#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x9s s ILE 2 N 0.00 0.04 -0.13 1.12 -4.36 -0.73 -1.81 121.20 115.32 1x9s s ILE 2 Ca 0.00 -0.32 -0.04 0.00 -0.26 0.00 0.00 60.65 60.03 1x9s s ILE 2 Cb 0.00 -0.15 -0.03 0.00 1.25 0.00 0.00 42.46 43.52 1x9s s ILE 2 CO 0.00 -0.18 0.00 -0.69 0.24 0.00 0.00 174.94 174.31 1x9s s VAL 3 N -0.53 4.29 0.20 8.37 1.01 -0.17 0.44 120.40 134.00 1x9s s VAL 3 Ca -0.06 -0.23 -0.04 0.00 0.00 0.00 0.00 61.98 61.65 1x9s s VAL 3 Cb -0.04 -2.86 -0.03 0.00 0.00 0.00 0.00 36.38 33.45 1x9s s VAL 3 CO -0.00 0.53 0.20 -0.55 0.00 0.00 0.00 175.10 175.28 1x9s s SER 4 N -0.17 0.11 -0.23 3.32 0.15 0.22 -0.41 113.70 116.67 1x9s s SER 4 Ca 0.05 -1.27 -0.28 0.00 0.70 0.00 0.00 55.95 55.15 1x9s s SER 4 Cb -0.13 0.42 0.14 0.00 -1.71 0.00 0.00 66.02 64.74 1x9s s SER 4 CO 0.02 -0.90 1.11 -0.62 1.20 0.00 0.00 173.24 174.05 1x9s s ASP 5 N -3.12 -0.32 0.26 5.45 2.15 -0.98 -4.35 116.67 115.76 1x9s s ASP 5 Ca 0.34 0.49 0.06 0.00 0.43 0.00 0.00 52.55 53.87 1x9s s ASP 5 Cb 0.05 0.45 -0.05 0.00 -0.30 0.00 0.00 42.92 43.07 1x9s s ASP 5 CO 0.11 -0.20 -0.06 0.27 -0.17 0.00 0.00 175.17 175.12 1x9s s ILE 6 N -0.48 1.55 -0.11 4.11 -4.36 -1.26 -1.50 121.20 119.13 1x9s s ILE 6 Ca 0.02 -2.12 0.02 0.00 -0.26 0.00 0.00 60.65 58.32 1x9s s ILE 6 Cb -0.03 -2.37 0.01 0.00 1.25 0.00 0.00 42.46 41.33 1x9s s ILE 6 CO -0.04 -0.35 -0.18 -1.61 0.24 0.00 0.00 174.94 173.00 1x9s s GLU 7 N -3.74 2.50 0.39 0.37 0.41 0.15 -4.98 118.70 113.80 1x9s s GLU 7 Ca 0.28 -0.67 0.04 0.00 -0.41 0.00 0.00 54.97 54.21 1x9s s GLU 7 Cb 0.03 -2.06 -0.03 0.00 -1.78 0.00 0.00 34.13 30.30 1x9s s GLU 7 CO 0.10 -0.02 0.13 0.00 -0.49 0.00 0.00 175.26 174.98 1x9s s ALA 8 N 0.86 2.75 -2.10 5.21 0.00 -1.26 -0.26 121.76 126.96 1x9s s ALA 8 Ca -0.08 -1.39 0.17 0.00 0.00 0.00 0.00 51.96 50.66 1x9s s ALA 8 Cb -0.15 0.79 0.81 0.00 0.00 0.00 0.00 23.12 24.57 1x9s s ALA 8 CO -0.00 -0.36 1.55 0.27 0.00 0.00 0.00 175.76 177.22 1x9s n ASN 9 N -1.21 0.71 -2.91 0.00 6.94 -0.28 -4.80 115.26 113.70 1x9s n ASN 9 Ca -0.05 -1.62 0.01 0.00 -0.02 0.00 0.00 54.58 52.90 1x9s n ASN 9 Cb 0.65 -0.05 0.01 0.00 -2.36 0.00 0.00 39.78 38.03 1x9s n ASN 9 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1x9s n ALA 10 N -0.28 -2.41 -1.77 -2.53 0.00 -1.26 -4.71 120.51 107.55 1x9s n ALA 10 Ca 0.13 -0.58 -0.32 0.00 0.00 0.00 0.00 53.44 52.66 1x9s n ALA 10 Cb 0.17 0.15 -0.01 0.00 0.00 0.00 0.00 19.45 19.75 1x9s n ALA 10 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1x9s s LEU 11 N 0.00 3.56 0.16 0.00 1.43 -1.26 -4.62 118.68 117.95 1x9s s LEU 11 Ca 0.20 1.66 -0.20 0.00 -1.03 0.00 0.00 54.13 54.77 1x9s s LEU 11 Cb -0.01 -4.52 0.08 0.00 0.03 0.00 0.00 46.19 41.77 1x9s s LEU 11 CO 0.00 -0.83 1.27 -0.11 0.23 0.00 0.00 176.35 176.91 1x9s n LEU 12 N -1.80 -0.69 -0.33 1.79 7.94 -1.26 -1.00 117.00 121.64 1x9s n LEU 12 Ca 0.07 1.45 0.22 0.00 -1.11 0.00 0.00 56.01 56.65 1x9s n LEU 12 Cb 0.54 -0.26 0.42 0.00 0.53 0.00 0.00 43.42 44.64 1x9s n LEU 12 CO 0.47 -1.24 0.92 -0.33 -1.11 0.00 0.00 177.39 176.09 1x9s h GLU 13 N 0.00 0.01 0.00 1.96 3.07 -1.98 -2.89 114.58 114.74 1x9s h GLU 13 Ca 0.21 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.07 1x9s h GLU 13 Cb 0.42 -0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.33 1x9s h GLU 13 CO -0.80 0.01 -0.10 -1.13 -1.40 0.00 0.00 179.01 175.59 1x9s n SER 14 N -5.39 1.33 -4.77 1.42 3.41 -0.19 -5.07 113.62 104.37 1x9s n SER 14 Ca 0.30 -2.16 -0.40 0.00 -0.26 0.00 0.00 58.87 56.34 1x9s n SER 14 Cb 0.99 -0.18 -0.01 0.00 -0.26 0.00 0.00 64.21 64.75 1x9s n SER 14 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1x9s s VAL 15 N -1.21 2.61 0.00 -3.33 0.11 -0.17 -4.87 120.40 113.54 1x9s s VAL 15 Ca 0.10 0.58 0.00 0.00 -2.93 0.00 0.00 61.98 59.73 1x9s s VAL 15 Cb 0.09 -3.36 0.00 0.00 -1.53 0.00 0.00 36.38 31.58 1x9s s VAL 15 CO 0.01 0.11 0.00 0.35 -3.33 0.00 0.00 175.10 172.24 1x9s n THR 16 N 0.45 0.00 -4.11 5.04 -2.24 -1.26 -4.87 114.28 107.29 1x9s n THR 16 Ca 0.02 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.57 1x9s n THR 16 Cb 0.42 1.00 -0.17 0.00 -2.10 0.00 0.00 70.33 69.49 1x9s n THR 16 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1x9s s LYS 17 N 0.00 1.05 -0.50 -0.78 2.20 -1.26 -4.83 119.74 115.62 1x9s s LYS 17 Ca 0.00 -0.14 -0.22 0.00 -0.36 0.00 0.00 55.97 55.25 1x9s s LYS 17 Cb 0.00 -1.09 0.04 0.00 -1.51 0.00 0.00 37.83 35.27 1x9s s LYS 17 CO 0.00 -0.14 0.77 0.12 -0.36 0.00 0.00 175.35 175.74 1x9s s PHE 18 N 1.22 2.95 -0.08 4.03 5.36 -1.26 -1.13 117.98 129.07 1x9s s PHE 18 Ca -0.06 -0.15 -0.22 0.00 -0.96 0.00 0.00 56.93 55.54 1x9s s PHE 18 Cb -0.14 -3.73 -0.18 0.00 -0.34 0.00 0.00 43.02 38.64 1x9s s PHE 18 CO -0.02 -1.11 0.84 0.45 -1.46 0.00 0.00 175.22 173.91 1x9s h HIS 19 N 9.09 -0.09 -2.04 10.12 3.86 -0.94 -3.42 115.15 131.72 1x9s h HIS 19 Ca -0.26 -0.00 0.23 0.00 -1.16 0.00 0.00 60.37 59.17 1x9s h HIS 19 Cb 1.09 0.03 -0.09 0.00 1.06 0.00 0.00 27.41 29.49 1x9s h HIS 19 CO 0.81 0.47 0.60 0.00 0.86 0.00 0.00 177.93 180.68 1x9s s GLY 21 N -2.95 0.24 0.00 0.00 0.00 -0.06 0.34 107.32 104.90 1x9s s GLY 21 Ca 0.13 -0.64 -0.00 0.00 0.00 0.00 0.00 44.72 44.21 1x9s s GLY 21 CO 0.00 -0.66 0.00 0.14 0.00 0.00 0.00 173.10 172.58 1x9s s VAL 22 N -3.92 0.01 -0.03 1.40 1.01 -0.56 -0.58 120.40 117.73 1x9s s VAL 22 Ca 0.13 -0.10 0.02 0.00 0.00 0.00 0.00 61.98 62.03 1x9s s VAL 22 Cb 0.02 -0.04 0.01 0.00 0.00 0.00 0.00 36.38 36.37 1x9s s VAL 22 CO -0.03 -0.05 -0.08 -0.63 0.00 0.00 0.00 175.10 174.31 1x9s s ILE 23 N -0.15 0.72 -0.18 2.22 1.01 -0.91 -2.32 121.20 121.58 1x9s s ILE 23 Ca -0.02 -0.32 -0.02 0.00 0.00 0.00 0.00 60.65 60.30 1x9s s ILE 23 Cb -0.01 -0.65 -0.01 0.00 0.01 0.00 0.00 42.46 41.80 1x9s s ILE 23 CO -0.00 0.23 -0.09 -0.47 0.00 0.00 0.00 174.94 174.61 1x9s s TYR 24 N 0.27 2.90 -0.28 3.97 5.04 0.45 -1.54 117.35 128.15 1x9s s TYR 24 Ca -0.04 -0.86 -0.07 0.00 -2.44 0.00 0.00 57.07 53.66 1x9s s TYR 24 Cb -0.09 -1.99 -0.00 0.00 0.35 0.00 0.00 41.96 40.23 1x9s s TYR 24 CO 0.00 -0.42 0.08 0.34 -1.34 0.00 0.00 175.55 174.22 1x9s s ASP 25 N 0.99 5.16 0.36 4.32 -1.08 -0.90 -1.00 116.67 124.51 1x9s s ASP 25 Ca -0.01 -0.55 0.03 0.00 -0.52 0.00 0.00 52.55 51.50 1x9s s ASP 25 Cb -0.15 -1.90 0.66 0.00 -1.46 0.00 0.00 42.92 40.07 1x9s s ASP 25 CO -0.01 -0.15 2.01 1.88 0.52 0.00 0.00 175.17 179.42 1x9s h TYR 26 N 8.25 0.75 0.00 -5.34 0.05 -1.70 0.49 116.97 119.48 1x9s h TYR 26 Ca -0.34 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.46 1x9s h TYR 26 Cb 1.14 -0.25 0.00 0.00 1.01 0.00 0.00 36.73 38.63 1x9s h TYR 26 CO 0.63 0.49 0.00 0.66 -1.05 0.00 0.00 178.16 178.88 1x9s h SER 27 N 0.81 0.00 0.00 3.88 4.64 -1.91 -3.13 113.55 117.84 1x9s h SER 27 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 1x9s h SER 27 Cb -0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.02 1x9s h SER 27 CO -0.04 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.27 1x9s n THR 28 N -2.37 0.00 -2.15 2.95 -2.24 -0.78 -5.03 114.28 104.66 1x9s n THR 28 Ca 0.00 -0.22 -0.16 0.00 -2.27 0.00 0.00 64.05 61.40 1x9s n THR 28 Cb 0.15 1.36 -0.03 0.00 -2.10 0.00 0.00 70.33 69.71 1x9s n THR 28 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1x9s n ALA 29 N -0.16 -0.58 -2.45 6.98 0.00 0.17 -4.97 120.51 119.50 1x9s n ALA 29 Ca 0.00 0.17 -0.25 0.00 0.00 0.00 0.00 53.44 53.36 1x9s n ALA 29 Cb 0.09 -1.78 -0.11 0.00 0.00 0.00 0.00 19.45 17.65 1x9s n ALA 29 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1x9s s GLU 30 N -4.57 1.60 -0.27 0.00 2.02 -1.21 -4.94 118.70 111.33 1x9s s GLU 30 Ca 0.00 -1.65 -0.06 0.00 0.02 0.00 0.00 54.97 53.28 1x9s s GLU 30 Cb 0.00 -1.80 -0.00 0.00 0.10 0.00 0.00 34.13 32.43 1x9s s GLU 30 CO 0.00 0.36 0.05 0.71 0.02 0.00 0.00 175.26 176.40 1x9s s TYR 31 N -2.11 3.10 -0.14 1.61 1.51 -1.26 -2.11 117.35 117.94 1x9s s TYR 31 Ca 0.26 -0.88 -0.03 0.00 -1.01 0.00 0.00 57.07 55.40 1x9s s TYR 31 Cb -0.06 -2.21 -0.03 0.00 -0.11 0.00 0.00 41.96 39.54 1x9s s TYR 31 CO 0.12 -0.53 -0.02 0.08 -1.11 0.00 0.00 175.55 174.09 1x9s s VAL 32 N 1.51 4.03 -0.03 0.71 1.01 -0.59 -4.98 120.40 122.06 1x9s s VAL 32 Ca 0.04 -0.32 -0.03 0.00 0.00 0.00 0.00 61.98 61.67 1x9s s VAL 32 Cb -0.16 -2.75 -0.04 0.00 0.00 0.00 0.00 36.38 33.43 1x9s s VAL 32 CO 0.01 0.51 0.14 -0.44 0.00 0.00 0.00 175.10 175.32 1x9s s SER 33 N 0.09 6.12 -0.19 3.32 0.01 -1.26 -2.13 113.70 119.66 1x9s s SER 33 Ca 0.00 0.30 -0.00 0.00 1.31 0.00 0.00 55.95 57.56 1x9s s SER 33 Cb -0.13 -1.88 0.05 0.00 0.21 0.00 0.00 66.02 64.26 1x9s s SER 33 CO 0.02 0.30 -0.06 -0.31 0.41 0.00 0.00 173.24 173.60 1x9s s TYR 34 N -1.21 1.98 0.68 2.43 1.51 0.25 -5.01 117.35 117.99 1x9s s TYR 34 Ca 0.23 -1.34 -0.04 0.00 -1.01 0.00 0.00 57.07 54.91 1x9s s TYR 34 Cb -0.12 -1.43 0.08 0.00 -0.11 0.00 0.00 41.96 40.37 1x9s s TYR 34 CO 0.14 -0.68 0.96 1.03 -1.11 0.00 0.00 175.55 175.89 1x9s s ARG 35 N 1.54 2.09 0.08 -0.62 0.52 -1.26 -0.88 118.95 120.41 1x9s s ARG 35 Ca -0.01 -0.59 -0.08 0.00 -0.52 0.00 0.00 55.73 54.53 1x9s s ARG 35 Cb -0.16 -2.27 0.07 0.00 0.52 0.00 0.00 34.95 33.11 1x9s s ARG 35 CO -0.07 -1.21 0.60 -2.30 0.02 0.00 0.00 175.30 172.33 1x9s n PRO 36 N -2.80 -0.11 -0.03 3.54 -0.02 -0.49 0.82 135.00 135.91 1x9s n PRO 36 Ca 0.10 0.59 0.01 0.00 -2.02 0.00 0.00 63.50 62.18 1x9s n PRO 36 Cb 0.60 -0.88 0.02 0.00 -0.02 0.00 0.00 33.50 33.23 1x9s n PRO 36 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1x9s n SER 37 N -4.55 0.32 -0.85 2.55 3.41 -1.26 -3.13 113.62 110.11 1x9s n SER 37 Ca 0.03 -2.00 0.07 0.00 -0.26 0.00 0.00 58.87 56.72 1x9s n SER 37 Cb 0.14 -0.05 0.20 0.00 -0.26 0.00 0.00 64.21 64.24 1x9s n SER 37 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1x9s n ASP 38 N -0.33 3.21 -0.21 4.04 8.00 0.24 -4.64 116.55 126.86 1x9s n ASP 38 Ca 0.02 -1.99 -0.02 0.00 0.71 0.00 0.00 54.79 53.51 1x9s n ASP 38 Cb 0.05 -0.30 0.09 0.00 -0.02 0.00 0.00 41.12 40.95 1x9s n ASP 38 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 1x9s h PHE 39 N 2.72 0.56 -0.66 1.24 3.57 -1.63 0.32 116.94 123.07 1x9s h PHE 39 Ca 0.00 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.50 1x9s h PHE 39 Cb 0.80 -0.16 -0.03 0.00 2.79 0.00 0.00 35.95 39.35 1x9s h PHE 39 CO 0.30 0.24 0.32 0.78 -2.23 0.00 0.00 178.31 177.73 1x9s h GLY 40 N 0.57 0.99 1.31 2.40 0.00 -1.88 -0.96 103.07 105.49 1x9s h GLY 40 Ca 0.29 -0.46 -0.18 0.00 0.00 0.00 0.00 47.33 46.98 1x9s h GLY 40 CO -0.21 0.44 -0.59 0.00 0.00 0.00 0.00 176.54 176.18 1x9s h ALA 41 N 1.44 0.55 -0.08 3.60 0.00 -1.58 -1.30 119.26 121.88 1x9s h ALA 41 Ca 0.23 -0.53 0.02 0.00 0.00 0.00 0.00 54.91 54.62 1x9s h ALA 41 Cb 0.08 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1x9s h ALA 41 CO -0.03 0.69 -0.02 -0.92 0.00 0.00 0.00 179.25 178.97 1x9s h TYR 42 N 0.54 -0.04 -0.73 0.00 3.20 0.21 0.66 116.97 120.80 1x9s h TYR 42 Ca 0.00 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.86 1x9s h TYR 42 Cb 1.17 0.03 -0.04 0.00 1.54 0.00 0.00 36.73 39.44 1x9s h TYR 42 CO 0.06 -0.04 0.39 -0.07 -1.64 0.00 0.00 178.16 176.86 1x9s h LEU 43 N -0.00 0.92 -0.68 2.82 3.38 -1.11 -2.00 115.31 118.64 1x9s h LEU 43 Ca 0.04 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 1x9s h LEU 43 Cb 0.06 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 1x9s h LEU 43 CO -0.08 0.75 0.28 0.44 0.09 0.00 0.00 178.44 179.92 1x9s h ASP 44 N 1.03 0.94 -0.87 -0.43 3.32 -0.46 -1.91 116.42 118.03 1x9s h ASP 44 Ca 0.26 -0.17 0.03 0.00 0.02 0.00 0.00 57.03 57.17 1x9s h ASP 44 Cb 0.05 -0.24 -0.05 0.00 0.22 0.00 0.00 39.33 39.31 1x9s h ASP 44 CO -0.04 0.85 0.57 0.00 -1.72 0.00 0.00 179.24 178.90 1x9s h ALA 45 N 1.12 1.43 -0.15 3.45 0.00 -0.18 0.73 119.26 125.66 1x9s h ALA 45 Ca 0.23 -0.05 -0.15 0.00 0.00 0.00 0.00 54.91 54.94 1x9s h ALA 45 Cb 0.20 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1x9s h ALA 45 CO -0.02 0.49 -0.47 -0.07 0.00 0.00 0.00 179.25 179.18 1x9s h LEU 46 N 1.11 0.68 -1.59 0.00 3.38 -1.06 -2.75 115.31 115.08 1x9s h LEU 46 Ca 0.34 -0.60 -0.05 0.00 0.09 0.00 0.00 57.88 57.66 1x9s h LEU 46 Cb -0.03 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1x9s h LEU 46 CO -0.09 1.16 -0.22 -0.33 0.09 0.00 0.00 178.44 179.05 1x9s h GLU 47 N 0.24 0.00 -0.38 1.13 5.08 -1.00 -2.22 114.58 117.43 1x9s h GLU 47 Ca -0.02 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 1x9s h GLU 47 Cb 1.09 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.33 1x9s h GLU 47 CO 0.10 0.22 0.10 0.00 -1.00 0.00 0.00 179.01 178.44 1x9s h ALA 48 N 1.78 0.50 0.00 3.43 0.00 -0.70 0.11 119.26 124.38 1x9s h ALA 48 Ca -0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 1x9s h ALA 48 Cb 0.46 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1x9s h ALA 48 CO 0.03 0.16 -0.06 1.49 0.00 0.00 0.00 179.25 180.87 1x9s h GLU 49 N 0.47 0.00 0.17 0.00 4.57 -1.12 -2.37 114.58 116.30 1x9s h GLU 49 Ca 0.12 0.00 -0.32 0.00 -1.18 0.00 0.00 59.36 57.98 1x9s h GLU 49 Cb 0.28 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 28.89 1x9s h GLU 49 CO -0.00 0.06 -1.51 0.28 -1.18 0.00 0.00 179.01 176.66 1x9s h VAL 50 N 0.00 1.21 -0.08 0.32 2.07 -0.77 0.19 116.25 119.20 1x9s h VAL 50 Ca -0.00 -2.77 -0.03 0.00 0.82 0.00 0.00 66.70 64.72 1x9s h VAL 50 Cb 0.36 2.88 -0.01 0.00 -1.52 0.00 0.00 31.29 33.00 1x9s h VAL 50 CO 0.01 0.84 -0.11 0.00 0.02 0.00 0.00 177.57 178.33 1x9s h ALA 51 N 0.34 1.67 -0.34 1.67 0.00 -0.31 -1.80 119.26 120.50 1x9s h ALA 51 Ca -0.25 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1x9s h ALA 51 Cb 2.07 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.81 1x9s h ALA 51 CO 0.21 0.24 0.00 2.89 0.00 0.00 0.00 179.25 182.59 1x9s n ARG 52 N -4.34 2.78 -2.49 0.00 1.85 -1.03 -4.87 116.66 108.56 1x9s n ARG 52 Ca -0.02 -1.63 -0.17 0.00 -1.00 0.00 0.00 57.85 55.04 1x9s n ARG 52 Cb 0.22 -1.75 0.00 0.00 -1.05 0.00 0.00 32.46 29.89 1x9s n ARG 52 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1x9s n GLY 53 N 0.56 -0.30 0.00 2.89 0.00 -0.68 -4.98 105.19 102.69 1x9s n GLY 53 Ca 0.15 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1x9s n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x9s n GLY 54 N -1.13 -0.29 2.93 -0.02 0.00 0.68 -1.69 105.19 105.66 1x9s n GLY 54 Ca -0.16 -1.71 -0.11 0.00 0.00 0.00 0.00 46.02 44.04 1x9s n GLY 54 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1x9s s LEU 55 N 0.00 2.11 -0.13 0.99 1.43 -1.26 -3.95 118.68 117.87 1x9s s LEU 55 Ca 0.00 -0.24 0.02 0.00 -1.03 0.00 0.00 54.13 52.87 1x9s s LEU 55 Cb 0.00 0.02 0.02 0.00 0.03 0.00 0.00 46.19 46.26 1x9s s LEU 55 CO 0.00 -0.13 -0.17 -0.63 0.23 0.00 0.00 176.35 175.64 1x9s s ILE 56 N -0.69 1.71 -0.19 -0.59 1.01 0.28 -1.78 121.20 120.95 1x9s s ILE 56 Ca -0.07 -0.75 -0.09 0.00 0.00 0.00 0.00 60.65 59.74 1x9s s ILE 56 Cb -0.05 -1.55 -0.05 0.00 0.01 0.00 0.00 42.46 40.82 1x9s s ILE 56 CO -0.00 0.48 0.10 -0.69 0.00 0.00 0.00 174.94 174.83 1x9s s VAL 57 N 1.09 5.17 0.12 2.92 1.01 0.17 -0.72 120.40 130.16 1x9s s VAL 57 Ca -0.03 0.10 0.02 0.00 0.00 0.00 0.00 61.98 62.08 1x9s s VAL 57 Cb -0.14 -3.35 -0.04 0.00 0.00 0.00 0.00 36.38 32.84 1x9s s VAL 57 CO -0.05 0.45 -0.05 -0.36 0.00 0.00 0.00 175.10 175.09 1x9s s PHE 58 N 0.35 1.03 -0.29 5.22 0.08 -0.56 0.70 117.98 124.52 1x9s s PHE 58 Ca 0.06 -0.92 -0.05 0.00 0.12 0.00 0.00 56.93 56.14 1x9s s PHE 58 Cb -0.11 -0.58 0.02 0.00 -0.57 0.00 0.00 43.02 41.78 1x9s s PHE 58 CO -0.01 -0.13 0.04 -1.58 -0.10 0.00 0.00 175.22 173.44 1x9s s HIS 59 N -3.59 3.15 -1.16 0.36 5.65 -1.26 -1.01 115.29 117.42 1x9s s HIS 59 Ca 0.16 -1.24 0.00 0.00 0.25 0.00 0.00 55.06 54.22 1x9s s HIS 59 Cb 0.05 -2.20 0.00 0.00 -1.18 0.00 0.00 32.58 29.26 1x9s s HIS 59 CO -0.02 -0.65 0.00 -1.71 -0.65 0.00 0.00 174.74 171.71 1x9s n ASN 60 N 4.79 -4.20 0.12 9.88 5.15 -1.26 -4.90 115.26 124.85 1x9s n ASN 60 Ca -0.15 0.00 -0.02 0.00 -0.60 0.00 0.00 54.58 53.82 1x9s n ASN 60 Cb 0.47 -3.35 0.10 0.00 -0.53 0.00 0.00 39.78 36.47 1x9s n ASN 60 CO 0.00 0.00 0.00 1.23 1.40 0.00 0.00 177.26 179.89 1x9s h GLY 61 N 0.00 0.00 1.52 8.20 0.00 -1.90 -2.37 103.07 108.52 1x9s h GLY 61 Ca -0.32 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 46.99 1x9s h GLY 61 CO 0.38 0.00 0.17 0.45 0.00 0.00 0.00 176.54 177.54 1x9s h HIS 62 N 0.00 0.62 0.00 5.60 3.86 -1.91 -1.04 115.15 122.28 1x9s h HIS 62 Ca -0.01 -0.03 -0.29 0.00 -1.16 0.00 0.00 60.37 58.89 1x9s h HIS 62 Cb 1.28 -0.19 -0.05 0.00 1.06 0.00 0.00 27.41 29.51 1x9s h HIS 62 CO 0.00 0.49 -1.95 1.63 0.86 0.00 0.00 177.93 178.96 1x9s n LYS 63 N -4.36 0.65 0.00 2.45 5.02 -1.22 -4.64 118.16 116.06 1x9s n LYS 63 Ca 0.03 0.14 0.00 0.00 -2.02 0.00 0.00 58.31 56.46 1x9s n LYS 63 Cb 0.15 -1.67 0.00 0.00 -0.02 0.00 0.00 35.03 33.49 1x9s n LYS 63 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 1x9s n TYR 64 N -2.86 0.00 -0.23 2.13 9.36 -0.89 -4.76 117.16 119.91 1x9s n TYR 64 Ca -0.21 0.00 -0.02 0.00 3.32 0.00 0.00 57.90 60.99 1x9s n TYR 64 Cb 1.04 0.00 0.05 0.00 -0.63 0.00 0.00 39.34 39.80 1x9s n TYR 64 CO 0.00 0.00 0.00 -0.44 0.22 0.00 0.00 176.86 176.64 1x9s h ASP 65 N 0.00 -0.85 0.05 2.98 5.19 -1.66 0.26 116.42 122.39 1x9s h ASP 65 Ca 0.00 0.22 -0.00 0.00 -0.62 0.00 0.00 57.03 56.63 1x9s h ASP 65 Cb 0.00 0.49 0.00 0.00 0.18 0.00 0.00 39.33 40.00 1x9s h ASP 65 CO 0.00 -0.26 -0.02 0.58 -3.12 0.00 0.00 179.24 176.41 1x9s h VAL 66 N -0.06 1.14 -0.12 -1.35 2.07 -1.50 0.19 116.25 116.62 1x9s h VAL 66 Ca 0.30 -0.65 -0.07 0.00 0.82 0.00 0.00 66.70 67.10 1x9s h VAL 66 Cb 0.53 1.58 -0.01 0.00 -1.52 0.00 0.00 31.29 31.86 1x9s h VAL 66 CO -0.71 0.16 -0.24 -0.65 0.02 0.00 0.00 177.57 176.16 1x9s h PRO 67 N -0.36 0.21 -0.01 1.57 0.11 -1.71 -2.35 132.00 129.46 1x9s h PRO 67 Ca -0.01 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 66.04 1x9s h PRO 67 Cb 0.32 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 31.41 1x9s h PRO 67 CO 0.01 0.44 0.00 0.00 -0.21 0.00 0.00 178.00 178.25 1x9s h ALA 68 N 1.57 0.02 -0.89 -0.75 0.00 -0.27 -2.04 119.26 116.90 1x9s h ALA 68 Ca 0.03 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.88 1x9s h ALA 68 Cb 0.53 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.26 1x9s h ALA 68 CO 0.04 -0.38 0.57 -0.07 0.00 0.00 0.00 179.25 179.41 1x9s h LEU 69 N -0.18 0.93 0.22 0.00 3.38 -0.46 0.27 115.31 119.48 1x9s h LEU 69 Ca 0.00 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.98 1x9s h LEU 69 Cb 0.20 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 1x9s h LEU 69 CO -0.00 0.63 -0.30 0.74 0.09 0.00 0.00 178.44 179.59 1x9s h THR 70 N 1.09 0.35 0.27 0.22 2.02 -1.20 0.18 112.91 115.84 1x9s h THR 70 Ca 0.37 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.54 1x9s h THR 70 Cb 0.06 0.35 -0.01 0.00 -1.74 0.00 0.00 68.15 66.81 1x9s h THR 70 CO -0.14 0.00 -0.20 0.50 0.37 0.00 0.00 175.52 176.05 1x9s h LYS 71 N -0.59 -0.46 0.00 6.66 3.64 -0.83 -2.53 116.57 122.47 1x9s h LYS 71 Ca 0.01 0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.40 1x9s h LYS 71 Cb 0.57 0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 32.49 1x9s h LYS 71 CO -0.11 -0.31 -0.07 -0.07 -2.27 0.00 0.00 179.45 176.62 1x9s h LEU 72 N -0.48 0.00 -0.48 5.20 3.38 -0.38 -1.86 115.31 120.70 1x9s h LEU 72 Ca -0.02 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.80 1x9s h LEU 72 Cb 0.41 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1x9s h LEU 72 CO -0.00 0.07 -0.38 0.00 0.09 0.00 0.00 178.44 178.21 1x9s h ALA 73 N 1.93 0.66 -0.09 1.53 0.00 -0.34 -1.35 119.26 121.61 1x9s h ALA 73 Ca -0.00 -0.45 -0.17 0.00 0.00 0.00 0.00 54.91 54.29 1x9s h ALA 73 Cb 0.12 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1x9s h ALA 73 CO 0.01 0.67 -0.66 -0.22 0.00 0.00 0.00 179.25 179.05 1x9s h LYS 74 N 0.68 0.36 0.23 0.00 1.63 -1.01 -1.44 116.57 117.02 1x9s h LYS 74 Ca 0.06 -0.27 -0.31 0.00 -0.85 0.00 0.00 60.65 59.28 1x9s h LYS 74 Cb 0.95 0.05 0.04 0.00 -0.60 0.00 0.00 32.23 32.67 1x9s h LYS 74 CO 0.09 0.90 -1.36 -0.07 -3.45 0.00 0.00 179.45 175.56 1x9s h LEU 75 N 0.26 0.81 0.00 5.20 3.38 -1.30 -3.02 115.31 120.63 1x9s h LEU 75 Ca -0.02 -0.91 -0.10 0.00 0.09 0.00 0.00 57.88 56.94 1x9s h LEU 75 Cb 1.21 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.68 1x9s h LEU 75 CO 0.11 1.66 -1.84 0.00 0.09 0.00 0.00 178.44 178.45 1x9s n GLN 76 N -3.79 0.65 0.00 1.13 6.02 -0.51 -4.51 117.38 116.37 1x9s n GLN 76 Ca -0.16 -0.05 0.00 0.00 -0.01 0.00 0.00 57.00 56.78 1x9s n GLN 76 Cb 1.05 -1.61 0.00 0.00 1.02 0.00 0.00 30.24 30.70 1x9s n GLN 76 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1x9s n LEU 77 N -2.51 1.10 -4.13 1.08 4.77 -0.91 -4.99 117.00 111.40 1x9s n LEU 77 Ca -0.10 -1.10 -0.28 0.00 -0.03 0.00 0.00 56.01 54.50 1x9s n LEU 77 Cb 0.73 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.76 1x9s n LEU 77 CO 0.44 0.28 -0.35 -3.20 -1.33 0.00 0.00 177.39 173.22 1x9s n ASN 78 N -0.24 0.30 -4.24 -1.43 5.15 -0.95 -4.94 115.26 108.92 1x9s n ASN 78 Ca 0.00 -1.14 -0.26 0.00 -0.60 0.00 0.00 54.58 52.58 1x9s n ASN 78 Cb 0.28 -2.34 -0.15 0.00 -0.53 0.00 0.00 39.78 37.04 1x9s n ASN 78 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 1x9s s ARG 79 N -6.96 1.50 -0.09 1.20 3.52 -0.59 -4.95 118.95 112.57 1x9s s ARG 79 Ca 0.00 -0.86 -0.20 0.00 -0.13 0.00 0.00 55.73 54.55 1x9s s ARG 79 Cb -0.00 -1.54 -0.04 0.00 -1.56 0.00 0.00 34.95 31.80 1x9s s ARG 79 CO 0.94 0.41 0.55 -1.21 -0.81 0.00 0.00 175.30 175.18 1x9s s GLU 80 N -0.89 4.36 -0.12 5.12 0.41 -1.26 -2.40 118.70 123.92 1x9s s GLU 80 Ca 0.08 0.59 -0.05 0.00 -0.41 0.00 0.00 54.97 55.18 1x9s s GLU 80 Cb -0.08 -3.43 0.06 0.00 -1.78 0.00 0.00 34.13 28.89 1x9s s GLU 80 CO 0.01 0.16 0.25 0.12 -0.49 0.00 0.00 175.26 175.31 1x9s s PHE 81 N 0.56 -0.37 -0.35 1.61 5.36 -1.26 -5.05 117.98 118.47 1x9s s PHE 81 Ca 0.30 0.88 0.02 0.00 -0.96 0.00 0.00 56.93 57.17 1x9s s PHE 81 Cb -0.16 0.00 0.15 0.00 -0.34 0.00 0.00 43.02 42.67 1x9s s PHE 81 CO 0.13 -0.29 0.35 -1.01 -1.46 0.00 0.00 175.22 172.93 1x9s s HIS 82 N 1.85 -0.23 0.17 10.12 3.76 -1.26 -4.34 115.29 125.36 1x9s s HIS 82 Ca -0.04 -0.79 -0.32 0.00 -0.15 0.00 0.00 55.06 53.76 1x9s s HIS 82 Cb -0.11 -0.47 -0.12 0.00 1.11 0.00 0.00 32.58 32.99 1x9s s HIS 82 CO -0.08 -0.95 1.74 1.28 -0.85 0.00 0.00 174.74 175.88 1x9s n LEU 83 N 4.41 3.87 -4.76 0.89 4.77 -1.26 -4.93 117.00 119.99 1x9s n LEU 83 Ca 0.09 1.04 -0.40 0.00 -0.03 0.00 0.00 56.01 56.71 1x9s n LEU 83 Cb 0.45 -1.54 -0.04 0.00 -2.33 0.00 0.00 43.42 39.96 1x9s n LEU 83 CO 0.08 0.11 0.80 -2.84 -1.33 0.00 0.00 177.39 174.21 1x9s s PRO 84 N 1.68 4.54 0.22 3.23 0.02 -1.26 -4.92 135.00 138.51 1x9s s PRO 84 Ca 0.78 1.80 -0.10 0.00 0.02 0.00 0.00 61.00 63.50 1x9s s PRO 84 Cb -0.53 -3.08 0.32 0.00 0.02 0.00 0.00 34.50 31.23 1x9s s PRO 84 CO 0.35 0.12 1.65 -0.09 -0.33 0.00 0.00 177.00 178.70 1x9s h ARG 85 N 3.58 0.09 0.00 5.54 2.43 -1.95 -0.64 114.38 123.42 1x9s h ARG 85 Ca -0.47 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.69 1x9s h ARG 85 Cb 1.21 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 1x9s h ARG 85 CO 0.66 0.06 0.00 1.05 -1.51 0.00 0.00 179.97 180.23 1x9s h GLU 86 N 0.09 0.00 -0.01 0.20 9.09 -2.00 -2.19 114.58 119.76 1x9s h GLU 86 Ca 0.34 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.75 1x9s h GLU 86 Cb 0.56 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.66 1x9s h GLU 86 CO -0.59 0.00 -0.22 0.09 0.05 0.00 0.00 179.01 178.34 1x9s n ASN 87 N -2.99 1.39 -4.55 3.06 4.13 -0.25 -4.85 115.26 111.20 1x9s n ASN 87 Ca -0.03 -1.18 -0.34 0.00 1.68 0.00 0.00 54.58 54.72 1x9s n ASN 87 Cb 0.08 0.15 -0.12 0.00 -1.54 0.00 0.00 39.78 38.36 1x9s n ASN 87 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1x9s s ILE 89 N -0.54 2.09 -0.25 0.00 1.01 0.10 -4.93 121.20 118.68 1x9s s ILE 89 Ca 0.08 -1.08 0.02 0.00 0.00 0.00 0.00 60.65 59.68 1x9s s ILE 89 Cb -0.12 -1.73 0.06 0.00 0.01 0.00 0.00 42.46 40.67 1x9s s ILE 89 CO 0.02 0.58 -0.11 -0.62 0.00 0.00 0.00 174.94 174.80 1x9s s ASP 90 N -0.43 4.21 0.55 3.58 -1.08 -1.26 -1.49 116.67 120.75 1x9s s ASP 90 Ca 0.05 -1.28 0.36 0.00 -0.52 0.00 0.00 52.55 51.16 1x9s s ASP 90 Cb -0.12 -1.49 1.78 0.00 -1.46 0.00 0.00 42.92 41.64 1x9s s ASP 90 CO 0.01 -0.17 2.09 0.71 0.52 0.00 0.00 175.17 178.33 1x9s h THR 91 N 6.66 0.00 -0.05 1.71 1.35 -1.44 -1.24 112.91 119.90 1x9s h THR 91 Ca -0.22 -0.20 -0.20 0.00 -0.55 0.00 0.00 66.41 65.24 1x9s h THR 91 Cb 1.06 1.11 0.01 0.00 -1.73 0.00 0.00 68.15 68.60 1x9s h THR 91 CO 0.47 0.00 -0.76 0.25 -0.25 0.00 0.00 175.52 175.23 1x9s h LEU 92 N 0.00 0.76 -1.04 3.87 5.85 -1.91 -1.57 115.31 121.27 1x9s h LEU 92 Ca 0.00 -0.70 -0.02 0.00 0.84 0.00 0.00 57.88 58.00 1x9s h LEU 92 Cb 0.21 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 40.98 1x9s h LEU 92 CO 0.00 1.35 0.39 0.58 -0.34 0.00 0.00 178.44 180.42 1x9s h VAL 93 N 0.23 1.23 -0.49 1.05 2.07 -1.69 -2.33 116.25 116.32 1x9s h VAL 93 Ca -0.08 -0.61 -0.08 0.00 0.82 0.00 0.00 66.70 66.74 1x9s h VAL 93 Cb 1.42 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 31.41 1x9s h VAL 93 CO 0.15 0.27 -0.01 -0.07 0.02 0.00 0.00 177.57 177.93 1x9s h LEU 94 N 1.07 0.87 -0.68 2.57 3.38 -1.17 -3.01 115.31 118.33 1x9s h LEU 94 Ca 0.26 -0.31 -0.11 0.00 0.09 0.00 0.00 57.88 57.81 1x9s h LEU 94 Cb 0.07 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 1x9s h LEU 94 CO -0.04 0.97 -0.16 0.28 0.09 0.00 0.00 178.44 179.58 1x9s h SER 95 N 0.74 0.86 0.60 -0.43 0.02 -1.05 -0.97 113.55 113.32 1x9s h SER 95 Ca 0.14 -0.29 -0.02 0.00 -0.84 0.00 0.00 61.79 60.78 1x9s h SER 95 Cb 0.53 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 62.83 1x9s h SER 95 CO 0.03 1.01 -0.09 0.03 -1.14 0.00 0.00 176.83 176.67 1x9s h ARG 96 N 0.76 0.00 0.09 3.45 3.08 -1.39 0.47 114.38 120.83 1x9s h ARG 96 Ca 0.11 0.00 -0.29 0.00 0.07 0.00 0.00 59.98 59.88 1x9s h ARG 96 Cb 0.68 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.72 1x9s h ARG 96 CO 0.05 0.09 -1.52 1.25 -1.07 0.00 0.00 179.97 178.77 1x9s h LEU 97 N 0.00 0.28 0.00 3.04 5.85 -1.35 -3.27 115.31 119.86 1x9s h LEU 97 Ca -0.00 -0.79 -0.09 0.00 0.84 0.00 0.00 57.88 57.83 1x9s h LEU 97 Cb 0.41 -0.09 0.01 0.00 0.37 0.00 0.00 40.66 41.36 1x9s h LEU 97 CO 0.01 1.64 -0.37 0.40 -0.34 0.00 0.00 178.44 179.79 1x9s h ILE 98 N -0.40 1.51 -2.10 4.05 2.04 -0.97 -3.32 117.51 118.33 1x9s h ILE 98 Ca -0.35 -2.01 -0.75 0.00 1.00 0.00 0.00 64.86 62.75 1x9s h ILE 98 Cb 1.70 2.74 -0.30 0.00 -0.74 0.00 0.00 36.82 40.22 1x9s h ILE 98 CO -0.01 0.56 0.71 1.41 0.00 0.00 0.00 178.15 180.83 1x9s n HIS 99 N -4.41 3.04 0.30 1.37 8.25 0.16 -4.76 115.22 119.18 1x9s n HIS 99 Ca -0.10 -2.68 0.17 0.00 -0.26 0.00 0.00 57.72 54.85 1x9s n HIS 99 Cb 0.56 -1.02 0.78 0.00 1.12 0.00 0.00 29.99 31.44 1x9s n HIS 99 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1x9s h SER 100 N 3.49 0.00 -0.06 0.41 4.64 -1.66 -2.13 113.55 118.25 1x9s h SER 100 Ca 0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.81 1x9s h SER 100 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 1x9s h SER 100 CO 1.21 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 176.71 1x9s n ASN 101 N -2.86 0.57 -4.48 4.97 6.94 -1.26 -4.25 115.26 114.89 1x9s n ASN 101 Ca -0.00 -1.52 -0.24 0.00 -0.02 0.00 0.00 54.58 52.80 1x9s n ASN 101 Cb 0.21 -0.04 -0.10 0.00 -2.36 0.00 0.00 39.78 37.49 1x9s n ASN 101 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1x9s s LEU 102 N -1.58 2.63 0.00 -4.53 1.43 -0.80 -5.03 118.68 110.79 1x9s s LEU 102 Ca 0.29 -1.09 0.03 0.00 -1.03 0.00 0.00 54.13 52.34 1x9s s LEU 102 Cb 0.14 -1.02 0.03 0.00 0.03 0.00 0.00 46.19 45.38 1x9s s LEU 102 CO 0.23 -0.07 0.26 0.29 0.23 0.00 0.00 176.35 177.29 1x9s n LYS 103 N -0.65 0.97 -3.58 1.70 5.02 -1.26 -5.04 118.16 115.32 1x9s n LYS 103 Ca -0.05 -1.31 -0.10 0.00 -2.02 0.00 0.00 58.31 54.83 1x9s n LYS 103 Cb 0.61 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.61 1x9s n LYS 103 CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 1x9s s ASP 104 N -2.39 -0.43 -0.01 4.39 1.47 -1.26 -4.75 116.67 113.69 1x9s s ASP 104 Ca 0.20 -0.20 0.02 0.00 1.18 0.00 0.00 52.55 53.74 1x9s s ASP 104 Cb -0.02 0.61 0.08 0.00 -0.34 0.00 0.00 42.92 43.24 1x9s s ASP 104 CO 0.12 -1.04 0.78 0.35 0.68 0.00 0.00 175.17 176.07 1x9s n THR 105 N -0.39 0.21 -3.95 2.11 -2.24 -1.26 -4.88 114.28 103.88 1x9s n THR 105 Ca -0.12 -0.12 -0.29 0.00 -2.27 0.00 0.00 64.05 61.26 1x9s n THR 105 Cb 0.63 -0.28 -0.01 0.00 -2.10 0.00 0.00 70.33 68.56 1x9s n THR 105 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1x9s n ASP 106 N -0.07 -1.39 -2.45 3.42 2.03 -1.26 -0.79 116.55 116.05 1x9s n ASP 106 Ca 0.03 -1.06 -0.18 0.00 0.52 0.00 0.00 54.79 54.10 1x9s n ASP 106 Cb 0.24 -2.88 -0.01 0.00 -0.72 0.00 0.00 41.12 37.76 1x9s n ASP 106 CO 0.00 0.00 0.00 0.23 -1.92 0.00 0.00 177.20 175.51 1x9s n MET 107 N -4.43 -1.99 0.00 -0.67 2.81 -1.26 -2.44 117.12 109.14 1x9s n MET 107 Ca -0.26 0.87 0.00 0.00 -1.81 0.00 0.00 57.70 56.50 1x9s n MET 107 Cb 0.66 -5.53 0.00 0.00 -0.71 0.00 0.00 33.22 27.65 1x9s n MET 107 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1x9s n GLY 108 N -0.97 0.58 0.17 3.03 0.00 -0.13 -4.83 105.19 103.03 1x9s n GLY 108 Ca -0.21 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.84 1x9s n GLY 108 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1x9s h LEU 109 N 0.00 0.00 -9.03 0.99 3.38 -0.62 -3.44 115.31 106.60 1x9s h LEU 109 Ca 0.00 0.00 -0.68 0.00 0.09 0.00 0.00 57.88 57.29 1x9s h LEU 109 Cb 0.00 0.00 -0.21 0.00 0.09 0.00 0.00 40.66 40.54 1x9s h LEU 109 CO 0.00 0.47 -0.77 -0.76 0.09 0.00 0.00 178.44 177.46 1x9s s LEU 110 N -7.06 2.77 0.04 1.67 1.43 -0.18 -5.02 118.68 112.33 1x9s s LEU 110 Ca 0.00 -0.34 -0.30 0.00 -1.03 0.00 0.00 54.13 52.46 1x9s s LEU 110 Cb 0.11 -1.61 -0.05 0.00 0.03 0.00 0.00 46.19 44.67 1x9s s LEU 110 CO 0.71 0.27 1.20 -0.13 0.23 0.00 0.00 176.35 178.63 1x9s s ARG 111 N -1.41 4.42 0.19 1.70 3.00 -1.26 -4.67 118.95 120.91 1x9s s ARG 111 Ca 0.15 1.76 -0.13 0.00 0.00 0.00 0.00 55.73 57.51 1x9s s ARG 111 Cb -0.11 -3.38 0.19 0.00 0.00 0.00 0.00 34.95 31.65 1x9s s ARG 111 CO 0.06 -0.29 1.72 0.77 0.00 0.00 0.00 175.30 177.56 1x9s h SER 112 N 6.92 0.05 -0.61 0.23 0.02 -1.95 -2.38 113.55 115.83 1x9s h SER 112 Ca -0.40 0.08 0.12 0.00 -0.84 0.00 0.00 61.79 60.75 1x9s h SER 112 Cb 1.21 0.10 -0.12 0.00 0.14 0.00 0.00 62.40 63.73 1x9s h SER 112 CO 0.82 0.05 -0.19 1.23 -1.14 0.00 0.00 176.83 177.61 1x9s h GLY 113 N 0.26 0.36 2.00 -3.77 0.00 -2.02 -0.36 103.07 99.54 1x9s h GLY 113 Ca 0.25 0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.82 1x9s h GLY 113 CO -0.30 -0.24 0.00 0.07 0.00 0.00 0.00 176.54 176.07 1x9s h LYS 114 N -0.03 0.00 -6.75 4.80 2.10 -1.83 -3.44 116.57 111.42 1x9s h LYS 114 Ca 0.29 0.00 -0.50 0.00 -2.00 0.00 0.00 60.65 58.44 1x9s h LYS 114 Cb 0.48 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.81 1x9s h LYS 114 CO -0.65 0.00 0.42 -0.51 -2.00 0.00 0.00 179.45 176.71 1x9s s LEU 115 N -5.96 4.58 0.61 7.07 1.43 -0.15 -5.05 118.68 121.21 1x9s s LEU 115 Ca -0.01 2.09 -0.07 0.00 -1.03 0.00 0.00 54.13 55.12 1x9s s LEU 115 Cb 0.10 -3.61 0.01 0.00 0.03 0.00 0.00 46.19 42.72 1x9s s LEU 115 CO 0.47 -0.03 0.93 -2.16 0.23 0.00 0.00 176.35 175.79 1x9s s PRO 116 N -1.10 2.85 0.34 1.29 0.04 -1.26 -4.97 135.00 132.19 1x9s s PRO 116 Ca 0.44 0.03 0.00 0.00 0.04 0.00 0.00 61.00 61.51 1x9s s PRO 116 Cb -0.29 -2.23 0.00 0.00 0.04 0.00 0.00 34.50 32.02 1x9s s PRO 116 CO 0.36 -0.78 0.00 0.41 0.04 0.00 0.00 177.00 177.03 1x9s n GLY 117 N -2.66 -2.16 3.73 0.56 0.00 -1.26 -4.68 105.19 98.72 1x9s n GLY 117 Ca 0.05 -1.19 -0.29 0.00 0.00 0.00 0.00 46.02 44.59 1x9s n GLY 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x9s s ALA 124 N -2.53 1.35 -0.02 4.61 0.00 -1.26 -4.98 121.76 118.93 1x9s s ALA 124 Ca 0.00 -0.55 0.01 0.00 0.00 0.00 0.00 51.96 51.42 1x9s s ALA 124 Cb 0.00 -3.03 0.01 0.00 0.00 0.00 0.00 23.12 20.10 1x9s s ALA 124 CO 0.00 -2.65 -0.04 -0.51 0.00 0.00 0.00 175.76 172.55 1x9s s LEU 125 N -6.29 1.68 0.02 0.00 1.43 -1.26 -4.45 118.68 109.81 1x9s s LEU 125 Ca 0.66 -0.10 -0.33 0.00 -1.03 0.00 0.00 54.13 53.33 1x9s s LEU 125 Cb -0.15 -0.32 -0.12 0.00 0.03 0.00 0.00 46.19 45.63 1x9s s LEU 125 CO 0.55 0.01 1.81 1.21 0.23 0.00 0.00 176.35 180.15 1x9s n GLU 126 N 3.45 2.32 -0.05 1.70 0.00 -1.26 -4.88 120.64 121.93 1x9s n GLU 126 Ca -0.19 0.85 -0.09 0.00 0.00 0.00 0.00 57.16 57.72 1x9s n GLU 126 Cb 0.55 -2.69 -0.03 0.00 0.00 0.00 0.00 31.44 29.27 1x9s n GLU 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1x9s h ALA 127 N 8.39 -0.29 -0.67 4.31 0.00 -1.99 -1.01 119.26 127.99 1x9s h ALA 127 Ca -0.47 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.49 1x9s h ALA 127 Cb 1.26 0.64 -0.03 0.00 0.00 0.00 0.00 17.79 19.66 1x9s h ALA 127 CO 0.93 -0.77 0.42 -1.49 0.00 0.00 0.00 179.25 178.34 1x9s h TRP 128 N -0.33 0.87 -0.77 0.00 -0.00 -1.95 -1.58 115.95 112.18 1x9s h TRP 128 Ca 0.13 0.00 -0.05 0.00 -0.00 0.00 0.00 58.89 58.97 1x9s h TRP 128 Cb 0.54 -0.29 -0.03 0.00 -0.00 0.00 0.00 29.16 29.38 1x9s h TRP 128 CO -0.46 0.58 0.30 0.78 -0.00 0.00 0.00 178.44 179.64 1x9s h GLY 129 N 0.91 1.24 0.95 1.49 0.00 -1.89 -0.76 103.07 105.01 1x9s h GLY 129 Ca 0.24 -0.68 -0.01 0.00 0.00 0.00 0.00 47.33 46.88 1x9s h GLY 129 CO -0.05 0.64 0.19 -1.82 0.00 0.00 0.00 176.54 175.50 1x9s h TYR 130 N 1.11 0.53 -0.25 5.60 3.20 -0.87 -0.84 116.97 125.46 1x9s h TYR 130 Ca 0.25 -0.02 0.05 0.00 3.14 0.00 0.00 58.73 62.15 1x9s h TYR 130 Cb 0.23 -0.17 -0.04 0.00 1.54 0.00 0.00 36.73 38.29 1x9s h TYR 130 CO 0.02 0.44 -0.03 0.00 -1.64 0.00 0.00 178.16 176.94 1x9s h ARG 131 N 0.47 0.03 -0.77 1.82 2.47 -0.91 -1.31 114.38 116.19 1x9s h ARG 131 Ca 0.13 -0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 58.82 1x9s h ARG 131 Cb 0.10 -0.01 -0.04 0.00 -1.65 0.00 0.00 29.97 28.37 1x9s h ARG 131 CO -0.02 0.02 0.36 -0.07 0.56 0.00 0.00 179.97 180.83 1x9s h LEU 132 N 0.03 1.00 -0.26 3.04 3.38 -0.90 -2.54 115.31 119.07 1x9s h LEU 132 Ca 0.12 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1x9s h LEU 132 Cb 0.17 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.66 1x9s h LEU 132 CO -0.23 0.85 0.00 1.23 0.09 0.00 0.00 178.44 180.38 1x9s h GLY 133 N 1.13 0.00 -1.17 0.83 0.00 -0.84 -3.18 103.07 99.83 1x9s h GLY 133 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.59 1x9s h GLY 133 CO -0.03 0.00 -0.12 1.18 0.00 0.00 0.00 176.54 177.56 1x9s n GLU 134 N -2.83 1.80 -0.19 4.80 -0.58 -0.52 -3.50 120.64 119.60 1x9s n GLU 134 Ca 0.04 -1.37 -0.05 0.00 -0.42 0.00 0.00 57.16 55.36 1x9s n GLU 134 Cb 0.45 -1.47 0.05 0.00 -0.57 0.00 0.00 31.44 29.91 1x9s n GLU 134 CO 0.00 0.00 0.00 0.52 -0.48 0.00 0.00 177.13 177.17 1x9s h MET 135 N 3.34 0.64 -0.57 3.49 2.86 -1.44 0.11 114.93 123.35 1x9s h MET 135 Ca 0.00 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.59 1x9s h MET 135 Cb 0.78 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 32.27 1x9s h MET 135 CO 0.00 0.42 0.31 0.87 1.06 0.00 0.00 176.91 179.57 1x9s h LYS 136 N 0.65 0.79 -0.13 1.72 1.57 -1.82 0.11 116.57 119.46 1x9s h LYS 136 Ca 0.23 -0.08 -0.16 0.00 -1.87 0.00 0.00 60.65 58.78 1x9s h LYS 136 Cb 0.05 -0.16 0.01 0.00 0.08 0.00 0.00 32.23 32.21 1x9s h LYS 136 CO -0.11 0.58 -0.53 0.78 -0.57 0.00 0.00 179.45 179.60 1x9s h GLY 137 N 0.86 0.64 0.73 3.86 0.00 -1.65 -1.97 103.07 105.55 1x9s h GLY 137 Ca 0.20 -0.88 -0.01 0.00 0.00 0.00 0.00 47.33 46.65 1x9s h GLY 137 CO -0.03 0.79 0.00 1.05 0.00 0.00 0.00 176.54 178.34 1x9s h GLU 138 N 0.22 0.08 -0.75 4.80 9.09 -0.55 -1.69 114.58 125.78 1x9s h GLU 138 Ca -0.03 -0.02 0.13 0.00 0.05 0.00 0.00 59.36 59.49 1x9s h GLU 138 Cb 1.16 -0.01 -0.09 0.00 -1.65 0.00 0.00 28.75 28.17 1x9s h GLU 138 CO 0.11 0.35 0.32 -0.92 0.05 0.00 0.00 179.01 178.92 1x9s h TYR 139 N -0.20 0.55 0.00 2.06 3.20 -0.85 0.40 116.97 122.13 1x9s h TYR 139 Ca 0.01 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.87 1x9s h TYR 139 Cb 0.32 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.45 1x9s h TYR 139 CO 0.03 0.10 -0.22 -0.22 -1.64 0.00 0.00 178.16 176.21 1x9s h LYS 140 N 0.48 0.00 -0.06 1.82 3.64 -1.14 -1.72 116.57 119.59 1x9s h LYS 140 Ca 0.40 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.74 1x9s h LYS 140 Cb 0.58 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 1x9s h LYS 140 CO -0.37 0.22 -0.12 -0.44 -2.27 0.00 0.00 179.45 176.47 1x9s h ASP 141 N 0.00 0.21 -0.64 4.20 3.32 0.69 -0.91 116.42 123.30 1x9s h ASP 141 Ca -0.00 -0.56 0.01 0.00 0.02 0.00 0.00 57.03 56.50 1x9s h ASP 141 Cb 0.41 -0.06 -0.03 0.00 0.22 0.00 0.00 39.33 39.87 1x9s h ASP 141 CO 0.03 0.73 0.41 0.44 -1.72 0.00 0.00 179.24 179.13 1x9s h ASP 142 N -0.30 0.70 0.39 6.45 5.19 -1.01 0.20 116.42 128.05 1x9s h ASP 142 Ca 0.00 -0.01 -0.02 0.00 -0.62 0.00 0.00 57.03 56.38 1x9s h ASP 142 Cb 0.69 -0.17 -0.00 0.00 0.18 0.00 0.00 39.33 40.03 1x9s h ASP 142 CO 0.03 0.50 -0.26 0.15 -3.12 0.00 0.00 179.24 176.54 1x9s h PHE 143 N 0.83 -0.71 -0.96 4.55 3.57 -1.31 0.26 116.94 123.18 1x9s h PHE 143 Ca 0.24 -0.00 0.17 0.00 3.53 0.00 0.00 57.97 61.91 1x9s h PHE 143 Cb -0.06 0.26 -0.09 0.00 2.79 0.00 0.00 35.95 38.85 1x9s h PHE 143 CO -0.04 -0.38 0.61 -0.22 -2.23 0.00 0.00 178.31 176.05 1x9s h LYS 144 N -0.62 0.68 -0.35 1.11 3.64 -1.05 0.29 116.57 120.27 1x9s h LYS 144 Ca -0.05 -0.04 -0.16 0.00 -1.27 0.00 0.00 60.65 59.13 1x9s h LYS 144 Cb 0.50 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 32.17 1x9s h LYS 144 CO 0.04 0.45 -0.39 -0.09 -2.27 0.00 0.00 179.45 177.18 1x9s h ARG 145 N 0.70 0.89 -0.02 1.90 2.43 -0.38 -3.03 114.38 116.86 1x9s h ARG 145 Ca 0.52 -0.48 -0.12 0.00 -0.81 0.00 0.00 59.98 59.08 1x9s h ARG 145 Cb 0.88 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.44 1x9s h ARG 145 CO -0.28 1.13 -0.56 0.52 -1.51 0.00 0.00 179.97 179.27 1x9s h MET 146 N 0.69 0.05 -0.28 0.20 2.86 0.14 -3.00 114.93 115.59 1x9s h MET 146 Ca 0.05 -0.03 -0.10 0.00 -2.06 0.00 0.00 59.70 57.56 1x9s h MET 146 Cb 0.99 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.64 1x9s h MET 146 CO 0.10 0.60 -0.22 -0.07 1.06 0.00 0.00 176.91 178.38 1x9s h LEU 147 N 0.04 0.68 -1.79 1.22 3.38 -1.05 -3.02 115.31 114.77 1x9s h LEU 147 Ca -0.00 -0.45 -0.03 0.00 0.09 0.00 0.00 57.88 57.49 1x9s h LEU 147 Cb 1.01 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.57 1x9s h LEU 147 CO 0.08 0.98 -0.14 -0.33 0.09 0.00 0.00 178.44 179.12 1x9s h GLU 148 N 0.38 0.00 0.00 1.13 5.08 -1.52 0.31 114.58 119.96 1x9s h GLU 148 Ca 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1x9s h GLU 148 Cb 0.76 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.01 1x9s h GLU 148 CO 0.06 0.14 0.00 0.39 -1.00 0.00 0.00 179.01 178.60 1x9s n GLU 149 N -4.18 0.17 -0.35 2.33 1.02 -1.14 -2.15 120.64 116.35 1x9s n GLU 149 Ca -0.02 0.33 0.08 0.00 -0.02 0.00 0.00 57.16 57.52 1x9s n GLU 149 Cb 0.22 -1.78 0.24 0.00 -0.02 0.00 0.00 31.44 30.09 1x9s n GLU 149 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1x9s n GLN 150 N -2.10 3.06 -3.57 3.49 1.13 0.10 -4.99 117.38 114.51 1x9s n GLN 150 Ca 0.03 -2.46 -0.22 0.00 -1.94 0.00 0.00 57.00 52.41 1x9s n GLN 150 Cb 0.27 -1.56 0.08 0.00 0.11 0.00 0.00 30.24 29.15 1x9s n GLN 150 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1x9s n GLY 151 N 0.55 -0.50 3.23 1.08 0.00 -0.91 -5.03 105.19 103.62 1x9s n GLY 151 Ca 0.18 0.22 -0.23 0.00 0.00 0.00 0.00 46.02 46.18 1x9s n GLY 151 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1x9s s GLU 152 N -6.08 1.18 0.34 1.61 2.02 -1.10 -5.03 118.70 111.65 1x9s s GLU 152 Ca 0.43 -0.97 -0.27 0.00 0.02 0.00 0.00 54.97 54.19 1x9s s GLU 152 Cb -0.19 -1.31 -0.09 0.00 0.10 0.00 0.00 34.13 32.64 1x9s s GLU 152 CO 0.73 0.32 1.09 -1.83 0.02 0.00 0.00 175.26 175.60 1x9s s GLU 153 N -1.41 4.38 0.03 1.61 4.04 -1.26 -4.19 118.70 121.89 1x9s s GLU 153 Ca 0.05 1.70 -0.15 0.00 0.04 0.00 0.00 54.97 56.62 1x9s s GLU 153 Cb -0.09 -2.88 -0.06 0.00 0.02 0.00 0.00 34.13 31.12 1x9s s GLU 153 CO 0.02 0.00 0.44 -0.47 -1.84 0.00 0.00 175.26 173.42 1x9s s TYR 154 N -1.38 3.72 0.08 4.83 5.04 -1.26 -5.03 117.35 123.35 1x9s s TYR 154 Ca 0.51 1.03 0.10 0.00 -2.44 0.00 0.00 57.07 56.27 1x9s s TYR 154 Cb -0.28 -2.32 -0.03 0.00 0.35 0.00 0.00 41.96 39.68 1x9s s TYR 154 CO 0.36 0.61 -0.26 0.08 -1.34 0.00 0.00 175.55 175.00 1x9s s VAL 155 N -1.14 2.24 0.00 3.14 1.01 -1.26 -5.07 120.40 119.32 1x9s s VAL 155 Ca 0.26 -1.54 0.00 0.00 0.00 0.00 0.00 61.98 60.70 1x9s s VAL 155 Cb -0.17 -1.93 0.00 0.00 0.00 0.00 0.00 36.38 34.28 1x9s s VAL 155 CO 0.15 0.24 0.00 -0.90 0.00 0.00 0.00 175.10 174.59 1x9s n ASP 156 N 1.36 0.00 -2.63 3.32 5.68 -1.26 -2.27 116.55 120.76 1x9s n ASP 156 Ca -0.17 0.00 -0.17 0.00 -0.50 0.00 0.00 54.79 53.95 1x9s n ASP 156 Cb 0.52 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 40.52 1x9s n ASP 156 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1x9s n GLY 157 N 0.00 3.51 0.05 6.12 0.00 -1.26 -4.87 105.19 108.74 1x9s n GLY 157 Ca 0.00 -1.94 0.09 0.00 0.00 0.00 0.00 46.02 44.17 1x9s n GLY 157 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1x9s n MET 158 N -0.21 0.08 0.31 1.61 0.00 -0.96 -2.78 117.12 115.17 1x9s n MET 158 Ca 0.22 0.33 0.19 0.00 0.00 0.00 0.00 57.70 58.45 1x9s n MET 158 Cb 0.73 -1.65 1.00 0.00 0.00 0.00 0.00 33.22 33.30 1x9s n MET 158 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 175.97 177.02 1x9s h GLU 159 N 0.00 0.00 -0.04 3.17 9.09 -1.89 -2.80 114.58 122.11 1x9s h GLU 159 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1x9s h GLU 159 Cb 0.28 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.38 1x9s h GLU 159 CO 0.00 0.02 0.00 0.91 0.05 0.00 0.00 179.01 179.99 1x9s n TRP 160 N -3.26 0.02 -0.05 2.06 7.02 -1.12 -4.62 117.44 117.49 1x9s n TRP 160 Ca -0.02 -0.01 -0.14 0.00 -1.02 0.00 0.00 57.50 56.31 1x9s n TRP 160 Cb 0.15 -0.00 -0.02 0.00 -2.42 0.00 0.00 31.31 29.01 1x9s n TRP 160 CO 0.00 0.00 0.00 -1.49 -2.02 0.00 0.00 177.69 174.18 1x9s h TRP 161 N 3.93 1.01 -3.65 -5.99 6.55 -1.67 -3.37 115.95 112.76 1x9s h TRP 161 Ca 0.00 -0.37 -0.45 0.00 0.95 0.00 0.00 58.89 59.01 1x9s h TRP 161 Cb 0.84 -0.18 -0.19 0.00 -0.86 0.00 0.00 29.16 28.76 1x9s h TRP 161 CO 0.01 1.19 -0.78 -0.80 -1.05 0.00 0.00 178.44 177.01 1x9s s ASN 162 N -6.97 2.13 0.37 -3.49 0.01 -1.26 -4.94 114.94 100.79 1x9s s ASN 162 Ca -0.10 -0.77 -0.25 0.00 -0.71 0.00 0.00 52.86 51.03 1x9s s ASN 162 Cb 0.10 -0.09 -0.09 0.00 0.41 0.00 0.00 41.25 41.58 1x9s s ASN 162 CO 0.88 -0.08 1.08 0.12 -1.51 0.00 0.00 177.10 177.59 1x9s s PHE 163 N -1.83 3.29 0.24 2.20 5.36 -1.26 -5.04 117.98 120.95 1x9s s PHE 163 Ca 0.08 1.64 -0.13 0.00 -0.96 0.00 0.00 56.93 57.56 1x9s s PHE 163 Cb -0.07 -3.21 -0.00 0.00 -0.34 0.00 0.00 43.02 39.40 1x9s s PHE 163 CO 0.04 -0.75 0.47 0.54 -1.46 0.00 0.00 175.22 174.06 1x9s s ASN 164 N -1.33 -0.10 0.46 6.13 2.20 -1.26 -5.06 114.94 115.98 1x9s s ASN 164 Ca 0.55 -0.90 0.26 0.00 -0.94 0.00 0.00 52.86 51.83 1x9s s ASN 164 Cb -0.26 0.58 0.84 0.00 -2.00 0.00 0.00 41.25 40.41 1x9s s ASN 164 CO 0.33 -1.12 1.79 -0.33 -2.94 0.00 0.00 177.10 174.82 1x9s h GLU 165 N 2.26 0.00 -0.04 3.55 4.39 -1.99 -2.91 114.58 119.84 1x9s h GLU 165 Ca -0.26 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.33 1x9s h GLU 165 Cb 1.25 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.89 1x9s h GLU 165 CO 0.36 0.14 -0.47 0.93 -1.16 0.00 0.00 179.01 178.81 1x9s h GLU 166 N 0.00 0.10 -0.20 2.33 3.07 -1.99 -1.19 114.58 116.69 1x9s h GLU 166 Ca -0.00 -0.05 -0.21 0.00 -0.50 0.00 0.00 59.36 58.60 1x9s h GLU 166 Cb 0.80 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 28.72 1x9s h GLU 166 CO 0.02 0.55 -0.69 1.98 -1.40 0.00 0.00 179.01 179.47 1x9s h MET 167 N 0.08 0.81 -0.42 2.33 1.85 -1.93 -2.45 114.93 115.20 1x9s h MET 167 Ca 0.00 -0.60 -0.09 0.00 -0.61 0.00 0.00 59.70 58.40 1x9s h MET 167 Cb 0.86 0.11 -0.02 0.00 0.43 0.00 0.00 31.60 32.98 1x9s h MET 167 CO 0.07 1.22 -0.12 1.98 -0.40 0.00 0.00 176.91 179.65 1x9s h MET 168 N 0.58 0.76 -0.39 0.39 -1.53 -1.32 0.27 114.93 113.68 1x9s h MET 168 Ca -0.03 -0.26 -0.07 0.00 -3.44 0.00 0.00 59.70 55.90 1x9s h MET 168 Cb 1.31 -0.06 -0.01 0.00 -0.55 0.00 0.00 31.60 32.29 1x9s h MET 168 CO 0.15 0.85 -0.04 -0.44 0.14 0.00 0.00 176.91 177.56 1x9s h ASP 169 N 0.69 0.71 -0.81 1.39 3.32 -1.17 -1.26 116.42 119.30 1x9s h ASP 169 Ca 0.12 -0.33 -0.05 0.00 0.02 0.00 0.00 57.03 56.79 1x9s h ASP 169 Cb 0.60 -0.19 -0.04 0.00 0.22 0.00 0.00 39.33 39.92 1x9s h ASP 169 CO 0.04 0.88 0.33 1.88 -1.72 0.00 0.00 179.24 180.64 1x9s h TYR 170 N 0.53 1.22 0.02 4.55 0.05 -1.21 -1.36 116.97 120.79 1x9s h TYR 170 Ca 0.11 -0.09 0.02 0.00 0.05 0.00 0.00 58.73 58.81 1x9s h TYR 170 Cb 0.54 -0.37 -0.02 0.00 1.01 0.00 0.00 36.73 37.89 1x9s h TYR 170 CO 0.04 0.92 -0.11 -0.97 -1.05 0.00 0.00 178.16 177.00 1x9s h ASN 171 N 1.17 -0.31 -0.91 3.88 -0.00 -0.58 -0.87 115.58 117.97 1x9s h ASN 171 Ca 0.27 0.04 0.01 0.00 -0.00 0.00 0.00 56.30 56.63 1x9s h ASN 171 Cb 0.21 0.13 -0.05 0.00 -0.00 0.00 0.00 38.32 38.61 1x9s h ASN 171 CO -0.02 -0.16 0.60 0.58 -0.00 0.00 0.00 177.43 178.43 1x9s h VAL 172 N -0.19 1.22 -0.71 2.57 2.07 -1.03 -2.15 116.25 118.03 1x9s h VAL 172 Ca 0.03 -0.42 0.10 0.00 0.82 0.00 0.00 66.70 67.24 1x9s h VAL 172 Cb 0.23 -0.11 -0.08 0.00 -1.52 0.00 0.00 31.29 29.82 1x9s h VAL 172 CO -0.09 0.22 0.34 -0.61 0.02 0.00 0.00 177.57 177.45 1x9s h GLN 173 N 1.22 0.54 -0.32 1.57 5.75 -0.54 -1.83 115.11 121.51 1x9s h GLN 173 Ca 0.34 -0.03 0.04 0.00 -0.15 0.00 0.00 58.65 58.84 1x9s h GLN 173 Cb -0.12 -0.12 -0.04 0.00 1.07 0.00 0.00 27.48 28.27 1x9s h GLN 173 CO -0.08 0.36 0.09 -0.44 -2.65 0.00 0.00 178.83 176.11 1x9s h ASP 174 N 0.56 0.08 -0.06 -0.69 3.45 -0.50 0.44 116.42 119.70 1x9s h ASP 174 Ca 0.36 0.04 -0.06 0.00 0.43 0.00 0.00 57.03 57.81 1x9s h ASP 174 Cb 0.42 0.04 -0.01 0.00 -0.56 0.00 0.00 39.33 39.22 1x9s h ASP 174 CO -0.30 0.08 -0.11 0.58 -1.57 0.00 0.00 179.24 177.92 1x9s h VAL 175 N 0.22 1.20 0.71 -1.35 2.07 -1.36 0.72 116.25 118.45 1x9s h VAL 175 Ca 0.14 -0.86 -0.03 0.00 0.82 0.00 0.00 66.70 66.77 1x9s h VAL 175 Cb 0.13 1.15 0.01 0.00 -1.52 0.00 0.00 31.29 31.06 1x9s h VAL 175 CO -0.16 0.28 -0.34 0.58 0.02 0.00 0.00 177.57 177.94 1x9s h VAL 176 N 0.34 0.26 -0.33 2.57 2.07 -0.42 0.30 116.25 121.03 1x9s h VAL 176 Ca 0.07 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 67.45 1x9s h VAL 176 Cb 0.40 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.45 1x9s h VAL 176 CO 0.02 0.01 0.14 0.58 0.02 0.00 0.00 177.57 178.35 1x9s h VAL 177 N -1.04 1.18 -0.69 2.57 2.07 -0.73 -1.69 116.25 117.92 1x9s h VAL 177 Ca -0.10 -0.52 0.07 0.00 0.82 0.00 0.00 66.70 66.97 1x9s h VAL 177 Cb 0.75 0.90 -0.06 0.00 -1.52 0.00 0.00 31.29 31.36 1x9s h VAL 177 CO 0.16 0.19 0.36 0.74 0.02 0.00 0.00 177.57 179.04 1x9s h THR 178 N 0.40 0.91 -0.62 2.57 2.02 0.51 0.31 112.91 119.01 1x9s h THR 178 Ca 0.11 -0.22 -0.03 0.00 0.77 0.00 0.00 66.41 67.04 1x9s h THR 178 Cb 0.16 0.21 -0.03 0.00 -1.74 0.00 0.00 68.15 66.75 1x9s h THR 178 CO -0.01 0.12 0.26 0.50 0.37 0.00 0.00 175.52 176.76 1x9s h LYS 179 N 0.65 0.89 -0.13 6.66 3.64 -0.11 0.99 116.57 129.16 1x9s h LYS 179 Ca 0.32 -0.13 -0.06 0.00 -1.27 0.00 0.00 60.65 59.51 1x9s h LYS 179 Cb 0.27 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.93 1x9s h LYS 179 CO -0.22 0.72 -0.15 0.00 -2.27 0.00 0.00 179.45 177.52 1x9s h ALA 180 N 1.41 0.19 -0.49 5.00 0.00 -0.25 -2.64 119.26 122.48 1x9s h ALA 180 Ca 0.21 -0.33 0.03 0.00 0.00 0.00 0.00 54.91 54.81 1x9s h ALA 180 Cb 0.15 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 1x9s h ALA 180 CO -0.02 0.08 0.28 1.25 0.00 0.00 0.00 179.25 180.84 1x9s h LEU 181 N -0.07 0.45 -0.44 0.00 7.12 -0.22 -0.40 115.31 121.74 1x9s h LEU 181 Ca 0.02 0.01 0.07 0.00 0.13 0.00 0.00 57.88 58.10 1x9s h LEU 181 Cb 0.70 -0.08 -0.06 0.00 -0.53 0.00 0.00 40.66 40.69 1x9s h LEU 181 CO 0.04 0.32 0.10 0.25 -0.13 0.00 0.00 178.44 179.01 1x9s h LEU 182 N 0.56 0.03 -0.73 2.25 5.85 -0.78 -0.09 115.31 122.39 1x9s h LEU 182 Ca 0.20 0.07 -0.13 0.00 0.84 0.00 0.00 57.88 58.86 1x9s h LEU 182 Cb 0.04 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 1x9s h LEU 182 CO -0.10 0.05 -0.49 -0.33 -0.34 0.00 0.00 178.44 177.23 1x9s h GLU 183 N 0.24 0.36 -0.52 1.25 5.08 -1.10 -0.98 114.58 118.91 1x9s h GLU 183 Ca 0.22 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 1x9s h GLU 183 Cb 0.27 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 1x9s h GLU 183 CO -0.27 0.77 0.29 -0.22 -1.00 0.00 0.00 179.01 178.58 1x9s h LYS 184 N 0.29 0.72 -0.48 2.33 3.64 -0.30 -2.17 116.57 120.60 1x9s h LYS 184 Ca 0.01 -0.08 -0.09 0.00 -1.27 0.00 0.00 60.65 59.22 1x9s h LYS 184 Cb 0.96 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.62 1x9s h LYS 184 CO 0.08 0.55 -0.07 -0.07 -2.27 0.00 0.00 179.45 177.68 1x9s h LEU 185 N 0.70 0.83 -0.46 5.20 3.38 -0.73 -2.82 115.31 121.41 1x9s h LEU 185 Ca 0.18 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1x9s h LEU 185 Cb 0.04 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.56 1x9s h LEU 185 CO -0.03 0.94 0.00 0.18 0.09 0.00 0.00 178.44 179.62 1x9s n LEU 186 N -4.18 0.58 -0.01 1.67 4.77 -0.40 -2.55 117.00 116.88 1x9s n LEU 186 Ca 0.02 0.62 0.16 0.00 -0.03 0.00 0.00 56.01 56.78 1x9s n LEU 186 Cb 0.35 -0.52 0.87 0.00 -2.33 0.00 0.00 43.42 41.79 1x9s n LEU 186 CO 0.43 -0.43 1.07 -1.54 -1.33 0.00 0.00 177.39 175.59 1x9s n SER 187 N -2.12 0.05 -4.52 -1.43 3.41 -0.85 -4.66 113.62 103.51 1x9s n SER 187 Ca 0.03 -0.72 -0.42 0.00 -0.26 0.00 0.00 58.87 57.49 1x9s n SER 187 Cb 0.26 -0.09 -0.03 0.00 -0.26 0.00 0.00 64.21 64.08 1x9s n SER 187 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1x9s s ASP 188 N -2.20 6.25 0.62 4.04 -1.08 -1.06 -4.90 116.67 118.35 1x9s s ASP 188 Ca 0.41 -0.52 0.39 0.00 -0.52 0.00 0.00 52.55 52.31 1x9s s ASP 188 Cb 0.21 -2.48 2.09 0.00 -1.46 0.00 0.00 42.92 41.28 1x9s s ASP 188 CO 0.40 -1.50 2.27 0.07 0.52 0.00 0.00 175.17 176.94 1x9s h LYS 189 N 9.62 0.00 -0.56 4.34 5.09 -1.83 -1.55 116.57 131.68 1x9s h LYS 189 Ca -0.27 0.00 -0.04 0.00 0.09 0.00 0.00 60.65 60.42 1x9s h LYS 189 Cb 1.06 0.00 -0.03 0.00 0.10 0.00 0.00 32.23 33.37 1x9s h LYS 189 CO 1.18 0.01 0.16 1.25 -2.09 0.00 0.00 179.45 179.97 1x9s h HIS 190 N 0.00 0.86 0.00 0.07 6.17 -1.97 -3.28 115.15 116.99 1x9s h HIS 190 Ca -0.00 -0.07 -0.37 0.00 0.71 0.00 0.00 60.37 60.64 1x9s h HIS 190 Cb 0.11 -0.25 -0.07 0.00 2.52 0.00 0.00 27.41 29.72 1x9s h HIS 190 CO 0.00 0.70 -2.39 0.66 0.71 0.00 0.00 177.93 177.61 1x9s n TYR 191 N -4.29 0.00 -3.91 5.26 4.02 -0.94 -4.78 117.16 112.52 1x9s n TYR 191 Ca 0.04 0.00 -0.29 0.00 -0.01 0.00 0.00 57.90 57.64 1x9s n TYR 191 Cb 0.21 -1.00 -0.16 0.00 -0.02 0.00 0.00 39.34 38.37 1x9s n TYR 191 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 1x9s s PHE 192 N -2.49 1.98 0.21 -0.72 0.08 -0.63 -0.97 117.98 115.44 1x9s s PHE 192 Ca -0.11 -1.37 -0.32 0.00 0.12 0.00 0.00 56.93 55.25 1x9s s PHE 192 Cb 0.06 -1.43 -0.14 0.00 -0.57 0.00 0.00 43.02 40.94 1x9s s PHE 192 CO 0.82 -0.69 1.31 -2.30 -0.10 0.00 0.00 175.22 174.26 1x9s n PRO 193 N 4.79 1.66 0.23 0.24 -0.02 -1.26 -3.95 135.00 136.70 1x9s n PRO 193 Ca -0.12 0.59 0.06 0.00 -2.02 0.00 0.00 63.50 62.01 1x9s n PRO 193 Cb 0.46 -2.19 0.52 0.00 -0.02 0.00 0.00 33.50 32.27 1x9s n PRO 193 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1x9s h PRO 194 N 3.93 0.00 -0.83 0.52 0.11 -1.94 -2.59 132.00 131.20 1x9s h PRO 194 Ca -0.44 0.00 0.19 0.00 0.11 0.00 0.00 66.00 65.86 1x9s h PRO 194 Cb 1.30 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.36 1x9s h PRO 194 CO 0.74 0.17 0.56 0.93 -0.21 0.00 0.00 178.00 180.19 1x9s h GLU 195 N 0.00 0.32 -5.90 1.05 3.07 -2.00 -3.42 114.58 107.70 1x9s h GLU 195 Ca -0.00 -0.02 -0.67 0.00 -0.50 0.00 0.00 59.36 58.17 1x9s h GLU 195 Cb 0.31 -0.07 -0.12 0.00 -0.84 0.00 0.00 28.75 28.03 1x9s h GLU 195 CO 0.02 0.21 -0.58 0.42 -1.40 0.00 0.00 179.01 177.69 1x9s s ILE 196 N -5.34 4.69 -0.57 3.13 1.01 -0.98 -5.06 121.20 118.08 1x9s s ILE 196 Ca -0.07 -0.17 -0.18 0.00 0.00 0.00 0.00 60.65 60.23 1x9s s ILE 196 Cb 0.22 -3.02 0.10 0.00 0.01 0.00 0.00 42.46 39.77 1x9s s ILE 196 CO 0.77 0.56 0.65 -0.62 0.00 0.00 0.00 174.94 176.30 1x9s s ASP 197 N -1.08 6.19 0.00 3.58 2.15 -1.26 -4.86 116.67 121.38 1x9s s ASP 197 Ca 0.15 -1.41 0.22 0.00 0.43 0.00 0.00 52.55 51.94 1x9s s ASP 197 Cb -0.12 -2.28 1.27 0.00 -0.30 0.00 0.00 42.92 41.49 1x9s s ASP 197 CO 0.05 -1.03 1.69 0.49 -0.17 0.00 0.00 175.17 176.20 1x9s n PHE 198 N 6.10 0.00 -0.48 -5.34 3.01 -1.26 -1.98 117.46 117.51 1x9s n PHE 198 Ca -0.10 0.00 0.11 0.00 1.01 0.00 0.00 57.45 58.47 1x9s n PHE 198 Cb 0.42 -0.05 0.34 0.00 -0.01 0.00 0.00 39.48 40.19 1x9s n PHE 198 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 1x9s n THR 199 N -1.05 1.42 -2.79 4.37 -2.24 -1.26 -4.27 114.28 108.46 1x9s n THR 199 Ca 0.15 -1.09 -0.01 0.00 -2.27 0.00 0.00 64.05 60.83 1x9s n THR 199 Cb 0.09 0.30 0.06 0.00 -2.10 0.00 0.00 70.33 68.68 1x9s n THR 199 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1x9s n ASP 200 N 1.40 1.11 -4.15 3.42 2.03 -0.84 -4.43 116.55 115.09 1x9s n ASP 200 Ca 0.25 -2.14 -0.11 0.00 0.52 0.00 0.00 54.79 53.32 1x9s n ASP 200 Cb 0.76 -0.31 -0.10 0.00 -0.72 0.00 0.00 41.12 40.75 1x9s n ASP 200 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 1x9s s VAL 201 N -3.16 0.63 0.77 5.18 -7.23 -1.25 -4.96 120.40 110.38 1x9s s VAL 201 Ca 0.25 -1.80 -0.11 0.00 -1.81 0.00 0.00 61.98 58.50 1x9s s VAL 201 Cb 0.35 -1.52 0.05 0.00 0.56 0.00 0.00 36.38 35.83 1x9s s VAL 201 CO -0.04 -0.81 1.09 -0.83 -0.31 0.00 0.00 175.10 174.19 1x9s s GLY 202 N -2.82 1.63 0.19 2.32 0.00 -1.26 -4.71 107.32 102.67 1x9s s GLY 202 Ca 0.08 -0.16 -0.12 0.00 0.00 0.00 0.00 44.72 44.52 1x9s s GLY 202 CO -0.04 0.23 1.74 0.10 0.00 0.00 0.00 173.10 175.13 1x9s h TYR 203 N -0.96 0.32 0.00 1.90 -0.00 -1.45 -1.47 116.97 115.30 1x9s h TYR 203 Ca -0.46 0.03 -0.01 0.00 0.00 0.00 0.00 58.73 58.28 1x9s h TYR 203 Cb 1.25 -0.06 -0.00 0.00 0.00 0.00 0.00 36.73 37.92 1x9s h TYR 203 CO 0.50 0.09 -0.05 0.00 -0.00 0.00 0.00 178.16 178.70 1x9s h THR 204 N 0.36 0.52 0.22 -0.90 1.03 -1.89 -2.27 112.91 109.97 1x9s h THR 204 Ca 0.25 -0.23 -0.34 0.00 -0.01 0.00 0.00 66.41 66.09 1x9s h THR 204 Cb 0.28 1.15 0.02 0.00 -1.07 0.00 0.00 68.15 68.54 1x9s h THR 204 CO -0.26 0.05 -1.56 0.74 -0.01 0.00 0.00 175.52 174.48 1x9s h THR 205 N 0.00 1.18 -0.64 0.00 2.02 -1.67 -2.92 112.91 110.88 1x9s h THR 205 Ca -0.00 -2.68 0.06 0.00 0.77 0.00 0.00 66.41 64.56 1x9s h THR 205 Cb 0.15 2.93 -0.05 0.00 -1.74 0.00 0.00 68.15 69.44 1x9s h THR 205 CO 0.01 0.83 0.35 0.15 0.37 0.00 0.00 175.52 177.23 1x9s h PHE 206 N 0.13 0.65 -0.09 3.16 3.04 -0.75 0.32 116.94 123.40 1x9s h PHE 206 Ca -0.28 0.02 -0.19 0.00 3.98 0.00 0.00 57.97 61.51 1x9s h PHE 206 Cb 2.13 -0.20 0.01 0.00 2.56 0.00 0.00 35.95 40.45 1x9s h PHE 206 CO 0.11 0.31 -0.70 -1.49 -2.02 0.00 0.00 178.31 174.53 1x9s h TRP 207 N 0.66 0.87 0.27 0.41 -0.00 -1.63 -3.16 115.95 113.36 1x9s h TRP 207 Ca 0.29 -0.41 0.01 0.00 -0.00 0.00 0.00 58.89 58.77 1x9s h TRP 207 Cb 0.17 -0.12 -0.03 0.00 -0.00 0.00 0.00 29.16 29.18 1x9s h TRP 207 CO -0.08 1.22 -0.35 1.03 -0.00 0.00 0.00 178.44 180.27 1x9s h SER 208 N 0.27 -0.96 0.58 -3.49 0.87 -1.20 -3.20 113.55 106.42 1x9s h SER 208 Ca -0.06 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.59 1x9s h SER 208 Cb 1.35 0.34 0.00 0.00 -0.44 0.00 0.00 62.40 63.65 1x9s h SER 208 CO 0.14 -0.47 -0.12 -0.62 -0.53 0.00 0.00 176.83 175.23 1x9s n GLU 209 N -5.45 0.36 -3.04 2.24 -0.58 0.11 -4.89 120.64 109.39 1x9s n GLU 209 Ca -0.09 -0.10 -0.21 0.00 -0.42 0.00 0.00 57.16 56.35 1x9s n GLU 209 Cb 0.35 -1.50 0.01 0.00 -0.57 0.00 0.00 31.44 29.74 1x9s n GLU 209 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 1x9s s SER 210 N -2.71 5.72 0.50 1.62 1.04 -1.19 -4.53 113.70 114.15 1x9s s SER 210 Ca 0.22 -0.01 -0.21 0.00 0.48 0.00 0.00 55.95 56.43 1x9s s SER 210 Cb 0.19 -1.17 -0.09 0.00 0.10 0.00 0.00 66.02 65.05 1x9s s SER 210 CO 0.52 -0.74 0.75 -0.11 0.98 0.00 0.00 173.24 174.65 1x9s n LEU 211 N -1.99 1.71 -0.24 2.42 7.94 -0.14 -4.85 117.00 121.85 1x9s n LEU 211 Ca 0.03 0.87 0.09 0.00 -1.11 0.00 0.00 56.01 55.89 1x9s n LEU 211 Cb 0.58 -1.25 0.35 0.00 0.53 0.00 0.00 43.42 43.63 1x9s n LEU 211 CO 0.44 -2.35 1.22 -0.08 -1.11 0.00 0.00 177.39 175.52 1x9s h GLU 212 N 0.76 0.74 -0.89 1.96 4.81 -1.90 -2.46 114.58 117.61 1x9s h GLU 212 Ca -0.45 -0.04 0.16 0.00 -0.13 0.00 0.00 59.36 58.90 1x9s h GLU 212 Cb 1.38 -0.17 -0.07 0.00 0.63 0.00 0.00 28.75 30.52 1x9s h GLU 212 CO 0.51 0.49 0.57 0.00 -0.73 0.00 0.00 179.01 179.86 1x9s h ALA 213 N 1.59 1.94 -0.73 2.92 0.00 -1.87 -1.60 119.26 121.51 1x9s h ALA 213 Ca 0.39 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.30 1x9s h ALA 213 Cb 0.48 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 1x9s h ALA 213 CO -0.16 -0.20 0.40 0.28 0.00 0.00 0.00 179.25 179.57 1x9s h VAL 214 N 0.60 1.22 -0.16 0.00 2.07 -1.78 -0.56 116.25 117.64 1x9s h VAL 214 Ca 0.45 -0.56 -0.03 0.00 0.82 0.00 0.00 66.70 67.38 1x9s h VAL 214 Cb 0.86 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 1x9s h VAL 214 CO -0.20 0.25 -0.02 -0.78 0.02 0.00 0.00 177.57 176.83 1x9s h ASP 215 N 1.01 0.30 -0.04 0.57 3.58 -1.44 -2.59 116.42 117.81 1x9s h ASP 215 Ca 0.26 -0.35 0.00 0.00 0.42 0.00 0.00 57.03 57.36 1x9s h ASP 215 Cb 0.04 -0.08 -0.00 0.00 1.72 0.00 0.00 39.33 41.00 1x9s h ASP 215 CO -0.04 0.58 0.02 0.40 -2.88 0.00 0.00 179.24 177.32 1x9s h ILE 216 N 0.03 1.00 -0.72 2.25 2.04 -1.11 -1.28 117.51 119.72 1x9s h ILE 216 Ca 0.04 -0.02 -0.02 0.00 1.00 0.00 0.00 64.86 65.87 1x9s h ILE 216 Cb 0.44 0.95 -0.03 0.00 -0.74 0.00 0.00 36.82 37.43 1x9s h ILE 216 CO 0.01 0.01 0.39 -0.33 0.00 0.00 0.00 178.15 178.23 1x9s h GLU 217 N 0.05 1.01 -0.40 2.37 4.39 -1.15 0.24 114.58 121.09 1x9s h GLU 217 Ca 0.02 -0.11 -0.14 0.00 0.34 0.00 0.00 59.36 59.47 1x9s h GLU 217 Cb 0.00 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 28.44 1x9s h GLU 217 CO -0.01 0.74 -0.30 0.45 -1.16 0.00 0.00 179.01 178.73 1x9s h HIS 218 N 1.01 1.01 -0.20 4.33 3.86 -1.23 0.19 115.15 124.12 1x9s h HIS 218 Ca 0.26 -0.27 -0.13 0.00 -1.16 0.00 0.00 60.37 59.07 1x9s h HIS 218 Cb 0.04 -0.23 -0.01 0.00 1.06 0.00 0.00 27.41 28.27 1x9s h HIS 218 CO 0.01 1.05 -0.42 0.00 0.86 0.00 0.00 177.93 179.43 1x9s h ARG 219 N 0.73 0.48 -0.38 2.45 3.08 -0.79 -2.04 114.38 117.91 1x9s h ARG 219 Ca 0.08 -0.24 -0.16 0.00 0.07 0.00 0.00 59.98 59.72 1x9s h ARG 219 Cb 0.86 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.91 1x9s h ARG 219 CO 0.08 0.81 -0.40 0.00 -1.07 0.00 0.00 179.97 179.39 1x9s h ALA 220 N 1.16 0.56 -0.44 0.04 0.00 -0.19 -1.97 119.26 118.41 1x9s h ALA 220 Ca 0.03 -0.46 -0.11 0.00 0.00 0.00 0.00 54.91 54.38 1x9s h ALA 220 Cb 0.90 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1x9s h ALA 220 CO 0.08 0.67 -0.14 0.00 0.00 0.00 0.00 179.25 179.86 1x9s h ALA 221 N 0.76 0.61 -0.23 0.00 0.00 -0.55 -1.70 119.26 118.15 1x9s h ALA 221 Ca 0.06 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 1x9s h ALA 221 Cb 1.00 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1x9s h ALA 221 CO 0.10 0.53 0.12 2.35 0.00 0.00 0.00 179.25 182.35 1x9s h TRP 222 N 0.71 0.33 -0.50 0.00 2.91 -1.31 0.53 115.95 118.63 1x9s h TRP 222 Ca 0.11 -0.01 -0.07 0.00 1.13 0.00 0.00 58.89 60.04 1x9s h TRP 222 Cb 0.69 -0.10 -0.02 0.00 -0.51 0.00 0.00 29.16 29.22 1x9s h TRP 222 CO 0.05 0.31 0.03 1.25 -1.03 0.00 0.00 178.44 179.05 1x9s h LEU 223 N 0.25 0.84 -1.18 0.65 5.85 -1.37 -2.81 115.31 117.54 1x9s h LEU 223 Ca 0.08 -0.29 -0.07 0.00 0.84 0.00 0.00 57.88 58.44 1x9s h LEU 223 Cb 0.10 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 1x9s h LEU 223 CO -0.01 0.92 -0.33 -0.07 -0.34 0.00 0.00 178.44 178.61 1x9s h LEU 224 N 0.73 0.00 -0.69 2.25 3.38 -1.11 -1.27 115.31 118.60 1x9s h LEU 224 Ca 0.14 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.03 1x9s h LEU 224 Cb 0.48 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 1x9s h LEU 224 CO 0.02 0.33 0.07 0.00 0.09 0.00 0.00 178.44 178.95 1x9s h ALA 225 N 1.67 0.90 -0.43 1.53 0.00 -0.71 -1.68 119.26 120.54 1x9s h ALA 225 Ca -0.00 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 1x9s h ALA 225 Cb 0.75 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1x9s h ALA 225 CO 0.04 0.66 0.23 -0.22 0.00 0.00 0.00 179.25 179.96 1x9s h LYS 226 N 1.00 0.61 -0.54 0.00 1.63 -1.12 -2.53 116.57 115.62 1x9s h LYS 226 Ca 0.19 -0.08 0.05 0.00 -0.85 0.00 0.00 60.65 59.96 1x9s h LYS 226 Cb 0.48 -0.12 -0.05 0.00 -0.60 0.00 0.00 32.23 31.95 1x9s h LYS 226 CO 0.02 0.50 0.28 0.37 -3.45 0.00 0.00 179.45 177.17 1x9s h GLN 227 N 0.56 0.52 -0.71 1.90 4.15 -0.65 0.10 115.11 120.99 1x9s h GLN 227 Ca 0.15 -0.03 -0.00 0.00 0.77 0.00 0.00 58.65 59.54 1x9s h GLN 227 Cb 0.08 -0.12 -0.04 0.00 0.21 0.00 0.00 27.48 27.61 1x9s h GLN 227 CO -0.02 0.35 0.44 0.93 -1.93 0.00 0.00 178.83 178.60 1x9s h GLU 228 N 0.54 0.95 -0.21 1.69 5.08 -1.17 -0.93 114.58 120.52 1x9s h GLU 228 Ca 0.23 -0.07 -0.12 0.00 -1.00 0.00 0.00 59.36 58.40 1x9s h GLU 228 Cb 0.13 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 1x9s h GLU 228 CO -0.16 0.66 -0.39 0.00 -1.00 0.00 0.00 179.01 178.12 1x9s h ARG 229 N 0.98 0.49 -0.04 2.33 3.08 -0.80 -3.08 114.38 117.34 1x9s h ARG 229 Ca 0.26 -0.24 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 1x9s h ARG 229 Cb -0.06 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 29.98 1x9s h ARG 229 CO -0.05 0.81 0.01 -0.91 -1.07 0.00 0.00 179.97 178.76 1x9s h ASN 230 N 0.41 0.06 -4.18 7.04 2.35 0.18 -3.50 115.58 117.94 1x9s h ASN 230 Ca 0.04 -0.21 0.00 0.00 -0.55 0.00 0.00 56.30 55.57 1x9s h ASN 230 Cb 0.87 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 39.22 1x9s h ASN 230 CO 0.07 0.26 0.00 0.61 -1.65 0.00 0.00 177.43 176.72 1x9s n GLY 231 N -0.52 -1.15 3.05 2.83 0.00 -0.45 -4.86 105.19 104.09 1x9s n GLY 231 Ca -0.07 -1.62 -0.32 0.00 0.00 0.00 0.00 46.02 44.01 1x9s n GLY 231 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1x9s s PHE 232 N -1.49 3.01 0.05 1.61 2.19 -0.64 -4.57 117.98 118.13 1x9s s PHE 232 Ca 0.00 -2.11 -0.37 0.00 0.33 0.00 0.00 56.93 54.78 1x9s s PHE 232 Cb 0.00 -1.85 -0.17 0.00 -1.31 0.00 0.00 43.02 39.69 1x9s s PHE 232 CO 0.00 -0.84 1.36 -2.30 1.83 0.00 0.00 175.22 175.27 1x9s n PRO 233 N 4.51 1.09 -4.68 10.12 -0.02 -1.26 -1.91 135.00 142.85 1x9s n PRO 233 Ca -0.14 0.39 -0.26 0.00 -2.02 0.00 0.00 63.50 61.47 1x9s n PRO 233 Cb 0.43 -2.03 -0.17 0.00 -0.02 0.00 0.00 33.50 31.72 1x9s n PRO 233 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1x9s s PHE 234 N 0.75 1.63 -1.31 6.00 5.36 -0.76 -2.01 117.98 127.64 1x9s s PHE 234 Ca 0.86 -0.62 -0.16 0.00 -0.96 0.00 0.00 56.93 56.05 1x9s s PHE 234 Cb -0.98 -1.17 0.09 0.00 -0.34 0.00 0.00 43.02 40.62 1x9s s PHE 234 CO 0.49 -0.30 1.76 -3.47 -1.46 0.00 0.00 175.22 172.24 1x9s n ASP 235 N 3.78 4.84 -0.01 6.13 -0.08 0.26 -4.82 116.55 126.65 1x9s n ASP 235 Ca -0.22 -2.93 -0.14 0.00 -1.51 0.00 0.00 54.79 49.99 1x9s n ASP 235 Cb 0.52 -1.69 -0.08 0.00 2.34 0.00 0.00 41.12 42.21 1x9s n ASP 235 CO 0.00 0.00 0.00 0.74 0.12 0.00 0.00 177.20 178.06 1x9s h THR 236 N 5.04 0.07 -0.79 5.18 2.02 -1.92 -0.86 112.91 121.64 1x9s h THR 236 Ca 0.44 0.00 0.18 0.00 0.77 0.00 0.00 66.41 67.80 1x9s h THR 236 Cb 0.82 0.07 -0.12 0.00 -1.74 0.00 0.00 68.15 67.18 1x9s h THR 236 CO 1.49 0.00 0.20 0.50 0.37 0.00 0.00 175.52 178.09 1x9s h LYS 237 N -0.53 0.25 -0.25 6.66 3.11 -2.00 -0.23 116.57 123.59 1x9s h LYS 237 Ca 0.06 -0.02 0.06 0.00 -2.81 0.00 0.00 60.65 57.94 1x9s h LYS 237 Cb 0.65 -0.06 -0.06 0.00 -1.00 0.00 0.00 32.23 31.77 1x9s h LYS 237 CO -0.43 0.17 -0.11 0.00 -2.81 0.00 0.00 179.45 176.27 1x9s h ALA 238 N 1.67 0.10 -0.01 5.00 0.00 -1.58 -1.46 119.26 122.98 1x9s h ALA 238 Ca 0.46 0.10 -0.08 0.00 0.00 0.00 0.00 54.91 55.39 1x9s h ALA 238 Cb 0.84 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 1x9s h ALA 238 CO -0.56 -0.51 -0.39 0.82 0.00 0.00 0.00 179.25 178.60 1x9s h ILE 239 N -0.07 1.29 -0.41 0.00 1.08 -0.49 -1.76 117.51 117.15 1x9s h ILE 239 Ca 0.13 -1.36 -0.10 0.00 -0.39 0.00 0.00 64.86 63.14 1x9s h ILE 239 Cb 0.26 1.72 -0.01 0.00 -3.07 0.00 0.00 36.82 35.72 1x9s h ILE 239 CO -0.30 0.39 -0.13 -0.33 -0.69 0.00 0.00 178.15 177.10 1x9s h GLU 240 N 0.02 0.81 -0.35 2.37 5.08 -0.61 0.11 114.58 122.01 1x9s h GLU 240 Ca -0.00 -0.32 -0.05 0.00 -1.00 0.00 0.00 59.36 57.98 1x9s h GLU 240 Cb 0.71 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.90 1x9s h GLU 240 CO 0.05 0.95 -0.01 0.93 -1.00 0.00 0.00 179.01 179.93 1x9s h GLU 241 N 0.63 0.55 -0.06 2.33 5.08 -1.04 -1.13 114.58 120.94 1x9s h GLU 241 Ca 0.10 -0.12 -0.14 0.00 -1.00 0.00 0.00 59.36 58.20 1x9s h GLU 241 Cb 0.66 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.82 1x9s h GLU 241 CO 0.05 0.58 -0.59 1.25 -1.00 0.00 0.00 179.01 179.30 1x9s h LEU 242 N 0.52 0.21 -0.42 1.33 5.85 -0.94 -2.51 115.31 119.35 1x9s h LEU 242 Ca 0.11 -0.12 -0.12 0.00 0.84 0.00 0.00 57.88 58.59 1x9s h LEU 242 Cb 0.35 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 1x9s h LEU 242 CO 0.01 0.75 -0.22 0.22 -0.34 0.00 0.00 178.44 178.86 1x9s h TYR 243 N 0.14 1.04 -0.51 1.25 3.20 0.04 0.15 116.97 122.27 1x9s h TYR 243 Ca -0.00 -0.26 -0.01 0.00 3.14 0.00 0.00 58.73 61.60 1x9s h TYR 243 Cb 1.07 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 39.08 1x9s h TYR 243 CO 0.02 1.05 0.29 0.28 -1.64 0.00 0.00 178.16 178.15 1x9s h VAL 244 N 0.72 1.17 0.68 1.81 2.07 -1.11 0.29 116.25 121.89 1x9s h VAL 244 Ca 0.09 -0.42 -0.03 0.00 0.82 0.00 0.00 66.70 67.16 1x9s h VAL 244 Cb 0.79 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 31.09 1x9s h VAL 244 CO 0.06 0.18 -0.35 -0.08 0.02 0.00 0.00 177.57 177.40 1x9s h GLU 245 N 0.68 -0.92 -0.45 1.57 4.81 -1.23 -1.85 114.58 117.18 1x9s h GLU 245 Ca 0.18 0.06 0.07 0.00 -0.13 0.00 0.00 59.36 59.54 1x9s h GLU 245 Cb 0.04 0.21 -0.06 0.00 0.63 0.00 0.00 28.75 29.57 1x9s h GLU 245 CO -0.03 -0.61 0.11 -0.07 -0.73 0.00 0.00 179.01 177.68 1x9s h LEU 246 N -0.95 0.05 -1.89 1.64 3.38 -0.76 -0.52 115.31 116.25 1x9s h LEU 246 Ca -0.09 0.07 0.01 0.00 0.09 0.00 0.00 57.88 57.97 1x9s h LEU 246 Cb 0.74 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 1x9s h LEU 246 CO 0.13 0.06 0.10 0.00 0.09 0.00 0.00 178.44 178.83 1x9s h ALA 247 N 1.33 1.96 0.13 1.53 0.00 -0.34 0.05 119.26 123.92 1x9s h ALA 247 Ca 0.22 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 1x9s h ALA 247 Cb 0.27 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1x9s h ALA 247 CO -0.27 0.02 -0.06 0.00 0.00 0.00 0.00 179.25 178.93 1x9s h ALA 248 N 1.91 -0.18 0.00 0.00 0.00 -0.26 -1.74 119.26 119.00 1x9s h ALA 248 Ca 0.06 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1x9s h ALA 248 Cb 0.07 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1x9s h ALA 248 CO -0.01 -0.36 -0.03 -0.09 0.00 0.00 0.00 179.25 178.75 1x9s h ARG 249 N -0.65 0.00 -0.05 0.00 9.65 -0.91 -1.52 114.38 120.91 1x9s h ARG 249 Ca -0.02 0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 58.85 1x9s h ARG 249 Cb 0.49 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.07 1x9s h ARG 249 CO 0.03 0.03 -0.02 -0.09 2.80 0.00 0.00 179.97 182.72 1x9s h ARG 250 N 0.00 0.10 0.05 0.20 2.43 -0.89 -1.64 114.38 114.62 1x9s h ARG 250 Ca -0.00 -0.04 0.02 0.00 -0.81 0.00 0.00 59.98 59.15 1x9s h ARG 250 Cb 0.07 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.58 1x9s h ARG 250 CO 0.00 0.49 -0.21 0.77 -1.51 0.00 0.00 179.97 179.52 1x9s h SER 251 N -0.30 -0.60 -0.90 -3.80 0.02 -0.47 0.34 113.55 107.83 1x9s h SER 251 Ca 0.01 0.08 0.06 0.00 -0.84 0.00 0.00 61.79 61.09 1x9s h SER 251 Cb 0.46 0.24 -0.06 0.00 0.14 0.00 0.00 62.40 63.19 1x9s h SER 251 CO 0.01 -0.28 0.59 -0.08 -1.14 0.00 0.00 176.83 175.92 1x9s h GLU 252 N -0.36 1.03 0.00 3.45 4.57 -1.35 0.86 114.58 122.77 1x9s h GLU 252 Ca 0.04 -0.06 -0.10 0.00 -1.18 0.00 0.00 59.36 58.07 1x9s h GLU 252 Cb 0.41 -0.23 -0.01 0.00 -0.16 0.00 0.00 28.75 28.76 1x9s h GLU 252 CO -0.16 0.68 -0.46 -0.07 -1.18 0.00 0.00 179.01 177.82 1x9s h LEU 253 N 1.06 0.00 -0.14 1.64 3.38 -0.70 -2.15 115.31 118.40 1x9s h LEU 253 Ca 0.38 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 58.19 1x9s h LEU 253 Cb 0.14 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.90 1x9s h LEU 253 CO -0.13 0.46 -0.55 0.25 0.09 0.00 0.00 178.44 178.57 1x9s h LEU 254 N 0.00 0.72 0.59 1.67 5.85 0.72 -2.30 115.31 122.56 1x9s h LEU 254 Ca -0.00 -0.62 -0.02 0.00 0.84 0.00 0.00 57.88 58.07 1x9s h LEU 254 Cb 0.84 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.66 1x9s h LEU 254 CO 0.06 1.22 -0.35 -0.09 -0.34 0.00 0.00 178.44 178.94 1x9s h ARG 255 N 0.27 -0.85 -0.83 1.25 2.43 -0.72 0.96 114.38 116.89 1x9s h ARG 255 Ca -0.03 0.06 0.07 0.00 -0.81 0.00 0.00 59.98 59.27 1x9s h ARG 255 Cb 1.18 0.19 -0.05 0.00 -0.42 0.00 0.00 29.97 30.87 1x9s h ARG 255 CO 0.11 -0.56 0.54 0.87 -1.51 0.00 0.00 179.97 179.42 1x9s h LYS 256 N -0.88 0.87 0.05 0.20 1.57 -1.49 -2.64 116.57 114.25 1x9s h LYS 256 Ca -0.07 -0.05 -0.23 0.00 -1.87 0.00 0.00 60.65 58.43 1x9s h LYS 256 Cb 0.71 -0.20 0.02 0.00 0.08 0.00 0.00 32.23 32.84 1x9s h LYS 256 CO 0.09 0.57 -0.92 -0.07 -0.57 0.00 0.00 179.45 178.55 1x9s h LEU 257 N 0.89 0.71 0.00 2.94 3.38 -1.09 -2.53 115.31 119.61 1x9s h LEU 257 Ca 0.36 -0.80 0.00 0.00 0.09 0.00 0.00 57.88 57.53 1x9s h LEU 257 Cb 0.25 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1x9s h LEU 257 CO -0.13 1.43 0.00 0.35 0.09 0.00 0.00 178.44 180.18 1x9s n THR 258 N -4.00 0.00 -0.07 0.22 -2.24 0.33 -1.39 114.28 107.13 1x9s n THR 258 Ca -0.12 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.51 1x9s n THR 258 Cb 0.83 -0.45 -0.05 0.00 -2.10 0.00 0.00 70.33 68.55 1x9s n THR 258 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1x9s n GLU 259 N -0.71 0.35 -0.08 -0.78 1.02 -1.02 -4.56 120.64 114.86 1x9s n GLU 259 Ca 0.05 0.15 0.06 0.00 -0.02 0.00 0.00 57.16 57.40 1x9s n GLU 259 Cb 0.02 -1.09 0.41 0.00 -0.02 0.00 0.00 31.44 30.77 1x9s n GLU 259 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 1x9s h THR 260 N -0.60 1.04 -3.74 2.62 2.02 -1.18 -3.35 112.91 109.72 1x9s h THR 260 Ca -0.34 -0.21 -0.67 0.00 0.77 0.00 0.00 66.41 65.97 1x9s h THR 260 Cb 1.21 0.39 -0.37 0.00 -1.74 0.00 0.00 68.15 67.64 1x9s h THR 260 CO -0.20 0.11 -0.73 -0.36 0.37 0.00 0.00 175.52 174.71 1x9s s PHE 261 N -5.54 3.50 0.89 3.16 0.08 -0.48 -5.05 117.98 114.55 1x9s s PHE 261 Ca -0.09 -2.53 -0.12 0.00 0.12 0.00 0.00 56.93 54.31 1x9s s PHE 261 Cb 0.18 -2.49 0.13 0.00 -0.57 0.00 0.00 43.02 40.27 1x9s s PHE 261 CO 0.75 -0.91 1.10 0.20 -0.10 0.00 0.00 175.22 176.26 1x9s s GLY 262 N 1.13 1.60 0.64 4.36 0.00 -1.26 -4.50 107.32 109.30 1x9s s GLY 262 Ca 0.01 -0.20 -0.10 0.00 0.00 0.00 0.00 44.72 44.43 1x9s s GLY 262 CO -0.05 0.30 1.03 -1.35 0.00 0.00 0.00 173.10 173.02 1x9s s SER 263 N -3.61 5.81 0.19 1.64 1.04 -1.26 -4.62 113.70 112.88 1x9s s SER 263 Ca 0.63 1.17 0.04 0.00 0.48 0.00 0.00 55.95 58.27 1x9s s SER 263 Cb -0.17 -2.12 -0.02 0.00 0.10 0.00 0.00 66.02 63.81 1x9s s SER 263 CO 0.56 -1.08 0.16 -2.67 0.98 0.00 0.00 173.24 171.19 1x9s n TRP 264 N -2.81 -0.44 -4.44 5.02 2.14 -0.81 -5.01 117.44 111.09 1x9s n TRP 264 Ca 0.06 -1.59 -0.31 0.00 2.07 0.00 0.00 57.50 57.74 1x9s n TRP 264 Cb 0.56 0.16 -0.11 0.00 -0.81 0.00 0.00 31.31 31.11 1x9s n TRP 264 CO 0.00 0.00 0.00 0.71 2.07 0.00 0.00 177.69 180.47 1x9s s TYR 265 N -2.76 2.71 0.00 -2.67 1.51 -1.26 -1.49 117.35 113.39 1x9s s TYR 265 Ca 0.22 -0.17 0.01 0.00 -1.01 0.00 0.00 57.07 56.13 1x9s s TYR 265 Cb 0.01 -1.49 -0.00 0.00 -0.11 0.00 0.00 41.96 40.37 1x9s s TYR 265 CO 0.16 0.35 -0.03 -0.65 -1.11 0.00 0.00 175.55 174.27 1x9s s GLN 266 N -1.73 0.22 0.60 -0.62 -0.21 -0.53 -4.94 119.66 112.44 1x9s s GLN 266 Ca 0.18 -0.15 -0.19 0.00 0.02 0.00 0.00 55.36 55.22 1x9s s GLN 266 Cb -0.11 -0.17 -0.03 0.00 1.00 0.00 0.00 33.01 33.70 1x9s s GLN 266 CO 0.09 0.04 1.22 -1.25 -2.12 0.00 0.00 175.29 173.27 1x9s s PRO 267 N -0.22 2.90 -0.30 2.91 0.04 -1.26 -0.44 135.00 138.63 1x9s s PRO 267 Ca -0.01 1.85 -0.16 0.00 0.04 0.00 0.00 61.00 62.73 1x9s s PRO 267 Cb -0.02 -1.92 0.21 0.00 0.04 0.00 0.00 34.50 32.81 1x9s s PRO 267 CO -0.00 -1.27 1.24 0.21 0.04 0.00 0.00 177.00 177.22 1x9s s LYS 268 N -3.35 0.07 0.00 4.56 2.47 0.09 -4.72 119.74 118.85 1x9s s LYS 268 Ca 0.78 0.12 0.00 0.00 -1.56 0.00 0.00 55.97 55.31 1x9s s LYS 268 Cb -0.31 0.01 0.00 0.00 -1.46 0.00 0.00 37.83 36.07 1x9s s LYS 268 CO 0.34 -0.02 0.00 0.41 0.16 0.00 0.00 175.35 176.25 1x9s n GLY 269 N 3.12 0.65 3.72 5.54 0.00 -1.26 -3.99 105.19 112.97 1x9s n GLY 269 Ca -0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 1x9s n GLY 269 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1x9s s GLY 270 N -1.30 2.27 -0.15 -0.02 0.00 -1.26 -4.93 107.32 101.93 1x9s s GLY 270 Ca 0.00 0.97 -0.08 0.00 0.00 0.00 0.00 44.72 45.61 1x9s s GLY 270 CO 0.00 2.14 -0.20 -1.30 0.00 0.00 0.00 173.10 173.74 1x9s n THR 271 N 3.77 0.84 -1.82 0.90 -2.24 -0.35 -4.76 114.28 110.63 1x9s n THR 271 Ca 0.09 -0.22 -0.31 0.00 -2.27 0.00 0.00 64.05 61.35 1x9s n THR 271 Cb 0.45 -1.69 0.03 0.00 -2.10 0.00 0.00 70.33 67.01 1x9s n THR 271 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1x9s s GLU 272 N -2.28 3.28 0.02 -0.78 2.02 -0.81 -4.89 118.70 115.25 1x9s s GLU 272 Ca -0.21 0.71 -0.17 0.00 0.02 0.00 0.00 54.97 55.31 1x9s s GLU 272 Cb 0.08 -2.05 -0.06 0.00 0.10 0.00 0.00 34.13 32.21 1x9s s GLU 272 CO 0.27 -0.79 0.49 1.41 0.02 0.00 0.00 175.26 176.66 1x9s s MET 273 N -5.20 4.11 -0.23 1.61 -2.45 -1.26 -1.86 119.30 114.01 1x9s s MET 273 Ca 0.56 0.57 -0.27 0.00 -1.25 0.00 0.00 55.69 55.31 1x9s s MET 273 Cb -0.12 -3.26 0.00 0.00 1.25 0.00 0.00 34.83 32.70 1x9s s MET 273 CO 0.54 0.59 0.92 0.12 1.05 0.00 0.00 175.02 178.24 1x9s s PHE 274 N -0.83 3.33 -0.04 4.11 5.36 -1.26 -4.84 117.98 123.81 1x9s s PHE 274 Ca 0.27 1.30 0.05 0.00 -0.96 0.00 0.00 56.93 57.58 1x9s s PHE 274 Cb -0.18 -3.14 -0.03 0.00 -0.34 0.00 0.00 43.02 39.33 1x9s s PHE 274 CO 0.16 -0.42 -0.16 0.00 -1.46 0.00 0.00 175.22 173.33 1x9s n HIS 276 N 2.26 2.06 0.06 0.00 -0.00 -0.98 -4.80 115.22 113.82 1x9s n HIS 276 Ca -0.17 0.36 0.04 0.00 0.46 0.00 0.00 57.72 58.40 1x9s n HIS 276 Cb 0.52 -2.51 0.19 0.00 -0.12 0.00 0.00 29.99 28.07 1x9s n HIS 276 CO 0.00 0.00 0.00 -2.30 0.46 0.00 0.00 176.34 174.50 1x9s n PRO 277 N 4.96 0.04 -0.10 1.57 -0.02 -1.26 -0.50 135.00 139.70 1x9s n PRO 277 Ca 0.23 0.54 -0.16 0.00 -2.02 0.00 0.00 63.50 62.08 1x9s n PRO 277 Cb 0.21 -1.64 -0.08 0.00 -0.02 0.00 0.00 33.50 31.97 1x9s n PRO 277 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1x9s n ARG 278 N -1.74 0.45 -0.01 -0.52 3.00 -1.26 -4.78 116.66 111.79 1x9s n ARG 278 Ca -0.00 0.14 0.07 0.00 -0.01 0.00 0.00 57.85 58.05 1x9s n ARG 278 Cb 0.01 -1.30 -0.13 0.00 0.00 0.00 0.00 32.46 31.04 1x9s n ARG 278 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 1x9s n THR 279 N -3.40 0.08 -0.09 0.55 -2.24 -1.18 -4.98 114.28 103.02 1x9s n THR 279 Ca -0.36 -0.41 0.00 0.00 -2.27 0.00 0.00 64.05 61.01 1x9s n THR 279 Cb 0.82 0.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.11 1x9s n THR 279 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1x9s n GLY 280 N 1.57 1.68 3.44 3.38 0.00 0.34 -4.96 105.19 110.64 1x9s n GLY 280 Ca -0.05 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.49 1x9s n GLY 280 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1x9s n LYS 281 N -2.00 0.72 -1.61 1.61 4.81 -1.26 -4.34 118.16 116.09 1x9s n LYS 281 Ca 0.00 0.16 -0.42 0.00 -0.87 0.00 0.00 58.31 57.18 1x9s n LYS 281 Cb 0.00 -2.28 0.01 0.00 0.02 0.00 0.00 35.03 32.78 1x9s n LYS 281 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 1x9s n PRO 282 N 8.25 1.37 -3.75 1.64 -0.02 -1.26 -2.31 135.00 138.92 1x9s n PRO 282 Ca 0.47 0.49 -0.28 0.00 -2.02 0.00 0.00 63.50 62.16 1x9s n PRO 282 Cb 0.19 -2.03 -0.12 0.00 -0.02 0.00 0.00 33.50 31.53 1x9s n PRO 282 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1x9s s LEU 283 N -0.42 3.58 0.54 2.45 1.43 0.14 -4.88 118.68 121.52 1x9s s LEU 283 Ca 0.62 -3.39 0.31 0.00 -1.03 0.00 0.00 54.13 50.65 1x9s s LEU 283 Cb -0.57 -1.24 1.49 0.00 0.03 0.00 0.00 46.19 45.90 1x9s s LEU 283 CO 0.57 -0.15 2.05 -0.65 0.23 0.00 0.00 176.35 178.41 1x9s h PRO 284 N 5.77 0.00 -0.04 1.29 0.11 -1.93 -2.40 132.00 134.80 1x9s h PRO 284 Ca 0.13 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 66.16 1x9s h PRO 284 Cb 0.83 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.93 1x9s h PRO 284 CO 0.59 0.09 -0.36 0.87 -0.21 0.00 0.00 178.00 178.98 1x9s h LYS 285 N 0.00 0.08 -6.86 1.05 1.57 -1.94 -3.43 116.57 107.04 1x9s h LYS 285 Ca -0.00 -0.03 -0.48 0.00 -1.87 0.00 0.00 60.65 58.27 1x9s h LYS 285 Cb 0.40 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.70 1x9s h LYS 285 CO 0.01 0.43 0.38 0.71 -0.57 0.00 0.00 179.45 180.42 1x9s s TYR 286 N -4.22 3.65 0.53 -1.35 2.02 -0.90 -5.00 117.35 112.08 1x9s s TYR 286 Ca -0.03 1.77 -0.20 0.00 -0.37 0.00 0.00 57.07 58.23 1x9s s TYR 286 Cb 0.14 -3.04 -0.07 0.00 -0.40 0.00 0.00 41.96 38.59 1x9s s TYR 286 CO 0.74 -0.04 0.94 -2.30 -1.57 0.00 0.00 175.55 173.31 1x9s n PRO 287 N 0.76 1.04 -2.11 -1.71 -0.02 -1.26 -4.75 135.00 126.94 1x9s n PRO 287 Ca 0.01 0.39 -0.39 0.00 -2.02 0.00 0.00 63.50 61.48 1x9s n PRO 287 Cb 0.48 -2.08 -0.01 0.00 -0.02 0.00 0.00 33.50 31.87 1x9s n PRO 287 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1x9s s ARG 288 N -2.41 4.04 0.00 -0.52 1.81 -1.26 -4.56 118.95 116.05 1x9s s ARG 288 Ca 0.70 2.10 0.00 0.00 -1.72 0.00 0.00 55.73 56.81 1x9s s ARG 288 Cb -0.47 -2.79 0.00 0.00 -0.45 0.00 0.00 34.95 31.24 1x9s s ARG 288 CO 0.52 -0.41 0.00 0.44 -0.68 0.00 0.00 175.30 175.17 1x9s n ILE 289 N 0.23 0.00 -3.68 1.52 -5.35 -0.78 -4.20 119.36 107.09 1x9s n ILE 289 Ca 0.03 0.00 -0.10 0.00 -0.27 0.00 0.00 62.75 62.42 1x9s n ILE 289 Cb 0.44 -0.47 -0.10 0.00 -1.74 0.00 0.00 39.64 37.77 1x9s n ILE 289 CO 0.00 0.00 0.00 -0.75 -1.76 0.00 0.00 176.55 174.04 1x9s s LYS 290 N -0.96 0.45 -0.39 6.28 2.36 -0.94 -1.21 119.74 125.34 1x9s s LYS 290 Ca 0.00 0.88 -0.10 0.00 -2.55 0.00 0.00 55.97 54.21 1x9s s LYS 290 Cb 0.00 0.02 0.05 0.00 -1.05 0.00 0.00 37.83 36.85 1x9s s LYS 290 CO 0.00 -0.16 0.22 0.99 1.55 0.00 0.00 175.35 177.95 1x9s s THR 291 N 1.49 4.33 0.28 3.43 2.01 -1.26 -2.83 115.64 123.09 1x9s s THR 291 Ca -0.09 -1.13 -0.30 0.00 0.31 0.00 0.00 61.69 60.47 1x9s s THR 291 Cb -0.08 -3.52 -0.12 0.00 0.01 0.00 0.00 72.50 68.79 1x9s s THR 291 CO -0.14 -0.35 1.60 -0.81 -0.69 0.00 0.00 174.62 174.23 1x9s n PRO 292 N 4.94 2.67 0.00 4.92 -0.04 -1.26 -4.81 135.00 141.42 1x9s n PRO 292 Ca -0.11 0.95 0.13 0.00 -0.04 0.00 0.00 63.50 64.43 1x9s n PRO 292 Cb 0.44 -2.73 0.38 0.00 -0.04 0.00 0.00 33.50 31.55 1x9s n PRO 292 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1x9s n LYS 293 N 2.27 0.62 -3.17 0.54 5.02 -1.26 -1.60 118.16 120.59 1x9s n LYS 293 Ca 0.09 -0.34 -0.10 0.00 -2.02 0.00 0.00 58.31 55.94 1x9s n LYS 293 Cb 0.36 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 33.84 1x9s n LYS 293 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1x9s n VAL 294 N -0.89 0.00 0.00 -0.18 0.31 -1.26 -4.85 118.33 111.46 1x9s n VAL 294 Ca 0.11 -1.27 0.00 0.00 -0.01 0.00 0.00 64.34 63.17 1x9s n VAL 294 Cb 0.34 0.63 0.00 0.00 -0.91 0.00 0.00 33.84 33.89 1x9s n VAL 294 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1x9s n GLY 295 N -0.29 1.32 0.78 2.92 0.00 -1.26 -0.73 105.19 107.93 1x9s n GLY 295 Ca 0.04 -0.61 0.04 0.00 0.00 0.00 0.00 46.02 45.48 1x9s n GLY 295 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x9s n GLY 296 N 0.00 -3.27 0.27 -0.02 0.00 -1.18 -4.56 105.19 96.43 1x9s n GLY 296 Ca 0.00 -1.15 0.15 0.00 0.00 0.00 0.00 46.02 45.02 1x9s n GLY 296 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 1x9s h ILE 297 N -0.28 0.29 -2.94 -0.61 -2.65 -1.92 -3.44 117.51 105.96 1x9s h ILE 297 Ca -0.05 -0.63 0.00 0.00 1.03 0.00 0.00 64.86 65.22 1x9s h ILE 297 Cb 0.59 1.48 0.00 0.00 -2.05 0.00 0.00 36.82 36.85 1x9s h ILE 297 CO 0.02 0.09 0.00 0.49 0.03 0.00 0.00 178.15 178.78 1x9s n PHE 298 N -3.30 0.00 -3.97 0.16 3.01 -1.26 -2.59 117.46 109.50 1x9s n PHE 298 Ca -0.01 0.00 -0.31 0.00 1.01 0.00 0.00 57.45 58.15 1x9s n PHE 298 Cb 0.30 0.00 -0.15 0.00 -0.01 0.00 0.00 39.48 39.61 1x9s n PHE 298 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1x9s s GLU 314 N 1.19 4.69 0.61 0.00 4.04 -1.26 -5.01 118.70 122.96 1x9s s GLU 314 Ca 0.00 1.44 -0.19 0.00 0.04 0.00 0.00 54.97 56.26 1x9s s GLU 314 Cb -0.19 -3.37 -0.03 0.00 0.02 0.00 0.00 34.13 30.56 1x9s s GLU 314 CO -0.09 0.22 1.29 -0.51 -1.84 0.00 0.00 175.26 174.34 1x9s s LEU 315 N -0.03 3.67 -0.54 1.83 1.43 -1.26 -4.95 118.68 118.83 1x9s s LEU 315 Ca 0.46 2.61 -0.19 0.00 -1.03 0.00 0.00 54.13 55.98 1x9s s LEU 315 Cb -0.23 -4.52 0.07 0.00 0.03 0.00 0.00 46.19 41.54 1x9s s LEU 315 CO 0.30 -1.79 0.68 -0.62 0.23 0.00 0.00 176.35 175.14 1x9s s ASP 316 N -1.32 6.21 0.47 2.29 3.68 -1.07 -4.92 116.67 122.01 1x9s s ASP 316 Ca 0.78 -1.05 0.14 0.00 2.13 0.00 0.00 52.55 54.55 1x9s s ASP 316 Cb -0.37 -2.31 1.10 0.00 -1.45 0.00 0.00 42.92 39.90 1x9s s ASP 316 CO 0.40 -1.00 2.06 0.74 0.13 0.00 0.00 175.17 177.50 1x9s h THR 317 N 5.89 0.97 -2.78 1.71 2.02 -1.92 -3.44 112.91 115.36 1x9s h THR 317 Ca -0.28 -0.09 -0.57 0.00 0.77 0.00 0.00 66.41 66.24 1x9s h THR 317 Cb 1.09 0.67 0.19 0.00 -1.74 0.00 0.00 68.15 68.36 1x9s h THR 317 CO 1.02 0.05 -0.75 0.54 0.37 0.00 0.00 175.52 176.75 1x9s n ARG 318 N -4.48 0.21 -0.10 6.66 1.74 -1.26 -4.91 116.66 114.51 1x9s n ARG 318 Ca 0.04 0.09 0.12 0.00 -0.77 0.00 0.00 57.85 57.33 1x9s n ARG 318 Cb 0.22 -1.53 0.22 0.00 -1.02 0.00 0.00 32.46 30.35 1x9s n ARG 318 CO 0.00 0.00 0.00 -0.85 -1.52 0.00 0.00 177.63 175.26 1x9s n GLU 319 N 0.20 2.30 -4.36 5.56 0.28 -1.26 -4.95 120.64 118.41 1x9s n GLU 319 Ca 0.08 -1.93 -0.31 0.00 -0.16 0.00 0.00 57.16 54.84 1x9s n GLU 319 Cb 0.50 -1.48 -0.10 0.00 1.43 0.00 0.00 31.44 31.79 1x9s n GLU 319 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 1x9s s TYR 320 N -1.74 2.80 -0.23 -1.84 2.02 -1.26 -5.10 117.35 112.00 1x9s s TYR 320 Ca 0.34 -0.11 0.02 0.00 -0.37 0.00 0.00 57.07 56.95 1x9s s TYR 320 Cb 0.21 -1.52 0.05 0.00 -0.40 0.00 0.00 41.96 40.31 1x9s s TYR 320 CO 0.31 0.39 -0.09 0.08 -1.57 0.00 0.00 175.55 174.66 1x9s s VAL 321 N -1.10 1.81 0.19 0.71 1.01 -1.26 -3.11 120.40 118.65 1x9s s VAL 321 Ca 0.19 -1.29 -0.27 0.00 0.00 0.00 0.00 61.98 60.61 1x9s s VAL 321 Cb -0.11 -1.95 -0.16 0.00 0.00 0.00 0.00 36.38 34.16 1x9s s VAL 321 CO 0.11 0.03 0.50 0.00 0.00 0.00 0.00 175.10 175.74 1x9s n ALA 322 N 4.59 -2.81 0.00 5.51 0.00 0.09 -0.26 120.51 127.63 1x9s n ALA 322 Ca -0.14 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.72 1x9s n ALA 322 Cb 0.44 -1.55 0.00 0.00 0.00 0.00 0.00 19.45 18.34 1x9s n ALA 322 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1x9s n GLY 323 N 1.93 2.67 3.47 0.00 0.00 -0.63 -4.87 105.19 107.76 1x9s n GLY 323 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 1x9s n GLY 323 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x9s s ALA 324 N -1.46 3.24 0.65 4.61 0.00 0.64 -4.94 121.76 124.50 1x9s s ALA 324 Ca 0.00 -1.63 -0.14 0.00 0.00 0.00 0.00 51.96 50.19 1x9s s ALA 324 Cb 0.00 -3.63 -0.01 0.00 0.00 0.00 0.00 23.12 19.49 1x9s s ALA 324 CO 0.00 -2.36 1.08 -1.25 0.00 0.00 0.00 175.76 173.23 1x9s s PRO 325 N 3.46 2.94 -0.05 0.00 0.04 -1.26 -4.32 135.00 135.82 1x9s s PRO 325 Ca 0.22 1.23 -0.27 0.00 0.04 0.00 0.00 61.00 62.22 1x9s s PRO 325 Cb -0.17 -1.98 0.06 0.00 0.04 0.00 0.00 34.50 32.45 1x9s s PRO 325 CO 0.14 -1.12 0.60 1.52 0.04 0.00 0.00 177.00 178.18 1x9s s TYR 326 N -2.55 -0.56 -0.48 0.56 1.13 -1.13 -5.01 117.35 109.31 1x9s s TYR 326 Ca 0.64 0.96 -0.20 0.00 -1.41 0.00 0.00 57.07 57.05 1x9s s TYR 326 Cb -0.17 0.34 0.04 0.00 -1.10 0.00 0.00 41.96 41.07 1x9s s TYR 326 CO 0.44 -0.56 0.65 0.99 -2.51 0.00 0.00 175.55 174.55 1x9s s THR 327 N -1.19 4.83 0.25 -3.49 2.01 -1.26 -2.21 115.64 114.57 1x9s s THR 327 Ca -0.11 -0.16 -0.30 0.00 0.31 0.00 0.00 61.69 61.42 1x9s s THR 327 Cb -0.01 -4.26 -0.10 0.00 0.01 0.00 0.00 72.50 68.13 1x9s s THR 327 CO 0.09 -0.72 1.51 -2.16 -0.69 0.00 0.00 174.62 172.64 1x9s s PRO 328 N 2.79 4.21 0.17 4.92 0.04 -1.26 -4.93 135.00 140.95 1x9s s PRO 328 Ca 0.19 2.40 0.03 0.00 0.04 0.00 0.00 61.00 63.66 1x9s s PRO 328 Cb -0.16 -3.09 -0.05 0.00 0.04 0.00 0.00 34.50 31.24 1x9s s PRO 328 CO 0.16 -0.52 -0.04 0.14 0.04 0.00 0.00 177.00 176.78 1x9s s VAL 329 N 0.18 0.91 0.20 -0.36 -7.23 -1.26 -0.73 120.40 112.11 1x9s s VAL 329 Ca 0.62 -2.01 0.09 0.00 -1.81 0.00 0.00 61.98 58.87 1x9s s VAL 329 Cb -0.44 -2.05 -0.05 0.00 0.56 0.00 0.00 36.38 34.40 1x9s s VAL 329 CO 0.43 -0.56 -0.17 -1.83 -0.31 0.00 0.00 175.10 172.66 1x9s s GLU 330 N -3.85 1.38 -0.44 4.82 -1.05 0.41 -4.83 118.70 115.14 1x9s s GLU 330 Ca 0.22 -1.54 -0.15 0.00 -0.15 0.00 0.00 54.97 53.35 1x9s s GLU 330 Cb 0.05 -1.35 0.05 0.00 -0.44 0.00 0.00 34.13 32.44 1x9s s GLU 330 CO 0.03 0.25 0.34 -1.58 0.95 0.00 0.00 175.26 175.26 1x9s s HIS 331 N -2.46 3.25 -0.22 4.83 5.65 -1.26 -1.46 115.29 123.63 1x9s s HIS 331 Ca 0.21 -0.88 -0.14 0.00 0.25 0.00 0.00 55.06 54.51 1x9s s HIS 331 Cb -0.04 -2.93 -0.04 0.00 -1.18 0.00 0.00 32.58 28.39 1x9s s HIS 331 CO 0.08 -0.73 0.30 0.54 -0.65 0.00 0.00 174.74 174.28 1x9s s VAL 332 N 1.63 5.27 -0.12 0.89 0.11 -0.56 -4.97 120.40 122.66 1x9s s VAL 332 Ca 0.04 0.48 -0.14 0.00 -2.93 0.00 0.00 61.98 59.43 1x9s s VAL 332 Cb -0.22 -3.63 -0.05 0.00 -1.53 0.00 0.00 36.38 30.95 1x9s s VAL 332 CO 0.07 0.29 0.33 -0.69 -3.33 0.00 0.00 175.10 171.78 1x9s s VAL 333 N 1.19 5.25 -0.16 2.04 1.01 -1.26 -1.93 120.40 126.54 1x9s s VAL 333 Ca 0.14 0.64 -0.39 0.00 0.00 0.00 0.00 61.98 62.36 1x9s s VAL 333 Cb -0.14 -3.65 -0.16 0.00 0.00 0.00 0.00 36.38 32.42 1x9s s VAL 333 CO 0.06 0.44 1.58 0.33 0.00 0.00 0.00 175.10 177.51 1x9s n PHE 334 N 3.07 1.80 -4.01 5.22 7.35 -1.26 -4.94 117.46 124.70 1x9s n PHE 334 Ca -0.12 0.63 -0.32 0.00 -0.76 0.00 0.00 57.45 56.87 1x9s n PHE 334 Cb 0.52 -2.39 -0.15 0.00 0.35 0.00 0.00 39.48 37.82 1x9s n PHE 334 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 1x9s s ASN 335 N 2.37 4.72 0.50 -2.13 2.47 -1.26 -4.85 114.94 116.77 1x9s s ASN 335 Ca 0.94 -1.86 0.20 0.00 0.42 0.00 0.00 52.86 52.56 1x9s s ASN 335 Cb -1.07 -1.63 1.09 0.00 -1.45 0.00 0.00 41.25 38.20 1x9s s ASN 335 CO 0.60 -0.33 1.57 -0.65 -3.72 0.00 0.00 177.10 174.57 1x9s h PRO 336 N 7.72 0.00 0.00 0.43 0.11 -1.98 0.99 132.00 139.27 1x9s h PRO 336 Ca -0.10 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 65.80 1x9s h PRO 336 Cb 1.03 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 1x9s h PRO 336 CO 0.52 0.00 -0.89 0.77 -0.21 0.00 0.00 178.00 178.18 1x9s h SER 337 N 0.00 0.33 -3.27 -2.05 0.02 -1.96 -3.44 113.55 103.18 1x9s h SER 337 Ca 0.00 -0.27 -0.57 0.00 -0.84 0.00 0.00 61.79 60.12 1x9s h SER 337 Cb 0.71 -0.10 -0.05 0.00 0.14 0.00 0.00 62.40 63.10 1x9s h SER 337 CO 0.00 1.07 1.07 -0.55 -1.14 0.00 0.00 176.83 177.28 1x9s s SER 338 N -6.97 6.35 0.54 3.07 0.15 0.34 -4.87 113.70 112.31 1x9s s SER 338 Ca -0.04 0.84 0.27 0.00 0.70 0.00 0.00 55.95 57.72 1x9s s SER 338 Cb 0.10 -2.54 1.56 0.00 -1.71 0.00 0.00 66.02 63.43 1x9s s SER 338 CO 0.84 -1.42 2.15 0.03 1.20 0.00 0.00 173.24 176.03 1x9s h ARG 339 N 10.65 0.00 0.18 5.44 2.47 -1.85 -2.38 114.38 128.89 1x9s h ARG 339 Ca -0.27 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.44 1x9s h ARG 339 Cb 1.11 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.43 1x9s h ARG 339 CO 1.08 0.07 -0.08 0.22 0.56 0.00 0.00 179.97 181.82 1x9s h ASP 340 N 0.00 -0.20 -0.80 7.04 3.58 -1.94 -0.49 116.42 123.60 1x9s h ASP 340 Ca -0.00 -0.20 0.06 0.00 0.42 0.00 0.00 57.03 57.31 1x9s h ASP 340 Cb 0.18 0.05 -0.06 0.00 1.72 0.00 0.00 39.33 41.22 1x9s h ASP 340 CO 0.01 0.09 0.48 0.45 -2.88 0.00 0.00 179.24 177.40 1x9s h HIS 341 N -0.51 0.89 -0.81 0.28 3.86 -1.77 0.20 115.15 117.30 1x9s h HIS 341 Ca -0.02 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.20 1x9s h HIS 341 Cb 0.39 -0.28 -0.04 0.00 1.06 0.00 0.00 27.41 28.53 1x9s h HIS 341 CO 0.01 0.44 0.46 0.82 0.86 0.00 0.00 177.93 180.53 1x9s h ILE 342 N 0.88 1.23 -0.02 2.45 2.04 -1.32 0.98 117.51 123.76 1x9s h ILE 342 Ca 0.35 -0.55 -0.16 0.00 1.00 0.00 0.00 64.86 65.51 1x9s h ILE 342 Cb 0.18 0.12 -0.02 0.00 -0.74 0.00 0.00 36.82 36.37 1x9s h ILE 342 CO -0.18 0.25 -0.70 -0.61 0.00 0.00 0.00 178.15 176.91 1x9s h GLN 343 N 1.12 0.12 -0.19 2.37 -0.00 -0.06 -2.35 115.11 116.12 1x9s h GLN 343 Ca 0.29 -0.10 -0.11 0.00 -0.00 0.00 0.00 58.65 58.72 1x9s h GLN 343 Cb -0.00 0.02 -0.00 0.00 0.00 0.00 0.00 27.48 27.50 1x9s h GLN 343 CO -0.05 0.78 -0.32 -0.22 0.00 0.00 0.00 178.83 179.02 1x9s h LYS 344 N 0.08 0.56 0.00 1.69 3.64 0.26 -2.97 116.57 119.84 1x9s h LYS 344 Ca -0.02 -0.34 -0.19 0.00 -1.27 0.00 0.00 60.65 58.83 1x9s h LYS 344 Cb 1.25 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 33.09 1x9s h LYS 344 CO 0.10 0.95 -0.87 0.87 -2.27 0.00 0.00 179.45 178.23 1x9s h LYS 345 N 0.22 0.15 0.06 1.90 1.79 -0.85 -3.04 116.57 116.80 1x9s h LYS 345 Ca 0.01 -0.17 -0.25 0.00 -2.18 0.00 0.00 60.65 58.06 1x9s h LYS 345 Cb 0.91 0.05 0.01 0.00 -1.58 0.00 0.00 32.23 31.61 1x9s h LYS 345 CO 0.07 0.93 -1.09 -0.07 -1.08 0.00 0.00 179.45 178.21 1x9s h LEU 346 N 0.08 0.53 -0.67 2.94 3.38 -1.51 -2.96 115.31 117.10 1x9s h LEU 346 Ca -0.04 -0.48 -0.11 0.00 0.09 0.00 0.00 57.88 57.35 1x9s h LEU 346 Cb 1.50 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 42.07 1x9s h LEU 346 CO 0.13 1.31 -0.11 1.56 0.09 0.00 0.00 178.44 181.42 1x9s h GLN 347 N 0.17 0.93 0.00 1.13 4.20 -1.63 0.28 115.11 120.19 1x9s h GLN 347 Ca -0.11 -0.33 0.00 0.00 0.06 0.00 0.00 58.65 58.27 1x9s h GLN 347 Cb 1.76 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 29.47 1x9s h GLN 347 CO 0.19 0.98 0.00 0.39 -0.67 0.00 0.00 178.83 179.72 1x9s n GLU 348 N -4.15 0.14 -0.03 1.46 1.02 -1.15 0.20 120.64 118.14 1x9s n GLU 348 Ca 0.02 0.14 0.05 0.00 -0.02 0.00 0.00 57.16 57.35 1x9s n GLU 348 Cb 0.39 -1.50 0.06 0.00 -0.02 0.00 0.00 31.44 30.37 1x9s n GLU 348 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1x9s n ALA 349 N -1.18 2.43 0.00 0.62 0.00 -0.09 -4.95 120.51 117.34 1x9s n ALA 349 Ca 0.04 -0.67 0.00 0.00 0.00 0.00 0.00 53.44 52.81 1x9s n ALA 349 Cb 0.04 -0.35 0.00 0.00 0.00 0.00 0.00 19.45 19.14 1x9s n ALA 349 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1x9s n GLY 350 N 0.55 1.29 3.67 0.00 0.00 0.13 -4.12 105.19 106.71 1x9s n GLY 350 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 1x9s n GLY 350 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1x9s s TRP 351 N -2.00 3.42 -0.51 1.61 -0.00 -0.20 -4.94 118.94 116.33 1x9s s TRP 351 Ca 0.00 1.19 -0.10 0.00 -0.00 0.00 0.00 56.10 57.19 1x9s s TRP 351 Cb 0.00 -2.96 0.13 0.00 -0.00 0.00 0.00 33.47 30.64 1x9s s TRP 351 CO 0.00 -0.20 0.39 0.08 -0.00 0.00 0.00 176.95 177.22 1x9s s VAL 352 N 2.00 4.40 0.27 5.86 1.01 -1.26 -4.15 120.40 128.53 1x9s s VAL 352 Ca 0.36 -1.84 -0.28 0.00 0.00 0.00 0.00 61.98 60.22 1x9s s VAL 352 Cb -0.16 -3.87 -0.14 0.00 0.00 0.00 0.00 36.38 32.20 1x9s s VAL 352 CO 0.12 -0.81 0.97 -2.65 0.00 0.00 0.00 175.10 172.74 1x9s n PRO 353 N 4.84 1.20 -0.08 2.72 -0.02 -1.26 -4.93 135.00 137.47 1x9s n PRO 353 Ca -0.07 0.42 -0.12 0.00 -2.02 0.00 0.00 63.50 61.72 1x9s n PRO 353 Cb 0.41 -1.76 -0.04 0.00 -0.02 0.00 0.00 33.50 32.09 1x9s n PRO 353 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1x9s n THR 354 N 0.32 1.39 -3.84 3.45 -1.04 -1.26 -4.97 114.28 108.33 1x9s n THR 354 Ca 0.11 0.06 -0.36 0.00 -2.04 0.00 0.00 64.05 61.82 1x9s n THR 354 Cb 0.31 -2.10 -0.12 0.00 -1.82 0.00 0.00 70.33 66.60 1x9s n THR 354 CO 0.00 0.00 0.00 -1.59 -0.64 0.00 0.00 175.07 172.84 1x9s s LYS 355 N -2.65 3.69 0.39 -2.82 0.00 -1.26 -5.08 119.74 112.01 1x9s s LYS 355 Ca -0.25 -0.46 0.07 0.00 0.00 0.00 0.00 55.97 55.33 1x9s s LYS 355 Cb 0.05 -3.28 -0.00 0.00 0.00 0.00 0.00 37.83 34.61 1x9s s LYS 355 CO 0.36 -0.10 0.50 0.71 0.00 0.00 0.00 175.35 176.82 1x9s s TYR 356 N 1.35 2.90 0.61 1.78 1.51 -1.26 -2.08 117.35 122.16 1x9s s TYR 356 Ca 0.05 -0.35 -0.13 0.00 -1.01 0.00 0.00 57.07 55.63 1x9s s TYR 356 Cb -0.15 -2.20 -0.03 0.00 -0.11 0.00 0.00 41.96 39.47 1x9s s TYR 356 CO 0.03 -0.22 1.04 0.95 -1.11 0.00 0.00 175.55 176.24 1x9s s THR 357 N -2.31 4.27 0.00 -0.71 -4.23 0.39 -4.80 115.64 108.26 1x9s s THR 357 Ca 0.50 0.88 0.00 0.00 -1.18 0.00 0.00 61.69 61.89 1x9s s THR 357 Cb -0.09 -3.59 0.00 0.00 1.34 0.00 0.00 72.50 70.16 1x9s s THR 357 CO 0.31 -0.82 0.74 -0.90 -0.54 0.00 0.00 174.62 173.42 1x9s n ASP 358 N -2.45 2.07 -2.69 3.99 5.75 -1.26 -3.11 116.55 118.85 1x9s n ASP 358 Ca 0.07 -1.35 -0.06 0.00 -0.01 0.00 0.00 54.79 53.45 1x9s n ASP 358 Cb 0.54 -0.40 0.08 0.00 -1.03 0.00 0.00 41.12 40.30 1x9s n ASP 358 CO 0.00 0.00 0.00 1.17 -0.11 0.00 0.00 177.20 178.26 1x9s n LYS 359 N 1.26 0.83 -3.16 0.11 4.81 -1.26 -5.08 118.16 115.66 1x9s n LYS 359 Ca 0.00 -1.43 -0.21 0.00 -0.87 0.00 0.00 58.31 55.80 1x9s n LYS 359 Cb 0.25 -0.11 0.02 0.00 0.02 0.00 0.00 35.03 35.21 1x9s n LYS 359 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1x9s n GLY 360 N -0.46 -0.78 0.00 3.14 0.00 -1.18 -5.05 105.19 100.86 1x9s n GLY 360 Ca -0.10 1.04 0.00 0.00 0.00 0.00 0.00 46.02 46.96 1x9s n GLY 360 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x9s n ALA 361 N -0.02 0.00 -1.75 4.61 0.00 -1.26 -4.94 120.51 117.15 1x9s n ALA 361 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.08 1x9s n ALA 361 Cb 0.53 0.00 0.03 0.00 0.00 0.00 0.00 19.45 20.01 1x9s n ALA 361 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1x9s s PRO 362 N -0.48 3.11 -0.08 0.00 0.02 -1.26 0.15 135.00 136.45 1x9s s PRO 362 Ca 0.00 1.97 -0.23 0.00 0.02 0.00 0.00 61.00 62.77 1x9s s PRO 362 Cb 0.00 -2.10 -0.04 0.00 0.02 0.00 0.00 34.50 32.38 1x9s s PRO 362 CO 0.00 -1.14 0.66 0.08 -0.33 0.00 0.00 177.00 176.28 1x9s s VAL 363 N -1.47 5.07 -0.42 3.83 1.01 -0.88 -4.67 120.40 122.87 1x9s s VAL 363 Ca 0.74 1.36 0.11 0.00 0.00 0.00 0.00 61.98 64.18 1x9s s VAL 363 Cb -0.34 -4.00 0.40 0.00 0.00 0.00 0.00 36.38 32.44 1x9s s VAL 363 CO 0.39 0.25 0.94 0.52 0.00 0.00 0.00 175.10 177.20 1x9s n VAL 364 N 3.82 1.51 -3.00 2.92 0.31 -1.26 -4.86 118.33 117.77 1x9s n VAL 364 Ca -0.02 -4.41 -0.23 0.00 -0.01 0.00 0.00 64.34 59.67 1x9s n VAL 364 Cb 0.51 -0.47 0.01 0.00 -0.91 0.00 0.00 33.84 32.98 1x9s n VAL 364 CO 0.00 0.00 0.00 1.51 -1.32 0.00 0.00 176.83 177.02 1x9s s ASP 365 N -3.15 5.87 0.50 4.52 1.47 -1.26 -4.86 116.67 119.77 1x9s s ASP 365 Ca 0.40 0.31 0.31 0.00 1.18 0.00 0.00 52.55 54.75 1x9s s ASP 365 Cb 0.38 -1.58 1.43 0.00 -0.34 0.00 0.00 42.92 42.81 1x9s s ASP 365 CO -0.08 -0.67 1.81 -0.78 0.68 0.00 0.00 175.17 176.12 1x9s h ASP 366 N 0.42 0.12 0.10 2.11 3.58 -1.98 -1.05 116.42 119.71 1x9s h ASP 366 Ca -0.46 0.02 -0.00 0.00 0.42 0.00 0.00 57.03 57.00 1x9s h ASP 366 Cb 1.25 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.30 1x9s h ASP 366 CO 0.58 0.02 -0.05 -0.08 -2.88 0.00 0.00 179.24 176.83 1x9s h GLU 367 N 0.10 -0.12 -0.30 0.28 4.81 -1.99 -1.59 114.58 115.76 1x9s h GLU 367 Ca 0.55 0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 59.69 1x9s h GLU 367 Cb 1.98 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 31.38 1x9s h GLU 367 CO -0.08 0.13 -0.21 -0.39 -0.73 0.00 0.00 179.01 177.73 1x9s h VAL 368 N -0.37 1.30 -0.87 0.32 -1.51 -1.62 -2.29 116.25 111.21 1x9s h VAL 368 Ca -0.01 -1.35 0.20 0.00 -1.23 0.00 0.00 66.70 64.31 1x9s h VAL 368 Cb 0.31 1.50 -0.06 0.00 -2.13 0.00 0.00 31.29 30.91 1x9s h VAL 368 CO 0.02 0.43 0.58 -0.07 -1.23 0.00 0.00 177.57 177.30 1x9s h LEU 369 N 0.43 0.37 -1.37 4.19 3.38 -1.25 0.95 115.31 122.02 1x9s h LEU 369 Ca 0.06 0.04 -0.07 0.00 0.09 0.00 0.00 57.88 58.00 1x9s h LEU 369 Cb 0.76 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 1x9s h LEU 369 CO 0.06 0.16 -0.31 -0.08 0.09 0.00 0.00 178.44 178.35 1x9s h GLU 370 N 0.38 0.00 -0.01 1.13 4.57 -0.71 -3.01 114.58 116.93 1x9s h GLU 370 Ca 0.45 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.63 1x9s h GLU 370 Cb 1.15 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.74 1x9s h GLU 370 CO -0.15 0.31 -0.58 0.41 -1.18 0.00 0.00 179.01 177.82 1x9s n GLY 371 N -0.49 -0.59 3.75 1.92 0.00 0.31 -4.95 105.19 105.15 1x9s n GLY 371 Ca -0.02 -0.54 -0.41 0.00 0.00 0.00 0.00 46.02 45.05 1x9s n GLY 371 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x9s s VAL 372 N -2.71 2.81 -0.07 1.61 1.01 -0.24 -5.02 120.40 117.79 1x9s s VAL 372 Ca 0.16 0.70 -0.00 0.00 0.00 0.00 0.00 61.98 62.84 1x9s s VAL 372 Cb 0.18 -3.45 0.03 0.00 0.00 0.00 0.00 36.38 33.13 1x9s s VAL 372 CO 0.66 0.12 -0.03 -0.13 0.00 0.00 0.00 175.10 175.73 1x9s s ARG 373 N -0.58 0.88 0.19 2.72 1.81 -1.26 -5.04 118.95 117.67 1x9s s ARG 373 Ca 0.57 -0.04 0.08 0.00 -1.72 0.00 0.00 55.73 54.62 1x9s s ARG 373 Cb -0.40 -1.07 -0.05 0.00 -0.45 0.00 0.00 34.95 32.98 1x9s s ARG 373 CO 0.44 -0.22 -0.15 0.14 -0.68 0.00 0.00 175.30 174.82 1x9s s VAL 374 N 1.59 1.72 0.05 3.52 -7.23 -1.26 -4.73 120.40 114.05 1x9s s VAL 374 Ca -0.00 -2.12 -0.34 0.00 -1.81 0.00 0.00 61.98 57.70 1x9s s VAL 374 Cb -0.13 -1.97 -0.19 0.00 0.56 0.00 0.00 36.38 34.65 1x9s s VAL 374 CO -0.04 -0.53 1.43 0.44 -0.31 0.00 0.00 175.10 176.09 1x9s h ASP 375 N 2.76 -1.05 -1.91 4.85 3.32 -1.94 -3.43 116.42 119.02 1x9s h ASP 375 Ca -0.39 0.04 -0.61 0.00 0.02 0.00 0.00 57.03 56.09 1x9s h ASP 375 Cb 1.22 0.27 0.01 0.00 0.22 0.00 0.00 39.33 41.05 1x9s h ASP 375 CO 0.59 -0.70 1.27 -0.67 -1.72 0.00 0.00 179.24 178.01 1x9s n ASP 376 N -5.59 3.30 -0.27 6.45 -0.08 -1.26 -4.87 116.55 114.22 1x9s n ASP 376 Ca -0.15 0.68 -0.03 0.00 -1.51 0.00 0.00 54.79 53.77 1x9s n ASP 376 Cb 0.49 -1.42 0.08 0.00 2.34 0.00 0.00 41.12 42.60 1x9s n ASP 376 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1x9s h PRO 377 N 11.41 0.95 -0.35 -0.67 0.13 -1.99 -1.59 132.00 139.89 1x9s h PRO 377 Ca -0.43 -0.06 0.02 0.00 -0.87 0.00 0.00 66.00 64.66 1x9s h PRO 377 Cb 1.27 -0.21 -0.02 0.00 0.13 0.00 0.00 31.00 32.16 1x9s h PRO 377 CO 0.96 0.63 0.23 1.49 -0.23 0.00 0.00 178.00 181.09 1x9s h GLU 378 N 0.98 0.41 -0.04 0.86 4.81 -1.97 0.99 114.58 120.63 1x9s h GLU 378 Ca 0.29 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.47 1x9s h GLU 378 Cb -0.05 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.24 1x9s h GLU 378 CO -0.09 0.27 -0.09 0.87 -0.73 0.00 0.00 179.01 179.24 1x9s h LYS 379 N 0.42 0.13 -0.91 1.92 1.79 -1.80 -1.29 116.57 116.84 1x9s h LYS 379 Ca 0.14 -0.09 0.11 0.00 -2.18 0.00 0.00 60.65 58.63 1x9s h LYS 379 Cb 0.03 0.01 -0.07 0.00 -1.58 0.00 0.00 32.23 30.63 1x9s h LYS 379 CO -0.03 0.69 0.58 0.37 -1.08 0.00 0.00 179.45 179.98 1x9s h GLN 380 N -0.40 0.83 -0.01 3.15 5.75 -0.58 -0.03 115.11 123.82 1x9s h GLN 380 Ca -0.00 -0.05 -0.16 0.00 -0.15 0.00 0.00 58.65 58.29 1x9s h GLN 380 Cb 0.69 -0.19 -0.02 0.00 1.07 0.00 0.00 27.48 29.04 1x9s h GLN 380 CO 0.02 0.55 -0.76 0.00 -2.65 0.00 0.00 178.83 175.99 1x9s h ALA 381 N 1.56 0.73 -0.04 3.38 0.00 -0.78 -3.11 119.26 121.01 1x9s h ALA 381 Ca 0.43 -0.67 -0.06 0.00 0.00 0.00 0.00 54.91 54.61 1x9s h ALA 381 Cb 0.49 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1x9s h ALA 381 CO -0.20 0.90 -0.28 0.00 0.00 0.00 0.00 179.25 179.68 1x9s h ALA 382 N 1.18 1.48 -1.00 0.00 0.00 0.21 -2.82 119.26 118.30 1x9s h ALA 382 Ca -0.02 -0.27 0.11 0.00 0.00 0.00 0.00 54.91 54.74 1x9s h ALA 382 Cb 1.33 -0.06 -0.08 0.00 0.00 0.00 0.00 17.79 18.98 1x9s h ALA 382 CO 0.10 0.39 0.63 0.82 0.00 0.00 0.00 179.25 181.20 1x9s h ILE 383 N 0.06 0.94 -0.22 0.00 2.04 -1.32 0.15 117.51 119.16 1x9s h ILE 383 Ca 0.01 -0.35 -0.12 0.00 1.00 0.00 0.00 64.86 65.40 1x9s h ILE 383 Cb 0.52 -0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 36.43 1x9s h ILE 383 CO 0.04 0.19 -0.36 0.44 0.00 0.00 0.00 178.15 178.45 1x9s h ASP 384 N 1.02 0.50 -0.69 1.72 3.32 -1.65 -1.38 116.42 119.26 1x9s h ASP 384 Ca 0.49 -0.20 -0.06 0.00 0.02 0.00 0.00 57.03 57.27 1x9s h ASP 384 Cb 0.45 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.83 1x9s h ASP 384 CO -0.25 0.82 0.20 -0.07 -1.72 0.00 0.00 179.24 178.22 1x9s h LEU 385 N 0.40 1.03 -0.55 1.55 3.38 -0.90 -0.36 115.31 119.86 1x9s h LEU 385 Ca 0.04 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 57.76 1x9s h LEU 385 Cb 0.82 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 1x9s h LEU 385 CO 0.07 0.97 0.12 0.40 0.09 0.00 0.00 178.44 180.08 1x9s h ILE 386 N 1.05 1.25 -0.50 1.22 2.04 -0.47 0.12 117.51 122.22 1x9s h ILE 386 Ca 0.22 -0.91 -0.04 0.00 1.00 0.00 0.00 64.86 65.14 1x9s h ILE 386 Cb 0.32 0.79 -0.02 0.00 -0.74 0.00 0.00 36.82 37.17 1x9s h ILE 386 CO -0.00 0.33 0.15 0.11 0.00 0.00 0.00 178.15 178.73 1x9s h LYS 387 N 0.78 0.79 -0.66 2.37 1.57 -0.81 -0.66 116.57 119.93 1x9s h LYS 387 Ca 0.17 -0.18 -0.03 0.00 -1.87 0.00 0.00 60.65 58.74 1x9s h LYS 387 Cb 0.37 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.54 1x9s h LYS 387 CO 0.01 0.74 0.30 1.49 -0.57 0.00 0.00 179.45 181.42 1x9s h GLU 388 N 0.68 0.97 -0.53 3.15 4.81 -0.87 -2.14 114.58 120.65 1x9s h GLU 388 Ca 0.16 -0.15 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1x9s h GLU 388 Cb 0.29 -0.17 -0.03 0.00 0.63 0.00 0.00 28.75 29.48 1x9s h GLU 388 CO -0.00 0.78 0.35 -0.92 -0.73 0.00 0.00 179.01 178.49 1x9s h TYR 389 N 0.93 0.67 -0.88 0.92 5.03 -0.39 0.47 116.97 123.72 1x9s h TYR 389 Ca 0.23 0.01 -0.02 0.00 2.58 0.00 0.00 58.73 61.53 1x9s h TYR 389 Cb 0.15 -0.23 -0.04 0.00 1.55 0.00 0.00 36.73 38.16 1x9s h TYR 389 CO 0.01 0.43 0.48 -0.07 -1.32 0.00 0.00 178.16 177.68 1x9s h LEU 390 N 0.72 1.10 -0.17 2.82 3.38 -0.86 -0.66 115.31 121.65 1x9s h LEU 390 Ca 0.20 -0.10 -0.06 0.00 0.09 0.00 0.00 57.88 58.01 1x9s h LEU 390 Cb -0.08 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.39 1x9s h LEU 390 CO -0.04 0.89 -0.11 -0.03 0.09 0.00 0.00 178.44 179.23 1x9s h MET 391 N 1.23 0.37 -0.21 1.13 4.05 -0.93 -1.74 114.93 118.82 1x9s h MET 391 Ca 0.31 -0.18 0.05 0.00 -0.28 0.00 0.00 59.70 59.60 1x9s h MET 391 Cb 0.04 -0.00 -0.04 0.00 -0.80 0.00 0.00 31.60 30.79 1x9s h MET 391 CO -0.05 0.71 -0.07 0.82 0.23 0.00 0.00 176.91 178.55 1x9s h ILE 392 N 0.03 0.75 -0.72 1.77 1.08 -0.66 -1.22 117.51 118.54 1x9s h ILE 392 Ca 0.03 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.52 1x9s h ILE 392 Cb 0.62 0.75 -0.04 0.00 -3.07 0.00 0.00 36.82 35.08 1x9s h ILE 392 CO 0.03 0.00 0.48 -0.61 -0.69 0.00 0.00 178.15 177.36 1x9s h GLN 393 N -0.02 0.92 -0.65 2.37 5.75 -1.10 0.16 115.11 122.54 1x9s h GLN 393 Ca 0.11 -0.06 0.03 0.00 -0.15 0.00 0.00 58.65 58.58 1x9s h GLN 393 Cb 0.19 -0.21 -0.04 0.00 1.07 0.00 0.00 27.48 28.49 1x9s h GLN 393 CO -0.23 0.61 0.40 -0.22 -2.65 0.00 0.00 178.83 176.74 1x9s h LYS 394 N 0.95 0.77 -0.20 1.69 1.63 -0.31 0.33 116.57 121.43 1x9s h LYS 394 Ca 0.27 -0.05 -0.08 0.00 -0.85 0.00 0.00 60.65 59.94 1x9s h LYS 394 Cb -0.07 -0.17 -0.00 0.00 -0.60 0.00 0.00 32.23 31.38 1x9s h LYS 394 CO -0.06 0.51 -0.19 0.00 -3.45 0.00 0.00 179.45 176.26 1x9s h ARG 395 N 0.79 0.48 -0.15 1.90 2.47 -0.29 -1.80 114.38 117.79 1x9s h ARG 395 Ca 0.26 -0.25 -0.00 0.00 -1.26 0.00 0.00 59.98 58.73 1x9s h ARG 395 Cb 0.01 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.33 1x9s h ARG 395 CO -0.10 0.82 0.09 0.82 0.56 0.00 0.00 179.97 182.16 1x9s h ILE 396 N 0.15 1.08 -0.52 2.04 2.04 -0.81 0.17 117.51 121.65 1x9s h ILE 396 Ca 0.03 -0.21 0.09 0.00 1.00 0.00 0.00 64.86 65.76 1x9s h ILE 396 Cb 0.73 0.96 -0.07 0.00 -0.74 0.00 0.00 36.82 37.70 1x9s h ILE 396 CO 0.05 0.08 0.12 1.23 0.00 0.00 0.00 178.15 179.63 1x9s h GLY 397 N 0.15 0.65 2.00 5.37 0.00 -0.31 0.36 103.07 111.30 1x9s h GLY 397 Ca 0.05 -0.04 -0.15 0.00 0.00 0.00 0.00 47.33 47.20 1x9s h GLY 397 CO -0.01 -0.06 -0.70 -1.61 0.00 0.00 0.00 176.54 174.16 1x9s h GLN 398 N 0.26 0.00 0.00 4.80 4.15 -1.07 0.17 115.11 123.43 1x9s h GLN 398 Ca 0.26 0.00 -0.35 0.00 0.77 0.00 0.00 58.65 59.33 1x9s h GLN 398 Cb 0.35 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 27.97 1x9s h GLN 398 CO -0.33 0.70 -2.22 -1.13 -1.93 0.00 0.00 178.83 173.92 1x9s n SER 399 N -3.59 0.39 0.00 -0.69 3.41 0.03 -2.48 113.62 110.69 1x9s n SER 399 Ca -0.00 0.10 0.00 0.00 -0.26 0.00 0.00 58.87 58.70 1x9s n SER 399 Cb 0.71 0.60 0.00 0.00 -0.26 0.00 0.00 64.21 65.26 1x9s n SER 399 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1x9s n ALA 400 N -2.74 2.39 -0.01 7.33 0.00 0.12 -1.64 120.51 125.96 1x9s n ALA 400 Ca -0.30 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.10 1x9s n ALA 400 Cb 1.12 0.14 -0.12 0.00 0.00 0.00 0.00 19.45 20.59 1x9s n ALA 400 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1x9s n GLU 401 N -2.12 0.64 -0.67 0.00 1.02 -0.73 -4.70 120.64 114.08 1x9s n GLU 401 Ca 0.00 0.20 -0.30 0.00 -0.02 0.00 0.00 57.16 57.04 1x9s n GLU 401 Cb 0.14 -1.75 0.20 0.00 -0.02 0.00 0.00 31.44 30.02 1x9s n GLU 401 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1x9s s GLY 402 N -5.00 1.62 0.19 0.62 0.00 0.60 -4.88 107.32 100.46 1x9s s GLY 402 Ca -0.05 0.23 -0.13 0.00 0.00 0.00 0.00 44.72 44.77 1x9s s GLY 402 CO 0.82 0.78 1.85 -0.55 0.00 0.00 0.00 173.10 176.00 1x9s h ASP 403 N -2.18 0.66 -0.73 1.64 3.45 -1.94 -2.27 116.42 115.05 1x9s h ASP 403 Ca -0.52 -0.01 -0.30 0.00 0.43 0.00 0.00 57.03 56.63 1x9s h ASP 403 Cb 1.30 -0.16 -0.18 0.00 -0.56 0.00 0.00 39.33 39.73 1x9s h ASP 403 CO 0.46 0.47 0.38 0.29 -1.57 0.00 0.00 179.24 179.28 1x9s n LYS 404 N -4.69 2.72 -1.78 3.56 4.76 -1.26 -4.94 118.16 116.53 1x9s n LYS 404 Ca 0.05 -2.55 -0.40 0.00 -2.87 0.00 0.00 58.31 52.54 1x9s n LYS 404 Cb 0.04 -2.03 0.01 0.00 -1.84 0.00 0.00 35.03 31.21 1x9s n LYS 404 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1x9s s ALA 405 N -2.66 3.37 0.18 7.82 0.00 -0.86 -4.57 121.76 125.04 1x9s s ALA 405 Ca 0.47 1.53 -0.16 0.00 0.00 0.00 0.00 51.96 53.81 1x9s s ALA 405 Cb 0.38 -3.61 0.14 0.00 0.00 0.00 0.00 23.12 20.03 1x9s s ALA 405 CO 0.10 -1.17 1.67 -1.49 0.00 0.00 0.00 175.76 174.87 1x9s h TRP 406 N 2.56 -0.14 -0.00 0.00 6.55 -1.41 0.50 115.95 124.00 1x9s h TRP 406 Ca -0.51 0.04 0.00 0.00 0.95 0.00 0.00 58.89 59.37 1x9s h TRP 406 Cb 1.26 0.13 -0.00 0.00 -0.86 0.00 0.00 29.16 29.69 1x9s h TRP 406 CO 0.51 -0.15 0.00 -0.07 -1.05 0.00 0.00 178.44 177.68 1x9s h LEU 407 N 0.05 0.00 0.00 -4.49 3.38 -1.62 0.16 115.31 112.79 1x9s h LEU 407 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1x9s h LEU 407 Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1x9s h LEU 407 CO -0.42 0.00 -0.34 0.54 0.09 0.00 0.00 178.44 178.31 1x9s n ARG 408 N -3.94 0.04 -0.01 1.13 1.74 0.08 -4.18 116.66 111.53 1x9s n ARG 408 Ca -0.03 0.02 0.07 0.00 -0.77 0.00 0.00 57.85 57.14 1x9s n ARG 408 Cb 0.09 -1.53 -0.13 0.00 -1.02 0.00 0.00 32.46 29.87 1x9s n ARG 408 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1x9s n TYR 409 N -1.58 0.00 -1.72 -1.55 4.01 0.48 -4.97 117.16 111.83 1x9s n TYR 409 Ca 0.06 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.37 1x9s n TYR 409 Cb 0.35 -0.40 -0.01 0.00 -0.31 0.00 0.00 39.34 38.97 1x9s n TYR 409 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1x9s n VAL 410 N -2.11 1.65 -3.06 -0.72 0.31 -0.77 -4.65 118.33 108.99 1x9s n VAL 410 Ca -0.05 -0.41 -0.20 0.00 -0.01 0.00 0.00 64.34 63.67 1x9s n VAL 410 Cb 0.47 -1.74 0.06 0.00 -0.91 0.00 0.00 33.84 31.72 1x9s n VAL 410 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1x9s s ALA 411 N -0.74 4.69 0.39 3.52 0.00 -0.64 -4.96 121.76 124.03 1x9s s ALA 411 Ca 0.58 -2.09 0.07 0.00 0.00 0.00 0.00 51.96 50.52 1x9s s ALA 411 Cb -0.54 -1.44 0.81 0.00 0.00 0.00 0.00 23.12 21.95 1x9s s ALA 411 CO 0.58 -0.81 2.02 0.93 0.00 0.00 0.00 175.76 178.49 1x9s h GLU 412 N 0.23 0.62 0.00 0.00 4.39 -1.95 -0.37 114.58 117.51 1x9s h GLU 412 Ca -0.31 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.36 1x9s h GLU 412 Cb 1.29 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 29.80 1x9s h GLU 412 CO 0.42 0.41 0.00 -0.40 -1.16 0.00 0.00 179.01 178.27 1x9s n ASP 413 N -4.47 0.00 -0.43 1.42 5.68 -1.26 -4.85 116.55 112.65 1x9s n ASP 413 Ca 0.06 -0.86 -0.05 0.00 -0.50 0.00 0.00 54.79 53.43 1x9s n ASP 413 Cb 0.12 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 40.08 1x9s n ASP 413 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1x9s n GLY 414 N 0.26 0.70 3.27 6.12 0.00 -0.15 -5.02 105.19 110.38 1x9s n GLY 414 Ca 0.11 -0.81 -0.18 0.00 0.00 0.00 0.00 46.02 45.15 1x9s n GLY 414 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x9s s LYS 415 N -2.68 1.09 -0.35 1.61 1.02 -1.26 -1.83 119.74 117.35 1x9s s LYS 415 Ca 0.00 -1.35 -0.12 0.00 0.02 0.00 0.00 55.97 54.52 1x9s s LYS 415 Cb 0.00 -0.91 -0.01 0.00 -0.52 0.00 0.00 37.83 36.40 1x9s s LYS 415 CO 0.00 0.16 0.23 0.42 -0.92 0.00 0.00 175.35 175.24 1x9s s ILE 416 N -2.50 5.08 -1.21 2.17 1.01 -0.80 -1.62 121.20 123.32 1x9s s ILE 416 Ca 0.13 -0.39 -0.10 0.00 0.00 0.00 0.00 60.65 60.30 1x9s s ILE 416 Cb -0.03 -3.66 0.20 0.00 0.01 0.00 0.00 42.46 38.98 1x9s s ILE 416 CO 0.03 -0.07 1.63 1.41 0.00 0.00 0.00 174.94 177.95 1x9s n HIS 417 N 5.08 3.56 -1.94 3.97 8.25 -1.26 -1.63 115.22 131.25 1x9s n HIS 417 Ca -0.13 -3.00 -0.41 0.00 -0.26 0.00 0.00 57.72 53.92 1x9s n HIS 417 Cb 0.49 -1.87 -0.01 0.00 1.12 0.00 0.00 29.99 29.71 1x9s n HIS 417 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1x9s s GLY 418 N 0.96 2.76 0.34 -1.41 0.00 -1.26 -4.84 107.32 103.87 1x9s s GLY 418 Ca 0.38 1.42 -0.26 0.00 0.00 0.00 0.00 44.72 46.27 1x9s s GLY 418 CO 0.01 2.18 1.00 -0.45 0.00 0.00 0.00 173.10 175.84 1x9s s SER 419 N -0.10 7.12 -0.04 1.64 0.15 0.98 -4.66 113.70 118.79 1x9s s SER 419 Ca 0.54 1.96 0.01 0.00 0.70 0.00 0.00 55.95 59.16 1x9s s SER 419 Cb -0.44 -2.59 0.02 0.00 -1.71 0.00 0.00 66.02 61.31 1x9s s SER 419 CO 0.54 -0.23 -0.02 -0.69 1.20 0.00 0.00 173.24 174.04 1x9s s VAL 420 N -1.57 0.39 -0.65 4.45 1.01 -1.26 -0.79 120.40 121.98 1x9s s VAL 420 Ca 0.52 -0.02 -0.15 0.00 0.00 0.00 0.00 61.98 62.33 1x9s s VAL 420 Cb -0.22 -0.46 0.16 0.00 0.00 0.00 0.00 36.38 35.87 1x9s s VAL 420 CO 0.27 0.20 0.61 0.21 0.00 0.00 0.00 175.10 176.39 1x9s s ASN 421 N 1.08 6.41 0.53 3.32 3.84 0.84 -4.94 114.94 126.03 1x9s s ASN 421 Ca -0.09 -2.13 0.46 0.00 0.21 0.00 0.00 52.86 51.31 1x9s s ASN 421 Cb -0.14 -2.21 1.69 0.00 -0.55 0.00 0.00 41.25 40.04 1x9s s ASN 421 CO -0.01 -0.75 1.58 -0.65 -2.79 0.00 0.00 177.10 174.48 1x9s h PRO 422 N 8.47 0.00 -0.27 0.43 0.11 -1.92 -1.68 132.00 137.14 1x9s h PRO 422 Ca -0.14 -0.00 -0.23 0.00 0.11 0.00 0.00 66.00 65.74 1x9s h PRO 422 Cb 1.08 -0.00 -0.38 0.00 0.11 0.00 0.00 31.00 31.80 1x9s h PRO 422 CO 0.93 0.00 -1.05 -1.71 -0.21 0.00 0.00 178.00 175.96 1x9s n ASN 423 N -4.12 1.55 0.00 -2.05 5.15 -1.26 -3.94 115.26 110.59 1x9s n ASN 423 Ca 0.43 -2.18 0.06 0.00 -0.60 0.00 0.00 54.58 52.29 1x9s n ASN 423 Cb 1.91 -0.41 0.29 0.00 -0.53 0.00 0.00 39.78 41.03 1x9s n ASN 423 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1x9s n GLY 424 N -0.22 -0.66 3.60 8.20 0.00 -0.70 -4.75 105.19 110.66 1x9s n GLY 424 Ca 0.09 -0.05 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 1x9s n GLY 424 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x9s s ALA 425 N -2.57 3.03 0.19 4.61 0.00 -0.65 -4.85 121.76 121.51 1x9s s ALA 425 Ca 0.11 -1.24 -0.12 0.00 0.00 0.00 0.00 51.96 50.70 1x9s s ALA 425 Cb 0.08 -0.95 0.20 0.00 0.00 0.00 0.00 23.12 22.44 1x9s s ALA 425 CO 0.17 0.64 1.73 -0.39 0.00 0.00 0.00 175.76 177.91 1x9s h VAL 426 N 3.11 0.76 0.00 0.00 -1.51 -1.86 -2.17 116.25 114.59 1x9s h VAL 426 Ca -0.48 -0.10 0.00 0.00 -1.23 0.00 0.00 66.70 64.89 1x9s h VAL 426 Cb 1.17 0.45 0.00 0.00 -2.13 0.00 0.00 31.29 30.77 1x9s h VAL 426 CO 0.54 0.05 0.00 0.71 -1.23 0.00 0.00 177.57 177.64 1x9s h THR 427 N 0.29 0.00 0.00 7.19 1.35 -1.91 -3.42 112.91 116.41 1x9s h THR 427 Ca 0.25 -0.20 0.00 0.00 -0.55 0.00 0.00 66.41 65.92 1x9s h THR 427 Cb 0.32 1.06 0.00 0.00 -1.73 0.00 0.00 68.15 67.79 1x9s h THR 427 CO -0.30 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.58 1x9s n GLY 428 N -0.60 1.17 3.88 5.82 0.00 -0.82 -4.10 105.19 110.55 1x9s n GLY 428 Ca -0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 1x9s n GLY 428 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1x9s s ARG 429 N -0.55 3.53 0.65 1.61 0.52 -1.26 -4.60 118.95 118.85 1x9s s ARG 429 Ca 0.00 0.58 -0.04 0.00 -0.52 0.00 0.00 55.73 55.74 1x9s s ARG 429 Cb 0.00 -2.16 0.05 0.00 0.52 0.00 0.00 34.95 33.36 1x9s s ARG 429 CO 0.00 -0.51 0.94 0.00 0.02 0.00 0.00 175.30 175.75 1x9s s ALA 430 N -3.07 3.39 0.04 2.13 0.00 -1.25 -1.64 121.76 121.35 1x9s s ALA 430 Ca 0.53 -1.04 0.04 0.00 0.00 0.00 0.00 51.96 51.49 1x9s s ALA 430 Cb -0.11 -2.44 -0.02 0.00 0.00 0.00 0.00 23.12 20.55 1x9s s ALA 430 CO 0.51 -1.11 -0.13 0.95 0.00 0.00 0.00 175.76 175.98 1x9s s THR 431 N -3.09 0.99 0.02 0.00 -4.23 -0.81 -4.62 115.64 103.90 1x9s s THR 431 Ca 0.59 -0.98 0.07 0.00 -1.18 0.00 0.00 61.69 60.18 1x9s s THR 431 Cb -0.11 -0.92 -0.02 0.00 1.34 0.00 0.00 72.50 72.79 1x9s s THR 431 CO 0.43 -0.06 -0.20 -1.00 -0.54 0.00 0.00 174.62 173.25 1x9s s HIS 432 N -0.91 1.73 0.23 3.99 3.76 -1.26 -0.11 115.29 122.72 1x9s s HIS 432 Ca -0.00 -0.36 -0.22 0.00 -0.15 0.00 0.00 55.06 54.33 1x9s s HIS 432 Cb -0.08 -1.06 0.04 0.00 1.11 0.00 0.00 32.58 32.60 1x9s s HIS 432 CO 0.01 0.05 0.68 0.00 -0.85 0.00 0.00 174.74 174.63 1x9s s ALA 433 N -0.69 -1.39 -1.19 -1.40 0.00 0.03 -4.30 121.76 112.83 1x9s s ALA 433 Ca 0.07 0.03 -0.05 0.00 0.00 0.00 0.00 51.96 52.02 1x9s s ALA 433 Cb -0.08 0.86 -0.02 0.00 0.00 0.00 0.00 23.12 23.88 1x9s s ALA 433 CO 0.01 -0.93 0.85 1.19 0.00 0.00 0.00 175.76 176.88 1x9s n PHE 434 N -0.43 -2.13 -3.95 0.00 3.72 -1.26 -0.02 117.46 113.40 1x9s n PHE 434 Ca -0.09 0.81 -0.21 0.00 -0.05 0.00 0.00 57.45 57.91 1x9s n PHE 434 Cb 0.61 -4.36 -0.02 0.00 -0.94 0.00 0.00 39.48 34.77 1x9s n PHE 434 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1x9s s PRO 435 N -5.39 3.32 -0.76 -1.08 0.04 -1.26 -3.92 135.00 125.96 1x9s s PRO 435 Ca 0.19 -0.83 -0.25 0.00 0.04 0.00 0.00 61.00 60.15 1x9s s PRO 435 Cb -0.04 -2.83 -0.05 0.00 0.04 0.00 0.00 34.50 31.62 1x9s s PRO 435 CO 0.78 0.39 2.01 1.21 0.04 0.00 0.00 177.00 181.43 1x9s s ASN 436 N -3.98 4.98 0.00 6.66 2.47 -1.26 -4.51 114.94 119.30 1x9s s ASN 436 Ca 0.35 -0.11 0.20 0.00 0.42 0.00 0.00 52.86 53.71 1x9s s ASN 436 Cb -0.09 -2.54 1.17 0.00 -1.45 0.00 0.00 41.25 38.34 1x9s s ASN 436 CO 0.29 -2.77 1.59 0.18 -3.72 0.00 0.00 177.10 172.66 1x9s n LEU 437 N 14.29 0.00 -1.45 3.21 4.77 -1.26 -2.00 117.00 134.55 1x9s n LEU 437 Ca 0.34 0.03 0.08 0.00 -0.03 0.00 0.00 56.01 56.43 1x9s n LEU 437 Cb 0.49 -0.03 0.32 0.00 -2.33 0.00 0.00 43.42 41.86 1x9s n LEU 437 CO 0.64 -0.01 0.76 0.00 -1.33 0.00 0.00 177.39 177.45 1x9s n ALA 438 N -1.03 3.08 -2.22 -1.18 0.00 -1.26 -4.17 120.51 113.72 1x9s n ALA 438 Ca 0.14 -1.39 0.03 0.00 0.00 0.00 0.00 53.44 52.23 1x9s n ALA 438 Cb 0.08 -1.03 0.03 0.00 0.00 0.00 0.00 19.45 18.53 1x9s n ALA 438 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1x9s n GLN 439 N 0.93 0.16 -2.08 0.00 10.64 -0.85 -5.08 117.38 121.11 1x9s n GLN 439 Ca 0.23 -1.80 -0.40 0.00 -1.83 0.00 0.00 57.00 53.19 1x9s n GLN 439 Cb 0.81 -0.33 -0.01 0.00 -0.86 0.00 0.00 30.24 29.85 1x9s n GLN 439 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.06 175.65 1x9s s ILE 440 N -0.34 2.66 0.32 -0.39 -1.09 -1.26 -4.91 121.20 116.19 1x9s s ILE 440 Ca 0.24 0.61 -0.29 0.00 -2.23 0.00 0.00 60.65 58.97 1x9s s ILE 440 Cb 0.26 -3.37 -0.12 0.00 -1.58 0.00 0.00 42.46 37.66 1x9s s ILE 440 CO -0.10 0.11 1.51 -2.65 -1.23 0.00 0.00 174.94 172.58 1x9s n PRO 441 N 0.32 2.57 -1.44 2.79 -0.02 -1.26 -4.95 135.00 133.01 1x9s n PRO 441 Ca 0.03 0.91 -0.31 0.00 -2.02 0.00 0.00 63.50 62.10 1x9s n PRO 441 Cb 0.43 -2.64 0.07 0.00 -0.02 0.00 0.00 33.50 31.34 1x9s n PRO 441 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1x9s s GLY 442 N 0.18 1.70 0.61 -1.23 0.00 -1.26 -4.49 107.32 102.83 1x9s s GLY 442 Ca 0.60 0.19 0.32 0.00 0.00 0.00 0.00 44.72 45.83 1x9s s GLY 442 CO 0.55 0.52 2.24 -0.39 0.00 0.00 0.00 173.10 176.02 1x9s h VAL 443 N -0.86 0.41 0.00 1.40 -1.51 -1.93 -1.74 116.25 112.02 1x9s h VAL 443 Ca -0.44 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.03 1x9s h VAL 443 Cb 1.22 0.96 0.00 0.00 -2.13 0.00 0.00 31.29 31.34 1x9s h VAL 443 CO 0.54 0.00 0.00 0.54 -1.23 0.00 0.00 177.57 177.42 1x9s n ARG 444 N -3.68 0.25 -3.32 5.19 3.00 -1.26 -4.24 116.66 112.60 1x9s n ARG 444 Ca -0.02 0.24 -0.21 0.00 -0.01 0.00 0.00 57.85 57.85 1x9s n ARG 444 Cb 0.13 -1.81 -0.00 0.00 0.00 0.00 0.00 32.46 30.78 1x9s n ARG 444 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 1x9s s SER 445 N -4.46 6.00 -0.12 0.55 1.04 -0.65 -4.98 113.70 111.07 1x9s s SER 445 Ca 0.10 0.12 -0.36 0.00 0.48 0.00 0.00 55.95 56.28 1x9s s SER 445 Cb 0.12 -1.53 -0.13 0.00 0.10 0.00 0.00 66.02 64.57 1x9s s SER 445 CO 0.56 -0.48 1.78 -2.65 0.98 0.00 0.00 173.24 173.43 1x9s n PRO 446 N -1.81 1.77 -1.01 4.02 -0.02 -1.26 -0.60 135.00 136.10 1x9s n PRO 446 Ca -0.01 0.65 -0.00 0.00 -2.02 0.00 0.00 63.50 62.12 1x9s n PRO 446 Cb 0.58 -2.42 -0.00 0.00 -0.02 0.00 0.00 33.50 31.63 1x9s n PRO 446 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1x9s n TYR 447 N 5.73 0.00 0.25 6.00 4.01 -1.26 -4.90 117.16 127.00 1x9s n TYR 447 Ca 0.23 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 58.09 1x9s n TYR 447 Cb 0.23 -0.85 0.67 0.00 -0.31 0.00 0.00 39.34 39.08 1x9s n TYR 447 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1x9s h GLY 448 N 0.00 0.00 0.56 2.72 0.00 -0.98 -2.34 103.07 103.04 1x9s h GLY 448 Ca -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.31 1x9s h GLY 448 CO 0.01 0.00 -0.13 0.83 0.00 0.00 0.00 176.54 177.25 1x9s h GLU 449 N 0.00 -0.34 -0.73 4.80 4.39 -1.79 -1.86 114.58 119.05 1x9s h GLU 449 Ca -0.00 0.02 0.01 0.00 0.34 0.00 0.00 59.36 59.74 1x9s h GLU 449 Cb 0.41 0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 29.10 1x9s h GLU 449 CO 0.02 0.01 0.48 1.96 -1.16 0.00 0.00 179.01 180.32 1x9s h GLN 450 N -0.79 0.94 0.28 2.33 4.20 -1.94 0.25 115.11 120.37 1x9s h GLN 450 Ca -0.04 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.60 1x9s h GLN 450 Cb 0.51 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 28.08 1x9s h GLN 450 CO 0.06 0.62 -0.13 0.00 -0.67 0.00 0.00 178.83 178.71 1x9s h ARG 452 N -0.47 0.59 0.00 0.00 9.65 -1.17 -2.59 114.38 120.40 1x9s h ARG 452 Ca -0.04 -0.08 -0.10 0.00 -1.10 0.00 0.00 59.98 58.66 1x9s h ARG 452 Cb 0.35 -0.11 -0.01 0.00 -1.39 0.00 0.00 29.97 28.80 1x9s h ARG 452 CO 0.06 0.50 -0.47 0.00 2.80 0.00 0.00 179.97 182.86 1x9s h ALA 453 N 1.59 0.99 0.00 2.80 0.00 -0.31 -2.73 119.26 121.59 1x9s h ALA 453 Ca 0.15 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1x9s h ALA 453 Cb 0.13 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1x9s h ALA 453 CO -0.01 0.59 0.00 0.00 0.00 0.00 0.00 179.25 179.83 1x9s n ALA 454 N -2.35 1.46 -3.59 0.00 0.00 -0.87 -4.20 120.51 110.96 1x9s n ALA 454 Ca -0.01 0.02 -0.37 0.00 0.00 0.00 0.00 53.44 53.08 1x9s n ALA 454 Cb 0.55 -1.23 -0.11 0.00 0.00 0.00 0.00 19.45 18.66 1x9s n ALA 454 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1x9s s PHE 455 N -3.14 3.44 0.01 0.00 0.40 -1.04 -0.57 117.98 117.08 1x9s s PHE 455 Ca 0.04 -2.01 -0.28 0.00 -0.60 0.00 0.00 56.93 54.08 1x9s s PHE 455 Cb 0.07 -2.96 0.10 0.00 0.51 0.00 0.00 43.02 40.74 1x9s s PHE 455 CO 0.23 -0.90 0.82 0.20 0.70 0.00 0.00 175.22 176.27 1x9s s GLY 456 N 1.86 -0.48 0.41 4.36 0.00 -0.85 -0.59 107.32 112.02 1x9s s GLY 456 Ca 0.04 1.07 0.13 0.00 0.00 0.00 0.00 44.72 45.96 1x9s s GLY 456 CO -0.01 0.45 1.91 0.00 0.00 0.00 0.00 173.10 175.45 1x9s h ALA 457 N 2.17 1.55 -0.60 3.20 0.00 -1.74 -2.44 119.26 121.40 1x9s h ALA 457 Ca -0.25 -0.25 0.17 0.00 0.00 0.00 0.00 54.91 54.59 1x9s h ALA 457 Cb 1.24 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 1x9s h ALA 457 CO 0.33 0.34 0.49 1.05 0.00 0.00 0.00 179.25 181.46 1x9s h GLU 458 N 0.02 0.00 -0.02 0.00 4.11 -0.95 0.27 114.58 118.00 1x9s h GLU 458 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1x9s h GLU 458 Cb 0.48 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.73 1x9s h GLU 458 CO 0.03 0.00 0.00 0.72 0.07 0.00 0.00 179.01 179.83 1x9s n HIS 459 N -4.08 0.03 -4.50 2.06 8.25 -0.92 -4.46 115.22 111.60 1x9s n HIS 459 Ca 0.11 -0.02 -0.33 0.00 -0.26 0.00 0.00 57.72 57.23 1x9s n HIS 459 Cb 0.72 0.00 -0.15 0.00 1.12 0.00 0.00 29.99 31.68 1x9s n HIS 459 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1x9s s HIS 460 N -1.97 2.78 -0.16 4.41 5.65 0.93 -4.69 115.29 122.23 1x9s s HIS 460 Ca 0.14 -1.08 -0.12 0.00 0.25 0.00 0.00 55.06 54.25 1x9s s HIS 460 Cb 0.07 -1.89 -0.05 0.00 -1.18 0.00 0.00 32.58 29.53 1x9s s HIS 460 CO 0.11 -0.50 0.23 -0.51 -0.65 0.00 0.00 174.74 173.42 1x9s s LEU 461 N 0.85 4.26 0.27 8.88 1.43 -1.26 -1.47 118.68 131.64 1x9s s LEU 461 Ca -0.05 0.43 -0.30 0.00 -1.03 0.00 0.00 54.13 53.18 1x9s s LEU 461 Cb -0.15 -2.25 -0.13 0.00 0.03 0.00 0.00 46.19 43.68 1x9s s LEU 461 CO -0.01 0.17 1.33 -0.67 0.23 0.00 0.00 176.35 177.40 1x9s n ASP 462 N 3.32 2.58 0.17 2.29 2.03 0.10 -4.80 116.55 122.23 1x9s n ASP 462 Ca -0.14 1.16 0.12 0.00 0.52 0.00 0.00 54.79 56.45 1x9s n ASP 462 Cb 0.52 -1.42 0.61 0.00 -0.72 0.00 0.00 41.12 40.10 1x9s n ASP 462 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 1x9s h GLY 463 N 3.53 0.00 0.00 0.27 0.00 -1.91 -0.50 103.07 104.46 1x9s h GLY 463 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.88 1x9s h GLY 463 CO 0.71 0.00 -0.38 1.39 0.00 0.00 0.00 176.54 178.26 1x9s n ILE 464 N -2.31 1.19 1.67 2.60 5.41 -1.26 -4.78 119.36 121.87 1x9s n ILE 464 Ca -0.01 0.29 0.15 0.00 1.00 0.00 0.00 62.75 64.17 1x9s n ILE 464 Cb 0.08 -1.83 0.68 0.00 -0.71 0.00 0.00 39.64 37.86 1x9s n ILE 464 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 1x9s n THR 465 N -3.74 0.00 -0.73 1.39 -2.24 -1.25 -4.92 114.28 102.80 1x9s n THR 465 Ca -0.05 -0.15 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 1x9s n THR 465 Cb 0.20 0.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.54 1x9s n THR 465 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1x9s n GLY 466 N 1.12 0.10 3.79 3.38 0.00 -0.20 -4.88 105.19 108.50 1x9s n GLY 466 Ca 0.20 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.84 1x9s n GLY 466 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x9s s LYS 467 N -1.22 4.46 0.45 1.61 -0.14 -1.26 -4.25 119.74 119.39 1x9s s LYS 467 Ca 0.00 1.05 -0.24 0.00 -1.36 0.00 0.00 55.97 55.42 1x9s s LYS 467 Cb 0.00 -3.19 -0.09 0.00 -1.68 0.00 0.00 37.83 32.87 1x9s s LYS 467 CO 0.00 0.55 1.14 -2.30 -0.76 0.00 0.00 175.35 173.98 1x9s n PRO 468 N 1.45 1.58 -2.29 -1.68 -0.02 -1.26 -0.72 135.00 132.05 1x9s n PRO 468 Ca -0.06 0.57 -0.26 0.00 -2.02 0.00 0.00 63.50 61.73 1x9s n PRO 468 Cb 0.49 -2.24 0.05 0.00 -0.02 0.00 0.00 33.50 31.79 1x9s n PRO 468 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 1x9s s TRP 469 N -1.27 3.05 0.22 6.00 0.52 -0.54 -4.83 118.94 122.09 1x9s s TRP 469 Ca 0.64 0.51 0.09 0.00 0.02 0.00 0.00 56.10 57.37 1x9s s TRP 469 Cb -0.51 -3.00 -0.04 0.00 -1.15 0.00 0.00 33.47 28.77 1x9s s TRP 469 CO 0.56 -1.16 -0.06 0.08 0.02 0.00 0.00 176.95 176.40 1x9s s VAL 470 N -3.13 3.31 0.09 4.03 1.01 0.15 -2.86 120.40 123.00 1x9s s VAL 470 Ca 0.58 -1.78 0.07 0.00 0.00 0.00 0.00 61.98 60.84 1x9s s VAL 470 Cb -0.11 -2.70 -0.04 0.00 0.00 0.00 0.00 36.38 33.54 1x9s s VAL 470 CO 0.45 -0.23 -0.09 -1.58 0.00 0.00 0.00 175.10 173.64 1x9s s GLN 471 N -3.22 2.19 -0.19 2.72 0.74 0.96 0.14 119.66 123.00 1x9s s GLN 471 Ca 0.28 -0.99 -0.01 0.00 0.05 0.00 0.00 55.36 54.69 1x9s s GLN 471 Cb -0.08 -2.33 0.05 0.00 1.10 0.00 0.00 33.01 31.75 1x9s s GLN 471 CO 0.17 0.52 -0.01 0.00 -0.55 0.00 0.00 175.29 175.42 1x9s s ALA 472 N -1.20 1.35 -0.24 1.58 0.00 0.28 -1.80 121.76 121.73 1x9s s ALA 472 Ca 0.21 -0.86 -0.08 0.00 0.00 0.00 0.00 51.96 51.23 1x9s s ALA 472 Cb -0.11 -1.20 -0.04 0.00 0.00 0.00 0.00 23.12 21.77 1x9s s ALA 472 CO 0.13 -1.04 0.10 0.20 0.00 0.00 0.00 175.76 175.15 1x9s s GLY 473 N 1.69 1.83 -0.09 0.00 0.00 -0.48 -0.57 107.32 109.70 1x9s s GLY 473 Ca -0.01 -1.05 0.04 0.00 0.00 0.00 0.00 44.72 43.70 1x9s s GLY 473 CO -0.07 0.48 -0.23 -0.42 0.00 0.00 0.00 173.10 172.85 1x9s s ILE 474 N 1.42 1.98 -0.12 0.90 1.09 -0.44 -0.65 121.20 125.38 1x9s s ILE 474 Ca 0.06 -0.99 0.03 0.00 -1.10 0.00 0.00 60.65 58.65 1x9s s ILE 474 Cb -0.15 -1.71 0.00 0.00 -1.06 0.00 0.00 42.46 39.54 1x9s s ILE 474 CO 0.05 0.54 -0.22 -0.62 -0.10 0.00 0.00 174.94 174.59 1x9s s ASP 475 N 0.27 3.16 -0.02 3.58 -1.08 0.60 -1.64 116.67 121.53 1x9s s ASP 475 Ca -0.16 -0.57 -0.30 0.00 -0.52 0.00 0.00 52.55 51.01 1x9s s ASP 475 Cb -0.17 -1.44 -0.05 0.00 -1.46 0.00 0.00 42.92 39.80 1x9s s ASP 475 CO 0.08 0.12 1.45 0.00 0.52 0.00 0.00 175.17 177.34 1x9s s ALA 476 N 0.56 3.60 0.13 3.66 0.00 -0.07 -1.28 121.76 128.36 1x9s s ALA 476 Ca -0.13 0.88 -0.31 0.00 0.00 0.00 0.00 51.96 52.40 1x9s s ALA 476 Cb -0.17 -3.63 -0.08 0.00 0.00 0.00 0.00 23.12 19.24 1x9s s ALA 476 CO 0.04 -1.03 1.35 -1.12 0.00 0.00 0.00 175.76 174.99 1x9s s SER 477 N 2.17 6.87 -0.55 0.00 0.01 -0.30 -4.04 113.70 117.87 1x9s s SER 477 Ca 0.65 2.30 -0.03 0.00 1.31 0.00 0.00 55.95 60.19 1x9s s SER 477 Cb -0.31 -2.59 0.03 0.00 0.21 0.00 0.00 66.02 63.35 1x9s s SER 477 CO 0.26 -0.60 0.07 0.61 0.41 0.00 0.00 173.24 173.99 1x9s n GLY 478 N 3.21 -0.07 0.26 3.44 0.00 -1.26 -4.67 105.19 106.10 1x9s n GLY 478 Ca 0.10 0.05 0.04 0.00 0.00 0.00 0.00 46.02 46.20 1x9s n GLY 478 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1x9s h LEU 479 N -0.05 0.18 -1.25 0.99 5.85 -1.94 -2.05 115.31 117.03 1x9s h LEU 479 Ca -0.21 0.11 0.02 0.00 0.84 0.00 0.00 57.88 58.63 1x9s h LEU 479 Cb 0.47 0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.57 1x9s h LEU 479 CO 0.26 0.07 0.51 -0.33 -0.34 0.00 0.00 178.44 178.61 1x9s h GLU 480 N 0.38 0.98 -0.05 1.25 4.39 -1.94 0.13 114.58 119.71 1x9s h GLU 480 Ca 0.38 -0.06 -0.23 0.00 0.34 0.00 0.00 59.36 59.79 1x9s h GLU 480 Cb 0.57 -0.22 0.01 0.00 -0.10 0.00 0.00 28.75 29.01 1x9s h GLU 480 CO -0.41 0.65 -0.88 -0.07 -1.16 0.00 0.00 179.01 177.14 1x9s h LEU 481 N 1.01 0.71 -0.77 1.33 3.38 -1.80 -2.25 115.31 116.92 1x9s h LEU 481 Ca 0.29 -0.52 -0.09 0.00 0.09 0.00 0.00 57.88 57.65 1x9s h LEU 481 Cb -0.06 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 1x9s h LEU 481 CO -0.07 1.31 -0.08 0.03 0.09 0.00 0.00 178.44 179.72 1x9s h ARG 482 N 0.36 0.85 -0.21 1.13 3.08 -0.80 0.30 114.38 119.09 1x9s h ARG 482 Ca -0.07 -0.28 -0.09 0.00 0.07 0.00 0.00 59.98 59.61 1x9s h ARG 482 Cb 1.51 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 31.47 1x9s h ARG 482 CO 0.16 0.90 -0.24 0.00 -1.07 0.00 0.00 179.97 179.73 1x9s h LEU 484 N 0.35 0.30 -0.11 0.00 5.85 -0.73 -2.55 115.31 118.42 1x9s h LEU 484 Ca 0.05 -0.44 0.04 0.00 0.84 0.00 0.00 57.88 58.38 1x9s h LEU 484 Cb 0.62 -0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.51 1x9s h LEU 484 CO 0.04 0.68 -0.30 0.00 -0.34 0.00 0.00 178.44 178.52 1x9s h ALA 485 N 0.63 -0.36 -0.57 1.25 0.00 -0.07 -1.27 119.26 118.88 1x9s h ALA 485 Ca 0.03 0.02 0.11 0.00 0.00 0.00 0.00 54.91 55.06 1x9s h ALA 485 Cb 0.58 0.57 -0.11 0.00 0.00 0.00 0.00 17.79 18.83 1x9s h ALA 485 CO 0.02 -0.78 -0.25 1.25 0.00 0.00 0.00 179.25 179.49 1x9s h HIS 486 N -0.39 -0.66 0.00 0.00 -0.00 -1.11 -0.06 115.15 112.93 1x9s h HIS 486 Ca 0.09 0.06 -0.01 0.00 -0.00 0.00 0.00 60.37 60.51 1x9s h HIS 486 Cb 0.53 0.38 -0.00 0.00 -0.00 0.00 0.00 27.41 28.31 1x9s h HIS 486 CO -0.38 -0.34 -0.06 0.74 -0.00 0.00 0.00 177.93 177.90 1x9s h PHE 487 N -0.11 0.00 -0.02 5.26 0.04 -1.00 -2.67 116.94 118.44 1x9s h PHE 487 Ca 0.25 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.02 1x9s h PHE 487 Cb 0.51 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.66 1x9s h PHE 487 CO -0.56 0.06 -0.21 0.00 -0.60 0.00 0.00 178.31 176.99 1x9s n MET 488 N -3.17 1.49 0.28 1.51 0.00 -0.35 -4.09 117.12 112.80 1x9s n MET 488 Ca 0.01 -1.11 0.14 0.00 0.00 0.00 0.00 57.70 56.73 1x9s n MET 488 Cb 0.35 -1.48 0.82 0.00 0.00 0.00 0.00 33.22 32.92 1x9s n MET 488 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1x9s h ALA 489 N 4.14 1.44 0.00 3.17 0.00 -0.70 0.99 119.26 128.30 1x9s h ALA 489 Ca 0.00 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1x9s h ALA 489 Cb 0.71 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 1x9s h ALA 489 CO 0.00 0.07 -0.11 -0.09 0.00 0.00 0.00 179.25 179.12 1x9s h ARG 490 N 0.00 0.00 0.00 0.00 2.43 -1.75 0.11 114.38 115.17 1x9s h ARG 490 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1x9s h ARG 490 Cb 0.15 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.70 1x9s h ARG 490 CO 0.01 0.11 -1.46 1.19 -1.51 0.00 0.00 179.97 178.30 1x9s n PHE 491 N -3.31 0.00 -0.22 2.20 3.72 0.17 -4.65 117.46 115.36 1x9s n PHE 491 Ca -0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1x9s n PHE 491 Cb 0.32 -0.24 0.00 0.00 -0.94 0.00 0.00 39.48 38.62 1x9s n PHE 491 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 1x9s n ASP 492 N -1.86 1.39 -3.07 4.37 5.75 -0.18 -4.92 116.55 118.04 1x9s n ASP 492 Ca -0.02 -1.61 -0.23 0.00 -0.01 0.00 0.00 54.79 52.92 1x9s n ASP 492 Cb 0.28 0.00 0.03 0.00 -1.03 0.00 0.00 41.12 40.41 1x9s n ASP 492 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1x9s n ASN 493 N -0.31 -5.89 0.00 -1.12 3.02 0.02 -2.23 115.26 108.76 1x9s n ASN 493 Ca 0.00 -0.30 0.00 0.00 -0.03 0.00 0.00 54.58 54.25 1x9s n ASN 493 Cb 0.25 -4.76 0.00 0.00 -0.61 0.00 0.00 39.78 34.66 1x9s n ASN 493 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1x9s n GLY 494 N -1.50 0.59 0.07 7.41 0.00 -1.24 -4.96 105.19 105.56 1x9s n GLY 494 Ca -0.10 -0.27 -0.12 0.00 0.00 0.00 0.00 46.02 45.53 1x9s n GLY 494 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1x9s h GLU 495 N 1.15 -0.08 -0.42 1.61 4.81 -1.80 0.36 114.58 120.21 1x9s h GLU 495 Ca 0.00 0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.19 1x9s h GLU 495 Cb 0.00 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.38 1x9s h GLU 495 CO 0.00 -0.05 0.07 -0.92 -0.73 0.00 0.00 179.01 177.38 1x9s h TYR 496 N -0.08 0.73 -0.16 0.92 3.20 -1.90 -1.31 116.97 118.36 1x9s h TYR 496 Ca -0.00 -0.10 0.02 0.00 3.14 0.00 0.00 58.73 61.78 1x9s h TYR 496 Cb 0.07 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.12 1x9s h TYR 496 CO -0.08 0.71 0.04 0.00 -1.64 0.00 0.00 178.16 177.19 1x9s h ALA 497 N 0.93 0.17 -0.74 1.82 0.00 -1.77 -0.98 119.26 118.71 1x9s h ALA 497 Ca 0.13 0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.08 1x9s h ALA 497 Cb 0.37 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 1x9s h ALA 497 CO 0.01 -0.40 0.47 1.25 0.00 0.00 0.00 179.25 180.58 1x9s h HIS 498 N 0.12 0.89 -0.14 0.00 -0.00 -0.17 -2.08 115.15 113.76 1x9s h HIS 498 Ca 0.07 0.02 -0.05 0.00 -0.00 0.00 0.00 60.37 60.42 1x9s h HIS 498 Cb 0.06 -0.29 -0.01 0.00 -0.00 0.00 0.00 27.41 27.16 1x9s h HIS 498 CO -0.12 0.53 -0.13 1.49 -0.00 0.00 0.00 177.93 179.69 1x9s h GLU 499 N 0.94 0.22 0.23 5.26 4.57 -0.74 -2.18 114.58 122.88 1x9s h GLU 499 Ca 0.29 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.41 1x9s h GLU 499 Cb -0.03 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.54 1x9s h GLU 499 CO -0.09 0.36 -0.11 0.82 -1.18 0.00 0.00 179.01 178.81 1x9s h ILE 500 N 0.21 0.83 -0.26 2.32 2.04 -0.49 -0.07 117.51 122.09 1x9s h ILE 500 Ca 0.04 -0.45 0.00 0.00 1.00 0.00 0.00 64.86 65.45 1x9s h ILE 500 Cb 0.37 1.09 0.00 0.00 -0.74 0.00 0.00 36.82 37.55 1x9s h ILE 500 CO 0.02 0.10 0.00 0.18 0.00 0.00 0.00 178.15 178.45 1x9s n LEU 501 N -5.13 1.77 0.00 1.44 4.32 -1.07 -4.47 117.00 113.87 1x9s n LEU 501 Ca -0.09 -0.89 0.00 0.00 -0.02 0.00 0.00 56.01 55.01 1x9s n LEU 501 Cb 0.22 -0.27 0.00 0.00 -1.62 0.00 0.00 43.42 41.74 1x9s n LEU 501 CO 0.33 0.37 0.00 0.59 -1.22 0.00 0.00 177.39 177.46 1x9s n ASN 502 N 0.29 0.00 -1.18 -1.43 3.02 -0.83 -5.08 115.26 110.04 1x9s n ASN 502 Ca 0.09 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.64 1x9s n ASN 502 Cb 0.32 0.04 0.00 0.00 -0.61 0.00 0.00 39.78 39.53 1x9s n ASN 502 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1x9s n GLY 503 N 1.18 1.30 2.98 7.41 0.00 -0.04 -5.04 105.19 112.98 1x9s n GLY 503 Ca 0.00 -1.78 -0.31 0.00 0.00 0.00 0.00 46.02 43.92 1x9s n GLY 503 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1x9s s ASP 504 N -1.00 4.50 0.29 1.61 1.11 -1.25 -4.75 116.67 117.19 1x9s s ASP 504 Ca 0.00 -3.00 0.04 0.00 0.18 0.00 0.00 52.55 49.77 1x9s s ASP 504 Cb 0.00 -1.68 0.68 0.00 1.07 0.00 0.00 42.92 42.99 1x9s s ASP 504 CO 0.00 -0.25 1.77 -0.29 1.18 0.00 0.00 175.17 177.58 1x9s h ILE 505 N 5.43 0.71 -0.72 0.77 6.09 -1.83 0.26 117.51 128.22 1x9s h ILE 505 Ca -0.06 -0.25 0.01 0.00 -1.37 0.00 0.00 64.86 63.19 1x9s h ILE 505 Cb 0.90 -0.08 -0.04 0.00 0.47 0.00 0.00 36.82 38.07 1x9s h ILE 505 CO 0.69 0.13 0.48 0.45 -3.07 0.00 0.00 178.15 176.84 1x9s h HIS 506 N 0.73 0.90 -0.08 2.19 3.86 -1.93 0.26 115.15 121.08 1x9s h HIS 506 Ca 0.55 0.02 -0.13 0.00 -1.16 0.00 0.00 60.37 59.65 1x9s h HIS 506 Cb 0.83 -0.30 0.01 0.00 1.06 0.00 0.00 27.41 29.00 1x9s h HIS 506 CO -0.03 0.56 -0.45 1.15 0.86 0.00 0.00 177.93 180.02 1x9s h THR 507 N 0.96 1.40 -0.81 2.45 2.02 -0.87 -0.54 112.91 117.52 1x9s h THR 507 Ca 0.27 -1.82 0.11 0.00 0.77 0.00 0.00 66.41 65.74 1x9s h THR 507 Cb -0.09 2.29 -0.08 0.00 -1.74 0.00 0.00 68.15 68.53 1x9s h THR 507 CO -0.06 0.54 0.43 0.11 0.37 0.00 0.00 175.52 176.91 1x9s h LYS 508 N -0.01 0.67 0.00 6.66 1.57 0.09 0.47 116.57 126.03 1x9s h LYS 508 Ca -0.03 -0.04 -0.10 0.00 -1.87 0.00 0.00 60.65 58.60 1x9s h LYS 508 Cb 1.10 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 33.25 1x9s h LYS 508 CO 0.09 0.44 -0.50 -0.91 -0.57 0.00 0.00 179.45 178.01 1x9s h ASN 509 N 0.69 0.00 -0.17 0.86 2.35 -0.49 -0.35 115.58 118.46 1x9s h ASN 509 Ca 0.41 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 56.08 1x9s h ASN 509 Cb 0.48 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.83 1x9s h ASN 509 CO -0.30 0.50 -0.16 1.56 -1.65 0.00 0.00 177.43 177.38 1x9s h GLN 510 N 0.00 0.58 0.06 0.81 7.50 0.15 -1.65 115.11 122.55 1x9s h GLN 510 Ca -0.00 -0.19 -0.25 0.00 0.50 0.00 0.00 58.65 58.71 1x9s h GLN 510 Cb 1.06 -0.05 -0.02 0.00 0.05 0.00 0.00 27.48 28.53 1x9s h GLN 510 CO 0.06 0.71 -1.22 0.82 -1.50 0.00 0.00 178.83 177.71 1x9s h ILE 511 N 0.52 1.49 0.31 2.54 1.08 -0.34 -3.35 117.51 119.75 1x9s h ILE 511 Ca 0.09 -3.16 -0.01 0.00 -0.39 0.00 0.00 64.86 61.38 1x9s h ILE 511 Cb 0.58 2.83 -0.00 0.00 -3.07 0.00 0.00 36.82 37.15 1x9s h ILE 511 CO 0.04 0.88 -0.19 0.00 -0.69 0.00 0.00 178.15 178.20 1x9s h ALA 512 N 0.80 -1.05 -2.40 1.87 0.00 -0.77 -3.41 119.26 114.30 1x9s h ALA 512 Ca -0.11 -0.10 -0.49 0.00 0.00 0.00 0.00 54.91 54.22 1x9s h ALA 512 Cb 1.89 0.29 0.07 0.00 0.00 0.00 0.00 17.79 20.03 1x9s h ALA 512 CO 0.15 -1.03 0.34 0.00 0.00 0.00 0.00 179.25 178.71 1x9s s ALA 513 N -4.15 3.06 -0.08 0.00 0.00 -0.65 -4.18 121.76 115.77 1x9s s ALA 513 Ca -0.07 -0.40 -0.05 0.00 0.00 0.00 0.00 51.96 51.43 1x9s s ALA 513 Cb 0.01 -2.90 -0.03 0.00 0.00 0.00 0.00 23.12 20.20 1x9s s ALA 513 CO 0.22 -0.93 0.22 0.93 0.00 0.00 0.00 175.76 176.20 1x9s h GLU 514 N -0.43 -0.19 0.00 0.00 3.07 -1.80 -3.42 114.58 111.82 1x9s h GLU 514 Ca -0.45 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.42 1x9s h GLU 514 Cb 1.24 0.04 0.00 0.00 -0.84 0.00 0.00 28.75 29.19 1x9s h GLU 514 CO 0.63 -0.12 0.00 1.28 -1.40 0.00 0.00 179.01 179.39 1x9s n LEU 515 N -4.88 0.00 -4.75 1.33 4.77 -1.26 -4.78 117.00 107.43 1x9s n LEU 515 Ca -0.02 0.00 -0.37 0.00 -0.03 0.00 0.00 56.01 55.59 1x9s n LEU 515 Cb 0.08 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.20 1x9s n LEU 515 CO 0.06 0.00 0.88 -2.16 -1.33 0.00 0.00 177.39 174.84 1x9s s PRO 516 N 0.00 3.14 0.00 3.23 0.04 -1.26 -4.38 135.00 135.77 1x9s s PRO 516 Ca 0.00 1.95 0.00 0.00 0.04 0.00 0.00 61.00 62.99 1x9s s PRO 516 Cb 0.00 -2.10 0.00 0.00 0.04 0.00 0.00 34.50 32.44 1x9s s PRO 516 CO 0.00 -1.11 0.00 0.25 0.04 0.00 0.00 177.00 176.18 1x9s n THR 517 N -1.25 -1.82 0.09 1.26 -2.24 -1.26 -4.60 114.28 104.46 1x9s n THR 517 Ca 0.12 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.90 1x9s n THR 517 Cb 0.48 -3.53 0.00 0.00 -2.10 0.00 0.00 70.33 65.18 1x9s n THR 517 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1x9s n ARG 518 N 0.01 0.12 0.00 -0.78 3.00 -1.26 0.57 116.66 118.31 1x9s n ARG 518 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.84 1x9s n ARG 518 Cb 0.00 -1.44 0.00 0.00 0.00 0.00 0.00 32.46 31.02 1x9s n ARG 518 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16 1x9s n ASP 519 N 1.13 1.35 0.15 0.55 -0.08 -1.26 -4.52 116.55 113.87 1x9s n ASP 519 Ca 0.00 -0.18 0.04 0.00 -1.51 0.00 0.00 54.79 53.14 1x9s n ASP 519 Cb 0.06 0.63 0.07 0.00 2.34 0.00 0.00 41.12 44.22 1x9s n ASP 519 CO 0.00 0.00 0.00 0.78 0.12 0.00 0.00 177.20 178.10 1x9s h ASN 520 N 0.00 0.00 -0.34 1.67 4.21 -0.13 -3.04 115.58 117.95 1x9s h ASN 520 Ca 0.00 0.00 -0.06 0.00 1.21 0.00 0.00 56.30 57.45 1x9s h ASN 520 Cb 0.00 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.18 1x9s h ASN 520 CO 0.00 0.44 0.00 0.00 -1.29 0.00 0.00 177.43 176.59 1x9s h ALA 521 N 1.56 1.20 -0.56 -0.83 0.00 -1.79 0.42 119.26 119.25 1x9s h ALA 521 Ca -0.00 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.59 1x9s h ALA 521 Cb 1.30 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 1x9s h ALA 521 CO 0.06 0.53 0.05 1.57 0.00 0.00 0.00 179.25 181.46 1x9s h LYS 522 N 0.66 0.96 -0.41 0.00 -0.00 -1.79 0.46 116.57 116.45 1x9s h LYS 522 Ca 0.13 -0.28 -0.02 0.00 -0.00 0.00 0.00 60.65 60.48 1x9s h LYS 522 Cb 0.40 -0.10 -0.02 0.00 -0.00 0.00 0.00 32.23 32.51 1x9s h LYS 522 CO 0.02 0.94 0.17 1.79 -0.00 0.00 0.00 179.45 182.37 1x9s h THR 523 N 0.85 1.19 0.11 0.07 1.35 -1.34 -2.97 112.91 112.17 1x9s h THR 523 Ca 0.17 -0.57 0.01 0.00 -0.55 0.00 0.00 66.41 65.47 1x9s h THR 523 Cb 0.47 0.82 -0.03 0.00 -1.73 0.00 0.00 68.15 67.68 1x9s h THR 523 CO 0.02 0.21 -0.21 0.15 -0.25 0.00 0.00 175.52 175.44 1x9s h PHE 524 N 0.51 -0.55 0.69 4.73 3.57 0.64 -2.58 116.94 123.95 1x9s h PHE 524 Ca 0.14 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.62 1x9s h PHE 524 Cb 0.17 0.23 -0.00 0.00 2.79 0.00 0.00 35.95 39.13 1x9s h PHE 524 CO -0.00 -0.30 -0.44 0.97 -2.23 0.00 0.00 178.31 176.30 1x9s h ILE 525 N -0.39 0.00 -0.13 1.41 6.09 -0.07 0.38 117.51 124.80 1x9s h ILE 525 Ca 0.03 0.00 0.04 0.00 -1.37 0.00 0.00 64.86 63.55 1x9s h ILE 525 Cb 0.41 0.00 -0.01 0.00 0.47 0.00 0.00 36.82 37.70 1x9s h ILE 525 CO -0.12 0.00 0.23 1.88 -3.07 0.00 0.00 178.15 177.08 1x9s h TYR 526 N -1.07 0.00 0.04 2.19 0.05 -1.60 0.51 116.97 117.09 1x9s h TYR 526 Ca -0.09 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.59 1x9s h TYR 526 Cb 0.86 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.61 1x9s h TYR 526 CO -0.10 0.00 -0.42 0.78 -1.05 0.00 0.00 178.16 177.37 1x9s h GLY 527 N 0.00 0.24 1.79 3.88 0.00 -0.98 -2.38 103.07 105.62 1x9s h GLY 527 Ca 0.06 -0.50 0.02 0.00 0.00 0.00 0.00 47.33 46.91 1x9s h GLY 527 CO -0.00 0.44 0.08 -2.75 0.00 0.00 0.00 176.54 174.32 1x9s h PHE 528 N -0.50 0.00 0.11 5.60 3.04 0.42 -2.70 116.94 122.91 1x9s h PHE 528 Ca -0.06 0.00 -0.28 0.00 3.98 0.00 0.00 57.97 61.61 1x9s h PHE 528 Cb 1.24 0.00 -0.00 0.00 2.56 0.00 0.00 35.95 39.75 1x9s h PHE 528 CO 0.20 0.00 -1.41 -0.07 -2.02 0.00 0.00 178.31 175.01 1x9s h LEU 529 N 0.00 0.38 -6.05 0.59 3.38 -0.89 -3.38 115.31 109.33 1x9s h LEU 529 Ca 0.04 -0.85 -0.77 0.00 0.09 0.00 0.00 57.88 56.39 1x9s h LEU 529 Cb 0.20 -0.12 -0.18 0.00 0.09 0.00 0.00 40.66 40.65 1x9s h LEU 529 CO -0.00 1.62 1.86 -1.22 0.09 0.00 0.00 178.44 180.79 1x9s n TYR 530 N -3.93 2.65 0.00 1.13 0.53 -0.90 -4.82 117.16 111.83 1x9s n TYR 530 Ca -0.25 -2.73 0.00 0.00 -1.02 0.00 0.00 57.90 53.90 1x9s n TYR 530 Cb 0.90 -1.65 0.00 0.00 -1.03 0.00 0.00 39.34 37.56 1x9s n TYR 530 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1x9s n GLY 531 N 1.45 0.60 1.19 2.72 0.00 -1.22 -4.89 105.19 105.04 1x9s n GLY 531 Ca 0.51 0.55 0.16 0.00 0.00 0.00 0.00 46.02 47.24 1x9s n GLY 531 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x9s n ALA 532 N 5.99 -3.09 -2.21 4.61 0.00 -1.24 -4.56 120.51 120.02 1x9s n ALA 532 Ca 0.00 0.44 -0.09 0.00 0.00 0.00 0.00 53.44 53.79 1x9s n ALA 532 Cb 0.00 -1.11 -0.10 0.00 0.00 0.00 0.00 19.45 18.25 1x9s n ALA 532 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1x9s s GLY 533 N -6.44 0.77 0.22 0.00 0.00 -1.26 -5.02 107.32 95.58 1x9s s GLY 533 Ca 0.00 -1.31 -0.08 0.00 0.00 0.00 0.00 44.72 43.33 1x9s s GLY 533 CO 0.00 -1.28 1.70 -0.55 0.00 0.00 0.00 173.10 172.97 1x9s h ASP 534 N 2.90 -0.01 0.35 1.64 5.19 -1.92 0.77 116.42 125.34 1x9s h ASP 534 Ca -0.34 0.13 -0.00 0.00 -0.62 0.00 0.00 57.03 56.19 1x9s h ASP 534 Cb 1.19 0.18 -0.02 0.00 0.18 0.00 0.00 39.33 40.85 1x9s h ASP 534 CO 0.60 -0.01 -0.33 -0.33 -3.12 0.00 0.00 179.24 176.04 1x9s h GLU 535 N 0.26 -0.68 0.00 3.56 5.08 -1.77 0.25 114.58 121.29 1x9s h GLU 535 Ca 0.35 0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 58.70 1x9s h GLU 535 Cb 0.55 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.95 1x9s h GLU 535 CO -0.45 -0.45 -0.27 1.57 -1.00 0.00 0.00 179.01 178.41 1x9s h LYS 536 N -0.70 0.00 0.17 2.33 2.10 -1.68 0.34 116.57 119.12 1x9s h LYS 536 Ca -0.02 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.62 1x9s h LYS 536 Cb 0.63 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.97 1x9s h LYS 536 CO -0.05 0.27 -0.08 -0.84 -2.00 0.00 0.00 179.45 176.74 1x9s h ILE 537 N 0.00 0.94 0.00 0.07 -2.65 0.11 -2.72 117.51 113.27 1x9s h ILE 537 Ca -0.00 -0.57 -0.02 0.00 1.03 0.00 0.00 64.86 65.30 1x9s h ILE 537 Cb 0.48 1.29 -0.00 0.00 -2.05 0.00 0.00 36.82 36.53 1x9s h ILE 537 CO 0.04 0.13 -0.10 1.23 0.03 0.00 0.00 178.15 179.48 1x9s h GLY 538 N -0.51 0.00 1.06 0.16 0.00 -0.27 -2.53 103.07 100.98 1x9s h GLY 538 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.31 1x9s h GLY 538 CO 0.04 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.52 1x9s n GLN 539 N -3.22 0.46 0.01 4.80 6.02 0.12 -1.41 117.38 124.15 1x9s n GLN 539 Ca 0.01 0.01 -0.20 0.00 -0.01 0.00 0.00 57.00 56.81 1x9s n GLN 539 Cb 0.37 -1.50 -0.14 0.00 1.02 0.00 0.00 30.24 29.99 1x9s n GLN 539 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 1x9s h ILE 540 N 0.00 1.32 0.00 5.09 2.04 -1.39 -3.39 117.51 121.18 1x9s h ILE 540 Ca 0.00 -2.43 -0.01 0.00 1.00 0.00 0.00 64.86 63.42 1x9s h ILE 540 Cb 0.01 2.96 -0.00 0.00 -0.74 0.00 0.00 36.82 39.06 1x9s h ILE 540 CO 0.00 0.67 -0.05 -0.37 0.00 0.00 0.00 178.15 178.39 1x9s h VAL 541 N -0.48 0.70 0.00 1.67 -1.51 -1.66 -3.50 116.25 111.48 1x9s h VAL 541 Ca -0.20 -1.54 0.00 0.00 -1.23 0.00 0.00 66.70 63.73 1x9s h VAL 541 Cb 1.58 1.34 0.00 0.00 -2.13 0.00 0.00 31.29 32.08 1x9s h VAL 541 CO 0.07 0.24 0.00 0.61 -1.23 0.00 0.00 177.57 177.25 1x9s n GLY 542 N 1.70 3.32 0.21 5.19 0.00 -0.50 -5.07 105.19 110.04 1x9s n GLY 542 Ca -0.05 -0.04 -0.07 0.00 0.00 0.00 0.00 46.02 45.86 1x9s n GLY 542 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x9s h ALA 543 N 1.98 -0.63 0.00 4.61 0.00 -1.90 -3.21 119.26 120.11 1x9s h ALA 543 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1x9s h ALA 543 Cb 0.00 0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1x9s h ALA 543 CO 0.00 -0.59 0.00 0.41 0.00 0.00 0.00 179.25 179.07 1x9s n GLY 544 N 0.19 0.00 0.00 0.00 0.00 -1.26 -4.13 105.19 99.99 1x9s n GLY 544 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1x9s n GLY 544 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1x9s n LYS 545 N 0.00 0.00 0.27 1.61 4.76 -1.26 -2.24 118.16 121.30 1x9s n LYS 545 Ca 0.00 0.00 0.11 0.00 -2.87 0.00 0.00 58.31 55.55 1x9s n LYS 545 Cb 0.00 0.00 0.72 0.00 -1.84 0.00 0.00 35.03 33.91 1x9s n LYS 545 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 1x9s h GLU 546 N 0.00 0.00 0.00 1.97 4.39 -1.86 0.25 114.58 119.33 1x9s h GLU 546 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1x9s h GLU 546 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1x9s h GLU 546 CO 0.00 0.06 0.00 0.07 -1.16 0.00 0.00 179.01 177.98 1x9s h ARG 547 N 0.00 0.00 0.00 2.33 -0.00 -1.88 -0.53 114.38 114.31 1x9s h ARG 547 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.98 1x9s h ARG 547 Cb 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.10 1x9s h ARG 547 CO 0.01 0.00 0.00 0.41 -0.00 0.00 0.00 179.97 180.39 1x9s n GLY 548 N -0.92 -1.05 0.34 0.08 0.00 0.87 -2.69 105.19 101.82 1x9s n GLY 548 Ca -0.01 -0.05 0.07 0.00 0.00 0.00 0.00 46.02 46.02 1x9s n GLY 548 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1x9s h LYS 549 N 0.00 0.65 -0.93 1.61 1.79 -1.26 0.09 116.57 118.53 1x9s h LYS 549 Ca 0.00 -0.04 0.11 0.00 -2.18 0.00 0.00 60.65 58.54 1x9s h LYS 549 Cb 0.28 -0.15 -0.08 0.00 -1.58 0.00 0.00 32.23 30.70 1x9s h LYS 549 CO 0.00 0.43 0.56 1.05 -1.08 0.00 0.00 179.45 180.41 1x9s h GLU 550 N 0.67 0.86 -0.34 3.15 -0.00 -1.75 -0.57 114.58 116.60 1x9s h GLU 550 Ca 0.27 -0.05 -0.14 0.00 -0.00 0.00 0.00 59.36 59.45 1x9s h GLU 550 Cb 0.23 -0.19 -0.01 0.00 -0.00 0.00 0.00 28.75 28.77 1x9s h GLU 550 CO -0.08 0.57 -0.33 1.37 -0.00 0.00 0.00 179.01 180.54 1x9s h LEU 551 N 0.89 0.80 -0.17 3.06 8.10 -1.21 -2.41 115.31 124.37 1x9s h LEU 551 Ca 0.46 -0.34 0.00 0.00 0.11 0.00 0.00 57.88 58.11 1x9s h LEU 551 Cb 0.46 -0.22 0.00 0.00 -0.44 0.00 0.00 40.66 40.46 1x9s h LEU 551 CO -0.27 1.06 0.00 0.29 -4.11 0.00 0.00 178.44 175.42 1x9s n LYS 552 N -4.07 0.91 -0.04 0.17 4.76 -0.28 -2.63 118.16 116.97 1x9s n LYS 552 Ca -0.01 0.00 -0.05 0.00 -2.87 0.00 0.00 58.31 55.38 1x9s n LYS 552 Cb 0.50 -1.08 -0.04 0.00 -1.84 0.00 0.00 35.03 32.57 1x9s n LYS 552 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 1x9s n LYS 553 N -0.41 0.64 -0.23 1.97 0.00 -0.84 -4.36 118.16 114.94 1x9s n LYS 553 Ca 0.00 0.04 -0.09 0.00 -0.00 0.00 0.00 58.31 58.26 1x9s n LYS 553 Cb 0.04 -1.16 0.03 0.00 -0.00 0.00 0.00 35.03 33.94 1x9s n LYS 553 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.40 178.97 1x9s h LYS 554 N 0.00 1.09 0.26 -1.58 5.09 -1.27 -1.30 116.57 118.86 1x9s h LYS 554 Ca -0.17 -0.31 -0.01 0.00 0.09 0.00 0.00 60.65 60.24 1x9s h LYS 554 Cb 1.29 -0.12 -0.00 0.00 0.10 0.00 0.00 32.23 33.50 1x9s h LYS 554 CO -0.02 1.03 -0.16 0.35 -2.09 0.00 0.00 179.45 178.55 1x9s h PHE 555 N 1.00 -0.43 0.00 0.07 3.57 -1.67 0.17 116.94 119.66 1x9s h PHE 555 Ca 0.19 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.69 1x9s h PHE 555 Cb 0.49 0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.38 1x9s h PHE 555 CO 0.04 -0.24 0.16 1.28 -2.23 0.00 0.00 178.31 177.32 1x9s n LEU 556 N -3.23 0.41 0.08 0.59 4.77 -1.22 0.20 117.00 118.60 1x9s n LEU 556 Ca -0.05 0.63 -0.22 0.00 -0.03 0.00 0.00 56.01 56.35 1x9s n LEU 556 Cb 0.16 -0.63 -0.15 0.00 -2.33 0.00 0.00 43.42 40.47 1x9s n LEU 556 CO 0.11 -0.77 -0.46 -0.33 -1.33 0.00 0.00 177.39 174.61 1x9s h GLU 557 N 0.00 0.37 -0.19 3.23 5.08 -0.57 -3.31 114.58 119.19 1x9s h GLU 557 Ca 0.00 -0.64 0.00 0.00 -1.00 0.00 0.00 59.36 57.72 1x9s h GLU 557 Cb 0.33 0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.81 1x9s h GLU 557 CO 0.00 1.28 0.00 0.09 -1.00 0.00 0.00 179.01 179.38 1x9s n ASN 558 N -3.57 1.67 -3.17 1.42 3.02 0.13 -4.08 115.26 110.69 1x9s n ASN 558 Ca -0.22 -1.75 -0.18 0.00 -0.03 0.00 0.00 54.58 52.40 1x9s n ASN 558 Cb 1.07 -0.12 -0.03 0.00 -0.61 0.00 0.00 39.78 40.09 1x9s n ASN 558 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 1x9s n THR 559 N 0.33 -0.23 -0.07 3.41 -1.04 -0.13 -4.93 114.28 111.62 1x9s n THR 559 Ca 0.15 -4.36 0.25 0.00 -2.04 0.00 0.00 64.05 58.06 1x9s n THR 559 Cb 0.32 -0.39 0.65 0.00 -1.82 0.00 0.00 70.33 69.09 1x9s n THR 559 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 1x9s h PRO 560 N 3.13 0.00 -0.80 -2.82 0.13 -1.71 -2.33 132.00 127.61 1x9s h PRO 560 Ca 0.09 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.18 1x9s h PRO 560 Cb 0.96 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.06 1x9s h PRO 560 CO 0.48 0.00 0.37 0.00 -0.23 0.00 0.00 178.00 178.62 1x9s h ALA 561 N 1.17 1.03 -0.09 -0.56 0.00 -1.91 0.29 119.26 119.19 1x9s h ALA 561 Ca 0.35 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 1x9s h ALA 561 Cb 1.87 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 19.33 1x9s h ALA 561 CO -0.00 0.61 -0.20 0.82 0.00 0.00 0.00 179.25 180.48 1x9s h ILE 562 N 1.14 1.19 -0.13 0.00 2.04 -1.78 -0.21 117.51 119.76 1x9s h ILE 562 Ca 0.27 -0.86 -0.17 0.00 1.00 0.00 0.00 64.86 65.10 1x9s h ILE 562 Cb 0.14 1.34 0.01 0.00 -0.74 0.00 0.00 36.82 37.57 1x9s h ILE 562 CO -0.03 0.26 -0.59 0.00 0.00 0.00 0.00 178.15 177.79 1x9s h ALA 563 N 1.67 0.25 -0.37 1.87 0.00 -1.45 -2.10 119.26 119.14 1x9s h ALA 563 Ca 0.03 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1x9s h ALA 563 Cb 0.43 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1x9s h ALA 563 CO 0.03 0.50 0.24 0.00 0.00 0.00 0.00 179.25 180.01 1x9s h ALA 564 N 0.51 0.46 -0.13 0.00 0.00 -0.56 -1.51 119.26 118.04 1x9s h ALA 564 Ca -0.04 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 54.88 1x9s h ALA 564 Cb 1.23 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.83 1x9s h ALA 564 CO 0.12 -0.07 -0.12 1.25 0.00 0.00 0.00 179.25 180.44 1x9s h LEU 565 N 0.49 -0.37 -0.27 0.00 5.85 -1.01 -0.38 115.31 119.61 1x9s h LEU 565 Ca 0.13 0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.96 1x9s h LEU 565 Cb -0.04 0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.15 1x9s h LEU 565 CO -0.03 -0.16 0.09 0.03 -0.34 0.00 0.00 178.44 178.03 1x9s h ARG 566 N -0.14 0.20 -0.50 1.25 3.08 -1.16 -0.69 114.38 116.43 1x9s h ARG 566 Ca 0.09 -0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.18 1x9s h ARG 566 Cb 0.27 -0.05 -0.05 0.00 0.08 0.00 0.00 29.97 30.22 1x9s h ARG 566 CO -0.22 0.13 0.22 0.93 -1.07 0.00 0.00 179.97 179.97 1x9s h GLU 567 N 0.21 0.42 -0.43 0.04 4.39 -0.81 -1.43 114.58 116.97 1x9s h GLU 567 Ca 0.12 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.78 1x9s h GLU 567 Cb 0.09 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.63 1x9s h GLU 567 CO -0.13 0.28 0.22 0.66 -1.16 0.00 0.00 179.01 178.87 1x9s h SER 568 N 0.43 0.55 -0.72 1.42 4.64 -0.64 -1.86 113.55 117.38 1x9s h SER 568 Ca 0.23 -0.11 0.06 0.00 -0.47 0.00 0.00 61.79 61.50 1x9s h SER 568 Cb 0.19 -0.14 -0.06 0.00 -0.31 0.00 0.00 62.40 62.08 1x9s h SER 568 CO -0.19 0.51 0.41 0.40 -0.87 0.00 0.00 176.83 177.09 1x9s h ILE 569 N 0.55 0.98 -0.13 0.95 2.04 -0.64 -2.25 117.51 119.02 1x9s h ILE 569 Ca 0.15 -0.26 0.03 0.00 1.00 0.00 0.00 64.86 65.78 1x9s h ILE 569 Cb 0.10 0.16 -0.03 0.00 -0.74 0.00 0.00 36.82 36.30 1x9s h ILE 569 CO -0.02 0.14 -0.08 1.56 0.00 0.00 0.00 178.15 179.74 1x9s h GLN 570 N 0.75 -0.08 -0.65 2.37 1.08 -0.83 -0.99 115.11 116.76 1x9s h GLN 570 Ca 0.32 0.01 0.18 0.00 -1.45 0.00 0.00 58.65 57.70 1x9s h GLN 570 Cb 0.19 0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 27.61 1x9s h GLN 570 CO -0.18 -0.05 0.46 1.96 -0.95 0.00 0.00 178.83 180.06 1x9s h GLN 571 N -0.09 0.06 -0.35 1.46 1.08 -0.80 0.33 115.11 116.80 1x9s h GLN 571 Ca 0.08 -0.00 -0.16 0.00 -1.45 0.00 0.00 58.65 57.11 1x9s h GLN 571 Cb 0.20 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.61 1x9s h GLN 571 CO -0.18 0.04 -0.42 1.15 -0.95 0.00 0.00 178.83 178.47 1x9s h THR 572 N 0.06 1.28 0.00 -0.54 2.02 -0.65 -3.41 112.91 111.67 1x9s h THR 572 Ca 0.31 -1.59 -0.14 0.00 0.77 0.00 0.00 66.41 65.76 1x9s h THR 572 Cb 1.14 1.44 -0.02 0.00 -1.74 0.00 0.00 68.15 68.98 1x9s h THR 572 CO -0.02 0.53 -1.46 0.18 0.37 0.00 0.00 175.52 175.12 1x9s n LEU 573 N -4.04 1.94 -4.84 2.58 4.77 0.20 -4.06 117.00 113.56 1x9s n LEU 573 Ca -0.02 0.33 -0.34 0.00 -0.03 0.00 0.00 56.01 55.95 1x9s n LEU 573 Cb 0.56 -0.76 -0.06 0.00 -2.33 0.00 0.00 43.42 40.82 1x9s n LEU 573 CO 0.49 -0.02 0.43 -0.69 -1.33 0.00 0.00 177.39 176.27 1x9s s VAL 574 N -2.79 4.62 0.00 4.08 1.01 0.91 0.17 120.40 128.39 1x9s s VAL 574 Ca -0.32 1.10 0.00 0.00 0.00 0.00 0.00 61.98 62.76 1x9s s VAL 574 Cb 0.07 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.75 1x9s s VAL 574 CO 0.45 -0.06 0.00 1.21 0.00 0.00 0.00 175.10 176.70 1x9s n GLU 575 N -0.01 0.69 -1.76 2.72 2.13 -1.26 -4.55 120.64 118.61 1x9s n GLU 575 Ca 0.02 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.84 1x9s n GLU 575 Cb 0.52 -0.12 0.00 0.00 0.27 0.00 0.00 31.44 32.11 1x9s n GLU 575 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1x9s n LYS 587 N -0.27 -3.82 -4.21 5.31 3.00 -1.26 -5.00 118.16 111.92 1x9s n LYS 587 Ca 0.00 2.88 -0.28 0.00 -0.00 0.00 0.00 58.31 60.91 1x9s n LYS 587 Cb 0.00 -3.21 -0.09 0.00 0.00 0.00 0.00 35.03 31.73 1x9s n LYS 587 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.40 175.82 1x9s s TRP 588 N -0.39 2.81 -0.09 5.64 0.52 -1.26 -4.99 118.94 121.18 1x9s s TRP 588 Ca 0.00 -0.13 0.08 0.00 0.02 0.00 0.00 56.10 56.07 1x9s s TRP 588 Cb 0.00 -1.41 -0.24 0.00 -1.15 0.00 0.00 33.47 30.67 1x9s s TRP 588 CO 0.00 0.48 0.48 1.17 0.02 0.00 0.00 176.95 179.10 1x9s n LYS 589 N 0.27 0.67 -3.68 4.98 4.81 0.44 -4.91 118.16 120.74 1x9s n LYS 589 Ca -0.11 0.24 -0.14 0.00 -0.87 0.00 0.00 58.31 57.44 1x9s n LYS 589 Cb 0.54 -1.73 -0.09 0.00 0.02 0.00 0.00 35.03 33.77 1x9s n LYS 589 CO 0.00 0.00 0.00 0.50 1.17 0.00 0.00 177.40 179.07 1x9s s ARG 590 N -2.57 0.65 0.00 1.64 3.52 -1.10 -5.03 118.95 116.06 1x9s s ARG 590 Ca -0.11 0.74 0.23 0.00 -0.13 0.00 0.00 55.73 56.46 1x9s s ARG 590 Cb 0.07 0.32 0.55 0.00 -1.56 0.00 0.00 34.95 34.33 1x9s s ARG 590 CO 0.80 -0.08 1.48 -2.13 -0.81 0.00 0.00 175.30 174.56 1x9s n ARG 591 N 2.72 2.63 -4.20 5.12 3.00 -1.26 -4.50 116.66 120.16 1x9s n ARG 591 Ca -0.14 -2.50 -0.12 0.00 -0.00 0.00 0.00 57.85 55.10 1x9s n ARG 591 Cb 0.56 -1.55 -0.10 0.00 0.00 0.00 0.00 32.46 31.37 1x9s n ARG 591 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.63 179.30 1x9s s TRP 592 N -1.23 1.11 0.16 -0.14 1.48 -1.26 -1.75 118.94 117.31 1x9s s TRP 592 Ca 0.45 -1.25 0.10 0.00 -1.06 0.00 0.00 56.10 54.34 1x9s s TRP 592 Cb 0.24 -0.60 -0.04 0.00 -1.16 0.00 0.00 33.47 31.92 1x9s s TRP 592 CO 0.33 -0.50 -0.21 0.42 -4.06 0.00 0.00 176.95 172.93 1x9s s ILE 593 N -4.00 2.56 -0.36 0.66 -1.09 -0.74 -4.87 121.20 113.37 1x9s s ILE 593 Ca 0.31 -1.79 -0.19 0.00 -2.23 0.00 0.00 60.65 56.76 1x9s s ILE 593 Cb 0.07 -2.20 0.00 0.00 -1.58 0.00 0.00 42.46 38.75 1x9s s ILE 593 CO 0.07 -0.01 0.55 -0.75 -1.23 0.00 0.00 174.94 173.57 1x9s s LYS 594 N -2.41 3.58 1.05 2.79 2.20 -1.26 0.78 119.74 126.46 1x9s s LYS 594 Ca 0.19 -0.15 -0.15 0.00 -0.36 0.00 0.00 55.97 55.50 1x9s s LYS 594 Cb -0.09 -3.83 0.21 0.00 -1.51 0.00 0.00 37.83 32.61 1x9s s LYS 594 CO 0.10 -0.71 1.12 0.20 -0.36 0.00 0.00 175.35 175.70 1x9s s GLY 595 N 1.79 1.58 0.65 5.54 0.00 -0.41 -4.86 107.32 111.61 1x9s s GLY 595 Ca 0.20 -0.63 0.38 0.00 0.00 0.00 0.00 44.72 44.67 1x9s s GLY 595 CO 0.14 0.07 2.24 1.41 0.00 0.00 0.00 173.10 176.96 1x9s h LEU 596 N -2.03 0.00 -3.21 0.66 3.38 -1.90 -0.91 115.31 111.31 1x9s h LEU 596 Ca -0.51 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.46 1x9s h LEU 596 Cb 1.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.07 1x9s h LEU 596 CO 0.50 0.00 0.00 -0.90 0.09 0.00 0.00 178.44 178.13 1x9s n ASP 597 N -3.22 4.03 0.00 -0.43 5.68 -1.26 -4.98 116.55 116.37 1x9s n ASP 597 Ca -0.02 -2.73 0.00 0.00 -0.50 0.00 0.00 54.79 51.53 1x9s n ASP 597 Cb 0.16 -0.50 0.00 0.00 -1.14 0.00 0.00 41.12 39.64 1x9s n ASP 597 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1x9s n GLY 598 N 0.03 3.10 3.57 6.12 0.00 -0.35 -3.06 105.19 114.61 1x9s n GLY 598 Ca 0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.91 1x9s n GLY 598 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1x9s n ARG 599 N -1.43 -0.41 -3.11 1.61 1.85 -1.26 -4.53 116.66 109.37 1x9s n ARG 599 Ca 0.00 -0.06 -0.38 0.00 -1.00 0.00 0.00 57.85 56.41 1x9s n ARG 599 Cb 0.00 -2.18 -0.06 0.00 -1.05 0.00 0.00 32.46 29.17 1x9s n ARG 599 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 1x9s s LYS 600 N -4.25 4.35 -0.35 2.89 1.02 -1.26 -1.29 119.74 120.85 1x9s s LYS 600 Ca 0.63 0.93 0.01 0.00 0.02 0.00 0.00 55.97 57.57 1x9s s LYS 600 Cb -0.22 -3.11 0.11 0.00 -0.52 0.00 0.00 37.83 34.08 1x9s s LYS 600 CO 0.62 0.53 0.11 0.08 -0.92 0.00 0.00 175.35 175.76 1x9s s VAL 601 N -1.28 1.49 0.10 3.17 1.01 0.23 -4.87 120.40 120.25 1x9s s VAL 601 Ca 0.37 -1.95 -0.36 0.00 0.00 0.00 0.00 61.98 60.04 1x9s s VAL 601 Cb -0.20 -2.10 -0.17 0.00 0.00 0.00 0.00 36.38 33.91 1x9s s VAL 601 CO 0.22 -0.68 1.15 1.57 0.00 0.00 0.00 175.10 177.36 1x9s n HIS 602 N 4.41 1.06 -3.71 5.22 -0.00 -1.26 -1.79 115.22 119.15 1x9s n HIS 602 Ca 0.02 0.79 -0.38 0.00 0.46 0.00 0.00 57.72 58.60 1x9s n HIS 602 Cb 0.41 -2.22 -0.12 0.00 -0.12 0.00 0.00 29.99 27.93 1x9s n HIS 602 CO 0.00 0.00 0.00 0.08 0.46 0.00 0.00 176.34 176.88 1x9s s VAL 603 N 0.03 4.06 0.03 3.57 1.01 -0.71 -4.87 120.40 123.51 1x9s s VAL 603 Ca 0.81 -0.95 -0.28 0.00 0.00 0.00 0.00 61.98 61.55 1x9s s VAL 603 Cb -1.00 -3.25 -0.16 0.00 0.00 0.00 0.00 36.38 31.97 1x9s s VAL 603 CO 0.52 -0.14 1.22 0.03 0.00 0.00 0.00 175.10 176.73 1x9s h ARG 604 N 8.29 -0.98 -4.94 2.72 3.08 -1.92 -3.45 114.38 117.17 1x9s h ARG 604 Ca -0.26 0.07 -0.47 0.00 0.07 0.00 0.00 59.98 59.39 1x9s h ARG 604 Cb 1.10 0.22 -0.30 0.00 0.08 0.00 0.00 29.97 31.07 1x9s h ARG 604 CO 0.62 -0.65 -0.80 -1.54 -1.07 0.00 0.00 179.97 176.52 1x9s s SER 605 N -4.15 1.54 0.56 7.04 1.04 -1.26 -5.01 113.70 113.45 1x9s s SER 605 Ca -0.15 -0.24 0.32 0.00 0.48 0.00 0.00 55.95 56.36 1x9s s SER 605 Cb 0.01 -0.34 1.47 0.00 0.10 0.00 0.00 66.02 67.26 1x9s s SER 605 CO 0.45 0.12 1.83 -0.65 0.98 0.00 0.00 173.24 175.96 1x9s h PRO 606 N 6.18 0.00 -0.09 4.02 0.11 -2.01 0.24 132.00 140.44 1x9s h PRO 606 Ca -0.33 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.70 1x9s h PRO 606 Cb 1.17 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 1x9s h PRO 606 CO 0.49 0.00 -0.32 0.45 -0.21 0.00 0.00 178.00 178.41 1x9s h HIS 607 N 0.00 0.20 -0.50 0.65 -0.00 -2.00 -2.96 115.15 110.54 1x9s h HIS 607 Ca 0.40 -0.04 0.00 0.00 -0.00 0.00 0.00 60.37 60.73 1x9s h HIS 607 Cb 1.78 -0.05 0.00 0.00 -0.00 0.00 0.00 27.41 29.14 1x9s h HIS 607 CO 0.00 0.48 0.00 0.00 -0.00 0.00 0.00 177.93 178.41 1x9s n ALA 608 N -2.48 2.95 -0.04 2.45 0.00 0.81 -4.65 120.51 119.55 1x9s n ALA 608 Ca -0.01 -1.70 -0.09 0.00 0.00 0.00 0.00 53.44 51.64 1x9s n ALA 608 Cb 0.40 -0.84 -0.03 0.00 0.00 0.00 0.00 19.45 18.98 1x9s n ALA 608 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1x9s h ALA 609 N 3.19 0.17 -0.97 0.00 0.00 -1.33 0.52 119.26 120.84 1x9s h ALA 609 Ca 0.00 0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.00 1x9s h ALA 609 Cb 1.35 0.08 -0.06 0.00 0.00 0.00 0.00 17.79 19.17 1x9s h ALA 609 CO 0.20 -0.43 0.64 1.25 0.00 0.00 0.00 179.25 180.91 1x9s h LEU 610 N 0.07 1.05 -0.21 0.00 5.85 -1.83 -0.68 115.31 119.56 1x9s h LEU 610 Ca 0.09 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 1x9s h LEU 610 Cb 0.11 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.89 1x9s h LEU 610 CO -0.15 0.71 0.09 -1.13 -0.34 0.00 0.00 178.44 177.63 1x9s h ASN 611 N 1.21 0.29 -0.47 1.25 -0.73 -1.72 -0.83 115.58 114.58 1x9s h ASN 611 Ca 0.39 -0.14 0.03 0.00 1.87 0.00 0.00 56.30 58.44 1x9s h ASN 611 Cb 0.02 -0.07 -0.03 0.00 0.27 0.00 0.00 38.32 38.50 1x9s h ASN 611 CO -0.12 0.35 0.27 0.74 -0.37 0.00 0.00 177.43 178.30 1x9s h THR 612 N 0.20 1.02 0.01 -3.57 2.02 -0.24 0.14 112.91 112.50 1x9s h THR 612 Ca 0.07 -0.18 0.02 0.00 0.77 0.00 0.00 66.41 67.09 1x9s h THR 612 Cb 0.15 0.44 -0.03 0.00 -1.74 0.00 0.00 68.15 66.97 1x9s h THR 612 CO -0.01 0.10 -0.14 0.25 0.37 0.00 0.00 175.52 176.09 1x9s h LEU 613 N 0.53 -0.41 -0.06 2.58 5.85 -0.91 -0.43 115.31 122.45 1x9s h LEU 613 Ca 0.20 0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.97 1x9s h LEU 613 Cb 0.05 0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.25 1x9s h LEU 613 CO -0.11 -0.20 0.03 -0.07 -0.34 0.00 0.00 178.44 177.75 1x9s h LEU 614 N -0.25 0.09 -0.70 2.25 3.38 -0.78 -1.17 115.31 118.13 1x9s h LEU 614 Ca 0.04 -0.16 0.01 0.00 0.09 0.00 0.00 57.88 57.86 1x9s h LEU 614 Cb 0.30 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 40.99 1x9s h LEU 614 CO -0.13 0.22 0.46 -0.61 0.09 0.00 0.00 178.44 178.48 1x9s h GLN 615 N -0.05 0.93 -0.46 1.13 4.15 -0.92 -1.12 115.11 118.76 1x9s h GLN 615 Ca 0.02 -0.06 -0.03 0.00 0.77 0.00 0.00 58.65 59.35 1x9s h GLN 615 Cb 0.16 -0.21 -0.02 0.00 0.21 0.00 0.00 27.48 27.62 1x9s h GLN 615 CO -0.00 0.62 0.15 1.03 -1.93 0.00 0.00 178.83 178.69 1x9s h SER 616 N 0.95 0.62 0.44 -0.69 0.87 -0.93 0.26 113.55 115.08 1x9s h SER 616 Ca 0.26 -0.08 -0.02 0.00 -1.23 0.00 0.00 61.79 60.71 1x9s h SER 616 Cb -0.11 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 61.70 1x9s h SER 616 CO -0.06 0.59 -0.21 0.00 -0.53 0.00 0.00 176.83 176.62 1x9s h ALA 617 N 1.50 -0.60 -0.97 6.23 0.00 -0.57 -0.98 119.26 123.88 1x9s h ALA 617 Ca 0.16 -0.19 0.15 0.00 0.00 0.00 0.00 54.91 55.03 1x9s h ALA 617 Cb 0.19 0.23 -0.10 0.00 0.00 0.00 0.00 17.79 18.12 1x9s h ALA 617 CO -0.01 -0.65 0.58 0.78 0.00 0.00 0.00 179.25 179.95 1x9s h GLY 618 N -0.96 1.64 0.58 0.00 0.00 -1.02 0.96 103.07 104.28 1x9s h GLY 618 Ca -0.06 -0.36 -0.03 0.00 0.00 0.00 0.00 47.33 46.88 1x9s h GLY 618 CO 0.10 0.03 -0.34 0.00 0.00 0.00 0.00 176.54 176.33 1x9s h ALA 619 N 1.58 -1.18 0.00 3.60 0.00 -0.34 -0.99 119.26 121.93 1x9s h ALA 619 Ca 0.52 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 1x9s h ALA 619 Cb 0.68 0.43 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 1x9s h ALA 619 CO -0.33 -1.14 -0.03 -0.07 0.00 0.00 0.00 179.25 177.68 1x9s h LEU 620 N -0.86 0.00 -0.37 0.00 3.38 -0.77 -1.11 115.31 115.59 1x9s h LEU 620 Ca -0.08 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.78 1x9s h LEU 620 Cb 0.68 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 1x9s h LEU 620 CO 0.09 0.03 -0.19 0.40 0.09 0.00 0.00 178.44 178.86 1x9s h ILE 621 N 0.00 1.28 0.00 1.22 2.04 -0.64 -2.00 117.51 119.42 1x9s h ILE 621 Ca -0.00 -1.32 -0.02 0.00 1.00 0.00 0.00 64.86 64.51 1x9s h ILE 621 Cb 0.05 1.34 -0.00 0.00 -0.74 0.00 0.00 36.82 37.47 1x9s h ILE 621 CO 0.00 0.44 -0.12 0.00 0.00 0.00 0.00 178.15 178.47 1x9s h LYS 623 N 0.00 -0.05 0.00 0.00 3.64 -1.08 -2.17 116.57 116.91 1x9s h LYS 623 Ca -0.00 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 1x9s h LYS 623 Cb 0.78 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.61 1x9s h LYS 623 CO 0.02 0.53 -0.06 1.25 -2.27 0.00 0.00 179.45 178.92 1x9s h LEU 624 N -0.94 0.00 0.20 5.20 7.12 -1.41 -2.34 115.31 123.13 1x9s h LEU 624 Ca -0.01 0.00 -0.01 0.00 0.13 0.00 0.00 57.88 57.99 1x9s h LEU 624 Cb 0.61 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.75 1x9s h LEU 624 CO 0.01 0.06 -0.10 -0.25 -0.13 0.00 0.00 178.44 178.03 1x9s h TRP 625 N 0.00 -0.25 0.00 1.25 7.01 -1.27 -0.92 115.95 121.78 1x9s h TRP 625 Ca -0.00 -0.01 0.00 0.00 2.11 0.00 0.00 58.89 60.99 1x9s h TRP 625 Cb 0.18 0.08 0.00 0.00 -2.10 0.00 0.00 29.16 27.33 1x9s h TRP 625 CO 0.00 0.16 0.00 -0.84 -2.79 0.00 0.00 178.44 174.97 1x9s h ILE 626 N -0.84 0.00 0.07 2.65 3.07 -1.24 -0.16 117.51 121.05 1x9s h ILE 626 Ca -0.03 -0.28 -0.00 0.00 1.55 0.00 0.00 64.86 66.10 1x9s h ILE 626 Cb 0.52 1.20 0.00 0.00 -0.27 0.00 0.00 36.82 38.27 1x9s h ILE 626 CO 0.04 0.00 -0.03 0.40 -1.05 0.00 0.00 178.15 177.51 1x9s h ILE 627 N 0.00 1.07 -0.44 0.16 2.04 -1.40 -3.12 117.51 115.83 1x9s h ILE 627 Ca 0.00 -1.53 -0.02 0.00 1.00 0.00 0.00 64.86 64.31 1x9s h ILE 627 Cb 0.30 1.91 -0.02 0.00 -0.74 0.00 0.00 36.82 38.27 1x9s h ILE 627 CO 0.00 0.32 0.20 0.50 0.00 0.00 0.00 178.15 179.17 1x9s h LYS 628 N -0.91 0.61 0.06 2.37 1.63 -0.82 -2.29 116.57 117.22 1x9s h LYS 628 Ca -0.01 -0.07 -0.00 0.00 -0.85 0.00 0.00 60.65 59.72 1x9s h LYS 628 Cb 0.60 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 32.11 1x9s h LYS 628 CO 0.01 0.48 -0.03 1.15 -3.45 0.00 0.00 179.45 177.62 1x9s h THR 629 N 0.61 0.96 -0.26 1.00 2.02 -1.12 -0.94 112.91 115.19 1x9s h THR 629 Ca 0.15 -0.08 -0.07 0.00 0.77 0.00 0.00 66.41 67.19 1x9s h THR 629 Cb 0.08 1.01 -0.01 0.00 -1.74 0.00 0.00 68.15 67.49 1x9s h THR 629 CO -0.02 0.02 -0.15 -0.08 0.37 0.00 0.00 175.52 175.66 1x9s h GLU 630 N -0.12 0.45 -0.27 6.66 4.22 -1.44 -1.05 114.58 123.03 1x9s h GLU 630 Ca -0.01 -0.13 -0.04 0.00 0.08 0.00 0.00 59.36 59.26 1x9s h GLU 630 Cb 0.10 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1x9s h GLU 630 CO 0.01 0.59 0.03 1.49 -2.18 0.00 0.00 179.01 178.96 1x9s h GLU 631 N 0.41 0.46 -0.19 1.92 4.81 -1.15 -1.20 114.58 119.65 1x9s h GLU 631 Ca 0.08 -0.13 -0.05 0.00 -0.13 0.00 0.00 59.36 59.12 1x9s h GLU 631 Cb 0.51 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.83 1x9s h GLU 631 CO 0.03 0.59 -0.11 0.52 -0.73 0.00 0.00 179.01 179.31 1x9s h MET 632 N 0.27 0.29 -0.30 1.92 2.86 -0.87 0.50 114.93 119.61 1x9s h MET 632 Ca 0.08 -0.07 -0.17 0.00 -2.06 0.00 0.00 59.70 57.48 1x9s h MET 632 Cb 0.36 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 31.98 1x9s h MET 632 CO 0.01 0.42 -0.50 -0.07 1.06 0.00 0.00 176.91 177.83 1x9s h LEU 633 N 0.28 0.92 -0.82 1.22 3.38 -0.99 -2.57 115.31 116.73 1x9s h LEU 633 Ca 0.06 -0.47 -0.12 0.00 0.09 0.00 0.00 57.88 57.44 1x9s h LEU 633 Cb 0.37 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1x9s h LEU 633 CO 0.02 1.25 -0.56 0.58 0.09 0.00 0.00 178.44 179.82 1x9s h VAL 634 N 0.66 1.33 0.00 1.22 2.07 -0.64 -2.48 116.25 118.41 1x9s h VAL 634 Ca 0.03 -1.96 0.00 0.00 0.82 0.00 0.00 66.70 65.58 1x9s h VAL 634 Cb 1.09 2.08 0.00 0.00 -1.52 0.00 0.00 31.29 32.94 1x9s h VAL 634 CO 0.11 0.55 0.00 -1.84 0.02 0.00 0.00 177.57 176.41 1x9s n GLU 635 N -3.77 0.01 0.00 1.57 0.28 0.12 -2.68 120.64 116.17 1x9s n GLU 635 Ca -0.01 0.01 0.12 0.00 -0.16 0.00 0.00 57.16 57.12 1x9s n GLU 635 Cb 0.58 -1.51 0.28 0.00 1.43 0.00 0.00 31.44 32.22 1x9s n GLU 635 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1x9s n LYS 636 N -1.53 0.52 0.00 3.44 5.02 -0.95 -4.95 118.16 119.70 1x9s n LYS 636 Ca 0.07 -0.33 0.00 0.00 -2.02 0.00 0.00 58.31 56.03 1x9s n LYS 636 Cb 0.34 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.86 1x9s n LYS 636 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1x9s n GLY 637 N 1.41 1.43 3.70 0.72 0.00 -1.09 -5.09 105.19 106.27 1x9s n GLY 637 Ca 0.09 -0.23 -0.43 0.00 0.00 0.00 0.00 46.02 45.45 1x9s n GLY 637 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1x9s n LEU 638 N 0.00 3.57 -4.79 0.99 4.32 -1.08 -4.97 117.00 115.05 1x9s n LEU 638 Ca 0.00 1.18 -0.36 0.00 -0.02 0.00 0.00 56.01 56.81 1x9s n LEU 638 Cb 0.00 -1.49 -0.07 0.00 -1.62 0.00 0.00 43.42 40.24 1x9s n LEU 638 CO 0.00 -0.38 -0.21 -0.75 -1.22 0.00 0.00 177.39 174.83 1x9s s LYS 639 N -1.28 3.46 -0.44 3.23 2.20 -1.26 -4.11 119.74 121.54 1x9s s LYS 639 Ca 0.60 -0.23 -0.22 0.00 -0.36 0.00 0.00 55.97 55.76 1x9s s LYS 639 Cb -0.58 -3.12 0.02 0.00 -1.51 0.00 0.00 37.83 32.65 1x9s s LYS 639 CO 0.57 0.66 0.74 -1.58 -0.36 0.00 0.00 175.35 175.37 1x9s s HIS 640 N -0.71 3.02 0.00 4.03 5.65 -1.26 -0.71 115.29 125.31 1x9s s HIS 640 Ca 0.13 0.11 0.00 0.00 0.25 0.00 0.00 55.06 55.55 1x9s s HIS 640 Cb -0.12 -3.54 0.00 0.00 -1.18 0.00 0.00 32.58 27.74 1x9s s HIS 640 CO 0.03 -0.93 0.00 0.41 -0.65 0.00 0.00 174.74 173.59 1x9s n GLY 641 N 4.98 2.98 0.18 1.59 0.00 0.81 -4.83 105.19 110.90 1x9s n GLY 641 Ca 0.01 -1.21 0.14 0.00 0.00 0.00 0.00 46.02 44.96 1x9s n GLY 641 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1x9s h TRP 642 N 0.00 0.00 -0.57 1.61 4.06 -1.93 -0.67 115.95 118.46 1x9s h TRP 642 Ca 0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 1x9s h TRP 642 Cb 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.16 1x9s h TRP 642 CO 0.00 0.00 0.00 -0.40 -3.56 0.00 0.00 178.44 174.48 1x9s n ASP 643 N -2.59 3.76 0.00 -3.49 5.75 -1.26 -4.63 116.55 114.08 1x9s n ASP 643 Ca 0.02 -2.24 0.00 0.00 -0.01 0.00 0.00 54.79 52.57 1x9s n ASP 643 Cb 0.31 -0.48 0.00 0.00 -1.03 0.00 0.00 41.12 39.92 1x9s n ASP 643 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1x9s n GLY 644 N 1.17 2.53 0.00 6.12 0.00 -0.26 -5.06 105.19 109.70 1x9s n GLY 644 Ca 0.21 -0.13 -0.00 0.00 0.00 0.00 0.00 46.02 46.10 1x9s n GLY 644 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1x9s n ASP 645 N 0.00 4.50 -4.09 1.61 8.00 0.11 -4.87 116.55 121.82 1x9s n ASP 645 Ca 0.00 -0.00 -0.09 0.00 0.71 0.00 0.00 54.79 55.41 1x9s n ASP 645 Cb 0.00 0.29 -0.10 0.00 -0.02 0.00 0.00 41.12 41.29 1x9s n ASP 645 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1x9s s PHE 646 N -2.01 0.59 -0.13 1.24 -0.71 -0.95 -0.85 117.98 115.15 1x9s s PHE 646 Ca -0.00 -0.87 -0.05 0.00 -1.04 0.00 0.00 56.93 54.96 1x9s s PHE 646 Cb 0.00 -0.39 0.06 0.00 -1.21 0.00 0.00 43.02 41.49 1x9s s PHE 646 CO 0.02 -0.26 0.27 0.00 -1.34 0.00 0.00 175.22 173.91 1x9s s ALA 647 N -3.14 -0.59 0.15 1.99 0.00 0.71 -0.14 121.76 120.74 1x9s s ALA 647 Ca 0.02 0.98 -0.31 0.00 0.00 0.00 0.00 51.96 52.65 1x9s s ALA 647 Cb 0.02 -1.00 -0.09 0.00 0.00 0.00 0.00 23.12 22.05 1x9s s ALA 647 CO -0.06 -0.60 1.49 0.71 0.00 0.00 0.00 175.76 177.30 1x9s s TYR 648 N 2.31 3.14 -0.10 0.00 1.51 -1.26 -0.38 117.35 122.56 1x9s s TYR 648 Ca -0.00 0.78 0.05 0.00 -1.01 0.00 0.00 57.07 56.89 1x9s s TYR 648 Cb -0.12 -3.82 -0.10 0.00 -0.11 0.00 0.00 41.96 37.81 1x9s s TYR 648 CO -0.09 -2.95 -0.03 -1.33 -1.11 0.00 0.00 175.55 170.04 1x9s n MET 649 N 3.91 1.56 -3.53 -0.62 2.81 -0.66 -4.57 117.12 116.02 1x9s n MET 649 Ca 0.13 0.03 -0.12 0.00 -1.81 0.00 0.00 57.70 55.92 1x9s n MET 649 Cb 0.40 -1.24 -0.04 0.00 -0.71 0.00 0.00 33.22 31.63 1x9s n MET 649 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1x9s s ALA 650 N -2.23 -1.84 -0.22 3.04 0.00 -1.17 -4.52 121.76 114.82 1x9s s ALA 650 Ca -0.09 1.30 -0.03 0.00 0.00 0.00 0.00 51.96 53.14 1x9s s ALA 650 Cb 0.03 -0.15 0.07 0.00 0.00 0.00 0.00 23.12 23.08 1x9s s ALA 650 CO 0.34 -0.45 0.07 -0.46 0.00 0.00 0.00 175.76 175.26 1x9s s TRP 651 N -1.83 0.78 -0.89 0.00 -0.00 -1.26 -1.43 118.94 114.32 1x9s s TRP 651 Ca -0.02 -0.82 -0.01 0.00 -0.00 0.00 0.00 56.10 55.26 1x9s s TRP 651 Cb -0.01 -1.00 0.25 0.00 -0.00 0.00 0.00 33.47 32.72 1x9s s TRP 651 CO -0.00 -0.65 0.94 0.28 -0.00 0.00 0.00 176.95 177.52 1x9s n VAL 652 N 5.12 3.41 0.00 5.86 0.31 0.72 -4.95 118.33 128.80 1x9s n VAL 652 Ca -0.07 -5.33 0.00 0.00 -0.01 0.00 0.00 64.34 58.93 1x9s n VAL 652 Cb 0.46 -2.25 0.00 0.00 -0.91 0.00 0.00 33.84 31.14 1x9s n VAL 652 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1x9s n HIS 653 N 1.76 0.00 -0.55 3.52 8.25 -1.26 -3.09 115.22 123.84 1x9s n HIS 653 Ca 0.25 0.00 0.10 0.00 -0.26 0.00 0.00 57.72 57.81 1x9s n HIS 653 Cb 0.37 0.00 0.34 0.00 1.12 0.00 0.00 29.99 31.82 1x9s n HIS 653 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 1x9s n ASP 654 N 2.78 4.48 -3.77 0.41 5.75 -1.26 -4.81 116.55 120.13 1x9s n ASP 654 Ca 0.00 -2.32 -0.12 0.00 -0.01 0.00 0.00 54.79 52.34 1x9s n ASP 654 Cb 0.00 -0.54 -0.08 0.00 -1.03 0.00 0.00 41.12 39.47 1x9s n ASP 654 CO 0.00 0.00 0.00 -0.70 -0.11 0.00 0.00 177.20 176.39 1x9s s GLU 655 N -1.61 0.72 0.08 0.11 2.12 -1.18 -0.89 118.70 118.06 1x9s s GLU 655 Ca 0.50 -0.37 0.06 0.00 0.36 0.00 0.00 54.97 55.52 1x9s s GLU 655 Cb 0.30 0.31 -0.03 0.00 0.26 0.00 0.00 34.13 34.97 1x9s s GLU 655 CO 0.27 -0.21 -0.16 0.96 -0.54 0.00 0.00 175.26 175.58 1x9s s ILE 656 N -1.94 1.25 -0.18 -3.70 -4.36 -0.65 -0.20 121.20 111.43 1x9s s ILE 656 Ca -0.09 -1.38 0.01 0.00 -0.26 0.00 0.00 60.65 58.92 1x9s s ILE 656 Cb -0.03 -1.20 0.03 0.00 1.25 0.00 0.00 42.46 42.51 1x9s s ILE 656 CO 0.00 -0.20 -0.14 -1.10 0.24 0.00 0.00 174.94 173.74 1x9s s GLN 657 N -1.83 2.35 -0.10 0.37 -1.52 -0.51 -1.33 119.66 117.09 1x9s s GLN 657 Ca 0.00 -0.75 0.04 0.00 -1.95 0.00 0.00 55.36 52.70 1x9s s GLN 657 Cb -0.10 -2.34 -0.00 0.00 -0.22 0.00 0.00 33.01 30.35 1x9s s GLN 657 CO 0.03 -0.31 -0.22 0.08 -0.25 0.00 0.00 175.29 174.61 1x9s s VAL 658 N 1.40 2.23 0.06 1.09 1.01 0.26 -1.65 120.40 124.80 1x9s s VAL 658 Ca 0.02 -0.96 -0.30 0.00 0.00 0.00 0.00 61.98 60.74 1x9s s VAL 658 Cb -0.14 -1.86 -0.05 0.00 0.00 0.00 0.00 36.38 34.33 1x9s s VAL 658 CO -0.10 0.56 0.95 -0.83 0.00 0.00 0.00 175.10 175.67 1x9s s GLY 659 N 0.28 2.95 0.06 4.51 0.00 0.48 -0.56 107.32 115.05 1x9s s GLY 659 Ca -0.16 0.53 0.07 0.00 0.00 0.00 0.00 44.72 45.17 1x9s s GLY 659 CO 0.08 1.51 -0.20 0.00 0.00 0.00 0.00 173.10 174.48 1x9s h ARG 661 N 4.60 0.00 -3.95 0.00 2.43 -1.26 0.43 114.38 116.62 1x9s h ARG 661 Ca -0.43 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 58.64 1x9s h ARG 661 Cb 1.17 0.00 -0.14 0.00 -0.42 0.00 0.00 29.97 30.57 1x9s h ARG 661 CO 0.42 0.53 -0.48 0.95 -1.51 0.00 0.00 179.97 179.89 1x9s s THR 662 N -3.44 0.17 0.22 0.20 -4.23 -1.26 -4.57 115.64 102.72 1x9s s THR 662 Ca 0.00 -1.39 -0.09 0.00 -1.18 0.00 0.00 61.69 59.04 1x9s s THR 662 Cb 0.11 -1.39 0.17 0.00 1.34 0.00 0.00 72.50 72.74 1x9s s THR 662 CO 0.73 -0.77 1.88 -0.33 -0.54 0.00 0.00 174.62 175.59 1x9s h GLU 663 N 2.91 0.99 -0.00 3.99 5.08 -1.96 0.20 114.58 125.79 1x9s h GLU 663 Ca -0.34 -0.06 0.03 0.00 -1.00 0.00 0.00 59.36 57.99 1x9s h GLU 663 Cb 1.18 -0.22 -0.04 0.00 0.50 0.00 0.00 28.75 30.16 1x9s h GLU 663 CO 0.59 0.66 -0.25 1.49 -1.00 0.00 0.00 179.01 180.50 1x9s h GLU 664 N 1.02 -0.38 -0.83 2.33 4.81 -1.99 0.40 114.58 119.95 1x9s h GLU 664 Ca 0.30 0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.59 1x9s h GLU 664 Cb -0.05 0.09 -0.05 0.00 0.63 0.00 0.00 28.75 29.36 1x9s h GLU 664 CO -0.09 -0.25 0.55 0.82 -0.73 0.00 0.00 179.01 179.31 1x9s h ILE 665 N -0.39 1.14 -0.48 2.32 2.04 -1.81 -0.33 117.51 120.00 1x9s h ILE 665 Ca 0.06 -0.35 -0.05 0.00 1.00 0.00 0.00 64.86 65.52 1x9s h ILE 665 Cb 0.47 0.02 -0.02 0.00 -0.74 0.00 0.00 36.82 36.55 1x9s h ILE 665 CO -0.22 0.19 0.09 0.00 0.00 0.00 0.00 178.15 178.20 1x9s h ALA 666 N 1.51 1.26 -0.38 1.87 0.00 0.72 -0.83 119.26 123.42 1x9s h ALA 666 Ca 0.33 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.93 1x9s h ALA 666 Cb 0.03 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1x9s h ALA 666 CO -0.10 0.51 -0.20 0.37 0.00 0.00 0.00 179.25 179.84 1x9s h GLN 667 N 0.71 0.72 -0.31 0.00 5.75 0.13 -2.47 115.11 119.63 1x9s h GLN 667 Ca 0.15 -0.27 -0.07 0.00 -0.15 0.00 0.00 58.65 58.31 1x9s h GLN 667 Cb 0.31 -0.04 -0.01 0.00 1.07 0.00 0.00 27.48 28.81 1x9s h GLN 667 CO 0.00 0.86 -0.08 0.28 -2.65 0.00 0.00 178.83 177.24 1x9s h VAL 668 N 0.64 1.28 -0.60 2.39 2.07 -0.53 -1.83 116.25 119.66 1x9s h VAL 668 Ca 0.09 -1.13 0.01 0.00 0.82 0.00 0.00 66.70 66.50 1x9s h VAL 668 Cb 0.68 1.37 -0.03 0.00 -1.52 0.00 0.00 31.29 31.79 1x9s h VAL 668 CO 0.05 0.36 0.39 0.58 0.02 0.00 0.00 177.57 178.97 1x9s h VAL 669 N 0.38 1.12 -0.32 2.57 2.07 -1.06 0.16 116.25 121.17 1x9s h VAL 669 Ca 0.08 -0.27 -0.00 0.00 0.82 0.00 0.00 66.70 67.33 1x9s h VAL 669 Cb 0.58 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 30.61 1x9s h VAL 669 CO 0.03 0.14 0.18 0.40 0.02 0.00 0.00 177.57 178.34 1x9s h ILE 670 N 0.78 1.12 -0.69 4.57 2.04 -1.38 0.27 117.51 124.22 1x9s h ILE 670 Ca 0.23 -0.31 -0.04 0.00 1.00 0.00 0.00 64.86 65.73 1x9s h ILE 670 Cb -0.05 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 36.76 1x9s h ILE 670 CO -0.07 0.13 0.27 -0.33 0.00 0.00 0.00 178.15 178.14 1x9s h GLU 671 N 0.40 1.04 -0.08 2.37 5.08 -0.99 -2.65 114.58 119.75 1x9s h GLU 671 Ca 0.11 -0.19 -0.13 0.00 -1.00 0.00 0.00 59.36 58.15 1x9s h GLU 671 Cb 0.04 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 1x9s h GLU 671 CO -0.02 0.87 -0.51 1.15 -1.00 0.00 0.00 179.01 179.50 1x9s h THR 672 N 0.99 1.35 0.00 1.13 2.02 -0.35 -2.00 112.91 116.05 1x9s h THR 672 Ca 0.23 -1.77 -0.06 0.00 0.77 0.00 0.00 66.41 65.58 1x9s h THR 672 Cb 0.22 1.86 -0.01 0.00 -1.74 0.00 0.00 68.15 68.49 1x9s h THR 672 CO -0.02 0.52 -0.29 0.00 0.37 0.00 0.00 175.52 176.11 1x9s h ALA 673 N 1.29 1.37 0.01 6.16 0.00 -0.21 -1.34 119.26 126.55 1x9s h ALA 673 Ca 0.01 -0.26 -0.16 0.00 0.00 0.00 0.00 54.91 54.49 1x9s h ALA 673 Cb 0.97 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.72 1x9s h ALA 673 CO 0.08 0.36 -0.63 0.37 0.00 0.00 0.00 179.25 179.43 1x9s h GLN 674 N 0.00 0.40 0.18 0.00 5.75 -1.12 -2.78 115.11 117.55 1x9s h GLN 674 Ca -0.00 -0.45 -0.00 0.00 -0.15 0.00 0.00 58.65 58.04 1x9s h GLN 674 Cb 0.57 0.13 -0.01 0.00 1.07 0.00 0.00 27.48 29.24 1x9s h GLN 674 CO 0.04 1.12 -0.14 0.93 -2.65 0.00 0.00 178.83 178.13 1x9s h GLU 675 N -0.12 -0.31 -0.86 1.69 5.08 -1.12 -2.44 114.58 116.49 1x9s h GLU 675 Ca -0.08 0.02 0.11 0.00 -1.00 0.00 0.00 59.36 58.41 1x9s h GLU 675 Cb 1.36 0.07 -0.06 0.00 0.50 0.00 0.00 28.75 30.62 1x9s h GLU 675 CO 0.12 -0.21 0.56 0.00 -1.00 0.00 0.00 179.01 178.48 1x9s h ALA 676 N 0.48 1.74 -0.57 3.43 0.00 -1.34 -0.25 119.26 122.74 1x9s h ALA 676 Ca -0.01 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1x9s h ALA 676 Cb 0.29 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1x9s h ALA 676 CO -0.01 0.06 0.04 1.98 0.00 0.00 0.00 179.25 181.32 1x9s h MET 677 N 0.77 0.99 -0.62 0.00 1.85 -1.20 0.29 114.93 117.01 1x9s h MET 677 Ca 0.41 -0.30 -0.07 0.00 -0.61 0.00 0.00 59.70 59.13 1x9s h MET 677 Cb 0.52 -0.10 -0.02 0.00 0.43 0.00 0.00 31.60 32.43 1x9s h MET 677 CO -0.17 0.97 0.11 0.00 -0.40 0.00 0.00 176.91 177.42 1x9s h ARG 678 N 0.88 1.03 -0.85 0.39 2.47 -0.66 -0.80 114.38 116.83 1x9s h ARG 678 Ca 0.17 -0.27 0.02 0.00 -1.26 0.00 0.00 59.98 58.64 1x9s h ARG 678 Cb 0.50 -0.12 -0.05 0.00 -1.65 0.00 0.00 29.97 28.65 1x9s h ARG 678 CO 0.02 0.95 0.56 2.35 0.56 0.00 0.00 179.97 184.41 1x9s h TRP 679 N 0.94 1.05 -0.35 3.04 7.01 -0.84 0.51 115.95 127.31 1x9s h TRP 679 Ca 0.19 0.03 -0.04 0.00 2.11 0.00 0.00 58.89 61.17 1x9s h TRP 679 Cb 0.41 -0.35 -0.01 0.00 -2.10 0.00 0.00 29.16 27.11 1x9s h TRP 679 CO 0.03 0.63 0.05 0.28 -2.79 0.00 0.00 178.44 176.64 1x9s h VAL 680 N 1.11 1.24 -0.69 2.65 2.07 -0.37 0.13 116.25 122.38 1x9s h VAL 680 Ca 0.33 -0.85 0.02 0.00 0.82 0.00 0.00 66.70 67.02 1x9s h VAL 680 Cb -0.06 1.11 -0.04 0.00 -1.52 0.00 0.00 31.29 30.79 1x9s h VAL 680 CO -0.09 0.28 0.45 1.23 0.02 0.00 0.00 177.57 179.46 1x9s h GLY 681 N 0.42 0.99 0.83 2.17 0.00 -0.50 -2.35 103.07 104.63 1x9s h GLY 681 Ca 0.11 -0.35 -0.02 0.00 0.00 0.00 0.00 47.33 47.07 1x9s h GLY 681 CO 0.01 0.32 0.03 -1.80 0.00 0.00 0.00 176.54 175.09 1x9s h ASP 682 N 0.90 0.31 -0.94 0.19 3.58 -0.68 -0.25 116.42 119.54 1x9s h ASP 682 Ca 0.27 -0.27 0.24 0.00 0.42 0.00 0.00 57.03 57.69 1x9s h ASP 682 Cb -0.05 -0.08 -0.06 0.00 1.72 0.00 0.00 39.33 40.86 1x9s h ASP 682 CO -0.08 0.50 0.64 -0.74 -2.88 0.00 0.00 179.24 176.68 1x9s h HIS 683 N 0.12 0.31 -0.39 0.28 2.76 -0.34 -0.04 115.15 117.85 1x9s h HIS 683 Ca 0.06 0.01 -0.18 0.00 -2.20 0.00 0.00 60.37 58.06 1x9s h HIS 683 Cb 0.32 -0.09 -0.11 0.00 1.55 0.00 0.00 27.41 29.08 1x9s h HIS 683 CO 0.02 0.06 -0.02 0.91 -1.30 0.00 0.00 177.93 177.61 1x9s n TRP 684 N -4.41 1.21 -4.09 5.26 8.01 -0.92 -4.95 117.44 117.55 1x9s n TRP 684 Ca 0.20 -1.52 -0.30 0.00 -1.31 0.00 0.00 57.50 54.57 1x9s n TRP 684 Cb 0.86 -0.50 -0.08 0.00 -2.01 0.00 0.00 31.31 29.58 1x9s n TRP 684 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.69 176.77 1x9s n ASN 685 N -1.05 0.07 -4.75 -0.99 3.02 -0.03 -4.80 115.26 106.73 1x9s n ASN 685 Ca 0.34 -1.09 -0.41 0.00 -0.03 0.00 0.00 54.58 53.38 1x9s n ASN 685 Cb 1.06 -1.37 -0.02 0.00 -0.61 0.00 0.00 39.78 38.84 1x9s n ASN 685 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1x9s s PHE 686 N -3.80 2.95 -1.57 3.10 5.36 -0.12 -4.90 117.98 119.00 1x9s s PHE 686 Ca 0.23 1.08 0.06 0.00 -0.96 0.00 0.00 56.93 57.34 1x9s s PHE 686 Cb -0.13 -3.84 0.23 0.00 -0.34 0.00 0.00 43.02 38.93 1x9s s PHE 686 CO 0.87 -2.66 1.08 0.54 -1.46 0.00 0.00 175.22 173.59 1x9s n ARG 687 N 1.88 1.79 -3.65 10.12 5.12 -1.26 -4.67 116.66 125.98 1x9s n ARG 687 Ca 0.05 -0.90 -0.16 0.00 -1.93 0.00 0.00 57.85 54.91 1x9s n ARG 687 Cb 0.40 -1.38 -0.15 0.00 -1.16 0.00 0.00 32.46 30.18 1x9s n ARG 687 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1x9s n LEU 689 N 5.33 2.21 -4.60 0.00 7.94 -1.26 -4.97 117.00 121.65 1x9s n LEU 689 Ca -0.05 1.16 -0.33 0.00 -1.11 0.00 0.00 56.01 55.68 1x9s n LEU 689 Cb 0.50 -1.32 -0.11 0.00 0.53 0.00 0.00 43.42 43.03 1x9s n LEU 689 CO 0.04 -1.02 -0.37 -0.76 -1.11 0.00 0.00 177.39 174.17 1x9s s LEU 690 N 0.33 3.22 0.27 -1.96 1.43 -1.26 -5.02 118.68 115.68 1x9s s LEU 690 Ca 0.67 -0.08 0.03 0.00 -1.03 0.00 0.00 54.13 53.72 1x9s s LEU 690 Cb -0.73 -1.79 -0.04 0.00 0.03 0.00 0.00 46.19 43.66 1x9s s LEU 690 CO 0.54 0.31 0.19 -1.81 0.23 0.00 0.00 176.35 175.81 1x9s s ASP 691 N -1.20 1.08 0.07 2.29 1.01 -1.26 -4.51 116.67 114.15 1x9s s ASP 691 Ca 0.16 -1.56 -0.05 0.00 0.71 0.00 0.00 52.55 51.80 1x9s s ASP 691 Cb -0.11 0.44 -0.02 0.00 1.01 0.00 0.00 42.92 44.24 1x9s s ASP 691 CO 0.05 -0.93 0.09 0.42 0.21 0.00 0.00 175.17 175.02 1x9s s THR 692 N -3.75 0.17 -0.01 -1.27 -4.23 -1.26 -1.14 115.64 104.15 1x9s s THR 692 Ca 0.39 -1.42 0.02 0.00 -1.18 0.00 0.00 61.69 59.49 1x9s s THR 692 Cb 0.05 -1.37 -0.00 0.00 1.34 0.00 0.00 72.50 72.52 1x9s s THR 692 CO 0.19 -0.79 -0.05 -1.83 -0.54 0.00 0.00 174.62 171.60 1x9s s GLU 693 N -3.76 0.42 0.08 3.99 -1.05 -0.40 -4.85 118.70 113.13 1x9s s GLU 693 Ca 0.05 -0.18 0.04 0.00 -0.15 0.00 0.00 54.97 54.73 1x9s s GLU 693 Cb 0.06 -0.41 -0.03 0.00 -0.44 0.00 0.00 34.13 33.30 1x9s s GLU 693 CO -0.10 0.10 -0.11 0.20 0.95 0.00 0.00 175.26 176.31 1x9s s GLY 694 N -0.07 0.79 -0.02 -3.83 0.00 -1.26 -0.29 107.32 102.64 1x9s s GLY 694 Ca 0.01 -1.08 0.02 0.00 0.00 0.00 0.00 44.72 43.67 1x9s s GLY 694 CO -0.00 -1.14 -0.05 0.54 0.00 0.00 0.00 173.10 172.45 1x9s s LYS 695 N -2.37 0.61 0.05 2.90 1.02 0.18 -4.95 119.74 117.18 1x9s s LYS 695 Ca 0.01 -0.16 -0.10 0.00 0.02 0.00 0.00 55.97 55.74 1x9s s LYS 695 Cb -0.06 -0.61 -0.06 0.00 -0.52 0.00 0.00 37.83 36.59 1x9s s LYS 695 CO 0.01 0.04 0.37 1.41 -0.92 0.00 0.00 175.35 176.26 1x9s s MET 696 N 0.30 3.74 0.00 1.68 1.75 -1.26 -1.38 119.30 124.12 1x9s s MET 696 Ca -0.03 0.15 0.00 0.00 -1.25 0.00 0.00 55.69 54.55 1x9s s MET 696 Cb -0.08 -3.04 0.00 0.00 2.84 0.00 0.00 34.83 34.56 1x9s s MET 696 CO -0.00 0.59 0.00 0.41 -0.65 0.00 0.00 175.02 175.37 1x9s n GLY 697 N 1.06 -0.81 0.14 2.11 0.00 -0.74 -4.82 105.19 102.12 1x9s n GLY 697 Ca -0.09 -0.98 0.02 0.00 0.00 0.00 0.00 46.02 44.97 1x9s n GLY 697 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x9s h PRO 698 N 0.00 0.00 0.00 1.61 0.13 -1.90 0.27 132.00 132.11 1x9s h PRO 698 Ca 0.00 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 65.01 1x9s h PRO 698 Cb 0.00 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.11 1x9s h PRO 698 CO 0.00 0.51 0.05 0.27 -0.23 0.00 0.00 178.00 178.61 1x9s n ASN 699 N -3.26 -1.45 0.26 1.44 0.23 -1.26 -1.07 115.26 110.15 1x9s n ASN 699 Ca 0.02 -2.38 0.12 0.00 -0.53 0.00 0.00 54.58 51.81 1x9s n ASN 699 Cb 0.72 2.52 0.72 0.00 -2.08 0.00 0.00 39.78 41.67 1x9s n ASN 699 CO 0.00 0.00 0.00 -0.25 -0.93 0.00 0.00 177.26 176.08 1x9s h TRP 700 N 1.79 0.00 0.35 -2.53 2.91 -0.84 -1.94 115.95 115.69 1x9s h TRP 700 Ca -0.24 0.00 -0.02 0.00 1.13 0.00 0.00 58.89 59.76 1x9s h TRP 700 Cb 0.96 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.61 1x9s h TRP 700 CO 0.00 0.11 -0.17 0.00 -1.03 0.00 0.00 178.44 177.35 1x9s h ALA 701 N 1.89 -0.48 -0.26 2.65 0.00 -1.79 -3.11 119.26 118.16 1x9s h ALA 701 Ca -0.00 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.62 1x9s h ALA 701 Cb 0.31 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1x9s h ALA 701 CO 0.01 -0.59 -0.28 0.82 0.00 0.00 0.00 179.25 179.21 1x9s h ILE 702 N -0.84 1.28 0.00 0.00 5.03 -1.89 -2.94 117.51 118.15 1x9s h ILE 702 Ca -0.05 -1.34 0.00 0.00 -0.12 0.00 0.00 64.86 63.35 1x9s h ILE 702 Cb 0.53 1.39 0.00 0.00 -3.03 0.00 0.00 36.82 35.71 1x9s h ILE 702 CO 0.08 0.43 0.00 0.00 -0.68 0.00 0.00 178.15 177.98