#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a1s s GLU 2 N 0.00 3.05 -0.28 0.03 0.41 -1.26 -0.95 118.70 119.70 2a1s s GLU 2 Ca 0.00 -1.23 -0.11 0.00 -0.41 0.00 0.00 54.97 53.22 2a1s s GLU 2 Cb 0.00 -4.20 -0.04 0.00 -1.78 0.00 0.00 34.13 28.10 2a1s s GLU 2 CO 0.00 -1.37 0.18 0.42 -0.49 0.00 0.00 175.26 174.00 2a1s s ILE 3 N 2.44 5.12 0.37 -1.63 1.09 -0.31 -5.00 121.20 123.28 2a1s s ILE 3 Ca 0.11 0.05 0.03 0.00 -1.10 0.00 0.00 60.65 59.74 2a1s s ILE 3 Cb -0.23 -3.46 -0.04 0.00 -1.06 0.00 0.00 42.46 37.67 2a1s s ILE 3 CO 0.08 0.23 0.10 0.27 -0.10 0.00 0.00 174.94 175.52 2a1s s ILE 4 N 1.73 0.80 0.19 2.92 -4.36 -1.26 -1.98 121.20 119.23 2a1s s ILE 4 Ca 0.07 -2.00 -0.24 0.00 -0.26 0.00 0.00 60.65 58.22 2a1s s ILE 4 Cb -0.16 -2.51 0.09 0.00 1.25 0.00 0.00 42.46 41.13 2a1s s ILE 4 CO 0.10 0.00 1.56 -0.09 0.24 0.00 0.00 174.94 176.74 2a1s h ARG 5 N 1.94 -0.10 0.00 0.37 2.43 -1.62 0.36 114.38 117.75 2a1s h ARG 5 Ca -0.37 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.80 2a1s h ARG 5 Cb 1.26 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.84 2a1s h ARG 5 CO 0.62 -0.07 0.00 -1.13 -1.51 0.00 0.00 179.97 177.88 2a1s n SER 6 N -5.40 0.00 -0.18 -3.80 3.41 -1.26 -2.38 113.62 104.00 2a1s n SER 6 Ca 0.05 0.06 0.06 0.00 -0.26 0.00 0.00 58.87 58.78 2a1s n SER 6 Cb 0.35 -0.31 -0.02 0.00 -0.26 0.00 0.00 64.21 63.97 2a1s n SER 6 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2a1s n ASN 7 N -1.31 1.08 -0.07 4.04 4.05 0.06 -4.82 115.26 118.29 2a1s n ASN 7 Ca 0.08 -1.04 -0.09 0.00 0.45 0.00 0.00 54.58 53.98 2a1s n ASN 7 Cb 0.16 0.64 -0.08 0.00 1.23 0.00 0.00 39.78 41.73 2a1s n ASN 7 CO 0.00 0.00 0.00 0.15 -3.05 0.00 0.00 177.26 174.36 2a1s h PHE 8 N 0.89 0.00 -0.04 1.20 3.57 -1.02 -3.32 116.94 118.23 2a1s h PHE 8 Ca 0.00 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 2a1s h PHE 8 Cb 0.36 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.10 2a1s h PHE 8 CO 0.00 0.65 0.00 0.87 -2.23 0.00 0.00 178.31 177.60 2a1s h LYS 9 N -1.00 0.07 -2.00 1.11 1.57 -1.88 -0.52 116.57 113.92 2a1s h LYS 9 Ca -0.04 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.70 2a1s h LYS 9 Cb 0.66 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.96 2a1s h LYS 9 CO -0.02 0.35 -0.03 -1.13 -0.57 0.00 0.00 179.45 178.04 2a1s n SER 10 N -4.90 5.08 0.00 0.86 3.41 -1.26 -2.25 113.62 114.56 2a1s n SER 10 Ca -0.07 -2.35 0.00 0.00 -0.26 0.00 0.00 58.87 56.19 2a1s n SER 10 Cb 0.18 -1.10 0.00 0.00 -0.26 0.00 0.00 64.21 63.03 2a1s n SER 10 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2a1s n ASN 11 N 1.62 0.00 0.01 4.04 2.85 -1.08 -4.96 115.26 117.75 2a1s n ASN 11 Ca 0.04 -0.22 -0.03 0.00 -0.11 0.00 0.00 54.58 54.26 2a1s n ASN 11 Cb 0.51 0.00 0.21 0.00 1.24 0.00 0.00 39.78 41.75 2a1s n ASN 11 CO 0.00 0.00 0.00 0.25 -2.11 0.00 0.00 177.26 175.40 2a1s h LEU 12 N 0.00 0.50 -0.44 1.20 5.85 -0.64 -2.98 115.31 118.80 2a1s h LEU 12 Ca 0.00 -0.15 0.06 0.00 0.84 0.00 0.00 57.88 58.63 2a1s h LEU 12 Cb 0.11 -0.13 -0.05 0.00 0.37 0.00 0.00 40.66 40.95 2a1s h LEU 12 CO 0.00 0.71 0.14 1.12 -0.34 0.00 0.00 178.44 180.07 2a1s h HIS 13 N 0.45 0.24 -0.91 1.25 2.07 -1.87 -1.45 115.15 114.93 2a1s h HIS 13 Ca 0.07 0.02 0.09 0.00 -2.85 0.00 0.00 60.37 57.71 2a1s h HIS 13 Cb 0.61 -0.04 -0.07 0.00 2.57 0.00 0.00 27.41 30.47 2a1s h HIS 13 CO 0.02 0.08 0.56 0.87 -3.07 0.00 0.00 177.93 176.39 2a1s h LYS 14 N 0.30 0.92 -0.36 5.12 1.57 -1.92 0.50 116.57 122.71 2a1s h LYS 14 Ca 0.21 -0.06 -0.17 0.00 -1.87 0.00 0.00 60.65 58.77 2a1s h LYS 14 Cb 0.22 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 2a1s h LYS 14 CO -0.23 0.61 -0.43 0.28 -0.57 0.00 0.00 179.45 179.12 2a1s h VAL 15 N 0.95 1.27 -0.53 0.50 2.07 -1.45 0.11 116.25 119.18 2a1s h VAL 15 Ca 0.43 -1.60 -0.12 0.00 0.82 0.00 0.00 66.70 66.23 2a1s h VAL 15 Cb 0.33 1.44 -0.02 0.00 -1.52 0.00 0.00 31.29 31.53 2a1s h VAL 15 CO -0.23 0.53 -0.14 1.88 0.02 0.00 0.00 177.57 179.64 2a1s h TYR 16 N 0.73 1.16 -0.37 1.57 0.99 -0.80 -1.13 116.97 119.12 2a1s h TYR 16 Ca 0.05 -0.25 -0.01 0.00 2.00 0.00 0.00 58.73 60.51 2a1s h TYR 16 Cb 1.02 -0.28 -0.02 0.00 1.00 0.00 0.00 36.73 38.46 2a1s h TYR 16 CO 0.06 1.08 0.17 0.37 -0.00 0.00 0.00 178.16 179.85 2a1s h GLN 17 N 0.90 0.54 -0.59 4.88 4.15 -0.70 0.52 115.11 124.80 2a1s h GLN 17 Ca 0.13 -0.08 -0.09 0.00 0.77 0.00 0.00 58.65 59.38 2a1s h GLN 17 Cb 0.71 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 28.28 2a1s h GLN 17 CO 0.05 0.49 0.01 0.00 -1.93 0.00 0.00 178.83 177.45 2a1s h ALA 18 N 1.02 0.90 -0.25 3.38 0.00 -0.61 -0.51 119.26 123.20 2a1s h ALA 18 Ca 0.13 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 2a1s h ALA 18 Cb 0.13 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2a1s h ALA 18 CO -0.02 0.65 0.04 0.82 0.00 0.00 0.00 179.25 180.75 2a1s h ILE 19 N 0.94 1.23 -0.26 0.00 2.04 -1.14 -3.04 117.51 117.27 2a1s h ILE 19 Ca 0.17 -0.78 0.04 0.00 1.00 0.00 0.00 64.86 65.30 2a1s h ILE 19 Cb 0.53 1.26 -0.04 0.00 -0.74 0.00 0.00 36.82 37.83 2a1s h ILE 19 CO 0.03 0.25 0.00 -0.08 0.00 0.00 0.00 178.15 178.35 2a1s h GLU 20 N 0.22 0.08 -0.57 2.37 4.81 -0.61 -3.24 114.58 117.63 2a1s h GLU 20 Ca 0.08 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 2a1s h GLU 20 Cb 0.33 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.69 2a1s h GLU 20 CO 0.01 0.05 0.00 -0.85 -0.73 0.00 0.00 179.01 177.49 2a1s n GLU 21 N -5.15 4.59 -3.34 1.92 0.28 -0.22 -4.97 120.64 113.75 2a1s n GLU 21 Ca -0.01 -3.10 -0.29 0.00 -0.16 0.00 0.00 57.16 53.60 2a1s n GLU 21 Cb 0.13 -2.18 -0.03 0.00 1.43 0.00 0.00 31.44 30.79 2a1s n GLU 21 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2a1s s ALA 22 N -2.61 3.62 -0.98 -1.84 0.00 -1.15 -4.79 121.76 114.02 2a1s s ALA 22 Ca 0.53 -0.55 0.26 0.00 0.00 0.00 0.00 51.96 52.20 2a1s s ALA 22 Cb 0.40 -2.30 0.64 0.00 0.00 0.00 0.00 23.12 21.86 2a1s s ALA 22 CO 0.17 0.25 1.51 -0.25 0.00 0.00 0.00 175.76 177.44 2a1s n ASP 23 N -0.92 0.41 0.00 0.00 8.00 0.53 -4.98 116.55 119.60 2a1s n ASP 23 Ca -0.02 -0.08 0.00 0.00 0.71 0.00 0.00 54.79 55.40 2a1s n ASP 23 Cb 0.54 0.10 0.00 0.00 -0.02 0.00 0.00 41.12 41.73 2a1s n ASP 23 CO 0.00 0.00 0.00 2.22 -0.39 0.00 0.00 177.20 179.03 2a1s n PHE 24 N -1.53 0.00 -4.00 1.24 1.16 -1.21 -4.67 117.46 108.44 2a1s n PHE 24 Ca 0.06 0.00 -0.10 0.00 -1.87 0.00 0.00 57.45 55.54 2a1s n PHE 24 Cb 0.34 0.00 -0.11 0.00 -1.61 0.00 0.00 39.48 38.10 2a1s n PHE 24 CO 0.00 0.00 0.00 -0.59 -1.87 0.00 0.00 176.76 174.30 2a1s s PHE 25 N -2.00 0.36 0.02 2.97 -0.12 -1.10 -1.93 117.98 116.18 2a1s s PHE 25 Ca 0.00 -0.56 -0.02 0.00 -0.05 0.00 0.00 56.93 56.30 2a1s s PHE 25 Cb 0.00 -0.25 -0.04 0.00 -0.63 0.00 0.00 43.02 42.10 2a1s s PHE 25 CO 0.00 -0.18 0.20 0.00 -0.05 0.00 0.00 175.22 175.19 2a1s s ALA 26 N -1.60 3.97 0.30 1.99 0.00 -0.30 -1.04 121.76 125.08 2a1s s ALA 26 Ca -0.13 -0.77 0.05 0.00 0.00 0.00 0.00 51.96 51.11 2a1s s ALA 26 Cb -0.09 -1.88 -0.06 0.00 0.00 0.00 0.00 23.12 21.09 2a1s s ALA 26 CO -0.01 0.77 -0.01 0.96 0.00 0.00 0.00 175.76 177.46 2a1s s ILE 27 N -1.39 1.48 -0.28 0.00 -4.36 0.73 -1.37 121.20 116.02 2a1s s ILE 27 Ca 0.30 -2.07 -0.25 0.00 -0.26 0.00 0.00 60.65 58.37 2a1s s ILE 27 Cb -0.13 -2.60 0.11 0.00 1.25 0.00 0.00 42.46 41.10 2a1s s ILE 27 CO 0.22 -0.18 0.96 -0.62 0.24 0.00 0.00 174.94 175.56 2a1s s ASP 28 N -3.47 -0.52 0.11 4.36 2.15 -0.75 -4.52 116.67 114.03 2a1s s ASP 28 Ca 0.32 0.99 0.06 0.00 0.43 0.00 0.00 52.55 54.36 2a1s s ASP 28 Cb 0.06 1.00 -0.04 0.00 -0.30 0.00 0.00 42.92 43.64 2a1s s ASP 28 CO 0.13 -0.18 -0.06 -0.83 -0.17 0.00 0.00 175.17 174.07 2a1s s GLY 29 N 0.24 1.83 -0.08 2.66 0.00 -1.26 -0.30 107.32 110.41 2a1s s GLY 29 Ca 0.02 -1.22 0.02 0.00 0.00 0.00 0.00 44.72 43.54 2a1s s GLY 29 CO -0.04 -1.20 -0.12 -0.54 0.00 0.00 0.00 173.10 171.19 2a1s s GLU 30 N -2.33 2.87 0.26 2.90 0.41 -0.37 -4.94 118.70 117.51 2a1s s GLU 30 Ca 0.24 -0.66 0.10 0.00 -0.41 0.00 0.00 54.97 54.23 2a1s s GLU 30 Cb -0.11 -2.51 -0.04 0.00 -1.78 0.00 0.00 34.13 29.68 2a1s s GLU 30 CO 0.16 0.48 -0.07 -0.06 -0.49 0.00 0.00 175.26 175.28 2a1s s PHE 31 N -0.34 2.57 0.39 1.61 2.99 -1.26 -1.10 117.98 122.84 2a1s s PHE 31 Ca 0.04 -0.25 0.13 0.00 0.00 0.00 0.00 56.93 56.84 2a1s s PHE 31 Cb -0.13 -1.14 0.95 0.00 0.00 0.00 0.00 43.02 42.70 2a1s s PHE 31 CO 0.02 0.64 1.89 0.77 -0.00 0.00 0.00 175.22 178.54 2a1s h SER 32 N 2.10 0.51 -5.81 1.36 0.02 -1.04 -3.47 113.55 107.23 2a1s h SER 32 Ca -0.43 0.03 0.34 0.00 -0.84 0.00 0.00 61.79 60.89 2a1s h SER 32 Cb 1.25 -0.07 -0.09 0.00 0.14 0.00 0.00 62.40 63.63 2a1s h SER 32 CO 0.60 0.25 0.87 -0.83 -1.14 0.00 0.00 176.83 176.58 2a1s s GLY 33 N -3.75 -0.27 -0.02 -3.77 0.00 -1.26 -0.57 107.32 97.68 2a1s s GLY 33 Ca -0.09 0.37 -0.01 0.00 0.00 0.00 0.00 44.72 44.99 2a1s s GLY 33 CO 0.78 2.85 -0.03 1.39 0.00 0.00 0.00 173.10 178.10 2a1s n ILE 34 N -0.70 0.14 -4.18 0.90 5.41 -1.26 -4.86 119.36 114.81 2a1s n ILE 34 Ca -0.03 0.47 -0.17 0.00 1.00 0.00 0.00 62.75 64.03 2a1s n ILE 34 Cb 0.61 -1.58 -0.11 0.00 -0.71 0.00 0.00 39.64 37.84 2a1s n ILE 34 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 2a1s s SER 35 N -3.98 1.60 0.00 4.38 0.15 -1.26 -4.43 113.70 110.16 2a1s s SER 35 Ca -0.02 -0.70 0.30 0.00 0.70 0.00 0.00 55.95 56.23 2a1s s SER 35 Cb 0.00 -0.03 1.46 0.00 -1.71 0.00 0.00 66.02 65.74 2a1s s SER 35 CO 0.03 -0.15 1.97 -0.90 1.20 0.00 0.00 173.24 175.40 2a1s n ASP 36 N 0.97 0.77 0.00 5.45 3.85 -0.16 -4.84 116.55 122.60 2a1s n ASP 36 Ca -0.19 -1.26 0.00 0.00 -0.71 0.00 0.00 54.79 52.63 2a1s n ASP 36 Cb 0.56 -0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.32 2a1s n ASP 36 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2a1s n GLY 37 N 1.09 -1.80 0.00 6.12 0.00 -1.26 -5.15 105.19 104.18 2a1s n GLY 37 Ca 0.21 0.53 0.00 0.00 0.00 0.00 0.00 46.02 46.76 2a1s n GLY 37 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2a1s n PRO 38 N -1.04 1.85 -2.71 1.61 -0.04 -1.26 -5.25 135.00 128.16 2a1s n PRO 38 Ca 0.00 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.45 2a1s n PRO 38 Cb 0.00 0.00 0.02 0.00 -0.04 0.00 0.00 33.50 33.48 2a1s n PRO 38 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2a1s s SER 39 N -1.00 -0.32 0.00 3.54 1.04 -1.26 -4.78 113.70 110.92 2a1s s SER 39 Ca 0.00 -0.30 0.00 0.00 0.48 0.00 0.00 55.95 56.13 2a1s s SER 39 Cb 0.00 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.53 2a1s s SER 39 CO 0.00 -0.02 0.00 0.49 0.98 0.00 0.00 173.24 174.69 2a1s n PHE 47 N 3.01 0.00 -1.06 5.02 3.72 -1.26 -5.19 117.46 121.70 2a1s n PHE 47 Ca 0.09 0.00 -0.35 0.00 -0.05 0.00 0.00 57.45 57.14 2a1s n PHE 47 Cb 0.64 0.00 0.08 0.00 -0.94 0.00 0.00 39.48 39.26 2a1s n PHE 47 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 2a1s n ASP 48 N 0.00 -2.62 -4.89 4.37 8.00 -1.26 -5.00 116.55 115.15 2a1s n ASP 48 Ca 0.00 0.43 -0.29 0.00 0.71 0.00 0.00 54.79 55.64 2a1s n ASP 48 Cb 0.00 -1.09 0.04 0.00 -0.02 0.00 0.00 41.12 40.04 2a1s n ASP 48 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2a1s s THR 49 N -2.09 3.65 0.40 -3.53 -4.23 -1.26 -4.87 115.64 103.71 2a1s s THR 49 Ca 0.57 0.40 0.07 0.00 -1.18 0.00 0.00 61.69 61.55 2a1s s THR 49 Cb -0.28 -3.51 0.28 0.00 1.34 0.00 0.00 72.50 70.32 2a1s s THR 49 CO 0.66 -0.64 2.03 1.55 -0.54 0.00 0.00 174.62 177.68 2a1s h PRO 50 N -0.50 0.60 -0.39 3.99 0.13 -1.94 -1.48 132.00 132.40 2a1s h PRO 50 Ca -0.45 -0.04 -0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2a1s h PRO 50 Cb 1.25 -0.14 -0.02 0.00 0.13 0.00 0.00 31.00 32.22 2a1s h PRO 50 CO 0.63 0.40 0.23 1.49 -0.23 0.00 0.00 178.00 180.51 2a1s h GLU 51 N 0.62 0.54 -0.57 0.86 4.57 -2.00 -1.91 114.58 116.69 2a1s h GLU 51 Ca 0.20 -0.06 -0.01 0.00 -1.18 0.00 0.00 59.36 58.32 2a1s h GLU 51 Cb 0.05 -0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 28.50 2a1s h GLU 51 CO -0.05 0.42 0.34 0.93 -1.18 0.00 0.00 179.01 179.47 2a1s h GLU 52 N 0.51 0.78 0.00 1.92 5.08 -1.68 -2.50 114.58 118.70 2a1s h GLU 52 Ca 0.14 -0.08 -0.10 0.00 -1.00 0.00 0.00 59.36 58.33 2a1s h GLU 52 Cb 0.03 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 2a1s h GLU 52 CO -0.02 0.57 -0.47 0.00 -1.00 0.00 0.00 179.01 178.09 2a1s h ARG 53 N 0.77 0.00 -0.39 2.33 3.08 -1.22 -1.19 114.38 117.76 2a1s h ARG 53 Ca 0.21 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.10 2a1s h ARG 53 Cb -0.00 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 2a1s h ARG 53 CO -0.04 0.47 -0.35 -0.92 -1.07 0.00 0.00 179.97 178.06 2a1s h TYR 54 N 0.00 1.08 -0.00 3.04 3.20 -1.16 -2.64 116.97 120.49 2a1s h TYR 54 Ca -0.00 -0.31 -0.19 0.00 3.14 0.00 0.00 58.73 61.37 2a1s h TYR 54 Cb 0.84 -0.23 -0.01 0.00 1.54 0.00 0.00 36.73 38.87 2a1s h TYR 54 CO 0.00 1.12 -0.84 1.96 -1.64 0.00 0.00 178.16 178.76 2a1s h GLN 55 N 0.75 0.14 0.24 1.82 7.50 -1.21 -2.04 115.11 122.31 2a1s h GLN 55 Ca 0.07 -0.15 -0.01 0.00 0.50 0.00 0.00 58.65 59.06 2a1s h GLN 55 Cb 0.93 0.04 0.00 0.00 0.05 0.00 0.00 27.48 28.50 2a1s h GLN 55 CO 0.09 0.90 -0.11 0.87 -1.50 0.00 0.00 178.83 179.07 2a1s h LYS 56 N 0.08 -0.31 -0.92 1.46 1.57 -1.24 -3.12 116.57 114.10 2a1s h LYS 56 Ca -0.03 0.02 0.26 0.00 -1.87 0.00 0.00 60.65 59.03 2a1s h LYS 56 Cb 1.45 0.07 -0.15 0.00 0.08 0.00 0.00 32.23 33.68 2a1s h LYS 56 CO 0.12 -0.21 0.23 -0.07 -0.57 0.00 0.00 179.45 178.96 2a1s h LEU 57 N -0.37 -0.05 -1.79 2.94 4.07 -1.58 -0.94 115.31 117.59 2a1s h LEU 57 Ca -0.03 0.22 0.09 0.00 0.08 0.00 0.00 57.88 58.24 2a1s h LEU 57 Cb 0.25 0.31 -0.03 0.00 1.08 0.00 0.00 40.66 42.27 2a1s h LEU 57 CO 0.05 -0.22 0.32 0.50 -1.08 0.00 0.00 178.44 178.02 2a1s h LYS 58 N 0.15 0.24 0.02 1.13 3.64 -1.35 -0.36 116.57 120.04 2a1s h LYS 58 Ca 0.59 -0.01 -0.39 0.00 -1.27 0.00 0.00 60.65 59.57 2a1s h LYS 58 Cb 1.26 -0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 32.96 2a1s h LYS 58 CO -0.72 0.16 -2.35 1.63 -2.27 0.00 0.00 179.45 175.90 2a1s n LYS 59 N -4.46 0.65 0.00 1.90 5.02 -0.42 -3.69 118.16 117.16 2a1s n LYS 59 Ca 0.07 0.21 0.14 0.00 -2.02 0.00 0.00 58.31 56.71 2a1s n LYS 59 Cb 0.37 -1.56 0.55 0.00 -0.02 0.00 0.00 35.03 34.37 2a1s n LYS 59 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 2a1s n HIS 60 N -3.55 0.00 0.00 2.13 8.25 -0.81 -4.43 115.22 116.81 2a1s n HIS 60 Ca -0.45 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.01 2a1s n HIS 60 Cb 0.96 -0.20 0.00 0.00 1.12 0.00 0.00 29.99 31.88 2a1s n HIS 60 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2a1s n SER 61 N -0.99 0.79 -1.05 0.41 7.64 -0.15 -0.99 113.62 119.29 2a1s n SER 61 Ca 0.13 -0.07 0.09 0.00 1.01 0.00 0.00 58.87 60.04 2a1s n SER 61 Cb 0.30 0.30 0.26 0.00 -1.01 0.00 0.00 64.21 64.05 2a1s n SER 61 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 2a1s n MET 62 N -0.38 2.32 0.05 1.43 2.81 -1.21 -3.54 117.12 118.61 2a1s n MET 62 Ca 0.00 -2.05 0.12 0.00 -1.81 0.00 0.00 57.70 53.96 2a1s n MET 62 Cb 0.00 -1.45 0.12 0.00 -0.71 0.00 0.00 33.22 31.18 2a1s n MET 62 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 2a1s n ASP 63 N 1.17 0.67 -4.82 7.83 10.43 -1.26 -4.89 116.55 125.68 2a1s n ASP 63 Ca 0.19 0.02 -0.33 0.00 2.57 0.00 0.00 54.79 57.24 2a1s n ASP 63 Cb 0.49 0.39 -0.03 0.00 1.84 0.00 0.00 41.12 43.81 2a1s n ASP 63 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 2a1s s PHE 64 N -3.18 3.21 -0.12 1.24 0.40 -1.23 -1.74 117.98 116.56 2a1s s PHE 64 Ca 0.05 1.52 -0.12 0.00 -0.60 0.00 0.00 56.93 57.78 2a1s s PHE 64 Cb 0.14 -2.91 -0.05 0.00 0.51 0.00 0.00 43.02 40.71 2a1s s PHE 64 CO 0.75 -0.64 0.27 -1.17 0.70 0.00 0.00 175.22 175.13 2a1s s LEU 65 N -3.99 4.33 -0.33 -0.37 2.96 -1.26 -4.89 118.68 115.13 2a1s s LEU 65 Ca 0.62 0.58 -0.26 0.00 -0.22 0.00 0.00 54.13 54.85 2a1s s LEU 65 Cb -0.13 -2.33 0.01 0.00 0.50 0.00 0.00 46.19 44.24 2a1s s LEU 65 CO 0.29 0.23 0.92 -0.22 -1.32 0.00 0.00 176.35 176.25 2a1s s LEU 66 N -0.23 4.01 0.00 -0.68 0.20 -1.26 -0.43 118.68 120.29 2a1s s LEU 66 Ca 0.17 0.77 0.00 0.00 0.69 0.00 0.00 54.13 55.77 2a1s s LEU 66 Cb -0.13 -3.29 0.00 0.00 -0.43 0.00 0.00 46.19 42.34 2a1s s LEU 66 CO 0.06 -0.77 0.71 2.22 -0.29 0.00 0.00 176.35 178.28 2a1s n PHE 67 N 6.58 0.00 -3.70 5.38 1.16 -0.26 -4.81 117.46 121.82 2a1s n PHE 67 Ca 0.07 -0.25 -0.16 0.00 -1.87 0.00 0.00 57.45 55.24 2a1s n PHE 67 Cb 0.48 -0.02 -0.16 0.00 -1.61 0.00 0.00 39.48 38.16 2a1s n PHE 67 CO 0.00 0.00 0.00 -1.14 -1.87 0.00 0.00 176.76 173.75 2a1s s GLN 68 N -0.50 0.02 -0.22 3.97 0.74 -1.21 -2.02 119.66 120.44 2a1s s GLN 68 Ca 0.00 0.46 -0.08 0.00 0.05 0.00 0.00 55.36 55.79 2a1s s GLN 68 Cb 0.00 -0.29 -0.04 0.00 1.10 0.00 0.00 33.01 33.79 2a1s s GLN 68 CO 0.00 -0.27 0.08 0.12 -0.55 0.00 0.00 175.29 174.67 2a1s s PHE 69 N 1.90 3.16 -0.35 1.67 5.36 0.85 -1.24 117.98 129.34 2a1s s PHE 69 Ca -0.01 -0.16 -0.11 0.00 -0.96 0.00 0.00 56.93 55.70 2a1s s PHE 69 Cb -0.12 -2.18 0.01 0.00 -0.34 0.00 0.00 43.02 40.39 2a1s s PHE 69 CO -0.05 -0.12 0.20 0.20 -1.46 0.00 0.00 175.22 174.00 2a1s s GLY 70 N 1.08 1.92 -0.20 13.12 0.00 0.59 -0.68 107.32 123.15 2a1s s GLY 70 Ca 0.04 -1.54 -0.02 0.00 0.00 0.00 0.00 44.72 43.20 2a1s s GLY 70 CO 0.03 0.79 -0.10 -2.27 0.00 0.00 0.00 173.10 171.55 2a1s s LEU 71 N 1.62 2.65 -0.12 0.66 2.96 -0.02 -1.81 118.68 124.61 2a1s s LEU 71 Ca 0.04 -0.47 0.02 0.00 -0.22 0.00 0.00 54.13 53.50 2a1s s LEU 71 Cb -0.18 -1.65 0.01 0.00 0.50 0.00 0.00 46.19 44.87 2a1s s LEU 71 CO 0.08 -0.00 -0.18 0.00 -1.32 0.00 0.00 176.35 174.93 2a1s s THR 73 N 0.97 5.42 -0.09 0.00 2.01 0.10 -1.15 115.64 122.91 2a1s s THR 73 Ca -0.06 0.31 0.02 0.00 0.31 0.00 0.00 61.69 62.27 2a1s s THR 73 Cb -0.15 -3.46 0.02 0.00 0.01 0.00 0.00 72.50 68.92 2a1s s THR 73 CO -0.03 0.59 -0.13 -0.36 -0.69 0.00 0.00 174.62 174.01 2a1s s PHE 74 N -0.88 1.69 -0.19 4.92 0.40 -0.81 -1.92 117.98 121.19 2a1s s PHE 74 Ca 0.16 -0.74 -0.03 0.00 -0.60 0.00 0.00 56.93 55.72 2a1s s PHE 74 Cb -0.13 -1.25 0.06 0.00 0.51 0.00 0.00 43.02 42.21 2a1s s PHE 74 CO 0.05 -0.40 0.05 0.21 0.70 0.00 0.00 175.22 175.82 2a1s s LYS 75 N 0.98 0.52 0.30 0.44 2.20 -0.44 -0.35 119.74 123.39 2a1s s LYS 75 Ca -0.08 -0.35 -0.29 0.00 -0.36 0.00 0.00 55.97 54.89 2a1s s LYS 75 Cb -0.15 -2.05 -0.11 0.00 -1.51 0.00 0.00 37.83 34.02 2a1s s LYS 75 CO -0.00 -0.65 1.45 -0.47 -0.36 0.00 0.00 175.35 175.31 2a1s s TYR 76 N 1.92 2.88 -0.37 4.03 5.04 -1.26 -0.79 117.35 128.81 2a1s s TYR 76 Ca -0.00 1.10 -0.03 0.00 -2.44 0.00 0.00 57.07 55.70 2a1s s TYR 76 Cb -0.17 -3.88 0.08 0.00 0.35 0.00 0.00 41.96 38.35 2a1s s TYR 76 CO -0.08 -2.71 0.13 0.34 -1.34 0.00 0.00 175.55 171.89 2a1s s ASP 77 N 0.08 5.16 0.60 4.32 -1.08 0.03 -4.92 116.67 120.86 2a1s s ASP 77 Ca 0.56 -1.68 0.38 0.00 -0.52 0.00 0.00 52.55 51.29 2a1s s ASP 77 Cb -0.43 -1.80 1.81 0.00 -1.46 0.00 0.00 42.92 41.04 2a1s s ASP 77 CO 0.51 -0.43 2.15 1.88 0.52 0.00 0.00 175.17 179.80 2a1s h TYR 78 N 8.06 0.00 -0.05 -5.34 -1.99 -1.95 -0.89 116.97 114.82 2a1s h TYR 78 Ca -0.17 0.00 -0.06 0.00 2.00 0.00 0.00 58.73 60.50 2a1s h TYR 78 Cb 1.06 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.79 2a1s h TYR 78 CO 0.58 0.01 -0.19 1.79 -0.00 0.00 0.00 178.16 180.35 2a1s h THR 79 N 0.00 1.46 -0.01 -2.88 1.35 -1.95 -3.29 112.91 107.59 2a1s h THR 79 Ca -0.00 -1.64 0.00 0.00 -0.55 0.00 0.00 66.41 64.22 2a1s h THR 79 Cb 0.29 2.40 0.00 0.00 -1.73 0.00 0.00 68.15 69.11 2a1s h THR 79 CO 0.00 0.45 -0.21 0.47 -0.25 0.00 0.00 175.52 175.98 2a1s n ASP 80 N -4.56 1.30 -3.49 5.36 9.92 -1.18 -4.95 116.55 118.94 2a1s n ASP 80 Ca -0.08 -1.12 -0.25 0.00 -0.53 0.00 0.00 54.79 52.80 2a1s n ASP 80 Cb 0.43 0.13 0.00 0.00 -0.64 0.00 0.00 41.12 41.05 2a1s n ASP 80 CO 0.00 0.00 0.00 -0.24 0.13 0.00 0.00 177.20 177.09 2a1s n SER 81 N -0.34 -4.10 -4.22 -2.24 2.88 -0.36 -4.98 113.62 100.26 2a1s n SER 81 Ca 0.13 -0.50 -0.24 0.00 -1.33 0.00 0.00 58.87 56.94 2a1s n SER 81 Cb 0.37 -3.36 -0.14 0.00 -0.75 0.00 0.00 64.21 60.33 2a1s n SER 81 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 2a1s s LYS 82 N -6.16 1.23 0.37 -1.46 -2.85 -1.09 -4.74 119.74 105.04 2a1s s LYS 82 Ca 0.46 -0.90 -0.25 0.00 -1.00 0.00 0.00 55.97 54.28 2a1s s LYS 82 Cb -0.24 -1.33 -0.09 0.00 -2.06 0.00 0.00 37.83 34.11 2a1s s LYS 82 CO 0.57 0.33 1.05 0.71 0.10 0.00 0.00 175.35 178.12 2a1s s TYR 83 N -0.84 3.35 -0.07 1.78 1.51 -0.96 -0.79 117.35 121.32 2a1s s TYR 83 Ca 0.06 1.66 0.02 0.00 -1.01 0.00 0.00 57.07 57.80 2a1s s TYR 83 Cb -0.09 -3.15 -0.02 0.00 -0.11 0.00 0.00 41.96 38.59 2a1s s TYR 83 CO 0.02 -0.58 -0.13 0.42 -1.11 0.00 0.00 175.55 174.16 2a1s s ILE 84 N -1.56 3.11 0.21 2.71 1.01 0.03 -1.68 121.20 125.04 2a1s s ILE 84 Ca 0.55 -0.69 0.11 0.00 0.00 0.00 0.00 60.65 60.62 2a1s s ILE 84 Cb -0.24 -2.24 -0.05 0.00 0.01 0.00 0.00 42.46 39.94 2a1s s ILE 84 CO 0.30 0.57 -0.20 0.42 0.00 0.00 0.00 174.94 176.03 2a1s s THR 85 N -0.45 2.54 -0.15 2.92 -4.23 0.66 -1.33 115.64 115.60 2a1s s THR 85 Ca 0.06 -2.06 -0.04 0.00 -1.18 0.00 0.00 61.69 58.47 2a1s s THR 85 Cb -0.12 -2.26 0.07 0.00 1.34 0.00 0.00 72.50 71.53 2a1s s THR 85 CO 0.02 -0.19 0.18 -0.54 -0.54 0.00 0.00 174.62 173.55 2a1s s LYS 86 N -2.93 0.11 -0.08 3.99 1.02 -0.81 -1.61 119.74 119.44 2a1s s LYS 86 Ca 0.24 0.29 0.05 0.00 0.02 0.00 0.00 55.97 56.56 2a1s s LYS 86 Cb -0.07 -0.98 -0.01 0.00 -0.52 0.00 0.00 37.83 36.25 2a1s s LYS 86 CO 0.12 -0.53 -0.23 -1.54 -0.92 0.00 0.00 175.35 172.25 2a1s s SER 87 N 2.28 3.19 0.10 2.83 1.04 -1.26 0.03 113.70 121.92 2a1s s SER 87 Ca 0.05 -0.50 0.10 0.00 0.48 0.00 0.00 55.95 56.08 2a1s s SER 87 Cb -0.14 -1.08 -0.04 0.00 0.10 0.00 0.00 66.02 64.86 2a1s s SER 87 CO -0.09 0.22 -0.26 -0.36 0.98 0.00 0.00 173.24 173.72 2a1s s PHE 88 N 0.01 2.24 -0.27 5.02 0.40 0.13 0.19 117.98 125.71 2a1s s PHE 88 Ca -0.08 -0.39 -0.00 0.00 -0.60 0.00 0.00 56.93 55.85 2a1s s PHE 88 Cb -0.15 -1.25 0.04 0.00 0.51 0.00 0.00 43.02 42.17 2a1s s PHE 88 CO 0.05 0.26 -0.06 -0.80 0.70 0.00 0.00 175.22 175.38 2a1s s ASN 89 N -1.80 4.51 -0.08 1.36 0.02 -0.13 -0.84 114.94 117.98 2a1s s ASN 89 Ca 0.12 -1.15 -0.11 0.00 -1.02 0.00 0.00 52.86 50.70 2a1s s ASN 89 Cb -0.10 -1.64 -0.05 0.00 0.02 0.00 0.00 41.25 39.48 2a1s s ASN 89 CO 0.05 -0.19 0.27 -0.36 0.02 0.00 0.00 177.10 176.89 2a1s s PHE 90 N 1.24 3.62 -0.23 2.20 0.40 0.15 -1.16 117.98 124.20 2a1s s PHE 90 Ca -0.04 0.71 -0.05 0.00 -0.60 0.00 0.00 56.93 56.95 2a1s s PHE 90 Cb -0.18 -2.15 -0.02 0.00 0.51 0.00 0.00 43.02 41.18 2a1s s PHE 90 CO -0.04 0.61 0.01 0.71 0.70 0.00 0.00 175.22 177.21 2a1s s TYR 91 N -0.76 3.01 -0.05 0.36 1.51 -0.84 -0.11 117.35 120.48 2a1s s TYR 91 Ca 0.18 -0.70 0.04 0.00 -1.01 0.00 0.00 57.07 55.59 2a1s s TYR 91 Cb -0.14 -2.16 -0.00 0.00 -0.11 0.00 0.00 41.96 39.55 2a1s s TYR 91 CO 0.07 -0.45 -0.17 0.14 -1.11 0.00 0.00 175.55 174.03 2a1s s VAL 92 N 1.51 1.41 -0.11 0.71 -7.23 -0.86 0.05 120.40 115.89 2a1s s VAL 92 Ca 0.06 -0.70 -0.05 0.00 -1.81 0.00 0.00 61.98 59.48 2a1s s VAL 92 Cb -0.15 -1.22 0.05 0.00 0.56 0.00 0.00 36.38 35.62 2a1s s VAL 92 CO -0.00 0.41 0.25 0.12 -0.31 0.00 0.00 175.10 175.57 2a1s s PHE 93 N 0.13 -0.33 -0.57 2.82 5.36 -0.76 -4.42 117.98 120.20 2a1s s PHE 93 Ca -0.06 0.79 -0.26 0.00 -0.96 0.00 0.00 56.93 56.44 2a1s s PHE 93 Cb -0.12 0.05 -0.04 0.00 -0.34 0.00 0.00 43.02 42.57 2a1s s PHE 93 CO 0.03 -0.23 2.07 -1.25 -1.46 0.00 0.00 175.22 174.37 2a1s s PRO 94 N 1.21 2.42 0.01 10.12 0.04 -1.26 -4.08 135.00 143.45 2a1s s PRO 94 Ca -0.09 0.89 -0.18 0.00 0.04 0.00 0.00 61.00 61.66 2a1s s PRO 94 Cb -0.10 -4.47 -0.06 0.00 0.04 0.00 0.00 34.50 29.91 2a1s s PRO 94 CO -0.08 -2.96 0.51 0.21 0.04 0.00 0.00 177.00 174.71 2a1s s LYS 95 N 7.51 4.15 0.09 4.56 2.20 -1.26 -4.90 119.74 132.09 2a1s s LYS 95 Ca 0.79 0.59 -0.31 0.00 -0.36 0.00 0.00 55.97 56.67 2a1s s LYS 95 Cb -0.14 -3.28 -0.07 0.00 -1.51 0.00 0.00 37.83 32.83 2a1s s LYS 95 CO 0.22 0.54 1.39 -1.25 -0.36 0.00 0.00 175.35 175.89 2a1s s PRO 96 N -0.69 4.32 0.21 4.03 0.04 -1.26 -4.84 135.00 136.81 2a1s s PRO 96 Ca 0.27 2.04 -0.09 0.00 0.04 0.00 0.00 61.00 63.27 2a1s s PRO 96 Cb -0.18 -3.33 0.17 0.00 0.04 0.00 0.00 34.50 31.21 2a1s s PRO 96 CO 0.16 -0.46 1.83 0.35 0.04 0.00 0.00 177.00 178.91 2a1s h PHE 97 N 7.04 1.12 -3.90 0.56 3.57 -1.93 -3.47 116.94 119.93 2a1s h PHE 97 Ca -0.41 -0.03 -0.11 0.00 3.53 0.00 0.00 57.97 60.95 2a1s h PHE 97 Cb 1.20 -0.36 -0.12 0.00 2.79 0.00 0.00 35.95 39.47 2a1s h PHE 97 CO 0.68 0.79 -0.31 1.21 -2.23 0.00 0.00 178.31 178.46 2a1s s ASN 98 N -6.16 0.02 0.00 0.41 2.47 -1.26 -5.03 114.94 105.39 2a1s s ASN 98 Ca -0.13 -0.92 0.03 0.00 0.42 0.00 0.00 52.86 52.26 2a1s s ASN 98 Cb 0.16 0.46 0.21 0.00 -1.45 0.00 0.00 41.25 40.62 2a1s s ASN 98 CO 0.81 -0.94 0.55 -1.14 -3.72 0.00 0.00 177.10 172.67 2a1s n ARG 99 N -0.25 0.25 -0.62 0.43 3.00 -1.26 -2.10 116.66 116.11 2a1s n ARG 99 Ca -0.05 0.00 0.05 0.00 -0.00 0.00 0.00 57.85 57.84 2a1s n ARG 99 Cb 0.63 -1.22 0.08 0.00 0.00 0.00 0.00 32.46 31.95 2a1s n ARG 99 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 2a1s n SER 100 N -0.72 1.17 -4.89 6.15 3.41 -1.26 -5.07 113.62 112.42 2a1s n SER 100 Ca 0.03 -2.65 -0.31 0.00 -0.26 0.00 0.00 58.87 55.68 2a1s n SER 100 Cb 0.01 -0.34 -0.05 0.00 -0.26 0.00 0.00 64.21 63.57 2a1s n SER 100 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2a1s s SER 101 N -2.14 6.55 0.24 4.04 0.01 -0.89 -5.02 113.70 116.49 2a1s s SER 101 Ca 0.23 0.79 -0.31 0.00 1.31 0.00 0.00 55.95 57.97 2a1s s SER 101 Cb 0.23 -2.17 -0.12 0.00 0.21 0.00 0.00 66.02 64.16 2a1s s SER 101 CO -0.04 -0.07 1.58 -0.81 0.41 0.00 0.00 173.24 174.31 2a1s n PRO 102 N -0.26 2.48 -3.01 12.44 -0.04 -1.26 -4.92 135.00 140.42 2a1s n PRO 102 Ca -0.01 0.89 -0.44 0.00 -0.04 0.00 0.00 63.50 63.90 2a1s n PRO 102 Cb 0.53 -2.65 -0.05 0.00 -0.04 0.00 0.00 33.50 31.28 2a1s n PRO 102 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2a1s s ASP 103 N 0.68 6.24 0.29 3.54 3.68 -1.26 -4.82 116.67 125.00 2a1s s ASP 103 Ca 0.70 -0.88 -0.29 0.00 2.13 0.00 0.00 52.55 54.21 2a1s s ASP 103 Cb -0.56 -2.35 -0.10 0.00 -1.45 0.00 0.00 42.92 38.46 2a1s s ASP 103 CO 0.43 -1.12 1.27 -0.69 0.13 0.00 0.00 175.17 175.20 2a1s s VAL 104 N 3.24 2.98 -0.16 1.11 1.01 -1.26 -5.02 120.40 122.30 2a1s s VAL 104 Ca 0.20 0.93 0.00 0.00 0.00 0.00 0.00 61.98 63.11 2a1s s VAL 104 Cb -0.18 -3.59 -0.00 0.00 0.00 0.00 0.00 36.38 32.61 2a1s s VAL 104 CO 0.12 0.20 -0.15 -0.54 0.00 0.00 0.00 175.10 174.73 2a1s s LYS 105 N -1.25 3.23 0.10 2.72 3.01 -1.26 -5.13 119.74 121.16 2a1s s LYS 105 Ca 0.50 -0.74 0.05 0.00 -1.01 0.00 0.00 55.97 54.78 2a1s s LYS 105 Cb -0.38 -2.64 -0.03 0.00 -1.01 0.00 0.00 37.83 33.77 2a1s s LYS 105 CO 0.47 0.02 -0.14 -0.59 0.51 0.00 0.00 175.35 175.62 2a1s s PHE 106 N 0.82 1.31 0.16 3.18 -0.12 -1.26 -5.01 117.98 117.04 2a1s s PHE 106 Ca -0.05 -0.52 -0.19 0.00 -0.05 0.00 0.00 56.93 56.11 2a1s s PHE 106 Cb -0.15 -0.71 -0.08 0.00 -0.63 0.00 0.00 43.02 41.46 2a1s s PHE 106 CO -0.00 0.10 0.65 0.08 -0.05 0.00 0.00 175.22 176.00 2a1s s VAL 107 N -1.80 4.65 -0.00 -2.49 1.01 -0.71 -4.99 120.40 116.07 2a1s s VAL 107 Ca 0.04 1.23 0.07 0.00 0.00 0.00 0.00 61.98 63.32 2a1s s VAL 107 Cb -0.07 -3.88 -0.02 0.00 0.00 0.00 0.00 36.38 32.41 2a1s s VAL 107 CO 0.02 0.35 -0.23 0.00 0.00 0.00 0.00 175.10 175.24 2a1s s GLN 109 N -0.72 3.27 0.25 0.00 0.74 0.26 -4.93 119.66 118.53 2a1s s GLN 109 Ca 0.09 -0.70 -0.04 0.00 0.05 0.00 0.00 55.36 54.76 2a1s s GLN 109 Cb -0.09 -3.08 0.47 0.00 1.10 0.00 0.00 33.01 31.41 2a1s s GLN 109 CO -0.00 -0.26 1.71 0.77 -0.55 0.00 0.00 175.29 176.95 2a1s h SER 110 N 8.12 0.16 0.34 6.67 0.02 -1.99 -0.39 113.55 126.48 2a1s h SER 110 Ca -0.39 0.13 -0.09 0.00 -0.84 0.00 0.00 61.79 60.60 2a1s h SER 110 Cb 1.15 0.14 -0.01 0.00 0.14 0.00 0.00 62.40 63.81 2a1s h SER 110 CO 0.60 0.04 -0.38 0.77 -1.14 0.00 0.00 176.83 176.71 2a1s h SER 111 N 0.36 0.07 -0.19 3.07 4.64 -1.95 -0.11 113.55 119.44 2a1s h SER 111 Ca 0.42 -0.03 -0.20 0.00 -0.47 0.00 0.00 61.79 61.51 2a1s h SER 111 Cb 0.68 -0.02 0.01 0.00 -0.31 0.00 0.00 62.40 62.75 2a1s h SER 111 CO -0.45 0.45 -0.66 0.28 -0.87 0.00 0.00 176.83 175.58 2a1s h SER 112 N 0.06 0.92 -0.28 4.97 0.02 -1.44 -2.48 113.55 115.32 2a1s h SER 112 Ca 0.00 -0.60 -0.07 0.00 -0.84 0.00 0.00 61.79 60.29 2a1s h SER 112 Cb 0.71 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.96 2a1s h SER 112 CO 0.05 1.36 -0.03 0.40 -1.14 0.00 0.00 176.83 177.47 2a1s h ILE 113 N 0.53 1.23 0.00 3.27 1.08 -0.66 -2.40 117.51 120.55 2a1s h ILE 113 Ca -0.03 -0.94 -0.20 0.00 -0.39 0.00 0.00 64.86 63.30 2a1s h ILE 113 Cb 1.29 0.97 -0.03 0.00 -3.07 0.00 0.00 36.82 35.98 2a1s h ILE 113 CO 0.14 0.32 -0.94 -0.78 -0.69 0.00 0.00 178.15 176.21 2a1s h ASP 114 N 0.60 0.00 0.23 1.72 3.58 -1.04 -2.04 116.42 119.47 2a1s h ASP 114 Ca 0.12 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.56 2a1s h ASP 114 Cb 0.43 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.48 2a1s h ASP 114 CO 0.02 0.94 -0.11 0.15 -2.88 0.00 0.00 179.24 177.35 2a1s h PHE 115 N 0.00 -0.29 -0.78 0.28 3.57 -1.17 -2.50 116.94 116.05 2a1s h PHE 115 Ca -0.01 -0.01 0.18 0.00 3.53 0.00 0.00 57.97 61.66 2a1s h PHE 115 Cb 1.66 0.10 -0.14 0.00 2.79 0.00 0.00 35.95 40.35 2a1s h PHE 115 CO 0.00 0.09 -0.03 -0.07 -2.23 0.00 0.00 178.31 176.07 2a1s h LEU 116 N -0.86 -0.44 -0.60 0.59 3.38 -1.50 -1.28 115.31 114.61 2a1s h LEU 116 Ca -0.03 0.21 0.12 0.00 0.09 0.00 0.00 57.88 58.27 2a1s h LEU 116 Cb 0.51 0.39 -0.10 0.00 0.09 0.00 0.00 40.66 41.54 2a1s h LEU 116 CO 0.05 -0.21 -0.01 0.00 0.09 0.00 0.00 178.44 178.36 2a1s h ALA 117 N 1.75 0.57 0.00 1.53 0.00 -1.37 -0.51 119.26 121.23 2a1s h ALA 117 Ca 0.42 0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.52 2a1s h ALA 117 Cb 0.74 0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.86 2a1s h ALA 117 CO -0.72 -0.40 0.00 0.66 0.00 0.00 0.00 179.25 178.80 2a1s h SER 118 N 0.10 0.00 -0.37 0.00 4.64 -0.76 -2.37 113.55 114.80 2a1s h SER 118 Ca 0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 2a1s h SER 118 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 2a1s h SER 118 CO -0.53 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.43 2a1s n GLN 119 N -2.63 3.06 -1.00 4.77 1.13 -0.76 -4.97 117.38 116.98 2a1s n GLN 119 Ca 0.00 -2.51 -0.00 0.00 -1.94 0.00 0.00 57.00 52.55 2a1s n GLN 119 Cb 0.19 -1.61 -0.00 0.00 0.11 0.00 0.00 30.24 28.93 2a1s n GLN 119 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2a1s n GLY 120 N 0.22 0.48 3.61 1.08 0.00 -0.89 -4.56 105.19 105.14 2a1s n GLY 120 Ca 0.18 -0.11 -0.52 0.00 0.00 0.00 0.00 46.02 45.58 2a1s n GLY 120 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2a1s n PHE 121 N -2.98 1.67 -3.21 1.61 7.35 -0.27 -4.90 117.46 116.73 2a1s n PHE 121 Ca -0.00 0.57 -0.45 0.00 -0.76 0.00 0.00 57.45 56.81 2a1s n PHE 121 Cb 0.01 -2.38 -0.04 0.00 0.35 0.00 0.00 39.48 37.42 2a1s n PHE 121 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 2a1s s ASP 122 N 0.91 6.25 0.48 -2.13 -1.08 -1.26 -4.69 116.67 115.15 2a1s s ASP 122 Ca 0.85 -1.71 0.20 0.00 -0.52 0.00 0.00 52.55 51.37 2a1s s ASP 122 Cb -0.93 -2.26 1.21 0.00 -1.46 0.00 0.00 42.92 39.48 2a1s s ASP 122 CO 0.48 -0.96 2.03 -0.26 0.52 0.00 0.00 175.17 176.98 2a1s h PHE 123 N 8.93 0.00 -0.38 -5.34 -1.00 -1.99 -1.57 116.94 115.58 2a1s h PHE 123 Ca -0.25 0.00 0.08 0.00 2.81 0.00 0.00 57.97 60.61 2a1s h PHE 123 Cb 1.09 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.63 2a1s h PHE 123 CO 0.82 0.15 0.26 -0.91 -1.61 0.00 0.00 178.31 177.03 2a1s h ASN 124 N 0.00 0.15 -0.48 2.17 2.35 -1.96 0.14 115.58 117.95 2a1s h ASN 124 Ca -0.00 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.63 2a1s h ASN 124 Cb 0.31 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.64 2a1s h ASN 124 CO 0.02 0.09 -0.18 0.11 -1.65 0.00 0.00 177.43 175.82 2a1s h LYS 125 N 0.17 0.99 0.36 0.81 1.57 -1.63 0.10 116.57 118.94 2a1s h LYS 125 Ca 0.18 -0.40 -0.02 0.00 -1.87 0.00 0.00 60.65 58.54 2a1s h LYS 125 Cb 0.48 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.75 2a1s h LYS 125 CO -0.03 1.08 -0.17 0.28 -0.57 0.00 0.00 179.45 180.04 2a1s h VAL 126 N 0.86 0.32 0.00 0.50 2.07 -1.52 -1.78 116.25 116.70 2a1s h VAL 126 Ca 0.12 -0.71 -0.06 0.00 0.82 0.00 0.00 66.70 66.87 2a1s h VAL 126 Cb 0.75 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 2a1s h VAL 126 CO 0.06 0.07 -1.03 -0.26 0.02 0.00 0.00 177.57 176.43 2a1s h PHE 127 N -1.03 0.00 0.00 1.57 0.05 -0.73 -2.92 116.94 113.88 2a1s h PHE 127 Ca -0.05 0.00 -0.29 0.00 3.82 0.00 0.00 57.97 61.45 2a1s h PHE 127 Cb 0.49 0.00 -0.05 0.00 2.00 0.00 0.00 35.95 38.39 2a1s h PHE 127 CO 0.03 0.22 -2.08 -2.13 -0.18 0.00 0.00 178.31 174.16 2a1s n ARG 128 N -2.81 1.20 -2.68 1.51 0.63 0.27 -4.78 116.66 110.00 2a1s n ARG 128 Ca -0.03 0.03 -0.08 0.00 -0.92 0.00 0.00 57.85 56.85 2a1s n ARG 128 Cb 0.65 -1.40 0.05 0.00 0.45 0.00 0.00 32.46 32.21 2a1s n ARG 128 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 2a1s n ASN 129 N -2.72 0.79 -4.87 6.15 4.05 -0.74 -5.03 115.26 112.91 2a1s n ASN 129 Ca -0.28 -2.61 -0.31 0.00 0.45 0.00 0.00 54.58 51.83 2a1s n ASN 129 Cb 0.97 -0.23 -0.02 0.00 1.23 0.00 0.00 39.78 41.73 2a1s n ASN 129 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 177.26 173.38 2a1s s GLY 130 N -2.78 1.87 -0.01 8.20 0.00 -0.67 -2.17 107.32 111.75 2a1s s GLY 130 Ca 0.26 -0.08 -0.30 0.00 0.00 0.00 0.00 44.72 44.60 2a1s s GLY 130 CO 0.01 0.16 1.17 -0.42 0.00 0.00 0.00 173.10 174.02 2a1s s ILE 131 N -2.68 4.26 0.86 0.90 1.01 0.11 -4.27 121.20 121.39 2a1s s ILE 131 Ca 0.54 1.60 -0.12 0.00 0.00 0.00 0.00 60.65 62.68 2a1s s ILE 131 Cb -0.10 -4.03 0.11 0.00 0.01 0.00 0.00 42.46 38.44 2a1s s ILE 131 CO 0.38 0.05 1.12 -2.16 0.00 0.00 0.00 174.94 174.34 2a1s s PRO 132 N 1.70 1.57 0.02 2.79 0.04 -1.26 -1.84 135.00 138.02 2a1s s PRO 132 Ca 0.56 0.41 -0.22 0.00 0.04 0.00 0.00 61.00 61.79 2a1s s PRO 132 Cb -0.26 -1.88 0.05 0.00 0.04 0.00 0.00 34.50 32.45 2a1s s PRO 132 CO 0.25 -1.93 0.51 1.52 0.04 0.00 0.00 177.00 177.38 2a1s s TYR 133 N -3.25 -0.41 0.04 0.56 -0.85 -1.20 -1.55 117.35 110.68 2a1s s TYR 133 Ca 0.62 0.52 0.05 0.00 -0.52 0.00 0.00 57.07 57.74 2a1s s TYR 133 Cb -0.14 0.31 -0.02 0.00 0.38 0.00 0.00 41.96 42.48 2a1s s TYR 133 CO 0.53 -0.60 -0.13 -0.51 -1.52 0.00 0.00 175.55 173.32 2a1s s LEU 134 N -1.77 2.19 0.44 -3.49 1.43 -1.13 -4.83 118.68 111.53 2a1s s LEU 134 Ca -0.07 -0.48 -0.04 0.00 -1.03 0.00 0.00 54.13 52.50 2a1s s LEU 134 Cb -0.01 -0.54 -0.04 0.00 0.03 0.00 0.00 46.19 45.63 2a1s s LEU 134 CO 0.01 -0.01 0.73 0.54 0.23 0.00 0.00 176.35 177.85 2a1s s ASN 135 N -1.25 6.29 0.12 2.29 2.20 -1.26 -4.73 114.94 118.60 2a1s s ASN 135 Ca -0.00 0.83 -0.24 0.00 -0.94 0.00 0.00 52.86 52.51 2a1s s ASN 135 Cb -0.08 -2.20 -0.05 0.00 -2.00 0.00 0.00 41.25 36.91 2a1s s ASN 135 CO 0.01 -0.49 1.23 0.00 -2.94 0.00 0.00 177.10 174.91 2a1s n GLN 136 N -2.04 -0.34 0.17 3.55 3.00 -0.35 -0.75 117.38 120.61 2a1s n GLN 136 Ca -0.01 1.20 0.03 0.00 -0.01 0.00 0.00 57.00 58.22 2a1s n GLN 136 Cb 0.55 -1.77 0.28 0.00 0.00 0.00 0.00 30.24 29.29 2a1s n GLN 136 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.06 177.99 2a1s h GLU 137 N 0.00 0.00 -0.09 -1.09 4.39 -1.95 -1.41 114.58 114.43 2a1s h GLU 137 Ca 0.12 0.00 -0.20 0.00 0.34 0.00 0.00 59.36 59.63 2a1s h GLU 137 Cb 0.32 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.96 2a1s h GLU 137 CO -0.72 0.47 -0.76 1.49 -1.16 0.00 0.00 179.01 178.33 2a1s h GLU 138 N 0.00 0.51 -0.24 2.33 4.81 -1.78 -2.60 114.58 117.61 2a1s h GLU 138 Ca -0.00 -0.43 -0.01 0.00 -0.13 0.00 0.00 59.36 58.79 2a1s h GLU 138 Cb 0.96 0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.42 2a1s h GLU 138 CO 0.06 1.06 0.12 1.49 -0.73 0.00 0.00 179.01 181.01 2a1s h GLU 139 N 0.34 0.34 0.09 1.92 4.81 -0.56 -2.05 114.58 119.47 2a1s h GLU 139 Ca -0.04 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.14 2a1s h GLU 139 Cb 1.35 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 30.67 2a1s h GLU 139 CO 0.14 0.33 -0.06 -0.09 -0.73 0.00 0.00 179.01 178.60 2a1s h ARG 140 N 0.26 -0.14 0.00 1.92 2.43 -1.30 -0.72 114.38 116.83 2a1s h ARG 140 Ca 0.08 0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.24 2a1s h ARG 140 Cb 0.09 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.67 2a1s h ARG 140 CO -0.01 -0.09 -0.13 0.37 -1.51 0.00 0.00 179.97 178.60 2a1s h GLN 141 N -0.15 0.00 0.24 0.20 4.15 -1.43 -1.47 115.11 116.65 2a1s h GLN 141 Ca -0.01 0.00 -0.33 0.00 0.77 0.00 0.00 58.65 59.09 2a1s h GLN 141 Cb 0.13 0.00 0.04 0.00 0.21 0.00 0.00 27.48 27.85 2a1s h GLN 141 CO 0.00 0.13 -1.43 1.25 -1.93 0.00 0.00 178.83 176.85 2a1s h LEU 142 N 0.00 0.85 -0.48 -2.39 5.85 -0.89 -2.99 115.31 115.25 2a1s h LEU 142 Ca -0.00 -0.91 -0.16 0.00 0.84 0.00 0.00 57.88 57.65 2a1s h LEU 142 Cb 0.27 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 2a1s h LEU 142 CO 0.02 1.69 -0.50 0.03 -0.34 0.00 0.00 178.44 179.34 2a1s h ARG 143 N 0.14 0.68 0.00 1.25 3.08 -0.64 -2.79 114.38 116.11 2a1s h ARG 143 Ca -0.25 -0.40 -0.09 0.00 0.07 0.00 0.00 59.98 59.31 2a1s h ARG 143 Cb 2.12 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 32.19 2a1s h ARG 143 CO 0.27 1.02 -0.43 0.93 -1.07 0.00 0.00 179.97 180.69 2a1s h GLU 144 N 0.53 0.00 0.00 0.04 5.08 -1.41 -2.24 114.58 116.58 2a1s h GLU 144 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2a1s h GLU 144 Cb 1.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.31 2a1s h GLU 144 CO 0.10 0.43 0.00 0.37 -1.00 0.00 0.00 179.01 178.91 2a1s h GLN 145 N 0.00 0.00 -2.29 2.33 4.15 -1.34 -3.31 115.11 114.65 2a1s h GLN 145 Ca -0.00 0.00 -0.73 0.00 0.77 0.00 0.00 58.65 58.68 2a1s h GLN 145 Cb 0.94 0.00 -0.21 0.00 0.21 0.00 0.00 27.48 28.42 2a1s h GLN 145 CO 0.06 0.00 1.39 0.66 -1.93 0.00 0.00 178.83 179.01 2a1s n TYR 146 N -3.08 2.56 -3.36 3.99 4.02 -0.84 -5.09 117.16 115.35 2a1s n TYR 146 Ca 0.02 -2.51 -0.16 0.00 -0.01 0.00 0.00 57.90 55.23 2a1s n TYR 146 Cb 0.37 -1.43 -0.08 0.00 -0.02 0.00 0.00 39.34 38.17 2a1s n TYR 146 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2a1s s ASP 147 N -0.47 1.21 -0.19 7.72 1.01 -1.25 -5.02 116.67 119.68 2a1s s ASP 147 Ca 0.49 -1.29 -0.10 0.00 0.71 0.00 0.00 52.55 52.36 2a1s s ASP 147 Cb 0.26 0.60 0.06 0.00 1.01 0.00 0.00 42.92 44.85 2a1s s ASP 147 CO -0.18 -0.30 0.45 -0.63 0.21 0.00 0.00 175.17 174.72 2a1s s ILE 173 N 1.74 -0.02 0.35 0.77 1.01 -1.26 -5.13 121.20 118.66 2a1s s ILE 173 Ca 0.15 0.08 -0.24 0.00 0.00 0.00 0.00 60.65 60.64 2a1s s ILE 173 Cb -0.15 -0.67 -0.10 0.00 0.01 0.00 0.00 42.46 41.56 2a1s s ILE 173 CO -0.13 0.03 0.93 -2.16 0.00 0.00 0.00 174.94 173.61 2a1s s PRO 174 N 1.43 4.42 0.36 2.79 0.04 -1.26 -4.86 135.00 137.93 2a1s s PRO 174 Ca -0.10 1.21 0.13 0.00 0.04 0.00 0.00 61.00 62.28 2a1s s PRO 174 Cb -0.08 -2.58 0.95 0.00 0.04 0.00 0.00 34.50 32.83 2a1s s PRO 174 CO -0.14 0.18 1.79 1.49 0.04 0.00 0.00 177.00 180.36 2a1s h GLU 175 N 2.72 0.53 0.00 4.56 4.57 -2.08 -0.21 114.58 124.67 2a1s h GLU 175 Ca -0.48 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 57.67 2a1s h GLU 175 Cb 1.19 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 29.66 2a1s h GLU 175 CO 0.64 0.35 0.00 0.38 -1.18 0.00 0.00 179.01 179.20 2a1s h ASP 176 N 0.55 0.00 -0.03 1.04 2.03 -2.06 -2.73 116.42 115.23 2a1s h ASP 176 Ca 0.56 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.86 2a1s h ASP 176 Cb 1.19 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.69 2a1s h ASP 176 CO -0.31 0.00 0.00 0.00 -1.03 0.00 0.00 179.24 177.90 2a1s n GLN 177 N -2.53 0.28 0.30 4.15 1.13 -0.12 -4.78 117.38 115.80 2a1s n GLN 177 Ca 0.02 -1.03 -0.18 0.00 -1.94 0.00 0.00 57.00 53.87 2a1s n GLN 177 Cb 0.27 -1.15 -0.10 0.00 0.11 0.00 0.00 30.24 29.37 2a1s n GLN 177 CO 0.00 0.00 0.00 -0.22 -1.44 0.00 0.00 177.06 175.40 2a1s h LYS 178 N 1.50 -0.97 -0.85 -1.09 3.64 -1.14 -2.49 116.57 115.17 2a1s h LYS 178 Ca 0.00 0.07 0.07 0.00 -1.27 0.00 0.00 60.65 59.52 2a1s h LYS 178 Cb 0.35 0.22 -0.06 0.00 -0.41 0.00 0.00 32.23 32.32 2a1s h LYS 178 CO 0.00 -0.65 0.52 0.87 -2.27 0.00 0.00 179.45 177.92 2a1s h LYS 179 N -1.01 0.90 -0.46 1.90 1.79 -1.87 -2.37 116.57 115.46 2a1s h LYS 179 Ca -0.06 -0.05 0.08 0.00 -2.18 0.00 0.00 60.65 58.43 2a1s h LYS 179 Cb 0.87 -0.20 -0.06 0.00 -1.58 0.00 0.00 32.23 31.25 2a1s h LYS 179 CO -0.05 0.60 0.08 0.35 -1.08 0.00 0.00 179.45 179.35 2a1s h PHE 180 N 0.93 0.13 -0.10 -1.35 3.04 -1.83 0.56 116.94 118.31 2a1s h PHE 180 Ca 0.38 0.03 -0.10 0.00 3.98 0.00 0.00 57.97 62.26 2a1s h PHE 180 Cb 0.21 0.01 -0.01 0.00 2.56 0.00 0.00 35.95 38.72 2a1s h PHE 180 CO -0.04 -0.01 -0.39 0.82 -2.02 0.00 0.00 178.31 176.68 2a1s h ILE 181 N 0.21 1.30 -0.22 1.41 5.03 -1.04 -2.61 117.51 121.59 2a1s h ILE 181 Ca 0.23 -1.45 -0.19 0.00 -0.12 0.00 0.00 64.86 63.33 2a1s h ILE 181 Cb 0.30 1.65 0.00 0.00 -3.03 0.00 0.00 36.82 35.74 2a1s h ILE 181 CO -0.31 0.43 -0.61 0.44 -0.68 0.00 0.00 178.15 177.42 2a1s h ASP 182 N 0.18 0.85 0.43 1.72 3.32 -0.87 -0.22 116.42 121.84 2a1s h ASP 182 Ca 0.02 -0.48 0.00 0.00 0.02 0.00 0.00 57.03 56.58 2a1s h ASP 182 Cb 0.77 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 40.07 2a1s h ASP 182 CO 0.06 1.26 0.00 0.00 -1.72 0.00 0.00 179.24 178.84 2a1s n GLN 183 N -3.97 0.02 -0.11 3.56 6.02 0.12 -1.89 117.38 121.13 2a1s n GLN 183 Ca -0.05 0.27 -0.13 0.00 -0.01 0.00 0.00 57.00 57.07 2a1s n GLN 183 Cb 0.65 -1.50 -0.12 0.00 1.02 0.00 0.00 30.24 30.30 2a1s n GLN 183 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 2a1s n VAL 184 N -1.48 1.29 -0.10 5.09 0.31 -0.98 -4.07 118.33 118.38 2a1s n VAL 184 Ca 0.03 -0.59 -0.09 0.00 -0.01 0.00 0.00 64.34 63.68 2a1s n VAL 184 Cb 0.15 -1.04 -0.02 0.00 -0.91 0.00 0.00 33.84 32.02 2a1s n VAL 184 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 2a1s h VAL 185 N 0.00 1.13 -0.69 2.52 2.07 -0.76 -2.96 116.25 117.56 2a1s h VAL 185 Ca -0.50 -0.35 0.11 0.00 0.82 0.00 0.00 66.70 66.78 2a1s h VAL 185 Cb 1.90 0.77 -0.08 0.00 -1.52 0.00 0.00 31.29 32.36 2a1s h VAL 185 CO -0.04 0.14 0.29 -0.33 0.02 0.00 0.00 177.57 177.64 2a1s h GLU 186 N 0.41 0.46 -0.11 1.57 5.08 -1.60 0.18 114.58 120.57 2a1s h GLU 186 Ca 0.11 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.44 2a1s h GLU 186 Cb 0.06 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 2a1s h GLU 186 CO -0.02 0.30 0.05 0.87 -1.00 0.00 0.00 179.01 179.21 2a1s h LYS 187 N 0.47 0.14 -0.00 2.33 1.57 -1.68 -2.06 116.57 117.33 2a1s h LYS 187 Ca 0.36 -0.01 -0.22 0.00 -1.87 0.00 0.00 60.65 58.91 2a1s h LYS 187 Cb 0.47 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.75 2a1s h LYS 187 CO -0.34 0.11 -0.93 0.82 -0.57 0.00 0.00 179.45 178.54 2a1s h ILE 188 N 0.14 1.40 0.00 1.86 1.08 -0.60 -2.34 117.51 119.05 2a1s h ILE 188 Ca 0.04 -2.44 0.00 0.00 -0.39 0.00 0.00 64.86 62.07 2a1s h ILE 188 Cb 0.01 2.41 0.00 0.00 -3.07 0.00 0.00 36.82 36.17 2a1s h ILE 188 CO -0.01 0.73 0.00 -0.33 -0.69 0.00 0.00 178.15 177.85 2a1s h GLU 189 N 0.23 0.00 0.00 2.37 4.39 -0.20 0.22 114.58 121.59 2a1s h GLU 189 Ca -0.08 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.62 2a1s h GLU 189 Cb 1.57 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.22 2a1s h GLU 189 CO 0.16 0.00 0.00 -3.47 -1.16 0.00 0.00 179.01 174.54 2a1s n ASP 190 N -2.63 0.00 -0.56 1.42 -0.08 -0.95 -4.29 116.55 109.47 2a1s n ASP 190 Ca 0.01 0.47 0.46 0.00 -1.51 0.00 0.00 54.79 54.22 2a1s n ASP 190 Cb 0.26 -0.48 0.80 0.00 2.34 0.00 0.00 41.12 44.03 2a1s n ASP 190 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 2a1s h LEU 191 N 0.00 0.01 -5.14 -2.67 5.85 -1.39 0.14 115.31 112.11 2a1s h LEU 191 Ca 0.00 0.00 -0.63 0.00 0.84 0.00 0.00 57.88 58.09 2a1s h LEU 191 Cb 0.00 0.00 -0.15 0.00 0.37 0.00 0.00 40.66 40.88 2a1s h LEU 191 CO 0.00 -0.00 1.44 -0.11 -0.34 0.00 0.00 178.44 179.43 2a1s n LEU 192 N -4.04 7.30 0.00 2.25 7.94 0.06 -4.11 117.00 126.40 2a1s n LEU 192 Ca 0.37 -4.52 0.00 0.00 -1.11 0.00 0.00 56.01 50.75 2a1s n LEU 192 Cb 1.72 -1.30 0.00 0.00 0.53 0.00 0.00 43.42 44.37 2a1s n LEU 192 CO 0.43 1.91 0.00 0.00 -1.11 0.00 0.00 177.39 178.62 2a1s n GLN 193 N 1.28 0.00 -0.97 1.96 10.64 0.47 -4.90 117.38 125.86 2a1s n GLN 193 Ca 0.56 0.00 -0.33 0.00 -1.83 0.00 0.00 57.00 55.40 2a1s n GLN 193 Cb 0.39 0.00 0.14 0.00 -0.86 0.00 0.00 30.24 29.91 2a1s n GLN 193 CO 0.00 0.00 0.00 0.43 -1.83 0.00 0.00 177.06 175.66 2a1s n SER 194 N -2.17 0.60 -0.45 2.61 7.64 -1.04 -4.92 113.62 115.89 2a1s n SER 194 Ca 0.00 0.53 0.13 0.00 1.01 0.00 0.00 58.87 60.54 2a1s n SER 194 Cb 0.00 -1.48 0.53 0.00 -1.01 0.00 0.00 64.21 62.25 2a1s n SER 194 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2a1s n GLU 195 N -3.39 1.61 -2.41 1.43 -0.58 -1.26 -4.86 120.64 111.18 2a1s n GLU 195 Ca 0.13 -0.89 -0.33 0.00 -0.42 0.00 0.00 57.16 55.65 2a1s n GLU 195 Cb 0.51 -1.46 -0.03 0.00 -0.57 0.00 0.00 31.44 29.89 2a1s n GLU 195 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 2a1s s GLU 196 N -1.95 3.85 -1.10 3.49 2.02 -1.26 -4.98 118.70 118.77 2a1s s GLU 196 Ca 0.37 1.07 -0.03 0.00 0.02 0.00 0.00 54.97 56.40 2a1s s GLU 196 Cb 0.20 -2.12 0.28 0.00 0.10 0.00 0.00 34.13 32.59 2a1s s GLU 196 CO 0.32 -0.35 1.84 -1.71 0.02 0.00 0.00 175.26 175.37 2a1s n ASN 197 N -1.46 7.12 -4.78 -0.19 5.15 -1.26 -5.02 115.26 114.82 2a1s n ASN 197 Ca 0.07 -3.51 -0.22 0.00 -0.60 0.00 0.00 54.58 50.32 2a1s n ASN 197 Cb 0.54 -1.24 -0.05 0.00 -0.53 0.00 0.00 39.78 38.50 2a1s n ASN 197 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 2a1s s LYS 198 N -3.21 2.78 -0.01 1.20 2.47 -1.26 -5.12 119.74 116.58 2a1s s LYS 198 Ca 0.39 -1.15 -0.04 0.00 -1.56 0.00 0.00 55.97 53.62 2a1s s LYS 198 Cb 0.15 -2.47 -0.04 0.00 -1.46 0.00 0.00 37.83 34.01 2a1s s LYS 198 CO -0.06 0.38 0.21 -0.80 0.16 0.00 0.00 175.35 175.24 2a1s s ASN 199 N -3.81 6.41 -0.90 1.43 0.01 -1.26 -4.69 114.94 112.13 2a1s s ASN 199 Ca 0.33 0.42 -0.19 0.00 -0.71 0.00 0.00 52.86 52.71 2a1s s ASN 199 Cb -0.07 -2.04 0.12 0.00 0.41 0.00 0.00 41.25 39.67 2a1s s ASN 199 CO 0.24 0.27 1.11 -0.22 -1.51 0.00 0.00 177.10 176.99 2a1s s LEU 200 N -1.82 4.95 -1.11 0.60 2.96 -0.89 -4.96 118.68 118.40 2a1s s LEU 200 Ca 0.27 -1.91 -0.23 0.00 -0.22 0.00 0.00 54.13 52.03 2a1s s LEU 200 Cb -0.13 -2.40 -0.07 0.00 0.50 0.00 0.00 46.19 44.09 2a1s s LEU 200 CO 0.17 -1.11 1.92 1.51 -1.32 0.00 0.00 176.35 177.51 2a1s s ASP 201 N 3.68 5.18 0.28 3.68 -4.77 -1.26 -2.83 116.67 120.63 2a1s s ASP 201 Ca 0.32 -1.42 -0.29 0.00 -3.30 0.00 0.00 52.55 47.85 2a1s s ASP 201 Cb -0.06 -2.58 -0.10 0.00 -1.09 0.00 0.00 42.92 39.09 2a1s s ASP 201 CO -0.07 -2.86 1.25 -0.22 0.70 0.00 0.00 175.17 173.96 2a1s s LEU 202 N 10.30 4.46 0.42 2.11 2.96 -1.09 -4.97 118.68 132.88 2a1s s LEU 202 Ca 0.68 2.48 -0.24 0.00 -0.22 0.00 0.00 54.13 56.83 2a1s s LEU 202 Cb -0.02 -3.63 -0.08 0.00 0.50 0.00 0.00 46.19 42.96 2a1s s LEU 202 CO 0.09 -0.42 1.17 -1.61 -1.32 0.00 0.00 176.35 174.25 2a1s s GLU 203 N -1.19 3.94 0.11 1.98 8.01 -1.26 -3.93 118.70 126.35 2a1s s GLU 203 Ca 0.50 1.81 -0.36 0.00 0.01 0.00 0.00 54.97 56.93 2a1s s GLU 203 Cb -0.37 -2.56 -0.15 0.00 -4.31 0.00 0.00 34.13 26.74 2a1s s GLU 203 CO 0.45 -0.41 1.46 -0.35 0.01 0.00 0.00 175.26 176.42 2a1s n PRO 204 N -0.16 1.59 -2.96 0.39 -0.04 -1.26 -4.75 135.00 127.81 2a1s n PRO 204 Ca 0.05 0.57 -0.12 0.00 -0.04 0.00 0.00 63.50 63.97 2a1s n PRO 204 Cb 0.47 -2.27 -0.02 0.00 -0.04 0.00 0.00 33.50 31.63 2a1s n PRO 204 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2a1s h THR 206 N 1.09 0.00 0.00 0.00 1.35 -1.94 -3.46 112.91 109.95 2a1s h THR 206 Ca -0.15 -0.91 0.00 0.00 -0.55 0.00 0.00 66.41 64.79 2a1s h THR 206 Cb 0.46 1.43 0.00 0.00 -1.73 0.00 0.00 68.15 68.31 2a1s h THR 206 CO 0.25 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.13 2a1s n GLY 207 N 1.21 3.10 0.09 5.82 0.00 -1.26 -4.70 105.19 109.45 2a1s n GLY 207 Ca 0.01 -0.99 -0.08 0.00 0.00 0.00 0.00 46.02 44.95 2a1s n GLY 207 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2a1s h PHE 208 N 0.00 0.17 -0.00 1.61 3.57 -1.98 -1.96 116.94 118.35 2a1s h PHE 208 Ca 0.00 -0.11 -0.02 0.00 3.53 0.00 0.00 57.97 61.37 2a1s h PHE 208 Cb 0.00 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 38.73 2a1s h PHE 208 CO 0.00 1.01 -0.07 1.96 -2.23 0.00 0.00 178.31 178.98 2a1s h GLN 209 N 0.04 0.06 -1.01 1.11 4.20 -1.94 -0.94 115.11 116.63 2a1s h GLN 209 Ca -0.04 -0.05 0.25 0.00 0.06 0.00 0.00 58.65 58.87 2a1s h GLN 209 Cb 1.67 0.01 -0.12 0.00 0.30 0.00 0.00 27.48 29.34 2a1s h GLN 209 CO 0.14 0.78 0.60 -0.09 -0.67 0.00 0.00 178.83 179.59 2a1s h ARG 210 N -0.65 0.55 -0.00 1.46 2.43 -1.90 0.24 114.38 116.50 2a1s h ARG 210 Ca -0.01 -0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 58.98 2a1s h ARG 210 Cb 0.80 -0.12 0.01 0.00 -0.42 0.00 0.00 29.97 30.24 2a1s h ARG 210 CO 0.01 0.36 -0.59 -0.22 -1.51 0.00 0.00 179.97 178.03 2a1s h LYS 211 N 0.56 0.40 -0.57 0.20 3.11 -1.33 -2.41 116.57 116.53 2a1s h LYS 211 Ca 0.65 -0.43 0.05 0.00 -2.81 0.00 0.00 60.65 58.11 2a1s h LYS 211 Cb 1.26 0.12 -0.03 0.00 -1.00 0.00 0.00 32.23 32.57 2a1s h LYS 211 CO -0.48 1.10 0.38 -0.07 -2.81 0.00 0.00 179.45 177.57 2a1s h LEU 212 N -0.12 0.50 -0.16 5.20 3.38 0.13 -1.30 115.31 122.94 2a1s h LEU 212 Ca -0.07 -0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.81 2a1s h LEU 212 Cb 1.30 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.94 2a1s h LEU 212 CO 0.12 0.33 -0.23 0.40 0.09 0.00 0.00 178.44 179.15 2a1s h ILE 213 N 0.58 1.35 0.37 1.22 2.04 -0.47 -2.62 117.51 119.97 2a1s h ILE 213 Ca 0.24 -1.45 -0.02 0.00 1.00 0.00 0.00 64.86 64.64 2a1s h ILE 213 Cb 0.23 1.92 0.00 0.00 -0.74 0.00 0.00 36.82 38.23 2a1s h ILE 213 CO -0.07 0.43 -0.18 1.88 0.00 0.00 0.00 178.15 180.22 2a1s h TYR 214 N 0.06 -0.46 -1.41 1.37 -1.99 -1.06 0.11 116.97 113.60 2a1s h TYR 214 Ca 0.02 -0.01 0.43 0.00 2.00 0.00 0.00 58.73 61.16 2a1s h TYR 214 Cb 0.80 0.15 -0.09 0.00 2.00 0.00 0.00 36.73 39.59 2a1s h TYR 214 CO 0.09 -0.16 0.97 0.37 -0.00 0.00 0.00 178.16 179.43 2a1s h GLN 215 N -0.73 0.08 0.08 4.88 4.15 -1.34 -1.73 115.11 120.50 2a1s h GLN 215 Ca -0.05 -0.01 -0.33 0.00 0.77 0.00 0.00 58.65 59.04 2a1s h GLN 215 Cb 0.50 -0.02 -0.03 0.00 0.21 0.00 0.00 27.48 28.15 2a1s h GLN 215 CO 0.08 0.06 -1.80 1.15 -1.93 0.00 0.00 178.83 176.39 2a1s h THR 216 N 0.09 0.81 -0.02 2.39 2.02 -0.98 -3.30 112.91 113.91 2a1s h THR 216 Ca 0.76 -2.56 0.00 0.00 0.77 0.00 0.00 66.41 65.38 2a1s h THR 216 Cb 2.66 2.52 0.00 0.00 -1.74 0.00 0.00 68.15 71.59 2a1s h THR 216 CO -0.21 0.73 0.00 0.18 0.37 0.00 0.00 175.52 176.59 2a1s n LEU 217 N -3.31 0.18 -0.06 2.58 4.77 0.33 -2.70 117.00 118.79 2a1s n LEU 217 Ca -0.23 -0.08 -0.21 0.00 -0.03 0.00 0.00 56.01 55.46 2a1s n LEU 217 Cb 1.05 -0.02 -0.13 0.00 -2.33 0.00 0.00 43.42 42.00 2a1s n LEU 217 CO 0.45 0.04 -0.43 0.77 -1.33 0.00 0.00 177.39 176.89 2a1s h SER 218 N 0.22 0.15 0.66 -1.43 4.64 -1.42 -3.29 113.55 113.09 2a1s h SER 218 Ca 0.00 -0.71 0.00 0.00 -0.47 0.00 0.00 61.79 60.61 2a1s h SER 218 Cb 0.05 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2a1s h SER 218 CO 0.00 1.52 -1.05 -2.67 -0.87 0.00 0.00 176.83 173.76 2a1s n TRP 219 N -4.20 0.54 -0.01 4.77 4.27 -1.22 -3.80 117.44 117.79 2a1s n TRP 219 Ca -0.28 0.16 0.07 0.00 -3.89 0.00 0.00 57.50 53.56 2a1s n TRP 219 Cb 0.76 -0.67 -0.12 0.00 -1.36 0.00 0.00 31.31 29.93 2a1s n TRP 219 CO 0.00 0.00 0.00 1.17 -2.29 0.00 0.00 177.69 176.57 2a1s n LYS 220 N -2.27 0.45 -3.13 -2.67 4.81 -1.10 -4.73 118.16 109.52 2a1s n LYS 220 Ca 0.01 -0.14 -0.20 0.00 -0.87 0.00 0.00 58.31 57.12 2a1s n LYS 220 Cb 0.49 -1.35 -0.04 0.00 0.02 0.00 0.00 35.03 34.15 2a1s n LYS 220 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2a1s n TYR 221 N -2.02 -0.47 0.96 5.64 4.02 -1.24 -4.93 117.16 119.12 2a1s n TYR 221 Ca -0.03 -3.47 0.00 0.00 -0.01 0.00 0.00 57.90 54.39 2a1s n TYR 221 Cb 0.39 -0.14 0.00 0.00 -0.02 0.00 0.00 39.34 39.57 2a1s n TYR 221 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 2a1s n PRO 222 N 0.88 0.83 0.00 -0.72 -0.04 -1.25 -3.84 135.00 130.85 2a1s n PRO 222 Ca 0.21 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.67 2a1s n PRO 222 Cb 0.60 -1.35 0.00 0.00 -0.04 0.00 0.00 33.50 32.71 2a1s n PRO 222 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2a1s n LYS 223 N -0.01 0.00 -2.16 0.54 5.02 -1.26 -4.75 118.16 115.55 2a1s n LYS 223 Ca 0.00 0.00 -0.39 0.00 -2.02 0.00 0.00 58.31 55.90 2a1s n LYS 223 Cb 0.17 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.19 2a1s n LYS 223 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2a1s n GLY 224 N 3.51 5.47 0.00 0.72 0.00 -1.26 -4.77 105.19 108.86 2a1s n GLY 224 Ca 0.00 -2.23 0.00 0.00 0.00 0.00 0.00 46.02 43.79 2a1s n GLY 224 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2a1s n ILE 225 N 0.99 0.00 -2.25 -0.61 5.41 -1.25 -4.47 119.36 117.17 2a1s n ILE 225 Ca 0.56 0.00 -0.04 0.00 1.00 0.00 0.00 62.75 64.27 2a1s n ILE 225 Cb 0.27 0.00 -0.03 0.00 -0.71 0.00 0.00 39.64 39.17 2a1s n ILE 225 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 176.55 178.12 2a1s n HIS 226 N 0.00 -3.09 -4.59 1.39 -0.00 -1.26 -3.88 115.22 103.78 2a1s n HIS 226 Ca 0.00 1.78 -0.30 0.00 0.46 0.00 0.00 57.72 59.66 2a1s n HIS 226 Cb 0.00 -3.18 -0.13 0.00 -0.12 0.00 0.00 29.99 26.56 2a1s n HIS 226 CO 0.00 0.00 0.00 0.14 0.46 0.00 0.00 176.34 176.94 2a1s s VAL 227 N -0.50 2.59 0.14 3.57 -7.23 -1.26 -2.68 120.40 115.03 2a1s s VAL 227 Ca -0.19 -1.38 -0.01 0.00 -1.81 0.00 0.00 61.98 58.59 2a1s s VAL 227 Cb 0.01 -2.11 -0.04 0.00 0.56 0.00 0.00 36.38 34.81 2a1s s VAL 227 CO 0.55 0.25 0.06 -0.70 -0.31 0.00 0.00 175.10 174.95 2a1s s GLU 228 N -1.65 0.97 -0.33 4.82 2.12 -0.97 -4.99 118.70 118.68 2a1s s GLU 228 Ca 0.15 -1.47 -0.02 0.00 0.36 0.00 0.00 54.97 53.99 2a1s s GLU 228 Cb -0.10 0.20 0.12 0.00 0.26 0.00 0.00 34.13 34.60 2a1s s GLU 228 CO 0.06 -0.26 0.16 0.99 -0.54 0.00 0.00 175.26 175.67 2a1s s THR 229 N -4.02 0.28 0.67 -1.70 2.01 -1.26 -2.64 115.64 108.97 2a1s s THR 229 Ca 0.26 -1.35 -0.00 0.00 0.31 0.00 0.00 61.69 60.90 2a1s s THR 229 Cb 0.07 -1.22 0.13 0.00 0.01 0.00 0.00 72.50 71.49 2a1s s THR 229 CO 0.03 -0.83 0.92 0.18 -0.69 0.00 0.00 174.62 174.23 2a1s n LEU 230 N 4.61 0.00 -4.18 4.42 4.77 -0.97 -4.88 117.00 120.76 2a1s n LEU 230 Ca 0.02 -1.95 -0.13 0.00 -0.03 0.00 0.00 56.01 53.92 2a1s n LEU 230 Cb 0.40 -0.60 -0.10 0.00 -2.33 0.00 0.00 43.42 40.78 2a1s n LEU 230 CO 0.10 -0.95 -0.41 -1.61 -1.33 0.00 0.00 177.39 173.20 2a1s s GLU 231 N -4.90 0.87 0.87 3.23 2.02 -1.26 -2.29 118.70 117.23 2a1s s GLU 231 Ca 0.61 -1.24 -0.11 0.00 0.02 0.00 0.00 54.97 54.25 2a1s s GLU 231 Cb -0.03 -0.45 0.16 0.00 0.10 0.00 0.00 34.13 33.90 2a1s s GLU 231 CO 0.41 0.05 1.21 0.95 0.02 0.00 0.00 175.26 177.89 2a1s s THR 232 N -2.86 2.06 0.17 3.63 -4.23 -1.26 -4.97 115.64 108.18 2a1s s THR 232 Ca 0.08 -0.17 0.03 0.00 -1.18 0.00 0.00 61.69 60.46 2a1s s THR 232 Cb -0.00 -2.88 -0.14 0.00 1.34 0.00 0.00 72.50 70.82 2a1s s THR 232 CO -0.01 0.00 1.40 -0.33 -0.54 0.00 0.00 174.62 175.13 2a1s h GLU 233 N -1.24 0.17 -0.18 3.99 5.08 -2.02 -3.08 114.58 117.30 2a1s h GLU 233 Ca -0.42 -0.19 0.00 0.00 -1.00 0.00 0.00 59.36 57.75 2a1s h GLU 233 Cb 1.26 0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.56 2a1s h GLU 233 CO 0.42 0.92 0.00 1.63 -1.00 0.00 0.00 179.01 180.99 2a1s n LYS 234 N -3.66 1.43 -0.03 2.33 5.02 -1.26 -5.05 118.16 116.94 2a1s n LYS 234 Ca -0.03 -0.66 0.00 0.00 -2.02 0.00 0.00 58.31 55.60 2a1s n LYS 234 Cb 0.79 -1.15 -0.00 0.00 -0.02 0.00 0.00 35.03 34.66 2a1s n LYS 234 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2a1s n LYS 235 N 0.04 -0.06 0.00 1.97 4.76 -1.16 -5.13 118.16 118.57 2a1s n LYS 235 Ca 0.06 0.04 0.00 0.00 -2.87 0.00 0.00 58.31 55.54 2a1s n LYS 235 Cb 0.16 -0.07 0.00 0.00 -1.84 0.00 0.00 35.03 33.27 2a1s n LYS 235 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 2a1s n GLU 236 N -0.92 0.00 -3.83 1.97 2.13 -1.26 -4.13 120.64 114.60 2a1s n GLU 236 Ca 0.00 0.00 -0.15 0.00 0.66 0.00 0.00 57.16 57.67 2a1s n GLU 236 Cb 0.01 0.00 -0.16 0.00 0.27 0.00 0.00 31.44 31.57 2a1s n GLU 236 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 2a1s s ARG 237 N -0.99 0.04 0.37 5.31 0.52 -1.26 -4.00 118.95 118.94 2a1s s ARG 237 Ca 0.00 0.12 0.05 0.00 -0.52 0.00 0.00 55.73 55.37 2a1s s ARG 237 Cb 0.00 -0.24 -0.07 0.00 0.52 0.00 0.00 34.95 35.17 2a1s s ARG 237 CO 0.00 -0.12 0.04 1.52 0.02 0.00 0.00 175.30 176.76 2a1s s TYR 238 N 0.78 2.18 0.08 -0.53 -0.85 -0.97 -4.25 117.35 113.79 2a1s s TYR 238 Ca -0.07 -0.85 0.04 0.00 -0.52 0.00 0.00 57.07 55.67 2a1s s TYR 238 Cb -0.10 -1.50 -0.04 0.00 0.38 0.00 0.00 41.96 40.71 2a1s s TYR 238 CO -0.02 0.19 -0.00 0.42 -1.52 0.00 0.00 175.55 174.62 2a1s s ILE 239 N -3.04 4.03 -0.04 -3.49 1.01 -1.25 -2.30 121.20 116.12 2a1s s ILE 239 Ca 0.34 -0.93 0.02 0.00 0.00 0.00 0.00 60.65 60.08 2a1s s ILE 239 Cb 0.09 -2.90 0.01 0.00 0.01 0.00 0.00 42.46 39.67 2a1s s ILE 239 CO 0.16 0.16 -0.09 -0.69 0.00 0.00 0.00 174.94 174.49 2a1s s VAL 240 N -1.27 0.82 -0.09 2.92 1.01 -1.08 -2.68 120.40 120.03 2a1s s VAL 240 Ca 0.25 -0.33 0.05 0.00 0.00 0.00 0.00 61.98 61.95 2a1s s VAL 240 Cb -0.12 -0.76 -0.00 0.00 0.00 0.00 0.00 36.38 35.50 2a1s s VAL 240 CO 0.17 0.27 -0.24 -0.63 0.00 0.00 0.00 175.10 174.67 2a1s s ILE 241 N 0.55 2.04 0.17 2.22 1.01 -1.13 -2.29 121.20 123.77 2a1s s ILE 241 Ca -0.09 -1.02 0.08 0.00 0.00 0.00 0.00 60.65 59.62 2a1s s ILE 241 Cb -0.13 -1.75 -0.04 0.00 0.01 0.00 0.00 42.46 40.55 2a1s s ILE 241 CO 0.01 0.56 -0.17 -0.44 0.00 0.00 0.00 174.94 174.90 2a1s s SER 242 N 0.22 2.63 -0.31 3.58 0.01 -1.09 -2.10 113.70 116.63 2a1s s SER 242 Ca -0.15 -0.89 -0.26 0.00 1.31 0.00 0.00 55.95 55.95 2a1s s SER 242 Cb -0.17 -0.15 0.01 0.00 0.21 0.00 0.00 66.02 65.92 2a1s s SER 242 CO 0.08 -0.07 0.93 -0.54 0.41 0.00 0.00 173.24 174.04 2a1s s LYS 243 N -2.98 4.00 -0.28 12.44 1.02 -1.26 -4.35 119.74 128.33 2a1s s LYS 243 Ca 0.17 0.82 -0.02 0.00 0.02 0.00 0.00 55.97 56.96 2a1s s LYS 243 Cb -0.05 -3.74 0.09 0.00 -0.52 0.00 0.00 37.83 33.62 2a1s s LYS 243 CO 0.07 -0.79 0.09 0.08 -0.92 0.00 0.00 175.35 173.87 2a1s s VAL 244 N 3.30 0.65 0.76 3.17 1.01 -1.26 -5.05 120.40 122.98 2a1s s VAL 244 Ca 0.39 -1.11 -0.11 0.00 0.00 0.00 0.00 61.98 61.14 2a1s s VAL 244 Cb -0.13 -1.42 0.05 0.00 0.00 0.00 0.00 36.38 34.88 2a1s s VAL 244 CO 0.14 -0.58 1.08 -0.62 0.00 0.00 0.00 175.10 175.12 2a1s s ASP 245 N 1.75 4.72 0.44 3.32 -1.08 -1.26 -4.40 116.67 120.15 2a1s s ASP 245 Ca 0.07 1.56 0.12 0.00 -0.52 0.00 0.00 52.55 53.79 2a1s s ASP 245 Cb -0.17 -2.34 0.96 0.00 -1.46 0.00 0.00 42.92 39.92 2a1s s ASP 245 CO -0.24 -1.86 2.00 -0.08 0.52 0.00 0.00 175.17 175.51 2a1s h GLU 246 N -1.01 0.13 -0.01 4.34 4.57 -1.99 -1.60 114.58 119.00 2a1s h GLU 246 Ca -0.45 -0.02 -0.17 0.00 -1.18 0.00 0.00 59.36 57.54 2a1s h GLU 246 Cb 1.24 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.79 2a1s h GLU 246 CO 0.56 0.23 -0.78 1.49 -1.18 0.00 0.00 179.01 179.33 2a1s h GLU 247 N 0.13 0.09 -0.17 1.92 4.81 -2.00 -2.27 114.58 117.08 2a1s h GLU 247 Ca 0.03 -0.08 -0.14 0.00 -0.13 0.00 0.00 59.36 59.03 2a1s h GLU 247 Cb 0.25 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.64 2a1s h GLU 247 CO 0.01 0.82 -0.49 1.49 -0.73 0.00 0.00 179.01 180.11 2a1s h GLU 248 N 0.05 0.45 0.03 1.92 4.57 -1.84 -2.44 114.58 117.33 2a1s h GLU 248 Ca -0.02 -0.26 -0.00 0.00 -1.18 0.00 0.00 59.36 57.90 2a1s h GLU 248 Cb 1.36 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.97 2a1s h GLU 248 CO 0.11 0.84 -0.01 -0.09 -1.18 0.00 0.00 179.01 178.68 2a1s h ARG 249 N 0.36 -0.03 0.21 1.92 2.43 -1.22 -0.30 114.38 117.75 2a1s h ARG 249 Ca 0.02 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.19 2a1s h ARG 249 Cb 0.99 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.54 2a1s h ARG 249 CO 0.09 0.22 -0.14 0.87 -1.51 0.00 0.00 179.97 179.50 2a1s h LYS 250 N -0.29 -0.33 -0.77 0.20 1.57 -1.47 -2.40 116.57 113.07 2a1s h LYS 250 Ca -0.00 0.02 0.05 0.00 -1.87 0.00 0.00 60.65 58.85 2a1s h LYS 250 Cb 0.27 0.08 -0.05 0.00 0.08 0.00 0.00 32.23 32.61 2a1s h LYS 250 CO 0.01 -0.22 0.47 -0.09 -0.57 0.00 0.00 179.45 179.04 2a1s h ARG 251 N -0.35 0.86 -0.81 3.15 2.43 -1.39 0.66 114.38 118.93 2a1s h ARG 251 Ca -0.02 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.06 2a1s h ARG 251 Cb 0.30 -0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 29.62 2a1s h ARG 251 CO 0.01 0.57 0.36 0.00 -1.51 0.00 0.00 179.97 179.40 2a1s h ARG 252 N 0.89 1.18 -0.62 0.20 3.08 -0.98 0.18 114.38 118.31 2a1s h ARG 252 Ca 0.33 -0.19 0.00 0.00 0.07 0.00 0.00 59.98 60.19 2a1s h ARG 252 Cb 0.11 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 29.96 2a1s h ARG 252 CO -0.15 0.93 0.00 0.39 -1.07 0.00 0.00 179.97 180.07 2a1s n GLU 253 N -4.29 2.97 -0.03 0.04 1.02 -0.59 -2.13 120.64 117.62 2a1s n GLU 253 Ca 0.08 -2.25 -0.02 0.00 -0.02 0.00 0.00 57.16 54.94 2a1s n GLU 253 Cb 0.16 -1.68 -0.05 0.00 -0.02 0.00 0.00 31.44 29.84 2a1s n GLU 253 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2a1s n GLN 254 N 0.97 2.56 -0.25 3.49 1.13 0.12 -3.98 117.38 121.42 2a1s n GLN 254 Ca 0.20 -0.01 0.04 0.00 -1.94 0.00 0.00 57.00 55.30 2a1s n GLN 254 Cb 0.67 -1.17 0.28 0.00 0.11 0.00 0.00 30.24 30.13 2a1s n GLN 254 CO 0.00 0.00 0.00 1.96 -1.44 0.00 0.00 177.06 177.58 2a1s h GLN 255 N 0.00 0.91 -0.20 -1.09 4.20 -0.97 -1.48 115.11 116.48 2a1s h GLN 255 Ca -0.15 -0.05 -0.18 0.00 0.06 0.00 0.00 58.65 58.32 2a1s h GLN 255 Cb 1.26 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 28.84 2a1s h GLN 255 CO 0.01 0.60 -0.57 -0.22 -0.67 0.00 0.00 178.83 177.98 2a1s h LYS 256 N 0.94 0.74 -0.20 1.46 3.64 -1.64 0.38 116.57 121.88 2a1s h LYS 256 Ca 0.35 -0.53 -0.12 0.00 -1.27 0.00 0.00 60.65 59.08 2a1s h LYS 256 Cb 0.18 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 2a1s h LYS 256 CO -0.12 1.15 -0.38 1.25 -2.27 0.00 0.00 179.45 179.08 2a1s h HIS 257 N 0.46 0.54 -0.24 1.91 2.76 -1.67 -2.86 115.15 116.04 2a1s h HIS 257 Ca -0.02 -0.15 -0.07 0.00 -2.20 0.00 0.00 60.37 57.94 2a1s h HIS 257 Cb 1.19 -0.12 -0.01 0.00 1.55 0.00 0.00 27.41 30.03 2a1s h HIS 257 CO 0.09 0.78 -0.10 0.00 -1.30 0.00 0.00 177.93 177.39 2a1s h ALA 258 N 1.21 0.34 0.39 5.26 0.00 -1.14 -1.86 119.26 123.46 2a1s h ALA 258 Ca 0.04 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 2a1s h ALA 258 Cb 0.85 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 2a1s h ALA 258 CO 0.07 0.18 -0.28 -0.22 0.00 0.00 0.00 179.25 179.00 2a1s h LYS 259 N 0.23 -0.64 -0.66 0.00 3.64 -0.91 -1.29 116.57 116.94 2a1s h LYS 259 Ca 0.06 0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.48 2a1s h LYS 259 Cb 0.59 0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 32.53 2a1s h LYS 259 CO 0.03 -0.43 0.40 1.05 -2.27 0.00 0.00 179.45 178.23 2a1s h GLU 260 N -0.66 0.89 0.00 1.90 4.11 -1.57 -1.13 114.58 118.11 2a1s h GLU 260 Ca -0.04 -0.07 -0.03 0.00 0.07 0.00 0.00 59.36 59.29 2a1s h GLU 260 Cb 0.57 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.62 2a1s h GLU 260 CO 0.01 0.62 -0.12 1.96 0.07 0.00 0.00 179.01 181.55 2a1s h GLN 261 N 0.91 0.00 0.03 1.06 1.08 -0.98 -1.40 115.11 115.80 2a1s h GLN 261 Ca 0.24 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.38 2a1s h GLN 261 Cb -0.04 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.40 2a1s h GLN 261 CO -0.05 0.12 -0.25 1.49 -0.95 0.00 0.00 178.83 179.20 2a1s h GLU 262 N 0.00 0.13 -1.19 1.46 4.81 -0.40 -3.06 114.58 116.32 2a1s h GLU 262 Ca -0.00 -0.17 0.34 0.00 -0.13 0.00 0.00 59.36 59.40 2a1s h GLU 262 Cb 0.30 0.06 -0.09 0.00 0.63 0.00 0.00 28.75 29.64 2a1s h GLU 262 CO 0.02 0.99 0.80 0.93 -0.73 0.00 0.00 179.01 181.02 2a1s h GLU 263 N -0.66 0.19 -0.05 1.92 5.08 -1.00 0.36 114.58 120.41 2a1s h GLU 263 Ca -0.04 -0.01 -0.13 0.00 -1.00 0.00 0.00 59.36 58.18 2a1s h GLU 263 Cb 1.10 -0.04 0.01 0.00 0.50 0.00 0.00 28.75 30.32 2a1s h GLU 263 CO 0.05 0.12 -0.49 1.25 -1.00 0.00 0.00 179.01 178.94 2a1s h LEU 264 N 0.19 0.53 -0.73 1.33 5.85 -1.30 -2.44 115.31 118.74 2a1s h LEU 264 Ca 0.66 -0.69 -0.07 0.00 0.84 0.00 0.00 57.88 58.62 2a1s h LEU 264 Cb 2.08 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 42.92 2a1s h LEU 264 CO -0.23 1.14 0.19 -1.13 -0.34 0.00 0.00 178.44 178.07 2a1s h ASN 265 N -0.04 1.09 0.60 1.25 -0.00 -1.12 -2.63 115.58 114.73 2a1s h ASN 265 Ca -0.05 -0.23 -0.04 0.00 -0.00 0.00 0.00 56.30 55.98 2a1s h ASN 265 Cb 1.16 -0.29 -0.01 0.00 -0.00 0.00 0.00 38.32 39.19 2a1s h ASN 265 CO 0.10 1.03 -0.21 0.44 -0.00 0.00 0.00 177.43 178.79 2a1s h ASP 266 N 1.10 0.00 0.37 1.15 5.19 -0.98 -2.47 116.42 120.77 2a1s h ASP 266 Ca 0.23 0.00 -0.18 0.00 -0.62 0.00 0.00 57.03 56.46 2a1s h ASP 266 Cb 0.36 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.86 2a1s h ASP 266 CO -0.00 0.21 -0.77 0.00 -3.12 0.00 0.00 179.24 175.56 2a1s h ALA 267 N 1.79 0.60 0.00 3.45 0.00 -1.12 -2.75 119.26 121.24 2a1s h ALA 267 Ca -0.00 -0.64 -0.01 0.00 0.00 0.00 0.00 54.91 54.27 2a1s h ALA 267 Cb 0.57 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 2a1s h ALA 267 CO 0.03 0.80 -0.03 -0.39 0.00 0.00 0.00 179.25 179.66 2a1s h VAL 268 N 0.21 0.07 0.00 0.00 -1.51 -1.10 -3.18 116.25 110.73 2a1s h VAL 268 Ca -0.03 -0.68 0.00 0.00 -1.23 0.00 0.00 66.70 64.75 2a1s h VAL 268 Cb 1.35 1.64 0.00 0.00 -2.13 0.00 0.00 31.29 32.14 2a1s h VAL 268 CO 0.13 0.03 0.00 0.61 -1.23 0.00 0.00 177.57 177.10 2a1s n GLY 269 N 0.26 2.80 0.30 5.19 0.00 -1.04 -1.97 105.19 110.73 2a1s n GLY 269 Ca 0.01 0.24 0.20 0.00 0.00 0.00 0.00 46.02 46.48 2a1s n GLY 269 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2a1s h PHE 270 N 0.00 0.00 -0.10 1.61 3.57 -1.59 -2.29 116.94 118.15 2a1s h PHE 270 Ca 0.00 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.53 2a1s h PHE 270 Cb 0.00 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.74 2a1s h PHE 270 CO 0.00 0.00 0.08 0.77 -2.23 0.00 0.00 178.31 176.93 2a1s h SER 271 N 0.00 0.00 -0.51 0.41 0.02 -1.66 -0.70 113.55 111.11 2a1s h SER 271 Ca 0.00 0.00 0.01 0.00 -0.84 0.00 0.00 61.79 60.96 2a1s h SER 271 Cb 0.25 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.77 2a1s h SER 271 CO 0.00 0.00 0.34 0.03 -1.14 0.00 0.00 176.83 176.06 2a1s h ARG 272 N 0.00 0.64 -0.21 3.45 3.08 -1.57 0.16 114.38 119.94 2a1s h ARG 272 Ca 0.05 -0.04 -0.17 0.00 0.07 0.00 0.00 59.98 59.88 2a1s h ARG 272 Cb 0.20 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.11 2a1s h ARG 272 CO -0.00 0.43 -0.55 0.28 -1.07 0.00 0.00 179.97 179.06 2a1s h VAL 273 N 0.66 1.30 -0.64 2.04 2.07 -1.33 -0.89 116.25 119.47 2a1s h VAL 273 Ca 0.19 -1.76 -0.09 0.00 0.82 0.00 0.00 66.70 65.86 2a1s h VAL 273 Cb -0.03 1.84 -0.02 0.00 -1.52 0.00 0.00 31.29 31.55 2a1s h VAL 273 CO -0.04 0.56 0.05 0.40 0.02 0.00 0.00 177.57 178.55 2a1s h ILE 274 N 0.47 1.27 -0.17 4.57 1.08 -1.35 -1.11 117.51 122.26 2a1s h ILE 274 Ca -0.01 -1.11 0.01 0.00 -0.39 0.00 0.00 64.86 63.36 2a1s h ILE 274 Cb 1.16 0.72 -0.01 0.00 -3.07 0.00 0.00 36.82 35.62 2a1s h ILE 274 CO 0.12 0.41 0.10 -0.74 -0.69 0.00 0.00 178.15 177.34 2a1s h HIS 275 N 1.02 0.18 -0.82 1.37 2.76 -0.55 0.36 115.15 119.47 2a1s h HIS 275 Ca 0.19 0.01 0.06 0.00 -2.20 0.00 0.00 60.37 58.43 2a1s h HIS 275 Cb 0.51 -0.06 -0.06 0.00 1.55 0.00 0.00 27.41 29.36 2a1s h HIS 275 CO 0.04 0.11 0.50 0.00 -1.30 0.00 0.00 177.93 177.27 2a1s h ALA 276 N 1.08 1.12 -0.28 5.26 0.00 -0.80 -1.21 119.26 124.43 2a1s h ALA 276 Ca 0.07 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 2a1s h ALA 276 Cb 0.00 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2a1s h ALA 276 CO -0.04 0.22 0.06 0.82 0.00 0.00 0.00 179.25 180.32 2a1s h ILE 277 N 0.91 1.22 -0.66 0.00 2.04 -0.72 -2.30 117.51 118.00 2a1s h ILE 277 Ca 0.36 -0.75 0.12 0.00 1.00 0.00 0.00 64.86 65.60 2a1s h ILE 277 Cb 0.18 1.17 -0.09 0.00 -0.74 0.00 0.00 36.82 37.35 2a1s h ILE 277 CO -0.18 0.24 0.20 0.00 0.00 0.00 0.00 178.15 178.41 2a1s h ALA 278 N 0.88 0.84 -0.72 1.87 0.00 0.39 -2.92 119.26 119.60 2a1s h ALA 278 Ca 0.09 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2a1s h ALA 278 Cb 0.31 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2a1s h ALA 278 CO 0.00 -0.26 0.00 0.09 0.00 0.00 0.00 179.25 179.08 2a1s n ASN 279 N -5.08 3.89 0.23 0.00 3.02 -0.52 -4.09 115.26 112.70 2a1s n ASN 279 Ca 0.11 -2.03 0.12 0.00 -0.03 0.00 0.00 54.58 52.75 2a1s n ASN 279 Cb 0.35 -0.49 0.35 0.00 -0.61 0.00 0.00 39.78 39.39 2a1s n ASN 279 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 2a1s h SER 280 N 4.19 0.00 0.00 6.41 4.64 -1.21 -3.48 113.55 124.10 2a1s h SER 280 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2a1s h SER 280 Cb 0.99 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 2a1s h SER 280 CO 0.01 0.10 0.00 0.61 -0.87 0.00 0.00 176.83 176.69 2a1s n GLY 281 N 0.65 2.05 3.87 -0.77 0.00 -1.26 -5.01 105.19 104.72 2a1s n GLY 281 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 2a1s n GLY 281 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a1s s LYS 282 N -0.04 3.84 0.14 1.61 1.02 -1.26 -4.85 119.74 120.20 2a1s s LYS 282 Ca 0.00 0.36 -0.34 0.00 0.02 0.00 0.00 55.97 56.01 2a1s s LYS 282 Cb 0.00 -2.60 -0.14 0.00 -0.52 0.00 0.00 37.83 34.58 2a1s s LYS 282 CO 0.00 0.28 1.62 -0.11 -0.92 0.00 0.00 175.35 176.21 2a1s n LEU 283 N -0.20 3.19 -4.36 3.17 7.94 -1.26 -4.64 117.00 120.83 2a1s n LEU 283 Ca 0.01 1.07 -0.34 0.00 -1.11 0.00 0.00 56.01 55.64 2a1s n LEU 283 Cb 0.53 -1.43 -0.14 0.00 0.53 0.00 0.00 43.42 42.91 2a1s n LEU 283 CO 0.44 -0.24 -0.39 -0.69 -1.11 0.00 0.00 177.39 175.41 2a1s s VAL 284 N 1.23 3.42 0.02 1.96 1.01 0.77 -2.72 120.40 126.09 2a1s s VAL 284 Ca 0.80 -0.50 0.02 0.00 0.00 0.00 0.00 61.98 62.30 2a1s s VAL 284 Cb -0.67 -2.52 -0.04 0.00 0.00 0.00 0.00 36.38 33.15 2a1s s VAL 284 CO 0.39 0.45 0.01 -0.63 0.00 0.00 0.00 175.10 175.33 2a1s s ILE 285 N 1.05 4.21 0.35 2.22 -1.09 -0.21 -2.43 121.20 125.30 2a1s s ILE 285 Ca 0.01 -0.67 -0.07 0.00 -2.23 0.00 0.00 60.65 57.69 2a1s s ILE 285 Cb -0.15 -2.92 0.02 0.00 -1.58 0.00 0.00 42.46 37.84 2a1s s ILE 285 CO -0.00 0.31 0.57 -0.83 -1.23 0.00 0.00 174.94 173.76 2a1s s GLY 286 N -1.77 1.09 -0.17 6.18 0.00 -0.82 -0.19 107.32 111.63 2a1s s GLY 286 Ca 0.22 -1.24 -0.00 0.00 0.00 0.00 0.00 44.72 43.69 2a1s s GLY 286 CO 0.13 -0.76 -0.07 -1.58 0.00 0.00 0.00 173.10 170.82 2a1s s HIS 287 N -2.90 1.91 -1.24 1.90 2.46 -1.26 -0.26 115.29 115.90 2a1s s HIS 287 Ca 0.25 -1.22 -0.08 0.00 0.47 0.00 0.00 55.06 54.48 2a1s s HIS 287 Cb -0.02 -1.41 -0.01 0.00 -0.13 0.00 0.00 32.58 31.01 2a1s s HIS 287 CO 0.17 -0.65 0.70 -1.71 -2.47 0.00 0.00 174.74 170.78 2a1s n ASN 288 N 4.82 -3.05 -0.49 9.88 5.15 -1.26 -4.89 115.26 125.42 2a1s n ASN 288 Ca -0.13 -0.92 0.12 0.00 -0.60 0.00 0.00 54.58 53.06 2a1s n ASN 288 Cb 0.47 -3.74 0.47 0.00 -0.53 0.00 0.00 39.78 36.45 2a1s n ASN 288 CO 0.00 0.00 0.00 1.15 1.40 0.00 0.00 177.26 179.81 2a1s n MET 289 N -4.16 1.66 -0.05 1.20 0.00 -1.26 -4.47 117.12 110.04 2a1s n MET 289 Ca -0.20 -0.97 -0.11 0.00 0.00 0.00 0.00 57.70 56.41 2a1s n MET 289 Cb 0.64 -1.44 -0.05 0.00 0.00 0.00 0.00 33.22 32.37 2a1s n MET 289 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 175.97 177.22 2a1s h LEU 290 N 2.17 -1.29 -1.06 3.17 6.46 -1.96 0.76 115.31 123.57 2a1s h LEU 290 Ca 0.00 0.19 0.02 0.00 -0.12 0.00 0.00 57.88 57.97 2a1s h LEU 290 Cb 0.47 0.55 -0.05 0.00 -0.73 0.00 0.00 40.66 40.89 2a1s h LEU 290 CO 0.00 -0.39 0.63 -0.07 -0.62 0.00 0.00 178.44 177.99 2a1s h LEU 291 N -0.41 1.07 0.11 2.25 4.07 -1.99 0.11 115.31 120.52 2a1s h LEU 291 Ca 0.11 -0.02 0.01 0.00 0.08 0.00 0.00 57.88 58.06 2a1s h LEU 291 Cb 0.59 -0.26 -0.02 0.00 1.08 0.00 0.00 40.66 42.06 2a1s h LEU 291 CO -0.46 0.75 -0.17 0.44 -1.08 0.00 0.00 178.44 177.92 2a1s h ASP 292 N 1.25 -0.48 -0.21 -0.43 3.32 -1.53 -1.06 116.42 117.28 2a1s h ASP 292 Ca 0.37 0.06 0.01 0.00 0.02 0.00 0.00 57.03 57.48 2a1s h ASP 292 Cb -0.07 0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 2a1s h ASP 292 CO -0.10 -0.25 0.12 0.58 -1.72 0.00 0.00 179.24 177.87 2a1s h VAL 293 N -0.34 1.02 -0.49 -1.35 2.07 -0.28 -0.57 116.25 116.30 2a1s h VAL 293 Ca 0.02 -0.09 0.08 0.00 0.82 0.00 0.00 66.70 67.53 2a1s h VAL 293 Cb 0.36 0.75 -0.07 0.00 -1.52 0.00 0.00 31.29 30.81 2a1s h VAL 293 CO -0.09 0.05 0.12 0.24 0.02 0.00 0.00 177.57 177.91 2a1s h MET 294 N 0.25 0.26 -0.18 1.57 2.86 -0.68 -1.45 114.93 117.56 2a1s h MET 294 Ca 0.08 -0.02 -0.08 0.00 -2.06 0.00 0.00 59.70 57.63 2a1s h MET 294 Cb -0.00 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.59 2a1s h MET 294 CO -0.04 0.17 -0.24 0.45 1.06 0.00 0.00 176.91 178.30 2a1s h HIS 295 N 0.26 0.36 0.24 -0.22 -0.00 -0.86 -0.03 115.15 114.90 2a1s h HIS 295 Ca 0.24 -0.07 -0.01 0.00 -0.00 0.00 0.00 60.37 60.53 2a1s h HIS 295 Cb 0.31 -0.09 0.00 0.00 -0.00 0.00 0.00 27.41 27.63 2a1s h HIS 295 CO -0.21 0.55 -0.11 1.15 -0.00 0.00 0.00 177.93 179.31 2a1s h THR 296 N 0.30 0.79 -0.73 2.45 2.02 -0.45 -1.80 112.91 115.50 2a1s h THR 296 Ca 0.05 -0.80 -0.06 0.00 0.77 0.00 0.00 66.41 66.38 2a1s h THR 296 Cb 0.60 1.21 -0.03 0.00 -1.74 0.00 0.00 68.15 68.18 2a1s h THR 296 CO 0.04 0.16 0.23 -0.37 0.37 0.00 0.00 175.52 175.95 2a1s h VAL 297 N -0.76 1.26 -0.23 3.16 -1.51 -1.29 0.75 116.25 117.62 2a1s h VAL 297 Ca -0.03 -0.88 0.03 0.00 -1.23 0.00 0.00 66.70 64.58 2a1s h VAL 297 Cb 0.50 0.45 -0.03 0.00 -2.13 0.00 0.00 31.29 30.08 2a1s h VAL 297 CO 0.05 0.35 0.05 -0.74 -1.23 0.00 0.00 177.57 176.05 2a1s h HIS 298 N 1.08 0.08 0.14 5.19 6.17 -0.98 -0.87 115.15 125.96 2a1s h HIS 298 Ca 0.24 0.01 -0.29 0.00 0.71 0.00 0.00 60.37 61.04 2a1s h HIS 298 Cb 0.29 -0.00 0.01 0.00 2.52 0.00 0.00 27.41 30.22 2a1s h HIS 298 CO 0.02 0.02 -1.44 1.96 0.71 0.00 0.00 177.93 179.21 2a1s h GLN 299 N 0.14 0.31 -0.02 5.26 4.20 -1.08 -3.29 115.11 120.63 2a1s h GLN 299 Ca 0.11 -0.52 0.00 0.00 0.06 0.00 0.00 58.65 58.29 2a1s h GLN 299 Cb 0.10 0.19 0.00 0.00 0.30 0.00 0.00 27.48 28.08 2a1s h GLN 299 CO -0.14 1.25 -0.21 1.19 -0.67 0.00 0.00 178.83 180.25 2a1s n PHE 300 N -3.85 0.00 0.00 2.96 3.01 0.23 -4.02 117.46 115.79 2a1s n PHE 300 Ca -0.23 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.23 2a1s n PHE 300 Cb 0.95 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.42 2a1s n PHE 300 CO 0.00 0.00 0.00 0.98 1.01 0.00 0.00 176.76 178.75 2a1s n TYR 301 N 0.30 0.00 -4.26 1.38 9.36 -0.61 -4.52 117.16 118.81 2a1s n TYR 301 Ca 0.08 0.00 -0.17 0.00 3.32 0.00 0.00 57.90 61.13 2a1s n TYR 301 Cb 0.38 0.00 -0.13 0.00 -0.63 0.00 0.00 39.34 38.95 2a1s n TYR 301 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2a1s n PRO 303 N 2.22 2.03 -1.61 0.00 -0.04 -1.24 -3.80 135.00 132.57 2a1s n PRO 303 Ca -0.17 0.72 -0.42 0.00 -0.04 0.00 0.00 63.50 63.59 2a1s n PRO 303 Cb 0.56 -2.32 0.01 0.00 -0.04 0.00 0.00 33.50 31.71 2a1s n PRO 303 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2a1s n LEU 304 N 1.39 2.41 -4.89 1.53 4.77 -1.26 -4.94 117.00 116.01 2a1s n LEU 304 Ca 0.08 1.07 -0.30 0.00 -0.03 0.00 0.00 56.01 56.83 2a1s n LEU 304 Cb 0.34 -1.34 0.05 0.00 -2.33 0.00 0.00 43.42 40.14 2a1s n LEU 304 CO 0.62 -1.46 0.74 -2.16 -1.33 0.00 0.00 177.39 173.80 2a1s s PRO 305 N -1.90 2.75 0.26 3.23 0.04 -1.26 -4.97 135.00 133.15 2a1s s PRO 305 Ca 0.62 0.38 -0.02 0.00 0.04 0.00 0.00 61.00 62.01 2a1s s PRO 305 Cb -0.59 -2.03 0.45 0.00 0.04 0.00 0.00 34.50 32.37 2a1s s PRO 305 CO 0.58 -1.08 1.83 0.00 0.04 0.00 0.00 177.00 178.37 2a1s h ALA 306 N -0.66 1.33 -2.09 8.56 0.00 -1.98 -3.45 119.26 120.96 2a1s h ALA 306 Ca -0.45 0.02 -0.48 0.00 0.00 0.00 0.00 54.91 54.00 2a1s h ALA 306 Cb 1.26 -0.19 -0.14 0.00 0.00 0.00 0.00 17.79 18.72 2a1s h ALA 306 CO 0.64 0.20 -0.67 0.16 0.00 0.00 0.00 179.25 179.58 2a1s s ASP 307 N -5.68 2.64 0.11 0.00 -4.77 -1.26 -4.96 116.67 102.74 2a1s s ASP 307 Ca -0.12 -1.19 -0.22 0.00 -3.30 0.00 0.00 52.55 47.72 2a1s s ASP 307 Cb 0.20 -0.14 -0.10 0.00 -1.09 0.00 0.00 42.92 41.79 2a1s s ASP 307 CO 0.80 -0.37 1.73 0.25 0.70 0.00 0.00 175.17 178.28 2a1s h LEU 308 N 2.30 -0.04 -0.58 2.11 5.85 -1.88 -2.08 115.31 120.98 2a1s h LEU 308 Ca -0.40 0.02 0.11 0.00 0.84 0.00 0.00 57.88 58.46 2a1s h LEU 308 Cb 1.23 0.04 -0.09 0.00 0.37 0.00 0.00 40.66 42.21 2a1s h LEU 308 CO 0.67 -0.01 0.07 -1.28 -0.34 0.00 0.00 178.44 177.56 2a1s h SER 309 N 0.03 -0.10 -0.19 1.25 0.87 -1.99 0.70 113.55 114.11 2a1s h SER 309 Ca 0.04 0.12 -0.08 0.00 -1.23 0.00 0.00 61.79 60.64 2a1s h SER 309 Cb 0.05 0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.19 2a1s h SER 309 CO -0.07 -0.04 -0.14 -0.33 -0.53 0.00 0.00 176.83 175.72 2a1s h GLU 310 N 0.20 0.58 -0.53 2.24 5.08 -1.93 -2.94 114.58 117.28 2a1s h GLU 310 Ca 0.31 -0.18 -0.06 0.00 -1.00 0.00 0.00 59.36 58.43 2a1s h GLU 310 Cb 0.47 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 2a1s h GLU 310 CO -0.44 0.71 0.11 0.35 -1.00 0.00 0.00 179.01 178.74 2a1s h PHE 311 N 0.53 0.91 -0.64 4.33 3.57 -0.21 -2.69 116.94 122.74 2a1s h PHE 311 Ca 0.09 -0.12 -0.05 0.00 3.53 0.00 0.00 57.97 61.42 2a1s h PHE 311 Cb 0.55 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 39.01 2a1s h PHE 311 CO 0.02 0.80 0.18 0.87 -2.23 0.00 0.00 178.31 177.96 2a1s h LYS 312 N 0.75 0.98 -0.17 1.11 1.57 -1.10 -0.93 116.57 118.78 2a1s h LYS 312 Ca 0.16 -0.20 0.05 0.00 -1.87 0.00 0.00 60.65 58.79 2a1s h LYS 312 Cb 0.36 -0.15 -0.06 0.00 0.08 0.00 0.00 32.23 32.47 2a1s h LYS 312 CO 0.01 0.85 -0.19 1.49 -0.57 0.00 0.00 179.45 181.04 2a1s h GLU 313 N 0.95 -0.20 -0.64 3.15 4.81 -1.41 0.66 114.58 121.89 2a1s h GLU 313 Ca 0.21 0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.48 2a1s h GLU 313 Cb 0.29 0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.68 2a1s h GLU 313 CO -0.01 -0.14 0.40 0.52 -0.73 0.00 0.00 179.01 179.06 2a1s h MET 314 N -0.21 0.77 -0.88 1.92 0.00 -1.13 -2.73 114.93 112.68 2a1s h MET 314 Ca 0.11 -0.05 -0.01 0.00 0.00 0.00 0.00 59.70 59.76 2a1s h MET 314 Cb 0.38 -0.17 -0.04 0.00 0.00 0.00 0.00 31.60 31.76 2a1s h MET 314 CO -0.30 0.51 0.51 1.15 0.00 0.00 0.00 176.91 178.78 2a1s h THR 315 N 0.80 1.25 -0.44 2.22 2.02 -0.62 -1.69 112.91 116.44 2a1s h THR 315 Ca 0.25 -0.58 0.07 0.00 0.77 0.00 0.00 66.41 66.92 2a1s h THR 315 Cb -0.00 0.03 -0.06 0.00 -1.74 0.00 0.00 68.15 66.38 2a1s h THR 315 CO -0.09 0.27 0.11 0.74 0.37 0.00 0.00 175.52 176.92 2a1s h THR 316 N 1.22 0.79 0.00 3.16 2.02 -0.58 0.22 112.91 119.74 2a1s h THR 316 Ca 0.31 -0.09 -0.03 0.00 0.77 0.00 0.00 66.41 67.37 2a1s h THR 316 Cb -0.01 0.51 -0.00 0.00 -1.74 0.00 0.00 68.15 66.91 2a1s h THR 316 CO -0.05 0.05 -0.14 0.00 0.37 0.00 0.00 175.52 175.74 2a1s n VAL 318 N -3.19 1.58 -3.03 0.00 0.31 -0.70 -4.76 118.33 108.54 2a1s n VAL 318 Ca 0.02 -0.74 -0.16 0.00 -0.01 0.00 0.00 64.34 63.45 2a1s n VAL 318 Cb 0.48 -1.13 -0.03 0.00 -0.91 0.00 0.00 33.84 32.25 2a1s n VAL 318 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2a1s n PHE 319 N -3.12 -2.09 0.32 3.52 0.99 0.73 -3.89 117.46 113.92 2a1s n PHE 319 Ca -0.29 -2.52 0.21 0.00 -0.00 0.00 0.00 57.45 54.85 2a1s n PHE 319 Cb 1.07 0.72 1.07 0.00 -1.00 0.00 0.00 39.48 41.34 2a1s n PHE 319 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.76 175.76 2a1s h PRO 320 N 4.67 0.00 -3.78 -1.08 0.13 -1.50 -3.40 132.00 127.04 2a1s h PRO 320 Ca 0.07 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.63 2a1s h PRO 320 Cb 0.98 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.72 2a1s h PRO 320 CO 0.29 0.00 -0.76 1.03 -0.23 0.00 0.00 178.00 178.33 2a1s s ARG 321 N -4.00 0.93 0.10 0.86 0.52 -1.26 -4.90 118.95 111.20 2a1s s ARG 321 Ca -0.03 -0.84 0.09 0.00 -0.52 0.00 0.00 55.73 54.42 2a1s s ARG 321 Cb 0.12 -2.22 -0.03 0.00 0.52 0.00 0.00 34.95 33.33 2a1s s ARG 321 CO 0.42 -0.77 -0.23 -0.51 0.02 0.00 0.00 175.30 174.23 2a1s s LEU 322 N 1.63 2.28 -0.07 2.53 1.02 -1.26 -0.16 118.68 124.64 2a1s s LEU 322 Ca 0.02 -0.68 -0.05 0.00 0.02 0.00 0.00 54.13 53.45 2a1s s LEU 322 Cb -0.18 -1.02 0.03 0.00 0.02 0.00 0.00 46.19 45.04 2a1s s LEU 322 CO -0.14 0.12 0.17 -0.22 0.02 0.00 0.00 176.35 176.30 2a1s s LEU 323 N -1.81 1.00 -0.23 1.79 0.20 -1.02 -0.03 118.68 118.57 2a1s s LEU 323 Ca 0.09 0.36 -0.06 0.00 0.69 0.00 0.00 54.13 55.21 2a1s s LEU 323 Cb -0.10 0.53 -0.02 0.00 -0.43 0.00 0.00 46.19 46.18 2a1s s LEU 323 CO 0.04 -0.10 0.01 -0.62 -0.29 0.00 0.00 176.35 175.39 2a1s s ASP 324 N 0.63 4.72 0.44 3.68 -1.08 -1.25 -1.95 116.67 121.86 2a1s s ASP 324 Ca -0.04 -0.29 0.24 0.00 -0.52 0.00 0.00 52.55 51.93 2a1s s ASP 324 Cb -0.06 -1.83 0.88 0.00 -1.46 0.00 0.00 42.92 40.45 2a1s s ASP 324 CO -0.03 -0.02 1.81 0.71 0.52 0.00 0.00 175.17 178.16 2a1s h THR 325 N 5.61 0.56 -0.10 1.71 1.35 -1.01 0.53 112.91 121.57 2a1s h THR 325 Ca -0.40 -1.16 -0.15 0.00 -0.55 0.00 0.00 66.41 64.15 2a1s h THR 325 Cb 1.17 1.79 0.01 0.00 -1.73 0.00 0.00 68.15 69.38 2a1s h THR 325 CO 0.59 0.23 -0.53 0.50 -0.25 0.00 0.00 175.52 176.06 2a1s h LYS 326 N 0.00 0.54 -0.68 4.72 3.64 -1.87 -1.20 116.57 121.72 2a1s h LYS 326 Ca -0.00 -0.45 0.01 0.00 -1.27 0.00 0.00 60.65 58.94 2a1s h LYS 326 Cb 0.77 0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 32.65 2a1s h LYS 326 CO 0.03 1.07 0.45 1.25 -2.27 0.00 0.00 179.45 179.98 2a1s h LEU 327 N 0.15 0.76 -0.57 5.20 5.85 -1.83 -1.98 115.31 122.88 2a1s h LEU 327 Ca -0.04 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.64 2a1s h LEU 327 Cb 1.18 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 42.00 2a1s h LEU 327 CO 0.11 0.54 0.23 -0.03 -0.34 0.00 0.00 178.44 178.95 2a1s h MET 328 N 0.90 0.86 -0.03 1.25 4.05 -0.85 -1.44 114.93 119.67 2a1s h MET 328 Ca 0.26 -0.15 -0.03 0.00 -0.28 0.00 0.00 59.70 59.49 2a1s h MET 328 Cb -0.07 -0.14 -0.01 0.00 -0.80 0.00 0.00 31.60 30.58 2a1s h MET 328 CO -0.07 0.74 -0.11 0.00 0.23 0.00 0.00 176.91 177.70 2a1s h ALA 329 N 1.08 1.76 0.00 0.39 0.00 -1.09 -2.49 119.26 118.91 2a1s h ALA 329 Ca 0.19 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2a1s h ALA 329 Cb 0.20 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2a1s h ALA 329 CO -0.02 0.18 0.00 0.77 0.00 0.00 0.00 179.25 180.19 2a1s h SER 330 N 0.05 0.00 -3.34 0.00 0.02 -0.51 -3.08 113.55 106.69 2a1s h SER 330 Ca 0.01 0.00 -0.48 0.00 -0.84 0.00 0.00 61.79 60.48 2a1s h SER 330 Cb 0.23 0.00 0.04 0.00 0.14 0.00 0.00 62.40 62.81 2a1s h SER 330 CO 0.02 0.00 0.05 -0.89 -1.14 0.00 0.00 176.83 174.87 2a1s s THR 331 N -3.24 4.35 0.48 -2.27 2.01 -0.67 -4.43 115.64 111.87 2a1s s THR 331 Ca 0.07 -0.08 -0.21 0.00 0.31 0.00 0.00 61.69 61.78 2a1s s THR 331 Cb 0.06 -3.66 -0.07 0.00 0.01 0.00 0.00 72.50 68.84 2a1s s THR 331 CO 0.65 -0.59 1.10 -1.10 -0.69 0.00 0.00 174.62 173.98 2a1s s GLN 332 N -4.73 3.70 -0.11 4.92 -1.52 -1.26 -0.79 119.66 119.87 2a1s s GLN 332 Ca 0.49 1.56 0.08 0.00 -1.95 0.00 0.00 55.36 55.54 2a1s s GLN 332 Cb -0.10 -2.21 0.43 0.00 -0.22 0.00 0.00 33.01 30.91 2a1s s GLN 332 CO 0.43 -0.55 1.19 -0.35 -0.25 0.00 0.00 175.29 175.76 2a1s n PRO 333 N -0.82 2.91 0.04 2.91 -0.04 -1.26 -4.87 135.00 133.87 2a1s n PRO 333 Ca 0.09 -1.65 0.11 0.00 -0.04 0.00 0.00 63.50 62.01 2a1s n PRO 333 Cb 0.51 -1.82 -0.06 0.00 -0.04 0.00 0.00 33.50 32.08 2a1s n PRO 333 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2a1s n PHE 334 N 0.39 0.39 -0.09 0.54 3.01 -0.60 -4.25 117.46 116.83 2a1s n PHE 334 Ca 0.15 0.11 0.02 0.00 1.01 0.00 0.00 57.45 58.74 2a1s n PHE 334 Cb 0.69 -0.62 0.33 0.00 -0.01 0.00 0.00 39.48 39.87 2a1s n PHE 334 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 2a1s h LYS 335 N 0.00 0.73 -0.00 -1.08 3.64 -0.87 -1.46 116.57 117.53 2a1s h LYS 335 Ca 0.00 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 2a1s h LYS 335 Cb 0.91 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.58 2a1s h LYS 335 CO 0.00 0.52 -0.12 -0.25 -2.27 0.00 0.00 179.45 177.32 2a1s n ASP 336 N -4.42 0.28 -0.03 4.20 10.43 -1.26 -4.15 116.55 121.60 2a1s n ASP 336 Ca 0.05 -0.18 -0.04 0.00 2.57 0.00 0.00 54.79 57.19 2a1s n ASP 336 Cb 0.08 -0.17 -0.04 0.00 1.84 0.00 0.00 41.12 42.83 2a1s n ASP 336 CO 0.00 0.00 0.00 -0.38 -1.07 0.00 0.00 177.20 175.75 2a1s n ILE 337 N -1.23 0.40 -3.17 0.53 5.41 -1.02 -5.00 119.36 115.28 2a1s n ILE 337 Ca 0.11 -0.19 -0.40 0.00 1.00 0.00 0.00 62.75 63.27 2a1s n ILE 337 Cb 0.30 -0.79 -0.07 0.00 -0.71 0.00 0.00 39.64 38.37 2a1s n ILE 337 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 2a1s s ILE 338 N -2.14 5.04 -0.30 1.39 1.01 -0.58 -4.95 121.20 120.66 2a1s s ILE 338 Ca -0.07 1.05 0.23 0.00 0.00 0.00 0.00 60.65 61.86 2a1s s ILE 338 Cb 0.02 -3.89 -0.09 0.00 0.01 0.00 0.00 42.46 38.51 2a1s s ILE 338 CO 0.19 0.09 0.94 0.59 0.00 0.00 0.00 174.94 176.76 2a1s n ASN 339 N 5.31 0.62 -3.70 3.58 3.02 -1.26 -4.79 115.26 118.03 2a1s n ASN 339 Ca -0.02 0.13 -0.22 0.00 -0.03 0.00 0.00 54.58 54.44 2a1s n ASN 339 Cb 0.50 0.82 -0.18 0.00 -0.61 0.00 0.00 39.78 40.31 2a1s n ASN 339 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2a1s s ASN 340 N -4.80 1.42 0.00 6.41 3.84 -1.26 -5.02 114.94 115.54 2a1s s ASN 340 Ca -0.01 -0.05 0.26 0.00 0.21 0.00 0.00 52.86 53.27 2a1s s ASN 340 Cb 0.12 -0.26 0.60 0.00 -0.55 0.00 0.00 41.25 41.15 2a1s s ASN 340 CO 0.81 -0.24 1.49 0.35 -2.79 0.00 0.00 177.10 176.72 2a1s n THR 341 N 5.24 0.00 -1.66 -5.21 -2.24 -1.26 -4.20 114.28 104.95 2a1s n THR 341 Ca -0.05 -0.35 -0.45 0.00 -2.27 0.00 0.00 64.05 60.93 2a1s n THR 341 Cb 0.50 0.97 -0.02 0.00 -2.10 0.00 0.00 70.33 69.67 2a1s n THR 341 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2a1s n SER 342 N 0.62 2.46 0.12 3.42 2.88 -1.26 -4.78 113.62 117.08 2a1s n SER 342 Ca 0.16 1.15 -0.12 0.00 -1.33 0.00 0.00 58.87 58.73 2a1s n SER 342 Cb 0.47 -1.40 -0.07 0.00 -0.75 0.00 0.00 64.21 62.46 2a1s n SER 342 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 2a1s h LEU 343 N 3.72 -1.12 -0.51 2.46 5.85 -1.98 0.30 115.31 124.03 2a1s h LEU 343 Ca -0.44 0.11 0.07 0.00 0.84 0.00 0.00 57.88 58.45 2a1s h LEU 343 Cb 1.29 0.40 -0.06 0.00 0.37 0.00 0.00 40.66 42.67 2a1s h LEU 343 CO 0.72 -0.43 0.20 0.00 -0.34 0.00 0.00 178.44 178.59 2a1s h ALA 344 N -0.91 0.64 0.00 1.25 0.00 -1.99 -1.46 119.26 116.79 2a1s h ALA 344 Ca -0.02 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 2a1s h ALA 344 Cb 0.58 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2a1s h ALA 344 CO -0.16 -0.18 -0.20 0.93 0.00 0.00 0.00 179.25 179.64 2a1s h GLU 345 N 0.40 0.00 0.04 0.00 3.07 -1.84 -2.79 114.58 113.46 2a1s h GLU 345 Ca 0.24 0.00 -0.18 0.00 -0.50 0.00 0.00 59.36 58.93 2a1s h GLU 345 Cb 0.24 0.00 0.02 0.00 -0.84 0.00 0.00 28.75 28.17 2a1s h GLU 345 CO -0.23 0.20 -0.72 1.25 -1.40 0.00 0.00 179.01 178.11 2a1s h LEU 346 N 0.00 0.57 -0.45 1.33 5.85 0.59 -2.70 115.31 120.50 2a1s h LEU 346 Ca -0.00 -0.80 -0.18 0.00 0.84 0.00 0.00 57.88 57.74 2a1s h LEU 346 Cb 0.51 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 2a1s h LEU 346 CO 0.03 1.31 -0.73 1.05 -0.34 0.00 0.00 178.44 179.75 2a1s h GLU 347 N -0.09 0.30 0.18 1.25 -0.00 -1.19 -0.58 114.58 114.45 2a1s h GLU 347 Ca -0.10 -0.25 -0.00 0.00 -0.00 0.00 0.00 59.36 59.01 2a1s h GLU 347 Cb 1.45 0.05 -0.01 0.00 -0.00 0.00 0.00 28.75 30.24 2a1s h GLU 347 CO 0.14 0.90 -0.14 0.87 -0.00 0.00 0.00 179.01 180.78 2a1s h LYS 348 N 0.20 -0.32 -1.01 1.06 1.57 -1.60 -2.26 116.57 114.21 2a1s h LYS 348 Ca -0.03 0.02 0.25 0.00 -1.87 0.00 0.00 60.65 59.03 2a1s h LYS 348 Cb 1.29 0.07 -0.12 0.00 0.08 0.00 0.00 32.23 33.55 2a1s h LYS 348 CO 0.12 -0.21 0.60 -0.09 -0.57 0.00 0.00 179.45 179.30 2a1s h ARG 349 N -0.33 0.54 0.00 3.15 9.65 -1.10 -1.88 114.38 124.41 2a1s h ARG 349 Ca -0.01 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.84 2a1s h ARG 349 Cb 0.29 -0.12 0.00 0.00 -1.39 0.00 0.00 29.97 28.75 2a1s h ARG 349 CO -0.00 0.35 0.00 1.28 2.80 0.00 0.00 179.97 184.40 2a1s n LEU 350 N -4.86 0.00 -0.07 3.80 4.77 -0.26 -2.34 117.00 118.04 2a1s n LEU 350 Ca 0.27 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 56.14 2a1s n LEU 350 Cb 0.77 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.71 2a1s n LEU 350 CO 0.17 0.00 -0.95 0.29 -1.33 0.00 0.00 177.39 175.57 2a1s n LYS 351 N -0.85 0.67 -1.51 3.23 5.02 -0.71 -3.83 118.16 120.18 2a1s n LYS 351 Ca 0.17 0.11 -0.30 0.00 -2.02 0.00 0.00 58.31 56.27 2a1s n LYS 351 Cb 0.08 -1.62 0.08 0.00 -0.02 0.00 0.00 35.03 33.55 2a1s n LYS 351 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2a1s s GLU 352 N -2.53 2.33 0.59 1.97 8.01 -0.99 -4.22 118.70 123.86 2a1s s GLU 352 Ca -0.11 0.80 -0.17 0.00 0.01 0.00 0.00 54.97 55.50 2a1s s GLU 352 Cb 0.07 -1.93 -0.04 0.00 -4.31 0.00 0.00 34.13 27.92 2a1s s GLU 352 CO 0.81 -1.48 1.08 0.95 0.01 0.00 0.00 175.26 176.63 2a1s s THR 353 N -3.08 3.51 -2.00 3.63 -4.23 -1.26 -1.50 115.64 110.71 2a1s s THR 353 Ca 0.60 0.79 0.00 0.00 -1.18 0.00 0.00 61.69 61.90 2a1s s THR 353 Cb -0.15 -3.29 0.01 0.00 1.34 0.00 0.00 72.50 70.41 2a1s s THR 353 CO 0.55 -0.36 1.02 -0.81 -0.54 0.00 0.00 174.62 174.48 2a1s n PRO 354 N -1.85 1.00 -2.25 3.99 -0.04 -1.26 -5.07 135.00 129.52 2a1s n PRO 354 Ca 0.10 -0.01 -0.27 0.00 -0.04 0.00 0.00 63.50 63.29 2a1s n PRO 354 Cb 0.52 -1.01 0.15 0.00 -0.04 0.00 0.00 33.50 33.12 2a1s n PRO 354 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2a1s s PHE 355 N -2.00 1.61 -0.07 0.54 0.40 -0.56 -5.01 117.98 112.89 2a1s s PHE 355 Ca 0.01 0.03 -0.02 0.00 -0.60 0.00 0.00 56.93 56.35 2a1s s PHE 355 Cb 0.00 -3.56 0.03 0.00 0.51 0.00 0.00 43.02 40.01 2a1s s PHE 355 CO 0.01 -2.18 0.05 -0.80 0.70 0.00 0.00 175.22 173.00 2a1s s ASN 356 N -4.81 1.48 0.12 1.36 0.01 -1.25 -4.72 114.94 107.13 2a1s s ASN 356 Ca 0.70 -0.09 -0.31 0.00 -0.71 0.00 0.00 52.86 52.45 2a1s s ASN 356 Cb -0.05 -0.25 -0.10 0.00 0.41 0.00 0.00 41.25 41.27 2a1s s ASN 356 CO 0.49 -0.25 1.67 -2.16 -1.51 0.00 0.00 177.10 175.34 2a1s s PRO 357 N 2.10 4.18 0.23 -0.60 0.04 -1.25 -4.72 135.00 134.99 2a1s s PRO 357 Ca 0.04 2.42 -0.31 0.00 0.04 0.00 0.00 61.00 63.19 2a1s s PRO 357 Cb -0.13 -3.43 -0.11 0.00 0.04 0.00 0.00 34.50 30.87 2a1s s PRO 357 CO -0.05 -0.72 1.64 -1.25 0.04 0.00 0.00 177.00 176.66 2a1s s PRO 358 N 2.11 4.14 0.21 0.56 0.04 -1.26 -4.96 135.00 135.85 2a1s s PRO 358 Ca 0.74 2.54 -0.30 0.00 0.04 0.00 0.00 61.00 64.03 2a1s s PRO 358 Cb -0.43 -3.07 -0.09 0.00 0.04 0.00 0.00 34.50 30.95 2a1s s PRO 358 CO 0.33 -0.67 1.26 0.21 0.04 0.00 0.00 177.00 178.17 2a1s s LYS 359 N 0.53 4.43 -0.00 4.56 2.20 -1.26 -5.00 119.74 125.20 2a1s s LYS 359 Ca 0.69 2.00 -0.26 0.00 -0.36 0.00 0.00 55.97 58.04 2a1s s LYS 359 Cb -0.48 -3.20 0.06 0.00 -1.51 0.00 0.00 37.83 32.71 2a1s s LYS 359 CO 0.38 -0.17 0.58 0.54 -0.36 0.00 0.00 175.35 176.33 2a1s s VAL 360 N -0.15 0.02 -0.02 4.02 0.11 -1.26 -2.27 120.40 120.85 2a1s s VAL 360 Ca 0.54 -0.13 -0.21 0.00 -2.93 0.00 0.00 61.98 59.25 2a1s s VAL 360 Cb -0.35 -0.95 0.04 0.00 -1.53 0.00 0.00 36.38 33.59 2a1s s VAL 360 CO 0.39 -0.07 0.46 -0.70 -3.33 0.00 0.00 175.10 171.85 2a1s s GLU 361 N -1.77 0.84 0.70 1.54 2.12 -0.68 -4.97 118.70 116.48 2a1s s GLU 361 Ca -0.09 -0.05 -0.11 0.00 0.36 0.00 0.00 54.97 55.08 2a1s s GLU 361 Cb -0.01 0.38 0.01 0.00 0.26 0.00 0.00 34.13 34.78 2a1s s GLU 361 CO 0.04 -0.25 1.06 -1.54 -0.54 0.00 0.00 175.26 174.03 2a1s s SER 362 N -1.36 5.39 0.67 -1.70 1.04 -1.26 -0.25 113.70 116.22 2a1s s SER 362 Ca -0.12 1.51 -0.09 0.00 0.48 0.00 0.00 55.95 57.73 2a1s s SER 362 Cb -0.03 -2.39 0.02 0.00 0.10 0.00 0.00 66.02 63.72 2a1s s SER 362 CO 0.05 -1.42 1.03 0.00 0.98 0.00 0.00 173.24 173.88 2a1s s ALA 363 N -3.10 3.04 0.12 5.32 0.00 -0.63 -4.68 121.76 121.82 2a1s s ALA 363 Ca 0.58 -0.49 -0.31 0.00 0.00 0.00 0.00 51.96 51.73 2a1s s ALA 363 Cb -0.13 -2.86 -0.10 0.00 0.00 0.00 0.00 23.12 20.03 2a1s s ALA 363 CO 0.55 -1.03 1.71 -2.00 0.00 0.00 0.00 175.76 174.98 2a1s s GLU 364 N -5.23 4.17 0.00 0.00 2.56 -1.26 -1.67 118.70 117.28 2a1s s GLU 364 Ca 0.57 2.46 0.00 0.00 0.00 0.00 0.00 54.97 58.00 2a1s s GLU 364 Cb -0.11 -3.46 0.00 0.00 2.00 0.00 0.00 34.13 32.57 2a1s s GLU 364 CO 0.49 -0.75 0.00 0.41 -0.56 0.00 0.00 175.26 174.85 2a1s n GLY 365 N 4.03 0.96 3.84 -1.50 0.00 -1.26 -5.03 105.19 106.24 2a1s n GLY 365 Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 2a1s n GLY 365 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2a1s s PHE 366 N -3.43 3.54 0.63 1.61 0.40 -0.67 -5.07 117.98 114.99 2a1s s PHE 366 Ca 0.00 0.47 -0.18 0.00 -0.60 0.00 0.00 56.93 56.63 2a1s s PHE 366 Cb 0.00 -1.96 -0.03 0.00 0.51 0.00 0.00 43.02 41.54 2a1s s PHE 366 CO 0.00 0.66 1.05 -2.30 0.70 0.00 0.00 175.22 175.32 2a1s n PRO 367 N 2.20 0.89 -4.48 0.24 -0.02 -1.26 -4.64 135.00 127.92 2a1s n PRO 367 Ca -0.19 0.35 -0.26 0.00 -2.02 0.00 0.00 63.50 61.38 2a1s n PRO 367 Cb 0.55 -2.27 -0.10 0.00 -0.02 0.00 0.00 33.50 31.66 2a1s n PRO 367 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2a1s s SER 368 N -1.34 3.92 0.68 2.55 1.04 -1.26 -4.86 113.70 114.42 2a1s s SER 368 Ca 0.78 -1.17 -0.01 0.00 0.48 0.00 0.00 55.95 56.03 2a1s s SER 368 Cb -0.40 -0.41 0.10 0.00 0.10 0.00 0.00 66.02 65.41 2a1s s SER 368 CO 0.45 -0.28 0.94 -0.31 0.98 0.00 0.00 173.24 175.02 2a1s s TYR 369 N -2.60 2.04 0.00 5.02 1.51 -1.26 -5.17 117.35 116.89 2a1s s TYR 369 Ca 0.34 -0.14 0.00 0.00 -1.01 0.00 0.00 57.07 56.27 2a1s s TYR 369 Cb 0.03 -2.96 0.00 0.00 -0.11 0.00 0.00 41.96 38.92 2a1s s TYR 369 CO 0.18 -1.48 0.00 0.94 -1.11 0.00 0.00 175.55 174.08 2a1s n GLN 375 N -2.73 0.00 -2.43 -0.62 -0.06 -1.26 -5.26 117.38 105.02 2a1s n GLN 375 Ca 0.12 0.00 -0.31 0.00 -2.00 0.00 0.00 57.00 54.81 2a1s n GLN 375 Cb 0.60 0.00 -0.03 0.00 -4.06 0.00 0.00 30.24 26.76 2a1s n GLN 375 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 2a1s s LEU 376 N 0.00 3.61 0.64 1.69 2.01 -1.26 -5.04 118.68 120.33 2a1s s LEU 376 Ca 0.00 1.42 -0.11 0.00 0.01 0.00 0.00 54.13 55.45 2a1s s LEU 376 Cb 0.00 -4.37 -0.03 0.00 0.01 0.00 0.00 46.19 41.81 2a1s s LEU 376 CO 0.00 -0.59 1.04 -1.00 1.01 0.00 0.00 176.35 176.81 2a1s s HIS 377 N -2.66 3.52 0.00 0.29 3.76 -1.26 -4.98 115.29 113.96 2a1s s HIS 377 Ca 0.56 1.29 0.00 0.00 -0.15 0.00 0.00 55.06 56.76 2a1s s HIS 377 Cb -0.10 -2.78 0.00 0.00 1.11 0.00 0.00 32.58 30.81 2a1s s HIS 377 CO 0.35 -0.83 0.00 -0.85 -0.85 0.00 0.00 174.74 172.57 2a1s n GLU 378 N -2.84 0.00 -0.08 1.40 0.28 -1.26 -4.90 120.64 113.25 2a1s n GLU 378 Ca 0.06 0.00 -0.07 0.00 -0.16 0.00 0.00 57.16 56.99 2a1s n GLU 378 Cb 0.54 0.00 -0.01 0.00 1.43 0.00 0.00 31.44 33.41 2a1s n GLU 378 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2a1s h ALA 379 N 0.00 -0.01 -0.43 -1.84 0.00 -1.91 -1.25 119.26 113.82 2a1s h ALA 379 Ca 0.00 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 2a1s h ALA 379 Cb 0.00 0.46 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 2a1s h ALA 379 CO 0.00 -0.60 0.26 0.78 0.00 0.00 0.00 179.25 179.69 2a1s h GLY 380 N -0.17 0.62 1.86 0.00 0.00 -1.84 0.25 103.07 103.79 2a1s h GLY 380 Ca 0.16 -0.26 -0.06 0.00 0.00 0.00 0.00 47.33 47.17 2a1s h GLY 380 CO -0.41 0.25 -0.23 -1.82 0.00 0.00 0.00 176.54 174.33 2a1s h TYR 381 N 0.57 0.18 -0.29 5.60 3.20 -1.88 -2.02 116.97 122.33 2a1s h TYR 381 Ca 0.15 -0.03 -0.16 0.00 3.14 0.00 0.00 58.73 61.84 2a1s h TYR 381 Cb -0.01 -0.05 -0.00 0.00 1.54 0.00 0.00 36.73 38.21 2a1s h TYR 381 CO -0.03 0.39 -0.43 -0.44 -1.64 0.00 0.00 178.16 176.01 2a1s h ASP 382 N 0.16 0.87 -0.49 -2.11 5.19 -0.37 -1.76 116.42 117.91 2a1s h ASP 382 Ca 0.03 -0.51 -0.00 0.00 -0.62 0.00 0.00 57.03 55.92 2a1s h ASP 382 Cb 0.49 -0.25 -0.02 0.00 0.18 0.00 0.00 39.33 39.73 2a1s h ASP 382 CO 0.03 1.21 0.29 0.00 -3.12 0.00 0.00 179.24 177.66 2a1s h ALA 383 N 0.68 0.63 -0.55 3.45 0.00 -0.76 0.11 119.26 122.82 2a1s h ALA 383 Ca 0.03 -0.07 0.07 0.00 0.00 0.00 0.00 54.91 54.93 2a1s h ALA 383 Cb 1.03 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 18.56 2a1s h ALA 383 CO 0.10 0.12 0.23 -0.92 0.00 0.00 0.00 179.25 178.79 2a1s h TYR 384 N 0.66 0.42 -0.05 0.00 3.20 -1.31 0.16 116.97 120.05 2a1s h TYR 384 Ca 0.18 0.03 -0.22 0.00 3.14 0.00 0.00 58.73 61.85 2a1s h TYR 384 Cb 0.01 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.17 2a1s h TYR 384 CO -0.03 0.16 -0.86 0.82 -1.64 0.00 0.00 178.16 176.62 2a1s h ILE 385 N 0.44 1.35 -0.50 1.81 1.08 -1.01 -1.92 117.51 118.77 2a1s h ILE 385 Ca 0.26 -2.23 0.06 0.00 -0.39 0.00 0.00 64.86 62.56 2a1s h ILE 385 Cb 0.25 2.23 -0.05 0.00 -3.07 0.00 0.00 36.82 36.18 2a1s h ILE 385 CO -0.23 0.68 0.20 0.74 -0.69 0.00 0.00 178.15 178.85 2a1s h THR 386 N 0.33 0.87 -0.42 -0.27 2.02 -0.08 -0.93 112.91 114.42 2a1s h THR 386 Ca -0.07 -0.13 -0.07 0.00 0.77 0.00 0.00 66.41 66.91 2a1s h THR 386 Cb 1.47 0.44 -0.02 0.00 -1.74 0.00 0.00 68.15 68.30 2a1s h THR 386 CO 0.16 0.07 -0.03 1.23 0.37 0.00 0.00 175.52 177.31 2a1s h GLY 387 N 0.39 0.76 0.97 2.16 0.00 -0.60 -2.78 103.07 103.97 2a1s h GLY 387 Ca 0.23 -0.51 -0.01 0.00 0.00 0.00 0.00 47.33 47.04 2a1s h GLY 387 CO -0.22 0.47 0.25 1.41 0.00 0.00 0.00 176.54 178.45 2a1s h LEU 388 N 0.66 0.63 -1.18 3.11 3.38 -0.51 -2.12 115.31 119.28 2a1s h LEU 388 Ca 0.13 -0.12 0.09 0.00 0.09 0.00 0.00 57.88 58.07 2a1s h LEU 388 Cb 0.46 -0.16 -0.06 0.00 0.09 0.00 0.00 40.66 40.98 2a1s h LEU 388 CO 0.02 0.57 0.58 0.00 0.09 0.00 0.00 178.44 179.70 2a1s h PHE 390 N 0.93 -0.35 -1.00 0.00 3.57 -1.22 0.75 116.94 119.62 2a1s h PHE 390 Ca 0.41 -0.01 0.16 0.00 3.53 0.00 0.00 57.97 62.06 2a1s h PHE 390 Cb 0.35 0.12 -0.10 0.00 2.79 0.00 0.00 35.95 39.11 2a1s h PHE 390 CO -0.00 0.00 0.62 0.82 -2.23 0.00 0.00 178.31 177.52 2a1s h ILE 391 N -0.84 0.79 -0.39 1.41 2.04 -1.31 1.12 117.51 120.33 2a1s h ILE 391 Ca -0.04 -0.29 -0.12 0.00 1.00 0.00 0.00 64.86 65.41 2a1s h ILE 391 Cb 0.52 -0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.46 2a1s h ILE 391 CO 0.06 0.15 -0.23 -1.28 0.00 0.00 0.00 178.15 176.86 2a1s h SER 392 N 0.84 0.88 0.05 1.72 0.87 -1.09 -1.86 113.55 114.96 2a1s h SER 392 Ca 0.54 -0.42 -0.25 0.00 -1.23 0.00 0.00 61.79 60.43 2a1s h SER 392 Cb 0.75 -0.24 0.02 0.00 -0.44 0.00 0.00 62.40 62.49 2a1s h SER 392 CO -0.33 1.11 -0.98 0.24 -0.53 0.00 0.00 176.83 176.34 2a1s h MET 393 N 0.65 0.65 -0.53 2.24 2.86 0.71 -3.16 114.93 118.36 2a1s h MET 393 Ca 0.08 -0.67 -0.08 0.00 -2.06 0.00 0.00 59.70 56.96 2a1s h MET 393 Cb 0.80 0.18 -0.02 0.00 0.06 0.00 0.00 31.60 32.62 2a1s h MET 393 CO 0.07 1.27 0.00 0.00 1.06 0.00 0.00 176.91 179.31 2a1s h ALA 394 N 0.50 0.71 -0.58 6.32 0.00 0.13 -2.83 119.26 123.52 2a1s h ALA 394 Ca -0.11 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.49 2a1s h ALA 394 Cb 1.63 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 19.20 2a1s h ALA 394 CO 0.19 0.53 0.26 -0.91 0.00 0.00 0.00 179.25 179.32 2a1s h ASN 395 N 0.80 0.75 -0.73 0.00 2.35 -1.40 -2.00 115.58 115.36 2a1s h ASN 395 Ca 0.15 -0.08 0.03 0.00 -0.55 0.00 0.00 56.30 55.84 2a1s h ASN 395 Cb 0.53 -0.19 -0.04 0.00 0.05 0.00 0.00 38.32 38.67 2a1s h ASN 395 CO 0.03 0.65 0.48 0.22 -1.65 0.00 0.00 177.43 177.16 2a1s h TYR 396 N 0.82 0.87 -0.46 1.19 3.20 -1.47 -2.01 116.97 119.11 2a1s h TYR 396 Ca 0.20 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 62.02 2a1s h TYR 396 Cb 0.12 -0.29 -0.02 0.00 1.54 0.00 0.00 36.73 38.08 2a1s h TYR 396 CO 0.01 0.52 0.00 -0.07 -1.64 0.00 0.00 178.16 176.98 2a1s h LEU 397 N 0.91 0.73 -1.36 2.82 3.38 -1.27 -2.41 115.31 118.11 2a1s h LEU 397 Ca 0.28 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2a1s h LEU 397 Cb 0.01 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.57 2a1s h LEU 397 CO -0.08 0.79 0.00 1.23 0.09 0.00 0.00 178.44 180.48 2a1s h GLY 398 N 0.96 0.00 2.00 0.83 0.00 -1.16 -3.01 103.07 102.69 2a1s h GLY 398 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.47 2a1s h GLY 398 CO 0.02 0.00 0.00 1.76 0.00 0.00 0.00 176.54 178.32 2a1s h SER 399 N 0.00 0.00 0.76 0.19 0.02 -0.90 -1.90 113.55 111.72 2a1s h SER 399 Ca 0.00 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 2a1s h SER 399 Cb 0.51 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.05 2a1s h SER 399 CO 0.00 0.00 -1.25 0.49 -1.14 0.00 0.00 176.83 174.93 2a1s n PHE 400 N -2.59 0.78 -1.06 3.45 3.01 -1.14 -4.70 117.46 115.22 2a1s n PHE 400 Ca 0.00 0.23 -0.35 0.00 1.01 0.00 0.00 57.45 58.35 2a1s n PHE 400 Cb 0.19 -0.89 0.10 0.00 -0.01 0.00 0.00 39.48 38.86 2a1s n PHE 400 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 2a1s n LEU 401 N -2.62 0.89 -3.92 4.37 4.77 -1.11 -4.83 117.00 114.55 2a1s n LEU 401 Ca -0.02 0.49 -0.31 0.00 -0.03 0.00 0.00 56.01 56.14 2a1s n LEU 401 Cb 0.59 -1.25 -0.15 0.00 -2.33 0.00 0.00 43.42 40.28 2a1s n LEU 401 CO 0.41 -3.13 -0.35 -0.94 -1.33 0.00 0.00 177.39 172.05 2a1s s SER 402 N -1.77 4.36 0.56 -1.43 1.04 -1.26 -0.97 113.70 114.23 2a1s s SER 402 Ca 0.63 -1.79 -0.15 0.00 0.48 0.00 0.00 55.95 55.12 2a1s s SER 402 Cb -0.29 -1.31 -0.06 0.00 0.10 0.00 0.00 66.02 64.47 2a1s s SER 402 CO 0.61 -0.36 1.01 -2.16 0.98 0.00 0.00 173.24 173.33 2a1s s PRO 403 N 1.22 3.68 0.22 4.02 0.04 -1.26 -5.10 135.00 137.81 2a1s s PRO 403 Ca 0.07 1.01 -0.32 0.00 0.04 0.00 0.00 61.00 61.80 2a1s s PRO 403 Cb -0.18 -2.09 -0.12 0.00 0.04 0.00 0.00 34.50 32.15 2a1s s PRO 403 CO -0.13 -0.50 1.70 -1.25 0.04 0.00 0.00 177.00 176.86 2a1s s PRO 404 N -4.23 4.13 0.35 0.56 0.04 -0.14 -4.99 135.00 130.72 2a1s s PRO 404 Ca 0.60 2.59 -0.06 0.00 0.04 0.00 0.00 61.00 64.17 2a1s s PRO 404 Cb -0.12 -3.07 -0.05 0.00 0.04 0.00 0.00 34.50 31.30 2a1s s PRO 404 CO 0.36 -0.73 0.65 0.21 0.04 0.00 0.00 177.00 177.53 2a1s s LYS 405 N 0.95 3.65 0.00 4.56 2.47 -0.73 -4.99 119.74 125.65 2a1s s LYS 405 Ca 0.73 0.14 0.00 0.00 -1.56 0.00 0.00 55.97 55.28 2a1s s LYS 405 Cb -0.49 -2.54 0.00 0.00 -1.46 0.00 0.00 37.83 33.34 2a1s s LYS 405 CO 0.34 0.08 0.00 1.51 0.16 0.00 0.00 175.35 177.44 2a1s n ILE 406 N -1.29 0.00 -3.74 5.43 0.13 -1.26 -4.28 119.36 114.35 2a1s n ILE 406 Ca -0.00 0.46 -0.36 0.00 -1.10 0.00 0.00 62.75 61.75 2a1s n ILE 406 Cb 0.54 -1.43 -0.09 0.00 -0.84 0.00 0.00 39.64 37.82 2a1s n ILE 406 CO 0.00 0.00 0.00 -2.28 2.80 0.00 0.00 176.55 177.07 2a1s s HIS 407 N -0.93 3.32 -0.37 9.51 2.46 -1.26 -4.89 115.29 123.14 2a1s s HIS 407 Ca 0.00 0.19 -0.11 0.00 0.47 0.00 0.00 55.06 55.61 2a1s s HIS 407 Cb 0.00 -2.21 0.02 0.00 -0.13 0.00 0.00 32.58 30.26 2a1s s HIS 407 CO 0.00 0.11 0.21 0.08 -2.47 0.00 0.00 174.74 172.67 2a1s s VAL 408 N 0.80 4.66 0.88 0.89 1.01 -1.26 -5.09 120.40 122.29 2a1s s VAL 408 Ca 0.07 -0.75 -0.12 0.00 0.00 0.00 0.00 61.98 61.18 2a1s s VAL 408 Cb -0.13 -3.56 0.12 0.00 0.00 0.00 0.00 36.38 32.81 2a1s s VAL 408 CO 0.02 -0.19 1.10 -0.55 0.00 0.00 0.00 175.10 175.49 2a1s s SER 409 N 1.58 3.71 0.20 3.32 0.15 -1.26 -4.78 113.70 116.62 2a1s s SER 409 Ca 0.03 1.29 0.23 0.00 0.70 0.00 0.00 55.95 58.20 2a1s s SER 409 Cb -0.19 -1.97 0.91 0.00 -1.71 0.00 0.00 66.02 63.06 2a1s s SER 409 CO 0.07 -2.46 1.70 0.00 1.20 0.00 0.00 173.24 173.75 2a1s n ALA 410 N -3.75 1.83 1.37 5.45 0.00 -1.26 -2.46 120.51 121.69 2a1s n ALA 410 Ca 0.07 0.03 0.13 0.00 0.00 0.00 0.00 53.44 53.68 2a1s n ALA 410 Cb 0.57 -1.39 0.43 0.00 0.00 0.00 0.00 19.45 19.06 2a1s n ALA 410 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2a1s n ARG 411 N -2.11 1.49 -1.43 0.00 1.74 -1.26 -4.93 116.66 110.17 2a1s n ARG 411 Ca 0.03 -0.93 -0.35 0.00 -0.77 0.00 0.00 57.85 55.84 2a1s n ARG 411 Cb 0.27 -1.48 0.10 0.00 -1.02 0.00 0.00 32.46 30.33 2a1s n ARG 411 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2a1s s SER 412 N -2.15 4.14 0.44 0.55 0.15 -1.03 -4.91 113.70 110.90 2a1s s SER 412 Ca 0.33 2.43 0.30 0.00 0.70 0.00 0.00 55.95 59.71 2a1s s SER 412 Cb 0.20 -2.60 1.26 0.00 -1.71 0.00 0.00 66.02 63.17 2a1s s SER 412 CO 0.39 -2.31 1.89 0.07 1.20 0.00 0.00 173.24 174.48 2a1s h LYS 413 N -0.23 0.00 0.00 5.44 2.10 -1.94 -3.06 116.57 118.87 2a1s h LYS 413 Ca -0.48 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.14 2a1s h LYS 413 Cb 1.31 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.63 2a1s h LYS 413 CO 0.50 0.00 -0.11 -0.07 -2.00 0.00 0.00 179.45 177.76 2a1s h LEU 414 N 0.00 0.00 0.00 7.07 3.38 -1.92 -3.16 115.31 120.67 2a1s h LEU 414 Ca 0.00 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.67 2a1s h LEU 414 Cb 0.44 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.13 2a1s h LEU 414 CO 0.00 0.11 -1.81 -0.38 0.09 0.00 0.00 178.44 176.45 2a1s n ILE 415 N -3.54 1.55 -0.31 1.22 -0.00 -1.16 -4.50 119.36 112.62 2a1s n ILE 415 Ca -0.01 -0.80 0.06 0.00 -0.00 0.00 0.00 62.75 62.00 2a1s n ILE 415 Cb 0.25 -0.92 0.16 0.00 -0.00 0.00 0.00 39.64 39.13 2a1s n ILE 415 CO 0.00 0.00 0.00 -0.33 -0.00 0.00 0.00 176.55 176.22 2a1s h GLU 416 N 0.00 0.02 0.00 0.38 5.08 -1.66 0.27 114.58 118.66 2a1s h GLU 416 Ca -0.32 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.04 2a1s h GLU 416 Cb 2.03 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.28 2a1s h GLU 416 CO 0.07 0.01 0.00 -0.35 -1.00 0.00 0.00 179.01 177.74 2a1s n PRO 417 N -5.52 0.05 -0.04 2.33 -0.04 -1.26 -1.06 135.00 129.46 2a1s n PRO 417 Ca 0.15 0.15 0.03 0.00 -0.04 0.00 0.00 63.50 63.79 2a1s n PRO 417 Cb 0.51 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.52 2a1s n PRO 417 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2a1s n PHE 418 N -1.17 0.11 -1.39 0.54 3.01 0.93 -5.03 117.46 114.46 2a1s n PHE 418 Ca 0.01 -0.25 -0.31 0.00 1.01 0.00 0.00 57.45 57.91 2a1s n PHE 418 Cb 0.01 -0.02 0.08 0.00 -0.01 0.00 0.00 39.48 39.54 2a1s n PHE 418 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 2a1s s PHE 419 N -0.72 2.80 -0.68 1.38 2.99 -0.22 -4.13 117.98 119.39 2a1s s PHE 419 Ca 0.09 1.49 -0.09 0.00 0.00 0.00 0.00 56.93 58.42 2a1s s PHE 419 Cb 0.05 -2.98 0.09 0.00 0.00 0.00 0.00 43.02 40.18 2a1s s PHE 419 CO 0.07 -1.57 0.22 0.09 -0.00 0.00 0.00 175.22 174.03 2a1s n ASN 420 N -3.37 -0.70 -4.02 1.36 4.13 0.95 -4.88 115.26 108.73 2a1s n ASN 420 Ca 0.08 -0.43 -0.31 0.00 1.68 0.00 0.00 54.58 55.61 2a1s n ASN 420 Cb 0.53 -0.62 -0.16 0.00 -1.54 0.00 0.00 39.78 37.99 2a1s n ASN 420 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 2a1s s LYS 421 N -3.35 2.28 0.02 3.52 1.02 -1.26 -4.75 119.74 117.22 2a1s s LYS 421 Ca 0.30 -0.70 0.03 0.00 0.02 0.00 0.00 55.97 55.62 2a1s s LYS 421 Cb -0.18 -2.27 -0.04 0.00 -0.52 0.00 0.00 37.83 34.82 2a1s s LYS 421 CO 0.37 -0.30 -0.02 -0.51 -0.92 0.00 0.00 175.35 173.97 2a1s s LEU 422 N 1.43 3.41 0.44 3.17 1.43 -1.10 -3.85 118.68 123.61 2a1s s LEU 422 Ca 0.03 -0.08 0.22 0.00 -1.03 0.00 0.00 54.13 53.26 2a1s s LEU 422 Cb -0.14 -2.00 1.20 0.00 0.03 0.00 0.00 46.19 45.28 2a1s s LEU 422 CO -0.10 0.26 1.83 0.15 0.23 0.00 0.00 176.35 178.72 2a1s h PHE 423 N 4.19 0.43 0.00 0.29 3.57 -1.95 -2.87 116.94 120.61 2a1s h PHE 423 Ca -0.49 0.01 -0.39 0.00 3.53 0.00 0.00 57.97 60.64 2a1s h PHE 423 Cb 1.17 -0.13 -0.06 0.00 2.79 0.00 0.00 35.95 39.72 2a1s h PHE 423 CO 0.60 0.08 -2.37 1.28 -2.23 0.00 0.00 178.31 175.67 2a1s n LEU 424 N -4.47 2.33 -4.40 0.59 4.77 -1.26 -4.79 117.00 109.76 2a1s n LEU 424 Ca 0.22 0.10 -0.45 0.00 -0.03 0.00 0.00 56.01 55.85 2a1s n LEU 424 Cb 0.85 -0.77 -0.03 0.00 -2.33 0.00 0.00 43.42 41.14 2a1s n LEU 424 CO 0.31 0.69 0.70 -0.32 -1.33 0.00 0.00 177.39 177.45 2a1s s MET 425 N -2.46 3.50 0.36 3.23 1.75 -1.09 -4.94 119.30 119.65 2a1s s MET 425 Ca -0.33 -1.90 0.05 0.00 -1.25 0.00 0.00 55.69 52.26 2a1s s MET 425 Cb 0.11 -4.63 0.69 0.00 2.84 0.00 0.00 34.83 33.84 2a1s s MET 425 CO 0.49 -1.58 1.96 0.00 -0.65 0.00 0.00 175.02 175.24 2a1s h ARG 426 N 8.56 0.60 0.00 4.11 2.47 -1.86 -2.91 114.38 125.35 2a1s h ARG 426 Ca 0.05 -0.08 0.00 0.00 -1.26 0.00 0.00 59.98 58.70 2a1s h ARG 426 Cb 1.04 -0.11 0.00 0.00 -1.65 0.00 0.00 29.97 29.25 2a1s h ARG 426 CO 0.99 0.49 0.00 0.28 0.56 0.00 0.00 179.97 182.29