 -0.10 1.53 0.08 0.00 0.00 0.00 175.10 176.90 1i1m h ARG 265 N 7.98 0.00 -1.97 2.72 0.11 -1.23 -3.39 114.38 118.61 1i1m h ARG 265 Ca -0.21 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 59.82 1i1m h ARG 265 Cb 1.06 0.00 -0.19 0.00 1.11 0.00 0.00 29.97 31.95 1i1m h ARG 265 CO 0.53 0.00 0.21 -1.54 0.10 0.00 0.00 179.97 179.27 1i1m s SER 266 N -4.46 -0.64 -0.09 0.08 1.04 -1.21 -0.95 113.70 107.46 1i1m s SER 266 Ca 0.08 0.73 -0.01 0.00 0.48 0.00 0.00 55.95 57.24 1i1m s SER 266 Cb 0.12 0.57 0.03 0.00 0.10 0.00 0.00 66.02 66.84 1i1m s SER 266 CO 0.67 -0.57 -0.05 -0.69 0.98 0.00 0.00 173.24 173.57 1i1m s VAL 267 N -1.11 0.77 -1.65 5.02 1.01 -0.20 -1.02 120.40 123.22 1i1m s VAL 267 Ca -0.10 -0.14 -0.02 0.00 0.00 0.00 0.00 61.98 61.72 1i1m s VAL 267 Cb -0.00 -0.84 0.00 0.00 0.00 0.00 0.00 36.38 35.54 1i1m s VAL 267 CO 0.09 0.32 0.31 0.47 0.00 0.00 0.00 175.10 176.29 1i1m n ASP 268 N 4.92 -5.93 0.00 3.32 8.00 -0.19 -1.33 116.55 125.33 1i1m n ASP 268 Ca -0.12 -0.15 0.00 0.00 0.71 0.00 0.00 54.79 55.23 1i1m n ASP 268 Cb 0.50 -4.87 0.00 0.00 -0.02 0.00 0.00 41.12 36.73 1i1m n ASP 268 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1i1m n GLY 269 N -1.26 1.69 3.62 0.44 0.00 -1.26 -5.01 105.19 103.41 1i1m n GLY 269 Ca -0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.46 1i1m n GLY 269 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1i1m s ILE 270 N -3.14 5.21 0.29 -0.61 1.01 -0.44 -5.05 121.20 118.47 1i1m s ILE 270 Ca 0.00 0.51 -0.29 0.00 0.00 0.00 0.00 60.65 60.86 1i1m s ILE 270 Cb 0.00 -3.66 -0.10 0.00 0.01 0.00 0.00 42.46 38.70 1i1m s ILE 270 CO 0.00 0.20 1.37 -1.58 0.00 0.00 0.00 174.94 174.93 1i1m s GLN 271 N 1.83 4.30 -0.39 2.79 0.74 -1.26 -1.03 119.66 126.63 1i1m s GLN 271 Ca 0.14 2.27 -0.18 0.00 0.05 0.00 0.00 55.36 57.64 1i1m s GLN 271 Cb -0.15 -3.09 0.01 0.00 1.10 0.00 0.00 33.01 30.88 1i1m s GLN 271 CO 0.09 -0.31 0.49 0.08 -0.55 0.00 0.00 175.29 175.09 1i1m s VAL 272 N -0.60 5.02 0.00 1.34 1.01 -0.13 -4.91 120.40 122.13 1i1m s VAL 272 Ca 0.54 0.00 0.00 0.00 0.00 0.00 0.00 61.98 62.52 1i1m s VAL 272 Cb -0.41 -4.02 0.00 0.00 0.00 0.00 0.00 36.38 31.95 1i1m s VAL 272 CO 0.49 -0.35 0.00 0.61 0.00 0.00 0.00 175.10 175.85 1i1m n GLY 273 N 4.98 3.00 0.16 4.51 0.00 -1.25 -1.11 105.19 115.49 1i1m n GLY 273 Ca -0.06 0.29 0.13 0.00 0.00 0.00 0.00 46.02 46.38 1i1m n GLY 273 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1i1m n GLU 274 N 8.70 0.65 -0.98 1.61 4.07 -1.26 -4.93 120.64 128.51 1i1m n GLU 274 Ca 0.00 -0.33 0.00 0.00 -0.06 0.00 0.00 57.16 56.77 1i1m n GLU 274 Cb 0.00 -1.49 0.00 0.00 -0.06 0.00 0.00 31.44 29.89 1i1m n GLU 274 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1i1m n GLY 275 N 1.35 0.51 3.41 8.31 0.00 -0.26 -5.00 105.19 113.50 1i1m n GLY 275 Ca 0.12 -0.01 -0.22 0.00 0.00 0.00 0.00 46.02 45.90 1i1m n GLY 275 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1i1m s ARG 276 N -0.05 1.79 0.17 1.61 0.52 -1.26 -4.84 118.95 116.88 1i1m s ARG 276 Ca 0.00 -2.06 -0.32 0.00 -0.52 0.00 0.00 55.73 52.84 1i1m s ARG 276 Cb 0.00 -0.24 -0.11 0.00 0.52 0.00 0.00 34.95 35.12 1i1m s ARG 276 CO 0.00 -0.51 1.75 0.00 0.02 0.00 0.00 175.30 176.56 1i1m s GLY 278 N 1.74 1.62 0.21 0.00 0.00 -1.26 -4.90 107.32 104.72 1i1m s GLY 278 Ca 0.76 -0.34 -0.09 0.00 0.00 0.00 0.00 44.72 45.05 1i1m s GLY 278 CO 0.33 0.08 1.81 -0.56 0.00 0.00 0.00 173.10 174.76 1i1m h PRO 279 N -0.93 1.08 -0.24 2.90 0.13 -1.97 -1.15 132.00 131.82 1i1m h PRO 279 Ca -0.46 -0.14 -0.19 0.00 -0.87 0.00 0.00 66.00 64.34 1i1m h PRO 279 Cb 1.27 -0.20 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1i1m h PRO 279 CO 0.62 0.82 -0.60 0.28 -0.23 0.00 0.00 178.00 178.89 1i1m h VAL 280 N 1.06 1.28 -0.62 1.56 2.07 -2.00 -1.76 116.25 117.85 1i1m h VAL 280 Ca 0.26 -1.80 -0.01 0.00 0.82 0.00 0.00 66.70 65.98 1i1m h VAL 280 Cb 0.08 1.73 -0.03 0.00 -1.52 0.00 0.00 31.29 31.54 1i1m h VAL 280 CO -0.04 0.58 0.35 0.74 0.02 0.00 0.00 177.57 179.22 1i1m h THR 281 N 0.60 1.20 0.02 2.57 2.02 -1.93 -1.93 112.91 115.47 1i1m h THR 281 Ca -0.00 -0.48 0.02 0.00 0.77 0.00 0.00 66.41 66.72 1i1m h THR 281 Cb 1.20 0.39 -0.03 0.00 -1.74 0.00 0.00 68.15 67.96 1i1m h THR 281 CO 0.13 0.21 -0.20 0.11 0.37 0.00 0.00 175.52 176.14 1i1m h LYS 282 N 0.84 -0.32 -0.58 6.66 1.79 -1.08 1.00 116.57 124.88 1i1m h LYS 282 Ca 0.22 0.02 0.10 0.00 -2.18 0.00 0.00 60.65 58.81 1i1m h LYS 282 Cb 0.03 0.07 -0.08 0.00 -1.58 0.00 0.00 32.23 30.67 1i1m h LYS 282 CO -0.04 -0.21 0.15 0.00 -1.08 0.00 0.00 179.45 178.27 1i1m h ARG 283 N -0.33 0.29 -0.57 3.15 3.08 -0.97 -0.30 114.38 118.73 1i1m h ARG 283 Ca 0.05 -0.02 -0.08 0.00 0.07 0.00 0.00 59.98 60.00 1i1m h ARG 283 Cb 0.39 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.36 1i1m h ARG 283 CO -0.17 0.19 0.04 0.82 -1.07 0.00 0.00 179.97 179.78 1i1m h ILE 284 N 0.30 1.26 -0.05 2.04 2.04 -0.93 -1.26 117.51 120.91 1i1m h ILE 284 Ca 0.30 -1.07 -0.00 0.00 1.00 0.00 0.00 64.86 65.09 1i1m h ILE 284 Cb 0.42 0.83 -0.00 0.00 -0.74 0.00 0.00 36.82 37.33 1i1m h ILE 284 CO -0.36 0.39 0.03 1.56 0.00 0.00 0.00 178.15 179.77 1i1m h GLN 285 N 0.88 0.07 -0.78 2.37 4.20 0.02 0.18 115.11 122.04 1i1m h GLN 285 Ca 0.17 -0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.90 1i1m h GLN 285 Cb 0.50 -0.01 -0.05 0.00 0.30 0.00 0.00 27.48 28.22 1i1m h GLN 285 CO 0.02 0.09 0.50 1.96 -0.67 0.00 0.00 178.83 180.73 1i1m h GLN 286 N 0.03 0.95 -0.34 1.46 4.20 -0.94 -0.05 115.11 120.43 1i1m h GLN 286 Ca 0.02 -0.06 -0.10 0.00 0.06 0.00 0.00 58.65 58.57 1i1m h GLN 286 Cb 0.03 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 27.58 1i1m h GLN 286 CO -0.00 0.63 -0.20 0.00 -0.67 0.00 0.00 178.83 178.59 1i1m h ALA 287 N 1.32 1.02 0.37 3.87 0.00 -0.95 0.73 119.26 125.62 1i1m h ALA 287 Ca 0.31 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1i1m h ALA 287 Cb -0.01 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1i1m h ALA 287 CO -0.10 0.58 -0.18 0.35 0.00 0.00 0.00 179.25 179.91 1i1m h PHE 288 N 0.56 -0.46 0.00 0.00 3.57 -0.28 -3.17 116.94 117.16 1i1m h PHE 288 Ca 0.09 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.58 1i1m h PHE 288 Cb 0.66 0.15 -0.00 0.00 2.79 0.00 0.00 35.95 39.55 1i1m h PHE 288 CO 0.03 -0.14 -0.00 0.74 -2.23 0.00 0.00 178.31 176.71 1i1m h PHE 289 N -0.97 0.00 0.00 0.41 0.04 -1.07 -2.30 116.94 113.05 1i1m h PHE 289 Ca -0.05 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.71 1i1m h PHE 289 Cb 0.53 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.68 1i1m h PHE 289 CO 0.03 0.00 -0.03 0.78 -0.60 0.00 0.00 178.31 178.49 1i1m h GLY 290 N 1.33 0.00 1.98 -1.45 0.00 -0.81 -2.42 103.07 101.69 1i1m h GLY 290 Ca -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 1i1m h GLY 290 CO 0.00 0.00 -0.14 1.41 0.00 0.00 0.00 176.54 177.81 1i1m h LEU 291 N 0.00 0.02 -1.43 3.11 3.38 -1.47 -0.39 115.31 118.52 1i1m h LEU 291 Ca -0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1i1m h LEU 291 Cb 0.28 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1i1m h LEU 291 CO 0.00 0.16 0.00 0.49 0.09 0.00 0.00 178.44 179.19 1i1m n PHE 292 N -4.36 0.06 -0.02 1.13 3.01 -0.91 -3.93 117.46 112.43 1i1m n PHE 292 Ca -0.02 -0.03 0.00 0.00 1.01 0.00 0.00 57.45 58.41 1i1m n PHE 292 Cb 0.22 0.00 -0.08 0.00 -0.01 0.00 0.00 39.48 39.61 1i1m n PHE 292 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 1i1m n THR 293 N 0.72 0.31 0.00 4.37 -1.04 -0.82 -2.22 114.28 115.60 1i1m n THR 293 Ca 0.17 -0.31 0.00 0.00 -2.04 0.00 0.00 64.05 61.86 1i1m n THR 293 Cb 0.46 -0.21 0.00 0.00 -1.82 0.00 0.00 70.33 68.76 1i1m n THR 293 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1i1m n GLY 294 N 2.15 0.40 0.30 3.41 0.00 -0.22 -4.74 105.19 106.50 1i1m n GLY 294 Ca -0.08 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.86 1i1m n GLY 294 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1i1m h GLU 295 N 3.26 1.01 -5.04 1.61 5.08 -1.72 -3.40 114.58 115.38 1i1m h GLU 295 Ca 0.00 -0.31 -0.63 0.00 -1.00 0.00 0.00 59.36 57.42 1i1m h GLU 295 Cb 0.00 -0.10 -0.15 0.00 0.50 0.00 0.00 28.75 29.00 1i1m h GLU 295 CO 0.00 0.99 -0.44 0.99 -1.00 0.00 0.00 179.01 179.55 1i1m s THR 296 N -5.00 5.29 0.14 1.13 2.01 -0.94 -4.99 115.64 113.27 1i1m s THR 296 Ca -0.11 0.29 -0.31 0.00 0.31 0.00 0.00 61.69 61.87 1i1m s THR 296 Cb 0.14 -3.57 -0.08 0.00 0.01 0.00 0.00 72.50 69.00 1i1m s THR 296 CO 0.85 0.26 1.37 -0.70 -0.69 0.00 0.00 174.62 175.71 1i1m s GLU 297 N 1.59 4.34 -1.20 4.92 2.12 -1.26 -4.33 118.70 124.88 1i1m s GLU 297 Ca 0.09 2.07 -0.19 0.00 0.36 0.00 0.00 54.97 57.31 1i1m s GLU 297 Cb -0.15 -3.23 0.09 0.00 0.26 0.00 0.00 34.13 31.09 1i1m s GLU 297 CO 0.09 -0.39 1.58 0.34 -0.54 0.00 0.00 175.26 176.34 1i1m s ASP 298 N 0.89 6.78 0.45 -1.70 2.15 -1.26 -4.77 116.67 119.21 1i1m s ASP 298 Ca 0.62 -2.28 0.29 0.00 0.43 0.00 0.00 52.55 51.61 1i1m s ASP 298 Cb -0.37 -2.54 0.99 0.00 -0.30 0.00 0.00 42.92 40.70 1i1m s ASP 298 CO 0.33 -1.18 1.83 0.11 -0.17 0.00 0.00 175.17 176.09 1i1m h LYS 299 N 8.11 0.00 0.00 4.34 1.57 -2.04 -3.30 116.57 125.25 1i1m h LYS 299 Ca 0.35 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.13 1i1m h LYS 299 Cb 0.91 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.22 1i1m h LYS 299 CO 1.40 0.00 -1.02 0.91 -0.57 0.00 0.00 179.45 180.16 1i1m n TRP 300 N -2.89 0.00 -2.46 -1.35 8.01 -1.26 -4.99 117.44 112.50 1i1m n TRP 300 Ca 0.02 0.00 -0.03 0.00 -1.31 0.00 0.00 57.50 56.19 1i1m n TRP 300 Cb 0.37 -0.04 0.01 0.00 -2.01 0.00 0.00 31.31 29.63 1i1m n TRP 300 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1i1m n GLY 301 N 1.45 0.61 0.18 6.99 0.00 -1.24 -4.97 105.19 108.21 1i1m n GLY 301 Ca 0.03 -0.51 0.12 0.00 0.00 0.00 0.00 46.02 45.66 1i1m n GLY 301 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1i1m h TRP 302 N -0.29 0.00 -3.72 1.61 6.55 -1.94 -3.45 115.95 114.70 1i1m h TRP 302 Ca -0.07 0.00 -0.64 0.00 0.95 0.00 0.00 58.89 59.13 1i1m h TRP 302 Cb 1.04 0.00 -0.16 0.00 -0.86 0.00 0.00 29.16 29.18 1i1m h TRP 302 CO 0.06 0.00 -0.29 -0.51 -1.05 0.00 0.00 178.44 176.65 1i1m s LEU 303 N -5.87 4.19 -0.36 -4.49 1.43 -1.26 0.09 118.68 112.41 1i1m s LEU 303 Ca 0.05 0.05 -0.10 0.00 -1.03 0.00 0.00 54.13 53.10 1i1m s LEU 303 Cb 0.07 -2.36 0.03 0.00 0.03 0.00 0.00 46.19 43.96 1i1m s LEU 303 CO 0.71 -0.23 0.17 -0.62 0.23 0.00 0.00 176.35 176.61 1i1m s ASP 304 N 1.70 5.59 0.14 2.29 2.15 -0.77 -4.94 116.67 122.81 1i1m s ASP 304 Ca 0.13 -0.99 -0.31 0.00 0.43 0.00 0.00 52.55 51.81 1i1m s ASP 304 Cb -0.16 -1.98 -0.09 0.00 -0.30 0.00 0.00 42.92 40.39 1i1m s ASP 304 CO 0.11 -0.35 1.48 -1.10 -0.17 0.00 0.00 175.17 175.14 1i1m s GLN 305 N 1.52 4.27 0.10 4.34 -0.21 -1.26 -0.81 119.66 127.61 1i1m s GLN 305 Ca 0.01 2.22 -0.07 0.00 0.02 0.00 0.00 55.36 57.55 1i1m s GLN 305 Cb -0.19 -3.20 -0.18 0.00 1.00 0.00 0.00 33.01 30.44 1i1m s GLN 305 CO 0.05 -0.52 1.22 0.28 -2.12 0.00 0.00 175.29 174.20 1i1m h VAL 306 N 4.14 1.40 0.00 1.09 2.07 -1.89 -3.47 116.25 119.58 1i1m h VAL 306 Ca -0.42 -2.59 0.00 0.00 0.82 0.00 0.00 66.70 64.50 1i1m h VAL 306 Cb 1.21 2.60 0.00 0.00 -1.52 0.00 0.00 31.29 33.58 1i1m h VAL 306 CO 0.89 0.77 0.00 0.59 0.02 0.00 0.00 177.57 179.84