#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ea9 n PHE 2 N 0.00 0.00 -0.27 1.12 3.01 -1.26 -4.75 117.46 115.32 1ea9 n PHE 2 Ca 0.00 0.00 0.02 0.00 1.01 0.00 0.00 57.45 58.48 1ea9 n PHE 2 Cb 0.00 0.00 0.15 0.00 -0.01 0.00 0.00 39.48 39.62 1ea9 n PHE 2 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 1ea9 h LEU 3 N 1.76 0.59 -0.87 4.37 4.07 -2.00 -3.03 115.31 120.19 1ea9 h LEU 3 Ca 0.00 0.05 0.00 0.00 0.08 0.00 0.00 57.88 58.01 1ea9 h LEU 3 Cb 0.00 -0.06 0.00 0.00 1.08 0.00 0.00 40.66 41.68 1ea9 h LEU 3 CO 0.00 0.34 0.00 -0.62 -1.08 0.00 0.00 178.44 177.08 1ea9 n GLU 4 N -4.79 0.64 -0.08 1.13 4.71 -1.26 -3.32 120.64 117.67 1ea9 n GLU 4 Ca 0.12 0.00 -0.11 0.00 -0.01 0.00 0.00 57.16 57.16 1ea9 n GLU 4 Cb 0.26 -1.28 -0.08 0.00 -1.01 0.00 0.00 31.44 29.33 1ea9 n GLU 4 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1ea9 n ALA 5 N 0.09 1.64 -1.48 0.62 0.00 -1.14 -5.03 120.51 115.21 1ea9 n ALA 5 Ca 0.00 -0.73 -0.36 0.00 0.00 0.00 0.00 53.44 52.35 1ea9 n ALA 5 Cb 0.14 0.10 0.08 0.00 0.00 0.00 0.00 19.45 19.77 1ea9 n ALA 5 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1ea9 n VAL 6 N -2.95 3.45 -3.63 0.00 0.31 -1.21 -4.64 118.33 109.65 1ea9 n VAL 6 Ca -0.29 -0.41 -0.15 0.00 -0.01 0.00 0.00 64.34 63.47 1ea9 n VAL 6 Cb 0.83 -1.21 -0.07 0.00 -0.91 0.00 0.00 33.84 32.48 1ea9 n VAL 6 CO 0.00 0.00 0.00 -0.47 -1.32 0.00 0.00 176.83 175.04 1ea9 s TYR 7 N -1.68 -0.51 -0.30 3.52 5.04 -1.14 -4.99 117.35 117.29 1ea9 s TYR 7 Ca 0.76 0.98 -0.04 0.00 -2.44 0.00 0.00 57.07 56.33 1ea9 s TYR 7 Cb -0.36 0.27 0.17 0.00 0.35 0.00 0.00 41.96 42.39 1ea9 s TYR 7 CO 0.47 -0.46 0.63 -1.58 -1.34 0.00 0.00 175.55 173.27 1ea9 s HIS 8 N -0.84 -1.49 -0.08 4.97 5.65 -1.26 -3.03 115.29 119.22 1ea9 s HIS 8 Ca -0.09 1.84 0.05 0.00 0.25 0.00 0.00 55.06 57.11 1ea9 s HIS 8 Cb -0.03 0.62 -0.00 0.00 -1.18 0.00 0.00 32.58 31.99 1ea9 s HIS 8 CO 0.06 -0.80 -0.23 0.50 -0.65 0.00 0.00 174.74 173.63 1ea9 s ARG 9 N 2.87 2.60 0.33 2.88 6.06 -1.26 -5.10 118.95 127.33 1ea9 s ARG 9 Ca 0.13 -0.82 -0.29 0.00 -2.50 0.00 0.00 55.73 52.25 1ea9 s ARG 9 Cb -0.14 -2.08 -0.12 0.00 0.06 0.00 0.00 34.95 32.67 1ea9 s ARG 9 CO -0.20 0.25 1.47 -2.30 -2.50 0.00 0.00 175.30 172.01 1ea9 n PRO 10 N 3.30 2.48 0.00 5.12 -0.02 -1.26 -4.08 135.00 140.54 1ea9 n PRO 10 Ca -0.19 0.88 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 1ea9 n PRO 10 Cb 0.52 -2.58 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 1ea9 n PRO 10 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1ea9 n ARG 11 N 1.19 0.00 0.00 -0.52 5.12 -0.78 -4.88 116.66 116.80 1ea9 n ARG 11 Ca 0.06 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.98 1ea9 n ARG 11 Cb 0.37 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.67 1ea9 n ARG 11 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 1ea9 n LYS 12 N 0.00 0.00 -0.00 5.56 5.02 -1.26 -1.34 118.16 126.14 1ea9 n LYS 12 Ca 0.00 0.00 0.06 0.00 -2.02 0.00 0.00 58.31 56.35 1ea9 n LYS 12 Cb 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 35.03 34.94 1ea9 n LYS 12 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1ea9 n ASN 13 N 6.27 0.96 -0.86 4.39 6.94 -1.26 -4.46 115.26 127.24 1ea9 n ASN 13 Ca 0.00 -0.59 0.05 0.00 -0.02 0.00 0.00 54.58 54.02 1ea9 n ASN 13 Cb 0.00 1.14 0.17 0.00 -2.36 0.00 0.00 39.78 38.73 1ea9 n ASN 13 CO 0.00 0.00 0.00 0.49 -1.03 0.00 0.00 177.26 176.72 1ea9 n PHE 14 N -1.44 0.69 0.00 -2.53 3.72 -0.45 -4.41 117.46 113.04 1ea9 n PHE 14 Ca 0.01 -0.28 0.00 0.00 -0.05 0.00 0.00 57.45 57.13 1ea9 n PHE 14 Cb 0.22 -0.12 0.00 0.00 -0.94 0.00 0.00 39.48 38.64 1ea9 n PHE 14 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1ea9 n SER 15 N 0.45 0.00 -3.45 4.37 2.88 -1.01 -4.05 113.62 112.81 1ea9 n SER 15 Ca 0.12 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.55 1ea9 n SER 15 Cb 0.46 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.90 1ea9 n SER 15 CO 0.00 0.00 0.00 -0.72 -1.23 0.00 0.00 175.04 173.09 1ea9 s TYR 16 N 0.00 -0.50 -0.15 0.66 -0.85 -1.18 -1.86 117.35 113.47 1ea9 s TYR 16 Ca 0.00 0.35 -0.16 0.00 -0.52 0.00 0.00 57.07 56.74 1ea9 s TYR 16 Cb 0.00 0.55 -0.04 0.00 0.38 0.00 0.00 41.96 42.84 1ea9 s TYR 16 CO 0.00 -0.76 0.40 0.00 -1.52 0.00 0.00 175.55 173.67 1ea9 s ALA 17 N -3.43 3.53 0.01 9.51 0.00 -1.26 -1.86 121.76 128.25 1ea9 s ALA 17 Ca 0.01 -0.34 -0.07 0.00 0.00 0.00 0.00 51.96 51.56 1ea9 s ALA 17 Cb -0.01 -2.56 -0.30 0.00 0.00 0.00 0.00 23.12 20.25 1ea9 s ALA 17 CO -0.11 -0.04 0.89 -0.92 0.00 0.00 0.00 175.76 175.59 1ea9 h TYR 18 N 6.85 0.60 -1.76 0.00 3.20 -1.91 -3.41 116.97 120.54 1ea9 h TYR 18 Ca -0.40 -0.44 0.00 0.00 3.14 0.00 0.00 58.73 61.03 1ea9 h TYR 18 Cb 1.17 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 39.42 1ea9 h TYR 18 CO 0.63 1.45 0.00 0.27 -1.64 0.00 0.00 178.16 178.87 1ea9 n ASN 19 N -3.54 0.20 -2.89 -2.11 2.04 -1.24 -4.87 115.26 102.85 1ea9 n ASN 19 Ca -0.17 -0.56 -0.37 0.00 -0.44 0.00 0.00 54.58 53.03 1ea9 n ASN 19 Cb 1.06 0.00 0.02 0.00 -2.53 0.00 0.00 39.78 38.33 1ea9 n ASN 19 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1ea9 n GLY 20 N 0.49 5.32 0.00 4.83 0.00 -1.26 -4.31 105.19 110.26 1ea9 n GLY 20 Ca 0.00 -2.36 0.00 0.00 0.00 0.00 0.00 46.02 43.66 1ea9 n GLY 20 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1ea9 n THR 21 N -0.19 0.00 -3.93 2.61 5.66 -1.26 -4.92 114.28 112.25 1ea9 n THR 21 Ca 0.53 0.00 -0.31 0.00 -3.05 0.00 0.00 64.05 61.21 1ea9 n THR 21 Cb 0.30 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.03 1ea9 n THR 21 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 1ea9 s THR 22 N 0.00 5.31 0.02 1.09 2.01 -1.26 -3.21 115.64 119.60 1ea9 s THR 22 Ca 0.00 -0.38 -0.03 0.00 0.31 0.00 0.00 61.69 61.59 1ea9 s THR 22 Cb 0.00 -3.57 -0.01 0.00 0.01 0.00 0.00 72.50 68.93 1ea9 s THR 22 CO 0.00 0.18 0.04 -0.69 -0.69 0.00 0.00 174.62 173.45 1ea9 s VAL 23 N -1.46 0.11 0.00 3.82 1.01 0.82 -3.13 120.40 121.57 1ea9 s VAL 23 Ca 0.33 -0.90 0.03 0.00 0.00 0.00 0.00 61.98 61.44 1ea9 s VAL 23 Cb -0.13 -0.44 -0.03 0.00 0.00 0.00 0.00 36.38 35.77 1ea9 s VAL 23 CO 0.26 -0.50 -0.06 -1.00 0.00 0.00 0.00 175.10 173.80 1ea9 s HIS 24 N -1.67 2.92 -0.12 5.22 3.76 -0.78 -0.48 115.29 124.13 1ea9 s HIS 24 Ca -0.13 -0.02 0.00 0.00 -0.15 0.00 0.00 55.06 54.76 1ea9 s HIS 24 Cb -0.07 -1.62 0.02 0.00 1.11 0.00 0.00 32.58 32.02 1ea9 s HIS 24 CO -0.01 0.39 -0.11 -0.51 -0.85 0.00 0.00 174.74 173.64 1ea9 s LEU 25 N -1.42 1.48 0.11 0.89 2.01 -1.09 -3.13 118.68 117.52 1ea9 s LEU 25 Ca 0.17 -0.39 0.05 0.00 0.01 0.00 0.00 54.13 53.97 1ea9 s LEU 25 Cb -0.11 -1.01 -0.04 0.00 0.01 0.00 0.00 46.19 45.04 1ea9 s LEU 25 CO 0.08 -0.07 0.04 -0.13 1.01 0.00 0.00 176.35 177.27 1ea9 s ARG 26 N 1.48 2.65 -0.20 1.70 1.81 -1.23 -3.82 118.95 121.34 1ea9 s ARG 26 Ca 0.03 -0.85 -0.15 0.00 -1.72 0.00 0.00 55.73 53.04 1ea9 s ARG 26 Cb -0.13 -2.57 0.06 0.00 -0.45 0.00 0.00 34.95 31.86 1ea9 s ARG 26 CO -0.08 0.53 0.52 0.42 -0.68 0.00 0.00 175.30 176.00 1ea9 s ILE 27 N -1.44 -0.01 0.10 1.52 -1.09 -1.22 -4.82 121.20 114.24 1ea9 s ILE 27 Ca 0.27 0.03 0.07 0.00 -2.23 0.00 0.00 60.65 58.79 1ea9 s ILE 27 Cb -0.11 -0.74 -0.04 0.00 -1.58 0.00 0.00 42.46 39.99 1ea9 s ILE 27 CO 0.20 0.01 -0.11 0.00 -1.23 0.00 0.00 174.94 173.81 1ea9 s ARG 28 N 0.84 2.10 0.37 2.79 1.70 -1.17 -0.92 118.95 124.66 1ea9 s ARG 28 Ca -0.05 -1.04 -0.13 0.00 -0.47 0.00 0.00 55.73 54.05 1ea9 s ARG 28 Cb -0.05 -2.29 0.04 0.00 -0.57 0.00 0.00 34.95 32.08 1ea9 s ARG 28 CO -0.07 0.51 0.71 0.95 -1.08 0.00 0.00 175.30 176.32 1ea9 s THR 29 N -1.20 0.00 0.26 4.99 -4.23 0.14 -2.89 115.64 112.71 1ea9 s THR 29 Ca 0.21 -1.13 -0.30 0.00 -1.18 0.00 0.00 61.69 59.29 1ea9 s THR 29 Cb -0.11 -2.75 -0.10 0.00 1.34 0.00 0.00 72.50 70.87 1ea9 s THR 29 CO 0.13 0.00 1.48 -0.75 -0.54 0.00 0.00 174.62 174.94 1ea9 s LYS 30 N -2.62 4.23 0.00 3.99 2.20 -1.26 0.29 119.74 126.57 1ea9 s LYS 30 Ca 0.18 2.38 0.00 0.00 -0.36 0.00 0.00 55.97 58.17 1ea9 s LYS 30 Cb -0.04 -3.08 0.00 0.00 -1.51 0.00 0.00 37.83 33.19 1ea9 s LYS 30 CO 0.13 -0.48 0.00 1.63 -0.36 0.00 0.00 175.35 176.27 1ea9 n LYS 31 N 2.27 0.00 -0.51 4.03 5.02 -1.24 -1.07 118.16 126.66 1ea9 n LYS 31 Ca 0.07 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.36 1ea9 n LYS 31 Cb 0.39 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.40 1ea9 n LYS 31 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1ea9 n ASP 32 N -2.31 0.01 -3.30 4.39 8.00 -1.26 -4.60 116.55 117.48 1ea9 n ASP 32 Ca 0.00 -1.90 -0.38 0.00 0.71 0.00 0.00 54.79 53.21 1ea9 n ASP 32 Cb 0.00 -0.18 0.00 0.00 -0.02 0.00 0.00 41.12 40.92 1ea9 n ASP 32 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1ea9 n ASP 33 N 0.00 7.47 -3.07 -2.24 2.03 -0.23 -4.72 116.55 115.80 1ea9 n ASP 33 Ca 0.00 -3.48 0.03 0.00 0.52 0.00 0.00 54.79 51.86 1ea9 n ASP 33 Cb 0.68 -1.22 -0.00 0.00 -0.72 0.00 0.00 41.12 39.86 1ea9 n ASP 33 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 1ea9 s MET 34 N -2.97 0.42 0.13 -0.67 -1.94 -1.26 -4.63 119.30 108.38 1ea9 s MET 34 Ca 0.49 0.08 -0.29 0.00 -1.71 0.00 0.00 55.69 54.25 1ea9 s MET 34 Cb 0.26 0.10 -0.06 0.00 2.01 0.00 0.00 34.83 37.14 1ea9 s MET 34 CO -0.18 -0.69 1.59 1.15 -0.01 0.00 0.00 175.02 176.88 1ea9 h THR 35 N 4.70 0.17 -3.26 2.05 2.02 -1.22 -3.46 112.91 113.91 1ea9 h THR 35 Ca -0.02 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.13 1ea9 h THR 35 Cb 1.20 0.17 -0.04 0.00 -1.74 0.00 0.00 68.15 67.73 1ea9 h THR 35 CO 0.02 0.00 0.13 0.00 0.37 0.00 0.00 175.52 176.03 1ea9 s ALA 36 N -5.91 -0.64 -0.27 6.16 0.00 -0.22 -4.97 121.76 115.91 1ea9 s ALA 36 Ca -0.16 -0.71 -0.08 0.00 0.00 0.00 0.00 51.96 51.02 1ea9 s ALA 36 Cb 0.09 0.87 0.13 0.00 0.00 0.00 0.00 23.12 24.21 1ea9 s ALA 36 CO 0.64 -0.96 0.58 0.14 0.00 0.00 0.00 175.76 176.16 1ea9 s VAL 37 N -3.31 -0.90 0.10 0.00 -7.23 -1.26 0.14 120.40 107.94 1ea9 s VAL 37 Ca 0.17 0.03 0.02 0.00 -1.81 0.00 0.00 61.98 60.39 1ea9 s VAL 37 Cb -0.04 -0.92 -0.04 0.00 0.56 0.00 0.00 36.38 35.94 1ea9 s VAL 37 CO 0.10 0.01 0.18 -0.31 -0.31 0.00 0.00 175.10 174.78 1ea9 s TYR 38 N 2.81 3.38 -0.30 2.82 1.51 -1.26 -1.26 117.35 125.05 1ea9 s TYR 38 Ca -0.00 0.14 -0.14 0.00 -1.01 0.00 0.00 57.07 56.06 1ea9 s TYR 38 Cb -0.13 -1.67 -0.03 0.00 -0.11 0.00 0.00 41.96 40.02 1ea9 s TYR 38 CO -0.18 0.55 0.33 0.00 -1.11 0.00 0.00 175.55 175.14 1ea9 s ALA 39 N -1.56 3.53 -0.48 3.71 0.00 0.46 0.35 121.76 127.76 1ea9 s ALA 39 Ca 0.33 -1.04 -0.14 0.00 0.00 0.00 0.00 51.96 51.10 1ea9 s ALA 39 Cb -0.12 -2.72 0.09 0.00 0.00 0.00 0.00 23.12 20.37 1ea9 s ALA 39 CO 0.26 -0.82 0.40 -1.17 0.00 0.00 0.00 175.76 174.42 1ea9 s LEU 40 N 1.99 5.69 0.00 0.00 1.98 -1.22 0.21 118.68 127.33 1ea9 s LEU 40 Ca 0.12 -1.50 0.03 0.00 -2.89 0.00 0.00 54.13 49.89 1ea9 s LEU 40 Cb -0.16 -2.15 -0.01 0.00 0.66 0.00 0.00 46.19 44.53 1ea9 s LEU 40 CO 0.11 -0.68 0.09 0.00 -1.89 0.00 0.00 176.35 173.98 1ea9 n ALA 41 N 5.15 0.31 0.00 5.97 0.00 -1.25 0.08 120.51 130.77 1ea9 n ALA 41 Ca -0.12 -1.03 0.00 0.00 0.00 0.00 0.00 53.44 52.29 1ea9 n ALA 41 Cb 0.43 0.73 0.00 0.00 0.00 0.00 0.00 19.45 20.61 1ea9 n ALA 41 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ea9 n GLY 42 N 0.44 -0.27 3.79 0.00 0.00 -0.76 -2.47 105.19 105.92 1ea9 n GLY 42 Ca -0.01 -0.96 -0.36 0.00 0.00 0.00 0.00 46.02 44.69 1ea9 n GLY 42 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ea9 s ASP 43 N -4.00 6.02 0.00 1.61 1.11 -1.26 -1.35 116.67 118.80 1ea9 s ASP 43 Ca 0.00 0.32 0.16 0.00 0.18 0.00 0.00 52.55 53.21 1ea9 s ASP 43 Cb 0.00 -1.92 0.96 0.00 1.07 0.00 0.00 42.92 43.03 1ea9 s ASP 43 CO 0.00 0.35 1.38 2.29 1.18 0.00 0.00 175.17 180.37 1ea9 n LYS 44 N 2.37 0.57 0.00 8.23 2.85 -1.26 -3.54 118.16 127.38 1ea9 n LYS 44 Ca -0.19 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.07 1ea9 n LYS 44 Cb 0.54 -1.44 0.00 0.00 -0.65 0.00 0.00 35.03 33.48 1ea9 n LYS 44 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1ea9 n TYR 45 N -0.94 0.00 -2.37 5.58 4.01 -1.26 -4.74 117.16 117.43 1ea9 n TYR 45 Ca 0.12 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.43 1ea9 n TYR 45 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.09 1ea9 n TYR 45 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1ea9 n MET 46 N -0.72 3.19 0.22 -0.72 0.00 -1.26 -4.75 117.12 113.08 1ea9 n MET 46 Ca 0.00 -3.23 -0.11 0.00 0.00 0.00 0.00 57.70 54.36 1ea9 n MET 46 Cb 0.00 -3.28 -0.06 0.00 0.00 0.00 0.00 33.22 29.89 1ea9 n MET 46 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 175.97 178.32 1ea9 h TRP 47 N 6.78 -0.81 0.00 3.17 -0.00 -1.85 -3.16 115.95 120.08 1ea9 h TRP 47 Ca 0.45 -0.00 -0.20 0.00 -0.00 0.00 0.00 58.89 59.14 1ea9 h TRP 47 Cb 0.77 0.30 0.01 0.00 -0.00 0.00 0.00 29.16 30.24 1ea9 h TRP 47 CO 1.35 -0.42 1.80 -0.40 -0.00 0.00 0.00 178.44 180.77 1ea9 n ASP 48 N -4.20 2.43 0.00 2.65 5.75 -1.26 -1.30 116.55 120.62 1ea9 n ASP 48 Ca -0.08 -2.18 0.00 0.00 -0.01 0.00 0.00 54.79 52.52 1ea9 n ASP 48 Cb 0.29 -0.80 0.00 0.00 -1.03 0.00 0.00 41.12 39.58 1ea9 n ASP 48 CO 0.00 0.00 0.00 1.57 -0.11 0.00 0.00 177.20 178.66 1ea9 n HIS 49 N 4.75 0.00 -0.91 2.11 -0.00 -1.21 -4.99 115.22 114.97 1ea9 n HIS 49 Ca 0.23 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.41 1ea9 n HIS 49 Cb 0.08 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.95 1ea9 n HIS 49 CO 0.00 0.00 0.00 0.25 0.46 0.00 0.00 176.34 177.05 1ea9 n THR 50 N 0.00 0.03 -2.71 3.57 -2.24 -0.42 -5.08 114.28 107.44 1ea9 n THR 50 Ca 0.00 -0.06 -0.42 0.00 -2.27 0.00 0.00 64.05 61.30 1ea9 n THR 50 Cb 0.00 1.59 -0.03 0.00 -2.10 0.00 0.00 70.33 69.78 1ea9 n THR 50 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 1ea9 s MET 51 N -0.03 4.56 -0.19 -0.78 -1.94 -1.18 -4.28 119.30 115.46 1ea9 s MET 51 Ca 0.00 1.42 -0.04 0.00 -1.71 0.00 0.00 55.69 55.36 1ea9 s MET 51 Cb 0.00 -3.46 0.09 0.00 2.01 0.00 0.00 34.83 33.48 1ea9 s MET 51 CO 0.00 -0.05 0.29 -1.83 -0.01 0.00 0.00 175.02 173.42 1ea9 s GLU 52 N 1.00 0.22 0.13 2.03 -1.05 -1.03 -5.01 118.70 114.99 1ea9 s GLU 52 Ca 0.52 0.51 -0.31 0.00 -0.15 0.00 0.00 54.97 55.54 1ea9 s GLU 52 Cb -0.21 -0.56 -0.10 0.00 -0.44 0.00 0.00 34.13 32.82 1ea9 s GLU 52 CO 0.28 -0.51 1.84 0.71 0.95 0.00 0.00 175.26 178.53 1ea9 s TYR 53 N 2.43 2.14 -0.33 4.83 1.51 -1.25 -3.95 117.35 122.72 1ea9 s TYR 53 Ca 0.06 -0.04 -0.08 0.00 -1.01 0.00 0.00 57.07 56.00 1ea9 s TYR 53 Cb -0.14 -4.19 0.02 0.00 -0.11 0.00 0.00 41.96 37.53 1ea9 s TYR 53 CO -0.12 -4.92 0.14 0.08 -1.11 0.00 0.00 175.55 169.62 1ea9 s VAL 54 N 2.72 4.23 -0.67 0.71 1.01 0.58 -4.80 120.40 124.18 1ea9 s VAL 54 Ca 0.81 -0.78 -0.25 0.00 0.00 0.00 0.00 61.98 61.75 1ea9 s VAL 54 Cb -0.46 -3.27 -0.12 0.00 0.00 0.00 0.00 36.38 32.52 1ea9 s VAL 54 CO 0.36 -0.07 2.42 -2.65 0.00 0.00 0.00 175.10 175.17 1ea9 n PRO 55 N 4.92 0.72 -2.18 2.72 -0.02 -1.26 0.17 135.00 140.08 1ea9 n PRO 55 Ca -0.13 -0.36 -0.41 0.00 -2.02 0.00 0.00 63.50 60.58 1ea9 n PRO 55 Cb 0.47 -3.31 -0.03 0.00 -0.02 0.00 0.00 33.50 30.61 1ea9 n PRO 55 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 1ea9 s MET 56 N 8.54 4.39 0.22 -0.52 -1.94 -0.39 -4.76 119.30 124.84 1ea9 s MET 56 Ca 1.00 2.13 0.10 0.00 -1.71 0.00 0.00 55.69 57.21 1ea9 s MET 56 Cb -0.26 -3.12 -0.04 0.00 2.01 0.00 0.00 34.83 33.42 1ea9 s MET 56 CO 0.22 -0.17 -0.10 0.99 -0.01 0.00 0.00 175.02 175.94 1ea9 s THR 57 N -0.73 3.09 -0.21 2.05 2.01 -1.21 -4.44 115.64 116.19 1ea9 s THR 57 Ca 0.51 -1.87 -0.29 0.00 0.31 0.00 0.00 61.69 60.35 1ea9 s THR 57 Cb -0.38 -2.57 -0.02 0.00 0.01 0.00 0.00 72.50 69.54 1ea9 s THR 57 CO 0.47 -0.23 1.41 -0.75 -0.69 0.00 0.00 174.62 174.83 1ea9 s LYS 58 N -3.16 4.01 -0.14 4.92 2.20 -1.26 -0.03 119.74 126.29 1ea9 s LYS 58 Ca 0.27 1.58 0.15 0.00 -0.36 0.00 0.00 55.97 57.62 1ea9 s LYS 58 Cb -0.07 -3.90 -0.22 0.00 -1.51 0.00 0.00 37.83 32.13 1ea9 s LYS 58 CO 0.16 -1.01 0.11 1.47 -0.36 0.00 0.00 175.35 175.72 1ea9 n LEU 59 N 7.47 0.00 -3.51 5.43 -0.00 -0.99 -4.91 117.00 120.49 1ea9 n LEU 59 Ca 0.16 0.00 -0.13 0.00 -0.00 0.00 0.00 56.01 56.03 1ea9 n LEU 59 Cb 0.45 0.34 -0.04 0.00 -0.00 0.00 0.00 43.42 44.18 1ea9 n LEU 59 CO 0.61 0.34 0.34 0.00 -0.00 0.00 0.00 177.39 178.68 1ea9 s ALA 60 N -2.54 -1.46 -0.26 1.47 0.00 -1.26 -5.05 121.76 112.66 1ea9 s ALA 60 Ca -0.08 0.60 -0.02 0.00 0.00 0.00 0.00 51.96 52.46 1ea9 s ALA 60 Cb 0.06 0.55 0.11 0.00 0.00 0.00 0.00 23.12 23.85 1ea9 s ALA 60 CO 0.69 -0.60 0.24 0.99 0.00 0.00 0.00 175.76 177.09 1ea9 s THR 61 N -2.91 -0.33 0.00 0.00 2.01 -1.26 -1.80 115.64 111.36 1ea9 s THR 61 Ca -0.03 -0.39 0.00 0.00 0.31 0.00 0.00 61.69 61.58 1ea9 s THR 61 Cb -0.00 -0.87 0.00 0.00 0.01 0.00 0.00 72.50 71.63 1ea9 s THR 61 CO -0.05 -0.41 0.00 -0.90 -0.69 0.00 0.00 174.62 172.57 1ea9 n ASP 62 N 5.31 0.00 0.00 3.53 3.85 -1.01 -4.57 116.55 123.65 1ea9 n ASP 62 Ca -0.04 0.00 0.00 0.00 -0.71 0.00 0.00 54.79 54.04 1ea9 n ASP 62 Cb 0.47 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.24 1ea9 n ASP 62 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 1ea9 n GLU 63 N 0.00 0.00 -1.78 0.11 1.02 -1.26 -3.92 120.64 114.81 1ea9 n GLU 63 Ca 0.00 0.50 -0.30 0.00 -0.02 0.00 0.00 57.16 57.34 1ea9 n GLU 63 Cb 0.00 -1.31 0.04 0.00 -0.02 0.00 0.00 31.44 30.16 1ea9 n GLU 63 CO 0.00 0.00 0.00 1.47 1.18 0.00 0.00 177.13 179.78 1ea9 n LEU 64 N -1.73 6.26 -3.72 -4.62 -0.00 -1.26 -4.73 117.00 107.20 1ea9 n LEU 64 Ca 0.00 -4.62 -0.14 0.00 -0.00 0.00 0.00 56.01 51.25 1ea9 n LEU 64 Cb 0.00 -0.67 -0.08 0.00 -0.00 0.00 0.00 43.42 42.66 1ea9 n LEU 64 CO 0.00 1.83 0.10 -0.36 -0.00 0.00 0.00 177.39 178.97 1ea9 s PHE 65 N -3.73 -0.31 -0.12 1.47 0.08 -1.25 -3.67 117.98 110.45 1ea9 s PHE 65 Ca 0.56 0.57 0.01 0.00 0.12 0.00 0.00 56.93 58.20 1ea9 s PHE 65 Cb 0.45 0.16 -0.01 0.00 -0.57 0.00 0.00 43.02 43.05 1ea9 s PHE 65 CO -0.04 -0.39 -0.17 -0.51 -0.10 0.00 0.00 175.22 174.01 1ea9 s ASP 66 N -1.00 3.68 0.15 1.36 -0.00 0.85 -2.41 116.67 119.30 1ea9 s ASP 66 Ca -0.10 -0.41 0.09 0.00 -0.00 0.00 0.00 52.55 52.13 1ea9 s ASP 66 Cb -0.04 -1.52 -0.04 0.00 -0.00 0.00 0.00 42.92 41.32 1ea9 s ASP 66 CO 0.04 0.17 -0.14 -0.31 -0.00 0.00 0.00 175.17 174.93 1ea9 s TYR 67 N 0.33 2.59 -0.04 4.23 2.02 -0.75 0.24 117.35 125.96 1ea9 s TYR 67 Ca -0.13 -0.24 0.02 0.00 -0.37 0.00 0.00 57.07 56.35 1ea9 s TYR 67 Cb -0.17 -1.32 0.01 0.00 -0.40 0.00 0.00 41.96 40.09 1ea9 s TYR 67 CO 0.07 0.45 -0.10 -1.58 -1.57 0.00 0.00 175.55 172.82 1ea9 s TRP 68 N -1.43 1.16 0.45 2.71 0.51 -0.09 -2.35 118.94 119.90 1ea9 s TRP 68 Ca 0.22 -0.36 -0.08 0.00 -2.12 0.00 0.00 56.10 53.76 1ea9 s TRP 68 Cb -0.10 -0.86 0.11 0.00 -0.81 0.00 0.00 33.47 31.81 1ea9 s TRP 68 CO 0.13 -0.18 0.56 -1.91 -0.51 0.00 0.00 176.95 175.03 1ea9 n GLU 69 N 3.61 -0.88 0.00 4.98 2.13 0.96 -3.43 120.64 128.00 1ea9 n GLU 69 Ca -0.21 -0.86 0.00 0.00 0.66 0.00 0.00 57.16 56.74 1ea9 n GLU 69 Cb 0.53 -0.62 0.00 0.00 0.27 0.00 0.00 31.44 31.61 1ea9 n GLU 69 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1ea9 s GLU 71 N -0.04 3.22 -0.07 0.00 2.12 -1.26 -2.69 118.70 119.98 1ea9 s GLU 71 Ca 0.00 -0.51 0.06 0.00 0.36 0.00 0.00 54.97 54.87 1ea9 s GLU 71 Cb 0.00 -3.95 -0.01 0.00 0.26 0.00 0.00 34.13 30.43 1ea9 s GLU 71 CO 0.00 -0.94 -0.24 0.54 -0.54 0.00 0.00 175.26 174.08 1ea9 s VAL 72 N 2.55 2.10 -0.62 3.70 0.11 0.36 -4.94 120.40 123.66 1ea9 s VAL 72 Ca 0.18 -1.04 0.04 0.00 -2.93 0.00 0.00 61.98 58.23 1ea9 s VAL 72 Cb -0.15 -1.77 0.16 0.00 -1.53 0.00 0.00 36.38 33.09 1ea9 s VAL 72 CO 0.17 0.57 0.40 0.42 -3.33 0.00 0.00 175.10 173.32 1ea9 s THR 73 N -0.09 2.57 -0.32 5.04 -4.23 -1.26 0.29 115.64 117.64 1ea9 s THR 73 Ca -0.06 -3.80 -0.41 0.00 -1.18 0.00 0.00 61.69 56.24 1ea9 s THR 73 Cb -0.14 -2.73 -0.16 0.00 1.34 0.00 0.00 72.50 70.81 1ea9 s THR 73 CO 0.04 -0.95 1.74 -2.65 -0.54 0.00 0.00 174.62 172.26 1ea9 n PRO 74 N 2.46 0.97 -0.34 3.99 -0.02 -1.20 -4.78 135.00 136.08 1ea9 n PRO 74 Ca 0.15 0.35 0.31 0.00 -2.02 0.00 0.00 63.50 62.29 1ea9 n PRO 74 Cb 0.35 -2.01 0.57 0.00 -0.02 0.00 0.00 33.50 32.38 1ea9 n PRO 74 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1ea9 h PRO 75 N 6.98 0.08 -2.06 0.52 0.11 -1.92 -1.78 132.00 133.94 1ea9 h PRO 75 Ca -0.46 -0.00 -0.55 0.00 0.11 0.00 0.00 66.00 65.10 1ea9 h PRO 75 Cb 1.33 -0.02 -0.41 0.00 0.11 0.00 0.00 31.00 32.00 1ea9 h PRO 75 CO 0.97 0.05 -0.82 0.66 -0.21 0.00 0.00 178.00 178.65 1ea9 n TYR 76 N -5.15 2.88 -3.36 0.65 4.01 -1.26 -4.96 117.16 109.97 1ea9 n TYR 76 Ca 0.37 -3.79 -0.25 0.00 -0.16 0.00 0.00 57.90 54.07 1ea9 n TYR 76 Cb 1.24 -0.42 -0.05 0.00 -0.31 0.00 0.00 39.34 39.81 1ea9 n TYR 76 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1ea9 n ARG 77 N -0.14 -1.06 -3.62 -0.72 3.00 -0.67 -4.84 116.66 108.61 1ea9 n ARG 77 Ca 0.29 0.08 -0.13 0.00 -0.01 0.00 0.00 57.85 58.09 1ea9 n ARG 77 Cb 0.51 -3.29 -0.07 0.00 0.00 0.00 0.00 32.46 29.62 1ea9 n ARG 77 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.63 176.65 1ea9 s ARG 78 N -5.08 0.76 -0.10 5.56 1.70 -1.26 -0.61 118.95 119.92 1ea9 s ARG 78 Ca 0.49 0.82 -0.06 0.00 -0.47 0.00 0.00 55.73 56.51 1ea9 s ARG 78 Cb -0.29 0.37 0.04 0.00 -0.57 0.00 0.00 34.95 34.50 1ea9 s ARG 78 CO 0.61 -0.11 0.24 0.54 -1.08 0.00 0.00 175.30 175.50 1ea9 s VAL 79 N 0.18 -0.02 -0.05 4.99 0.11 -1.17 -4.48 120.40 119.96 1ea9 s VAL 79 Ca -0.00 0.09 0.06 0.00 -2.93 0.00 0.00 61.98 59.20 1ea9 s VAL 79 Cb -0.05 -0.36 -0.02 0.00 -1.53 0.00 0.00 36.38 34.43 1ea9 s VAL 79 CO -0.00 0.04 -0.23 -0.75 -3.33 0.00 0.00 175.10 170.82 1ea9 s LYS 80 N 0.79 2.47 0.39 1.54 2.20 -0.46 0.19 119.74 126.87 1ea9 s LYS 80 Ca -0.05 -0.87 -0.14 0.00 -0.36 0.00 0.00 55.97 54.55 1ea9 s LYS 80 Cb -0.07 -2.19 0.05 0.00 -1.51 0.00 0.00 37.83 34.12 1ea9 s LYS 80 CO -0.05 0.46 0.77 1.52 -0.36 0.00 0.00 175.35 177.69 1ea9 s TYR 81 N -0.34 0.24 0.00 4.03 1.13 0.19 -1.83 117.35 120.77 1ea9 s TYR 81 Ca 0.02 -0.90 0.00 0.00 -1.41 0.00 0.00 57.07 54.78 1ea9 s TYR 81 Cb -0.12 0.77 0.00 0.00 -1.10 0.00 0.00 41.96 41.51 1ea9 s TYR 81 CO 0.02 -1.57 0.00 0.41 -2.51 0.00 0.00 175.55 171.90 1ea9 n GLY 82 N -0.54 5.24 3.34 5.49 0.00 0.11 0.16 105.19 118.99 1ea9 n GLY 82 Ca -0.08 -1.04 -0.09 0.00 0.00 0.00 0.00 46.02 44.81 1ea9 n GLY 82 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ea9 s PHE 83 N 0.88 0.20 -0.24 1.61 0.08 -0.74 -3.44 117.98 116.34 1ea9 s PHE 83 Ca 0.00 -0.57 -0.03 0.00 0.12 0.00 0.00 56.93 56.45 1ea9 s PHE 83 Cb 0.00 0.05 -0.18 0.00 -0.57 0.00 0.00 43.02 42.32 1ea9 s PHE 83 CO 0.00 -0.71 -0.14 -0.11 -0.10 0.00 0.00 175.22 174.15 1ea9 n LEU 84 N -0.20 2.69 -3.22 -0.37 0.00 0.15 -1.39 117.00 114.67 1ea9 n LEU 84 Ca -0.10 0.02 -0.20 0.00 0.00 0.00 0.00 56.01 55.73 1ea9 n LEU 84 Cb 0.63 -0.93 0.02 0.00 0.00 0.00 0.00 43.42 43.14 1ea9 n LEU 84 CO 0.22 0.83 -0.27 0.18 0.00 0.00 0.00 177.39 178.35 1ea9 n LEU 85 N -3.53 -4.53 -4.62 -1.96 4.32 -1.26 -3.33 117.00 102.10 1ea9 n LEU 85 Ca -0.45 0.28 -0.28 0.00 -0.02 0.00 0.00 56.01 55.54 1ea9 n LEU 85 Cb 0.97 -2.19 -0.09 0.00 -1.62 0.00 0.00 43.42 40.49 1ea9 n LEU 85 CO 0.24 -1.17 -0.38 -1.58 -1.22 0.00 0.00 177.39 173.28 1ea9 s GLN 86 N -2.10 2.25 -0.20 3.23 0.74 0.38 -3.14 119.66 120.82 1ea9 s GLN 86 Ca 0.24 -1.07 -0.11 0.00 0.05 0.00 0.00 55.36 54.47 1ea9 s GLN 86 Cb -0.03 -2.33 0.07 0.00 1.10 0.00 0.00 33.01 31.81 1ea9 s GLN 86 CO 0.66 0.48 0.49 -1.14 -0.55 0.00 0.00 175.29 175.24 1ea9 s GLN 87 N -2.55 0.49 5.04 1.67 0.74 -0.49 -0.74 119.66 123.81 1ea9 s GLN 87 Ca 0.24 0.92 0.00 0.00 0.05 0.00 0.00 55.36 56.58 1ea9 s GLN 87 Cb -0.10 0.03 0.00 0.00 1.10 0.00 0.00 33.01 34.04 1ea9 s GLN 87 CO 0.16 -0.16 0.00 0.41 -0.55 0.00 0.00 175.29 175.15 1ea9 n GLY 88 N 4.30 2.27 0.00 2.59 0.00 -1.26 0.12 105.19 113.21 1ea9 n GLY 88 Ca -0.22 0.37 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1ea9 n GLY 88 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1ea9 n HIS 89 N 4.82 0.00 -3.09 1.61 8.25 -1.26 -5.00 115.22 120.55 1ea9 n HIS 89 Ca 0.00 -0.43 -0.40 0.00 -0.26 0.00 0.00 57.72 56.62 1ea9 n HIS 89 Cb 0.00 -0.04 -0.06 0.00 1.12 0.00 0.00 29.99 31.01 1ea9 n HIS 89 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 1ea9 s GLU 90 N -0.86 4.19 -0.04 -0.41 2.12 0.32 -5.06 118.70 118.95 1ea9 s GLU 90 Ca 0.00 0.64 0.04 0.00 0.36 0.00 0.00 54.97 56.01 1ea9 s GLU 90 Cb 0.00 -3.60 -0.00 0.00 0.26 0.00 0.00 34.13 30.79 1ea9 s GLU 90 CO 0.00 -0.31 -0.16 -1.59 -0.54 0.00 0.00 175.26 172.66 1ea9 s LYS 91 N 2.14 1.66 -0.24 4.30 -2.85 -1.26 -1.40 119.74 122.10 1ea9 s LYS 91 Ca 0.29 -0.57 -0.04 0.00 -1.00 0.00 0.00 55.97 54.65 1ea9 s LYS 91 Cb -0.16 -1.46 0.13 0.00 -2.06 0.00 0.00 37.83 34.28 1ea9 s LYS 91 CO 0.10 0.24 0.43 0.50 0.10 0.00 0.00 175.35 176.71 1ea9 s ARG 92 N 0.03 0.38 -0.06 1.78 3.52 -1.19 -4.85 118.95 118.57 1ea9 s ARG 92 Ca -0.03 0.77 -0.17 0.00 -0.13 0.00 0.00 55.73 56.17 1ea9 s ARG 92 Cb -0.11 -0.07 -0.05 0.00 -1.56 0.00 0.00 34.95 33.16 1ea9 s ARG 92 CO 0.02 -0.51 0.46 1.67 -0.81 0.00 0.00 175.30 176.13 1ea9 s TRP 93 N 2.62 3.62 -0.06 5.12 -2.14 -1.19 -3.99 118.94 122.92 1ea9 s TRP 93 Ca 0.09 0.97 -0.22 0.00 2.66 0.00 0.00 56.10 59.60 1ea9 s TRP 93 Cb -0.14 -2.46 -0.04 0.00 -3.10 0.00 0.00 33.47 27.73 1ea9 s TRP 93 CO -0.16 0.38 0.63 1.41 -2.66 0.00 0.00 176.95 176.55 1ea9 s MET 94 N -0.16 4.39 0.44 3.25 1.75 -0.49 -1.56 119.30 126.93 1ea9 s MET 94 Ca 0.25 0.75 0.06 0.00 -1.25 0.00 0.00 55.69 55.51 1ea9 s MET 94 Cb -0.16 -3.42 -0.04 0.00 2.84 0.00 0.00 34.83 34.05 1ea9 s MET 94 CO 0.12 0.16 0.17 0.95 -0.65 0.00 0.00 175.02 175.77 1ea9 s THR 95 N 0.51 2.07 0.56 10.11 -4.23 -0.72 -1.79 115.64 122.15 1ea9 s THR 95 Ca 0.33 -1.73 0.35 0.00 -1.18 0.00 0.00 61.69 59.46 1ea9 s THR 95 Cb -0.17 -2.80 0.51 0.00 1.34 0.00 0.00 72.50 71.38 1ea9 s THR 95 CO 0.16 0.00 1.77 -0.33 -0.54 0.00 0.00 174.62 175.68 1ea9 h GLU 96 N 1.37 0.00 0.00 3.99 4.39 -1.00 -3.37 114.58 119.96 1ea9 h GLU 96 Ca -0.42 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.28 1ea9 h GLU 96 Cb 1.26 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.91 1ea9 h GLU 96 CO 0.70 0.00 0.00 0.66 -1.16 0.00 0.00 179.01 179.21 1ea9 n TYR 97 N -3.99 0.00 -2.80 4.33 0.53 -1.26 -5.00 117.16 108.98 1ea9 n TYR 97 Ca 0.22 0.00 -0.05 0.00 -1.02 0.00 0.00 57.90 57.05 1ea9 n TYR 97 Cb 1.18 0.00 0.02 0.00 -1.03 0.00 0.00 39.34 39.51 1ea9 n TYR 97 CO 0.00 0.00 0.00 -0.25 -1.02 0.00 0.00 176.86 175.59 1ea9 n ASP 98 N -0.46 0.46 -4.17 7.72 8.00 -1.26 -5.07 116.55 121.77 1ea9 n ASP 98 Ca 0.00 -1.35 -0.39 0.00 0.71 0.00 0.00 54.79 53.76 1ea9 n ASP 98 Cb 0.00 -0.12 -0.09 0.00 -0.02 0.00 0.00 41.12 40.89 1ea9 n ASP 98 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1ea9 s PHE 99 N -0.11 3.49 1.02 1.24 0.08 -1.26 -1.76 117.98 120.68 1ea9 s PHE 99 Ca 0.16 -2.25 -0.11 0.00 0.12 0.00 0.00 56.93 54.85 1ea9 s PHE 99 Cb -0.01 -3.39 0.20 0.00 -0.57 0.00 0.00 43.02 39.25 1ea9 s PHE 99 CO 0.10 -0.95 1.09 -1.17 -0.10 0.00 0.00 175.22 174.20 1ea9 s LEU 100 N 0.77 1.97 -0.02 -0.37 0.20 -0.60 -4.84 118.68 115.79 1ea9 s LEU 100 Ca 0.11 1.89 0.04 0.00 0.69 0.00 0.00 54.13 56.86 1ea9 s LEU 100 Cb -0.22 -4.07 -0.06 0.00 -0.43 0.00 0.00 46.19 41.41 1ea9 s LEU 100 CO -0.03 -3.56 0.07 1.07 -0.29 0.00 0.00 176.35 173.61 1ea9 n THR 101 N -4.52 0.08 -5.10 3.68 5.66 -1.26 -3.15 114.28 109.67 1ea9 n THR 101 Ca 0.08 -0.12 -0.30 0.00 -3.05 0.00 0.00 64.05 60.66 1ea9 n THR 101 Cb 0.53 0.03 -0.15 0.00 -1.55 0.00 0.00 70.33 69.19 1ea9 n THR 101 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 175.07 171.32 1ea9 s GLU 102 N -2.25 1.89 -0.22 1.09 2.12 -1.26 -4.89 118.70 115.18 1ea9 s GLU 102 Ca -0.02 -0.94 -0.42 0.00 0.36 0.00 0.00 54.97 53.95 1ea9 s GLU 102 Cb 0.02 -1.90 -0.19 0.00 0.26 0.00 0.00 34.13 32.32 1ea9 s GLU 102 CO 0.18 0.51 1.40 -2.30 -0.54 0.00 0.00 175.26 174.51 1ea9 n PRO 103 N 2.25 0.28 -1.69 4.30 -0.02 -1.26 -4.76 135.00 134.10 1ea9 n PRO 103 Ca -0.16 0.10 -0.52 0.00 -2.02 0.00 0.00 63.50 60.90 1ea9 n PRO 103 Cb 0.52 -1.64 -0.06 0.00 -0.02 0.00 0.00 33.50 32.30 1ea9 n PRO 103 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1ea9 n PRO 104 N 3.10 1.70 0.12 0.52 -0.02 -1.26 -4.91 135.00 134.25 1ea9 n PRO 104 Ca 0.25 0.62 -0.11 0.00 -2.02 0.00 0.00 63.50 62.24 1ea9 n PRO 104 Cb 0.04 -2.38 -0.07 0.00 -0.02 0.00 0.00 33.50 31.07 1ea9 n PRO 104 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ea9 h ALA 105 N 7.79 -0.36 -3.18 3.55 0.00 -2.05 -3.44 119.26 121.57 1ea9 h ALA 105 Ca -0.47 -0.19 -0.62 0.00 0.00 0.00 0.00 54.91 53.62 1ea9 h ALA 105 Cb 1.29 0.14 -0.17 0.00 0.00 0.00 0.00 17.79 19.05 1ea9 h ALA 105 CO 0.93 -0.42 -0.56 0.54 0.00 0.00 0.00 179.25 179.74 1ea9 s ASN 106 N -5.23 5.66 0.00 0.00 6.03 -1.26 -4.96 114.94 115.18 1ea9 s ASN 106 Ca -0.12 0.04 0.04 0.00 -1.03 0.00 0.00 52.86 51.79 1ea9 s ASN 106 Cb 0.01 -1.99 0.21 0.00 -3.03 0.00 0.00 41.25 36.45 1ea9 s ASN 106 CO 0.44 0.12 0.95 -0.81 -2.03 0.00 0.00 177.10 175.77 1ea9 n PRO 107 N 3.93 0.06 -0.26 3.55 -0.04 -1.26 -3.40 135.00 137.58 1ea9 n PRO 107 Ca -0.16 0.24 0.05 0.00 -0.04 0.00 0.00 63.50 63.59 1ea9 n PRO 107 Cb 0.52 -1.50 0.18 0.00 -0.04 0.00 0.00 33.50 32.66 1ea9 n PRO 107 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1ea9 h ASP 108 N 0.00 0.35 -0.37 3.54 5.19 -1.93 -1.63 116.42 121.58 1ea9 h ASP 108 Ca 0.00 0.10 -0.00 0.00 -0.62 0.00 0.00 57.03 56.50 1ea9 h ASP 108 Cb 0.04 0.05 -0.00 0.00 0.18 0.00 0.00 39.33 39.60 1ea9 h ASP 108 CO 0.00 0.15 0.01 0.54 -3.12 0.00 0.00 179.24 176.82 1ea9 n ARG 109 N -4.95 3.51 -3.92 3.56 5.12 -1.22 -4.93 116.66 113.83 1ea9 n ARG 109 Ca 0.14 -2.03 -0.29 0.00 -1.93 0.00 0.00 57.85 53.73 1ea9 n ARG 109 Cb 0.38 -2.00 -0.04 0.00 -1.16 0.00 0.00 32.46 29.65 1ea9 n ARG 109 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1ea9 s LEU 110 N -1.78 4.35 0.92 0.55 1.43 -0.61 -0.40 118.68 123.13 1ea9 s LEU 110 Ca 0.35 0.25 -0.13 0.00 -1.03 0.00 0.00 54.13 53.56 1ea9 s LEU 110 Cb 0.27 -2.96 0.02 0.00 0.03 0.00 0.00 46.19 43.55 1ea9 s LEU 110 CO 0.10 0.12 0.37 0.49 0.23 0.00 0.00 176.35 177.66 1ea9 n PHE 111 N -0.03 -1.55 -3.70 0.29 3.72 0.42 -4.52 117.46 112.10 1ea9 n PHE 111 Ca -0.06 0.24 -0.12 0.00 -0.05 0.00 0.00 57.45 57.46 1ea9 n PHE 111 Cb 0.52 -1.79 -0.09 0.00 -0.94 0.00 0.00 39.48 37.18 1ea9 n PHE 111 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 176.76 174.71 1ea9 s GLU 112 N -3.44 0.56 -0.64 -1.08 2.12 -1.26 0.57 118.70 115.53 1ea9 s GLU 112 Ca 0.57 0.75 -0.05 0.00 0.36 0.00 0.00 54.97 56.61 1ea9 s GLU 112 Cb -0.23 0.22 0.17 0.00 0.26 0.00 0.00 34.13 34.55 1ea9 s GLU 112 CO 0.67 -0.09 0.48 -0.47 -0.54 0.00 0.00 175.26 175.31 1ea9 s TYR 113 N 0.56 3.47 0.00 5.30 6.04 0.13 -4.99 117.35 127.87 1ea9 s TYR 113 Ca -0.02 -2.55 0.00 0.00 0.04 0.00 0.00 57.07 54.54 1ea9 s TYR 113 Cb -0.04 -3.32 0.00 0.00 -1.04 0.00 0.00 41.96 37.56 1ea9 s TYR 113 CO -0.03 -0.88 0.00 -2.30 -1.54 0.00 0.00 175.55 170.80 1ea9 n PRO 114 N 3.67 0.00 -3.68 4.97 -0.02 -1.26 -3.04 135.00 135.64 1ea9 n PRO 114 Ca 0.08 0.00 -0.14 0.00 -2.02 0.00 0.00 63.50 61.42 1ea9 n PRO 114 Cb 0.40 0.00 -0.08 0.00 -0.02 0.00 0.00 33.50 33.79 1ea9 n PRO 114 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1ea9 s PHE 115 N -0.12 -0.56 -0.62 6.00 2.19 -1.26 -4.36 117.98 119.25 1ea9 s PHE 115 Ca 0.00 1.30 -0.27 0.00 0.33 0.00 0.00 56.93 58.29 1ea9 s PHE 115 Cb 0.00 0.21 -0.01 0.00 -1.31 0.00 0.00 43.02 41.92 1ea9 s PHE 115 CO 0.00 -0.33 1.67 0.42 1.83 0.00 0.00 175.22 178.82 1ea9 s ILE 116 N -0.02 3.49 -0.49 3.12 1.01 0.22 -4.94 121.20 123.59 1ea9 s ILE 116 Ca -0.02 0.31 -0.15 0.00 0.00 0.00 0.00 60.65 60.79 1ea9 s ILE 116 Cb -0.03 -4.21 0.10 0.00 0.01 0.00 0.00 42.46 38.32 1ea9 s ILE 116 CO 0.02 -1.14 0.42 0.20 0.00 0.00 0.00 174.94 174.44 1ea9 s ASN 117 N 6.59 6.08 0.00 3.58 0.01 -1.26 -4.92 114.94 125.02 1ea9 s ASN 117 Ca 0.59 -1.57 0.00 0.00 -0.71 0.00 0.00 52.86 51.17 1ea9 s ASN 117 Cb -0.12 -2.16 0.00 0.00 0.41 0.00 0.00 41.25 39.38 1ea9 s ASN 117 CO 0.20 -0.72 0.31 -0.81 -1.51 0.00 0.00 177.10 174.57 1ea9 n PRO 118 N 5.17 0.00 -0.08 -0.60 -0.04 -1.26 -1.47 135.00 136.72 1ea9 n PRO 118 Ca -0.12 0.03 -0.09 0.00 -0.04 0.00 0.00 63.50 63.27 1ea9 n PRO 118 Cb 0.42 -1.53 -0.04 0.00 -0.04 0.00 0.00 33.50 32.31 1ea9 n PRO 118 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 1ea9 n VAL 119 N -0.81 1.46 0.22 0.52 3.14 -1.26 -4.19 118.33 117.41 1ea9 n VAL 119 Ca 0.00 0.13 0.18 0.00 -2.96 0.00 0.00 64.34 61.69 1ea9 n VAL 119 Cb 0.03 -2.31 0.80 0.00 -1.06 0.00 0.00 33.84 31.30 1ea9 n VAL 119 CO 0.00 0.00 0.00 0.44 -6.46 0.00 0.00 176.83 170.81 1ea9 h ASP 120 N -1.00 0.00 -2.22 6.55 5.19 -1.64 -3.43 116.42 119.87 1ea9 h ASP 120 Ca -0.08 0.00 -0.62 0.00 -0.62 0.00 0.00 57.03 55.71 1ea9 h ASP 120 Cb 0.82 0.00 0.12 0.00 0.18 0.00 0.00 39.33 40.44 1ea9 h ASP 120 CO -0.05 0.00 -0.09 0.52 -3.12 0.00 0.00 179.24 176.50 1ea9 n VAL 121 N -3.33 1.99 -2.93 -1.35 0.31 -1.11 -4.73 118.33 107.18 1ea9 n VAL 121 Ca 0.02 -0.50 -0.42 0.00 -0.01 0.00 0.00 64.34 63.43 1ea9 n VAL 121 Cb 0.46 -0.74 -0.05 0.00 -0.91 0.00 0.00 33.84 32.61 1ea9 n VAL 121 CO 0.00 0.00 0.00 0.12 -1.32 0.00 0.00 176.83 175.63 1ea9 s PHE 122 N -1.14 3.15 -0.52 3.52 2.19 -1.26 -4.91 117.98 119.02 1ea9 s PHE 122 Ca 0.61 0.72 0.07 0.00 0.33 0.00 0.00 56.93 58.66 1ea9 s PHE 122 Cb -0.71 -3.34 0.25 0.00 -1.31 0.00 0.00 43.02 37.90 1ea9 s PHE 122 CO 0.59 -0.66 0.62 1.04 1.83 0.00 0.00 175.22 178.64 1ea9 n GLN 123 N 6.36 1.60 -2.26 10.12 6.02 -1.26 -4.95 117.38 133.01 1ea9 n GLN 123 Ca 0.04 -3.95 -0.41 0.00 -0.01 0.00 0.00 57.00 52.67 1ea9 n GLN 123 Cb 0.48 -1.76 -0.03 0.00 1.02 0.00 0.00 30.24 29.96 1ea9 n GLN 123 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 1ea9 s PRO 124 N -1.77 4.47 -0.97 -1.09 0.04 -1.26 -4.81 135.00 129.61 1ea9 s PRO 124 Ca 0.37 2.05 -0.28 0.00 0.04 0.00 0.00 61.00 63.19 1ea9 s PRO 124 Cb 0.15 -3.12 -0.23 0.00 0.04 0.00 0.00 34.50 31.34 1ea9 s PRO 124 CO -0.07 -0.03 2.61 -2.30 0.04 0.00 0.00 177.00 177.24 1ea9 n PRO 125 N 1.00 0.07 0.16 0.56 -0.02 -1.26 -4.75 135.00 130.75 1ea9 n PRO 125 Ca -0.00 -0.01 0.09 0.00 -2.02 0.00 0.00 63.50 61.56 1ea9 n PRO 125 Cb 0.43 -1.58 0.49 0.00 -0.02 0.00 0.00 33.50 32.81 1ea9 n PRO 125 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ea9 n ALA 126 N 10.27 0.86 0.74 3.55 0.00 -1.26 -1.48 120.51 133.19 1ea9 n ALA 126 Ca 0.64 0.17 0.08 0.00 0.00 0.00 0.00 53.44 54.33 1ea9 n ALA 126 Cb 0.08 -1.08 0.41 0.00 0.00 0.00 0.00 19.45 18.85 1ea9 n ALA 126 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.50 174.83 1ea9 n TRP 127 N -2.16 0.00 -0.04 0.00 4.27 -1.26 -2.85 117.44 115.40 1ea9 n TRP 127 Ca -0.01 0.00 -0.13 0.00 -3.89 0.00 0.00 57.50 53.47 1ea9 n TRP 127 Cb 0.16 -0.34 -0.08 0.00 -1.36 0.00 0.00 31.31 29.68 1ea9 n TRP 127 CO 0.00 0.00 0.00 -0.39 -2.29 0.00 0.00 177.69 175.01 1ea9 h VAL 128 N 0.00 1.38 -0.11 -1.67 -1.51 -1.60 -2.06 116.25 110.68 1ea9 h VAL 128 Ca 0.00 -1.33 0.01 0.00 -1.23 0.00 0.00 66.70 64.16 1ea9 h VAL 128 Cb 0.19 2.04 -0.03 0.00 -2.13 0.00 0.00 31.29 31.37 1ea9 h VAL 128 CO 0.00 0.38 -0.19 0.11 -1.23 0.00 0.00 177.57 176.63 1ea9 h LYS 129 N -0.19 -0.15 -0.98 5.19 1.57 -1.76 0.36 116.57 120.62 1ea9 h LYS 129 Ca 0.01 0.01 0.23 0.00 -1.87 0.00 0.00 60.65 59.03 1ea9 h LYS 129 Cb 0.66 0.03 -0.08 0.00 0.08 0.00 0.00 32.23 32.92 1ea9 h LYS 129 CO 0.03 -0.10 0.64 -0.44 -0.57 0.00 0.00 179.45 179.00 1ea9 h ASP 130 N -0.16 0.46 -4.17 0.86 3.32 -1.71 -3.41 116.42 111.61 1ea9 h ASP 130 Ca 0.02 0.06 -0.49 0.00 0.02 0.00 0.00 57.03 56.65 1ea9 h ASP 130 Cb 0.21 -0.02 0.05 0.00 0.22 0.00 0.00 39.33 39.80 1ea9 h ASP 130 CO -0.19 0.14 0.38 0.00 -1.72 0.00 0.00 179.24 177.85 1ea9 s ALA 131 N -5.49 2.78 -0.14 3.45 0.00 0.13 -4.98 121.76 117.51 1ea9 s ALA 131 Ca -0.09 0.44 -0.02 0.00 0.00 0.00 0.00 51.96 52.29 1ea9 s ALA 131 Cb 0.24 -3.23 0.05 0.00 0.00 0.00 0.00 23.12 20.17 1ea9 s ALA 131 CO 0.79 -0.67 0.03 0.42 0.00 0.00 0.00 175.76 176.33 1ea9 s ILE 132 N -2.34 0.39 0.00 0.00 1.09 -1.26 -4.69 121.20 114.39 1ea9 s ILE 132 Ca 0.64 -0.24 0.00 0.00 -1.10 0.00 0.00 60.65 59.96 1ea9 s ILE 132 Cb -0.16 -0.78 0.00 0.00 -1.06 0.00 0.00 42.46 40.46 1ea9 s ILE 132 CO 0.33 -0.03 0.00 0.49 -0.10 0.00 0.00 174.94 175.63 1ea9 n PHE 133 N 5.12 -2.49 0.00 3.97 3.01 -0.37 -1.77 117.46 124.93 1ea9 n PHE 133 Ca -0.08 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.38 1ea9 n PHE 133 Cb 0.48 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.95 1ea9 n PHE 133 CO 0.00 0.00 0.00 0.98 1.01 0.00 0.00 176.76 178.75 1ea9 n TYR 134 N -2.73 0.00 -2.56 1.38 4.19 -1.07 -3.66 117.16 112.71 1ea9 n TYR 134 Ca 0.00 0.00 -0.33 0.00 3.31 0.00 0.00 57.90 60.88 1ea9 n TYR 134 Cb 0.00 0.00 -0.04 0.00 0.49 0.00 0.00 39.34 39.79 1ea9 n TYR 134 CO 0.00 0.00 0.00 -1.14 0.91 0.00 0.00 176.86 176.63 1ea9 s GLN 135 N 0.00 3.88 -0.15 2.98 0.74 0.31 -2.07 119.66 125.34 1ea9 s GLN 135 Ca 0.00 1.25 -0.08 0.00 0.05 0.00 0.00 55.36 56.58 1ea9 s GLN 135 Cb 0.00 -2.11 0.06 0.00 1.10 0.00 0.00 33.01 32.05 1ea9 s GLN 135 CO 0.00 -0.35 0.37 -1.50 -0.55 0.00 0.00 175.29 173.26 1ea9 s ILE 136 N -2.12 -0.08 -0.44 -2.34 2.07 0.35 0.51 121.20 119.14 1ea9 s ILE 136 Ca 0.65 0.12 -0.20 0.00 -1.41 0.00 0.00 60.65 59.80 1ea9 s ILE 136 Cb -0.14 -0.55 0.02 0.00 0.13 0.00 0.00 42.46 41.92 1ea9 s ILE 136 CO 0.20 0.05 0.62 0.12 -1.91 0.00 0.00 174.94 174.02 1ea9 s PHE 137 N 1.48 3.08 0.25 3.50 5.99 -1.26 -2.06 117.98 128.96 1ea9 s PHE 137 Ca -0.09 -0.10 -0.03 0.00 0.00 0.00 0.00 56.93 56.72 1ea9 s PHE 137 Cb -0.09 -3.29 0.48 0.00 0.00 0.00 0.00 43.02 40.12 1ea9 s PHE 137 CO -0.12 -0.85 1.76 -1.35 -0.00 0.00 0.00 175.22 174.66 1ea9 h PRO 138 N 8.86 0.57 -0.56 10.12 0.11 -1.86 -3.15 132.00 146.09 1ea9 h PRO 138 Ca -0.25 -0.03 0.09 0.00 0.11 0.00 0.00 66.00 65.91 1ea9 h PRO 138 Cb 1.10 -0.13 -0.10 0.00 0.11 0.00 0.00 31.00 31.97 1ea9 h PRO 138 CO 0.88 0.38 -0.42 1.49 -0.21 0.00 0.00 178.00 180.12 1ea9 h GLU 139 N 0.59 -0.22 -2.25 1.05 4.22 -1.81 -3.25 114.58 112.91 1ea9 h GLU 139 Ca 0.43 0.02 -0.58 0.00 0.08 0.00 0.00 59.36 59.31 1ea9 h GLU 139 Cb 0.59 0.05 -0.42 0.00 0.50 0.00 0.00 28.75 29.47 1ea9 h GLU 139 CO -0.35 -0.15 -0.69 2.89 -2.18 0.00 0.00 179.01 178.53 1ea9 n ARG 140 N -5.41 2.96 0.01 1.92 0.00 -1.19 0.98 116.66 115.92 1ea9 n ARG 140 Ca 0.02 -4.70 -0.01 0.00 -0.00 0.00 0.00 57.85 53.15 1ea9 n ARG 140 Cb 0.35 -2.18 -0.00 0.00 -0.00 0.00 0.00 32.46 30.62 1ea9 n ARG 140 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 1ea9 n PHE 141 N -0.09 0.00 -3.81 2.89 7.35 -1.22 -3.08 117.46 119.49 1ea9 n PHE 141 Ca 0.30 0.00 -0.12 0.00 -0.76 0.00 0.00 57.45 56.87 1ea9 n PHE 141 Cb 0.42 -0.05 -0.10 0.00 0.35 0.00 0.00 39.48 40.10 1ea9 n PHE 141 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1ea9 s ALA 142 N -2.25 -0.55 -0.51 3.13 0.00 -1.26 -4.48 121.76 115.83 1ea9 s ALA 142 Ca -0.03 0.21 0.06 0.00 0.00 0.00 0.00 51.96 52.19 1ea9 s ALA 142 Cb 0.00 -0.01 0.21 0.00 0.00 0.00 0.00 23.12 23.32 1ea9 s ALA 142 CO 0.04 -0.21 0.50 -1.71 0.00 0.00 0.00 175.76 174.38 1ea9 n ASN 143 N 1.69 1.25 -0.03 0.00 4.05 -1.26 0.75 115.26 121.71 1ea9 n ASN 143 Ca -0.20 -2.84 0.00 0.00 0.45 0.00 0.00 54.58 51.98 1ea9 n ASN 143 Cb 0.56 -0.64 0.00 0.00 1.23 0.00 0.00 39.78 40.93 1ea9 n ASN 143 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1ea9 n GLY 144 N 1.89 -0.63 2.69 8.20 0.00 -1.26 -4.47 105.19 111.60 1ea9 n GLY 144 Ca 0.25 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.02 1ea9 n GLY 144 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ea9 s ASP 145 N -1.22 2.35 0.36 1.61 -1.08 -1.26 -4.78 116.67 112.65 1ea9 s ASP 145 Ca 0.00 -0.56 0.24 0.00 -0.52 0.00 0.00 52.55 51.71 1ea9 s ASP 145 Cb 0.00 -0.41 1.30 0.00 -1.46 0.00 0.00 42.92 42.36 1ea9 s ASP 145 CO 0.00 -0.30 1.73 0.74 0.52 0.00 0.00 175.17 177.86 1ea9 h THR 146 N 6.45 0.00 -2.99 1.71 2.02 -1.96 -3.39 112.91 114.75 1ea9 h THR 146 Ca -0.16 0.00 -0.68 0.00 0.77 0.00 0.00 66.41 66.35 1ea9 h THR 146 Cb 1.13 0.53 -0.18 0.00 -1.74 0.00 0.00 68.15 67.90 1ea9 h THR 146 CO 0.29 0.00 0.21 -0.13 0.37 0.00 0.00 175.52 176.26 1ea9 s ARG 147 N -3.61 3.10 0.00 6.66 3.00 -1.26 -4.76 118.95 122.08 1ea9 s ARG 147 Ca -0.03 -1.01 0.00 0.00 0.00 0.00 0.00 55.73 54.69 1ea9 s ARG 147 Cb 0.07 -4.19 0.00 0.00 0.00 0.00 0.00 34.95 30.83 1ea9 s ARG 147 CO 0.22 -1.49 0.00 0.09 0.00 0.00 0.00 175.30 174.12 1ea9 n ASN 148 N 6.63 0.00 -1.89 0.23 3.02 -1.26 -4.87 115.26 117.12 1ea9 n ASN 148 Ca -0.07 0.00 -0.06 0.00 -0.03 0.00 0.00 54.58 54.42 1ea9 n ASN 148 Cb 0.44 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.61 1ea9 n ASN 148 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1ea9 n ASP 149 N -1.34 -0.75 0.05 6.41 8.00 -1.26 -4.78 116.55 122.88 1ea9 n ASP 149 Ca 0.00 -1.83 0.06 0.00 0.71 0.00 0.00 54.79 53.73 1ea9 n ASP 149 Cb 0.00 1.34 -0.06 0.00 -0.02 0.00 0.00 41.12 42.38 1ea9 n ASP 149 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 1ea9 n PRO 150 N -0.26 0.62 -1.70 -0.24 -0.02 -1.26 -5.00 135.00 127.15 1ea9 n PRO 150 Ca -0.01 0.13 -0.30 0.00 -2.02 0.00 0.00 63.50 61.30 1ea9 n PRO 150 Cb 0.27 -1.77 0.08 0.00 -0.02 0.00 0.00 33.50 32.06 1ea9 n PRO 150 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1ea9 s GLU 151 N -3.15 2.18 0.00 -0.52 2.02 -1.26 -4.96 118.70 113.00 1ea9 s GLU 151 Ca -0.03 0.47 0.00 0.00 0.02 0.00 0.00 54.97 55.43 1ea9 s GLU 151 Cb 0.09 -1.94 0.00 0.00 0.10 0.00 0.00 34.13 32.38 1ea9 s GLU 151 CO 0.81 -1.52 0.00 0.41 0.02 0.00 0.00 175.26 174.99 1ea9 n GLY 152 N -2.55 0.00 0.00 -1.39 0.00 -1.26 -4.63 105.19 95.36 1ea9 n GLY 152 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1ea9 n GLY 152 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ea9 n THR 153 N 0.00 0.00 -0.20 2.61 -2.24 -1.26 -4.34 114.28 108.85 1ea9 n THR 153 Ca 0.00 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.70 1ea9 n THR 153 Cb 0.00 -1.77 0.07 0.00 -2.10 0.00 0.00 70.33 66.54 1ea9 n THR 153 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1ea9 n LEU 154 N 0.00 0.00 -1.63 3.22 4.77 -1.26 -4.84 117.00 117.26 1ea9 n LEU 154 Ca 0.00 -0.25 -0.15 0.00 -0.03 0.00 0.00 56.01 55.58 1ea9 n LEU 154 Cb 0.00 -0.26 0.01 0.00 -2.33 0.00 0.00 43.42 40.83 1ea9 n LEU 154 CO 0.00 -1.73 -0.30 -2.65 -1.33 0.00 0.00 177.39 171.39 1ea9 n PRO 155 N -2.86 0.00 0.00 3.23 -0.02 -1.26 -4.96 135.00 129.13 1ea9 n PRO 155 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 1ea9 n PRO 155 Cb 0.16 -0.39 0.00 0.00 -0.02 0.00 0.00 33.50 33.25 1ea9 n PRO 155 CO 0.00 0.00 0.00 -2.67 1.98 0.00 0.00 175.50 174.81 1ea9 n TRP 156 N -0.65 0.00 -1.52 6.00 4.27 -1.26 -5.13 117.44 119.14 1ea9 n TRP 156 Ca 0.02 0.00 -0.19 0.00 -3.89 0.00 0.00 57.50 53.45 1ea9 n TRP 156 Cb 0.19 0.00 0.13 0.00 -1.36 0.00 0.00 31.31 30.27 1ea9 n TRP 156 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1ea9 n GLY 157 N -0.64 -1.47 2.10 -1.67 0.00 -1.26 -5.05 105.19 97.21 1ea9 n GLY 157 Ca 0.00 -1.68 0.00 0.00 0.00 0.00 0.00 46.02 44.34 1ea9 n GLY 157 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ea9 n SER 158 N -3.59 -1.97 -0.08 1.61 3.41 -1.26 -4.89 113.62 106.84 1ea9 n SER 158 Ca 0.10 0.69 -0.12 0.00 -0.26 0.00 0.00 58.87 59.28 1ea9 n SER 158 Cb 0.36 1.97 -0.08 0.00 -0.26 0.00 0.00 64.21 66.21 1ea9 n SER 158 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ea9 n ALA 159 N -3.48 1.65 -3.27 7.33 0.00 -1.26 -4.73 120.51 116.75 1ea9 n ALA 159 Ca 0.00 -0.71 -0.29 0.00 0.00 0.00 0.00 53.44 52.44 1ea9 n ALA 159 Cb 0.00 0.12 -0.06 0.00 0.00 0.00 0.00 19.45 19.51 1ea9 n ALA 159 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1ea9 n ASP 160 N -3.01 4.23 -4.86 0.00 8.00 -1.26 -4.99 116.55 114.65 1ea9 n ASP 160 Ca -0.30 -3.50 -0.21 0.00 0.71 0.00 0.00 54.79 51.49 1ea9 n ASP 160 Cb 0.81 -0.71 -0.03 0.00 -0.02 0.00 0.00 41.12 41.17 1ea9 n ASP 160 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 1ea9 s PRO 161 N -2.76 2.77 -0.17 -0.24 0.05 -1.26 -4.84 135.00 128.55 1ea9 s PRO 161 Ca 0.41 -1.25 -0.09 0.00 0.05 0.00 0.00 61.00 60.11 1ea9 s PRO 161 Cb 0.17 -2.51 0.04 0.00 0.05 0.00 0.00 34.50 32.25 1ea9 s PRO 161 CO -0.03 0.12 0.18 2.41 0.05 0.00 0.00 177.00 179.73 1ea9 n THR 162 N -1.38-11.12 -3.13 1.26 -1.04 -1.26 -4.07 114.28 93.55 1ea9 n THR 162 Ca -0.02 2.22 -0.24 0.00 -2.04 0.00 0.00 64.05 63.97 1ea9 n THR 162 Cb 0.59 -6.09 0.00 0.00 -1.82 0.00 0.00 70.33 63.01 1ea9 n THR 162 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1ea9 s PRO 163 N -0.81 3.28 0.00 -2.82 0.02 -1.26 -3.76 135.00 129.64 1ea9 s PRO 163 Ca -0.21 -0.38 -0.00 0.00 0.02 0.00 0.00 61.00 60.43 1ea9 s PRO 163 Cb 0.01 -2.59 -0.02 0.00 0.02 0.00 0.00 34.50 31.92 1ea9 s PRO 163 CO 0.66 -0.08 1.39 0.45 -0.33 0.00 0.00 177.00 179.09 1ea9 n SER 164 N -1.96 3.38 0.00 2.53 2.88 -1.26 -4.42 113.62 114.77 1ea9 n SER 164 Ca -0.01 -1.92 0.00 0.00 -1.33 0.00 0.00 58.87 55.61 1ea9 n SER 164 Cb 0.57 -0.73 0.00 0.00 -0.75 0.00 0.00 64.21 63.29 1ea9 n SER 164 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ea9 s PHE 166 N 0.46 -0.42 0.07 0.00 0.08 -1.26 -4.66 117.98 112.24 1ea9 s PHE 166 Ca 0.00 0.14 -0.27 0.00 0.12 0.00 0.00 56.93 56.92 1ea9 s PHE 166 Cb 0.00 0.58 0.09 0.00 -0.57 0.00 0.00 43.02 43.12 1ea9 s PHE 166 CO 0.00 -0.95 0.81 -0.06 -0.10 0.00 0.00 175.22 174.93 1ea9 s PHE 167 N -3.80 -0.37 -0.65 0.36 0.08 -1.26 -4.19 117.98 108.15 1ea9 s PHE 167 Ca 0.04 0.19 -0.00 0.00 0.12 0.00 0.00 56.93 57.27 1ea9 s PHE 167 Cb -0.02 0.56 0.43 0.00 -0.57 0.00 0.00 43.02 43.42 1ea9 s PHE 167 CO -0.07 -0.68 1.87 0.41 -0.10 0.00 0.00 175.22 176.64 1ea9 n GLY 168 N -0.31 5.87 3.73 4.36 0.00 -1.26 -4.90 105.19 112.68 1ea9 n GLY 168 Ca -0.10 -2.43 -0.42 0.00 0.00 0.00 0.00 46.02 43.07 1ea9 n GLY 168 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ea9 s GLY 169 N -1.99 1.80 0.43 -0.02 0.00 0.27 -4.53 107.32 103.28 1ea9 s GLY 169 Ca 0.59 1.41 0.03 0.00 0.00 0.00 0.00 44.72 46.76 1ea9 s GLY 169 CO -0.11 2.56 0.07 0.51 0.00 0.00 0.00 173.10 176.13 1ea9 s ASP 170 N 0.85 3.20 -0.00 1.64 3.84 0.23 -4.46 116.67 121.97 1ea9 s ASP 170 Ca 0.67 -1.60 -0.19 0.00 -0.00 0.00 0.00 52.55 51.42 1ea9 s ASP 170 Cb -0.45 0.36 -0.29 0.00 -1.38 0.00 0.00 42.92 41.16 1ea9 s ASP 170 CO 0.37 -0.83 1.00 -0.07 -0.00 0.00 0.00 175.17 175.64 1ea9 h LEU 171 N 1.70 0.62 -0.84 2.11 3.38 -1.80 -3.26 115.31 117.21 1ea9 h LEU 171 Ca -0.39 -0.87 0.21 0.00 0.09 0.00 0.00 57.88 56.91 1ea9 h LEU 171 Cb 1.28 -0.20 -0.13 0.00 0.09 0.00 0.00 40.66 41.71 1ea9 h LEU 171 CO 0.66 1.43 0.26 -0.61 0.09 0.00 0.00 178.44 180.27 1ea9 h GLN 172 N -0.11 0.28 -0.51 1.13 -0.00 -1.89 0.48 115.11 114.49 1ea9 h GLN 172 Ca -0.15 -0.02 0.10 0.00 -0.00 0.00 0.00 58.65 58.59 1ea9 h GLN 172 Cb 1.68 -0.06 -0.09 0.00 0.00 0.00 0.00 27.48 29.00 1ea9 h GLN 172 CO 0.18 0.18 -0.10 0.78 0.00 0.00 0.00 178.83 179.87 1ea9 h GLY 173 N 0.29 0.40 0.77 2.39 0.00 -1.71 0.48 103.07 105.69 1ea9 h GLY 173 Ca 0.51 0.15 0.07 0.00 0.00 0.00 0.00 47.33 48.06 1ea9 h GLY 173 CO -0.57 -0.19 0.62 -2.08 0.00 0.00 0.00 176.54 174.32 1ea9 h VAL 174 N 0.02 1.07 0.00 4.60 2.07 -0.18 0.32 116.25 124.16 1ea9 h VAL 174 Ca 0.25 -0.38 -0.01 0.00 0.82 0.00 0.00 66.70 67.37 1ea9 h VAL 174 Cb 0.38 -0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 30.02 1ea9 h VAL 174 CO -0.51 0.20 -0.07 0.40 0.02 0.00 0.00 177.57 177.62 1ea9 h ILE 175 N 1.11 0.53 0.00 4.57 2.04 0.97 -2.13 117.51 124.60 1ea9 h ILE 175 Ca 0.42 -0.29 0.00 0.00 1.00 0.00 0.00 64.86 65.98 1ea9 h ILE 175 Cb 0.19 1.19 0.00 0.00 -0.74 0.00 0.00 36.82 37.47 1ea9 h ILE 175 CO -0.17 0.06 0.00 0.47 0.00 0.00 0.00 178.15 178.52 1ea9 n ASP 176 N -3.71 0.00 -0.70 1.72 8.00 0.11 -4.04 116.55 117.93 1ea9 n ASP 176 Ca -0.02 0.47 0.00 0.00 0.71 0.00 0.00 54.79 55.95 1ea9 n ASP 176 Cb 0.17 -0.46 0.00 0.00 -0.02 0.00 0.00 41.12 40.81 1ea9 n ASP 176 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1ea9 n HIS 177 N -1.87 0.00 -0.05 1.24 8.25 -0.71 -3.78 115.22 118.30 1ea9 n HIS 177 Ca 0.00 -0.13 -0.12 0.00 -0.26 0.00 0.00 57.72 57.21 1ea9 n HIS 177 Cb 0.00 -0.12 -0.06 0.00 1.12 0.00 0.00 29.99 30.93 1ea9 n HIS 177 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1ea9 h LEU 178 N 0.74 0.28 -0.44 2.41 5.85 -1.52 -1.24 115.31 121.38 1ea9 h LEU 178 Ca 0.00 -0.33 0.00 0.00 0.84 0.00 0.00 57.88 58.39 1ea9 h LEU 178 Cb 0.45 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.41 1ea9 h LEU 178 CO 0.00 0.54 0.00 -0.67 -0.34 0.00 0.00 178.44 177.97 1ea9 n ASP 179 N -4.73 0.20 -0.05 1.25 2.03 -1.25 -0.91 116.55 113.10 1ea9 n ASP 179 Ca -0.05 0.58 -0.14 0.00 0.52 0.00 0.00 54.79 55.70 1ea9 n ASP 179 Cb 0.23 -0.61 -0.12 0.00 -0.72 0.00 0.00 41.12 39.90 1ea9 n ASP 179 CO 0.00 0.00 0.00 -0.74 -1.92 0.00 0.00 177.20 174.54 1ea9 h HIS 180 N 0.00 0.03 -0.39 -0.67 -0.00 -1.50 -1.83 115.15 110.80 1ea9 h HIS 180 Ca 0.00 -0.02 -0.04 0.00 -0.00 0.00 0.00 60.37 60.31 1ea9 h HIS 180 Cb 0.07 -0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 27.45 1ea9 h HIS 180 CO 0.00 0.83 0.07 -0.07 -0.00 0.00 0.00 177.93 178.76 1ea9 h LEU 181 N -0.77 0.54 -1.54 0.26 3.38 -0.77 0.33 115.31 116.73 1ea9 h LEU 181 Ca -0.00 -0.09 0.08 0.00 0.09 0.00 0.00 57.88 57.96 1ea9 h LEU 181 Cb 0.84 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.41 1ea9 h LEU 181 CO 0.01 0.56 0.42 0.28 0.09 0.00 0.00 178.44 179.80 1ea9 h SER 182 N 0.57 0.48 -0.09 -0.43 0.02 -0.97 0.52 113.55 113.65 1ea9 h SER 182 Ca 0.13 0.01 -0.12 0.00 -0.84 0.00 0.00 61.79 60.97 1ea9 h SER 182 Cb 0.26 -0.09 0.01 0.00 0.14 0.00 0.00 62.40 62.71 1ea9 h SER 182 CO 0.00 0.30 -0.41 0.50 -1.14 0.00 0.00 176.83 176.08 1ea9 h LYS 183 N 0.54 0.43 -0.88 3.45 3.64 0.42 -3.12 116.57 121.05 1ea9 h LYS 183 Ca 0.28 -0.35 0.10 0.00 -1.27 0.00 0.00 60.65 59.41 1ea9 h LYS 183 Cb 0.41 0.07 -0.06 0.00 -0.41 0.00 0.00 32.23 32.24 1ea9 h LYS 183 CO -0.09 0.98 0.57 1.25 -2.27 0.00 0.00 179.45 179.89 1ea9 h LEU 184 N -0.01 0.77 -1.13 5.20 7.12 0.15 -3.47 115.31 123.94 1ea9 h LEU 184 Ca -0.03 0.02 0.00 0.00 0.13 0.00 0.00 57.88 58.01 1ea9 h LEU 184 Cb 1.06 -0.13 0.00 0.00 -0.53 0.00 0.00 40.66 41.05 1ea9 h LEU 184 CO 0.09 0.45 0.00 0.61 -0.13 0.00 0.00 178.44 179.45 1ea9 n GLY 185 N -1.41 0.89 3.99 3.75 0.00 0.16 -4.36 105.19 108.20 1ea9 n GLY 185 Ca 0.15 -0.62 -0.19 0.00 0.00 0.00 0.00 46.02 45.36 1ea9 n GLY 185 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ea9 s VAL 186 N -2.38 4.07 -0.03 1.61 1.01 -1.21 -4.78 120.40 118.69 1ea9 s VAL 186 Ca 0.00 -0.96 0.02 0.00 0.00 0.00 0.00 61.98 61.04 1ea9 s VAL 186 Cb 0.00 -3.41 -0.03 0.00 0.00 0.00 0.00 36.38 32.93 1ea9 s VAL 186 CO 0.00 -0.17 -0.00 0.59 0.00 0.00 0.00 175.10 175.52 1ea9 n ASN 187 N -1.67 4.10 -4.00 3.32 4.13 -0.73 -4.84 115.26 115.57 1ea9 n ASN 187 Ca -0.00 -0.01 -0.10 0.00 1.68 0.00 0.00 54.58 56.16 1ea9 n ASN 187 Cb 0.58 0.36 -0.06 0.00 -1.54 0.00 0.00 39.78 39.12 1ea9 n ASN 187 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1ea9 s ALA 188 N -2.07 -0.08 -0.08 5.41 0.00 -0.79 -1.55 121.76 122.60 1ea9 s ALA 188 Ca -0.03 -0.93 -0.04 0.00 0.00 0.00 0.00 51.96 50.97 1ea9 s ALA 188 Cb 0.01 1.05 0.04 0.00 0.00 0.00 0.00 23.12 24.22 1ea9 s ALA 188 CO 0.11 -0.78 0.18 0.08 0.00 0.00 0.00 175.76 175.35 1ea9 s VAL 189 N -4.01 -0.04 -0.23 0.00 1.01 -1.03 -2.59 120.40 113.50 1ea9 s VAL 189 Ca 0.22 0.16 -0.10 0.00 0.00 0.00 0.00 61.98 62.27 1ea9 s VAL 189 Cb 0.01 -0.29 -0.05 0.00 0.00 0.00 0.00 36.38 36.05 1ea9 s VAL 189 CO 0.07 0.07 0.14 -0.47 0.00 0.00 0.00 175.10 174.90 1ea9 s TYR 190 N 1.17 3.28 -0.16 5.22 5.04 -0.88 0.18 117.35 131.21 1ea9 s TYR 190 Ca -0.09 0.14 -0.06 0.00 -2.44 0.00 0.00 57.07 54.62 1ea9 s TYR 190 Cb -0.11 -2.24 -0.04 0.00 0.35 0.00 0.00 41.96 39.93 1ea9 s TYR 190 CO -0.07 0.04 0.04 -0.06 -1.34 0.00 0.00 175.55 174.16 1ea9 s PHE 191 N 1.00 3.21 1.22 4.97 0.40 0.11 -0.50 117.98 128.40 1ea9 s PHE 191 Ca 0.07 0.04 -0.20 0.00 -0.60 0.00 0.00 56.93 56.24 1ea9 s PHE 191 Cb -0.13 -2.00 0.29 0.00 0.51 0.00 0.00 43.02 41.69 1ea9 s PHE 191 CO 0.04 0.19 1.10 0.95 0.70 0.00 0.00 175.22 178.20 1ea9 s THR 192 N 0.11 1.56 0.30 0.64 -4.23 -0.87 -2.42 115.64 110.73 1ea9 s THR 192 Ca 0.04 0.00 -0.28 0.00 -1.18 0.00 0.00 61.69 60.26 1ea9 s THR 192 Cb -0.13 -2.47 -0.14 0.00 1.34 0.00 0.00 72.50 71.11 1ea9 s THR 192 CO 0.01 0.00 1.07 -0.81 -0.54 0.00 0.00 174.62 174.36 1ea9 n PRO 193 N -4.83 1.51 -2.71 3.99 -0.04 -1.26 -4.28 135.00 127.38 1ea9 n PRO 193 Ca 0.13 0.53 -0.08 0.00 -0.04 0.00 0.00 63.50 64.04 1ea9 n PRO 193 Cb 0.60 -1.95 0.08 0.00 -0.04 0.00 0.00 33.50 32.19 1ea9 n PRO 193 CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 1ea9 n LEU 194 N 1.17 -0.55 -4.22 1.53 -0.00 -1.26 -4.15 117.00 109.52 1ea9 n LEU 194 Ca 0.09 -3.65 -0.29 0.00 -0.00 0.00 0.00 56.01 52.16 1ea9 n LEU 194 Cb 0.33 0.27 -0.16 0.00 -0.00 0.00 0.00 43.42 43.86 1ea9 n LEU 194 CO 0.60 1.81 -0.54 -0.36 -0.00 0.00 0.00 177.39 178.90 1ea9 s PHE 195 N -1.17 2.05 -0.37 1.47 0.40 -1.26 -4.14 117.98 114.95 1ea9 s PHE 195 Ca 0.25 -0.52 -0.05 0.00 -0.60 0.00 0.00 56.93 56.01 1ea9 s PHE 195 Cb 0.41 -1.35 -0.12 0.00 0.51 0.00 0.00 43.02 42.48 1ea9 s PHE 195 CO -0.04 -0.13 0.85 1.17 0.70 0.00 0.00 175.22 177.77 1ea9 n LYS 196 N 2.83 0.00 -2.86 0.44 4.81 0.19 -4.48 118.16 119.09 1ea9 n LYS 196 Ca -0.17 0.00 -0.10 0.00 -0.87 0.00 0.00 58.31 57.17 1ea9 n LYS 196 Cb 0.52 -0.41 -0.02 0.00 0.02 0.00 0.00 35.03 35.14 1ea9 n LYS 196 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1ea9 n ALA 197 N 2.47 0.14 -1.91 3.14 0.00 -1.26 0.13 120.51 123.21 1ea9 n ALA 197 Ca 0.25 -0.73 0.05 0.00 0.00 0.00 0.00 53.44 53.01 1ea9 n ALA 197 Cb 0.04 0.40 0.11 0.00 0.00 0.00 0.00 19.45 20.00 1ea9 n ALA 197 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1ea9 n THR 198 N -0.41 1.09 -3.91 0.00 -2.24 -1.24 -4.87 114.28 102.71 1ea9 n THR 198 Ca -0.07 -1.91 -0.10 0.00 -2.27 0.00 0.00 64.05 59.71 1ea9 n THR 198 Cb 0.21 0.31 -0.06 0.00 -2.10 0.00 0.00 70.33 68.68 1ea9 n THR 198 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1ea9 s THR 199 N -1.61 0.05 0.22 4.28 -4.23 -1.26 -5.05 115.64 108.04 1ea9 s THR 199 Ca 0.31 -1.23 -0.08 0.00 -1.18 0.00 0.00 61.69 59.51 1ea9 s THR 199 Cb 0.32 -1.80 0.17 0.00 1.34 0.00 0.00 72.50 72.53 1ea9 s THR 199 CO -0.09 -0.23 1.83 -0.55 -0.54 0.00 0.00 174.62 175.05 1ea9 h ASN 200 N 2.43 0.69 -3.44 3.99 7.08 -1.94 -3.34 115.58 121.05 1ea9 h ASN 200 Ca -0.30 0.02 -0.60 0.00 -3.08 0.00 0.00 56.30 52.34 1ea9 h ASN 200 Cb 1.24 -0.12 -0.10 0.00 -2.08 0.00 0.00 38.32 37.25 1ea9 h ASN 200 CO 0.44 0.45 0.16 -1.38 -2.08 0.00 0.00 177.43 175.02 1ea9 s HIS 201 N -6.08 3.32 -0.40 4.14 -3.43 -1.26 -4.59 115.29 107.00 1ea9 s HIS 201 Ca -0.13 0.88 0.00 0.00 -0.80 0.00 0.00 55.06 55.02 1ea9 s HIS 201 Cb 0.17 -2.83 0.00 0.00 -1.43 0.00 0.00 32.58 28.49 1ea9 s HIS 201 CO 0.77 -0.26 0.70 1.63 -2.00 0.00 0.00 174.74 175.58 1ea9 n LYS 202 N 5.44 0.87 -0.00 -0.38 4.76 -1.26 -3.82 118.16 123.77 1ea9 n LYS 202 Ca -0.01 0.00 0.14 0.00 -2.87 0.00 0.00 58.31 55.57 1ea9 n LYS 202 Cb 0.49 -1.21 0.78 0.00 -1.84 0.00 0.00 35.03 33.25 1ea9 n LYS 202 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 1ea9 n TYR 203 N 0.37 0.01 -1.90 2.13 4.01 -1.26 -3.62 117.16 116.90 1ea9 n TYR 203 Ca 0.00 -0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.35 1ea9 n TYR 203 Cb 0.35 0.00 0.04 0.00 -0.31 0.00 0.00 39.34 39.42 1ea9 n TYR 203 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 1ea9 n ASP 204 N -0.81 7.37 -4.70 7.72 2.03 -1.25 -4.42 116.55 122.50 1ea9 n ASP 204 Ca 0.20 -3.83 -0.57 0.00 0.52 0.00 0.00 54.79 51.12 1ea9 n ASP 204 Cb 0.12 -1.02 -0.07 0.00 -0.72 0.00 0.00 41.12 39.43 1ea9 n ASP 204 CO 0.00 0.00 0.00 1.07 -1.92 0.00 0.00 177.20 176.35 1ea9 n THR 205 N -0.57 0.32 -0.03 5.18 5.66 -1.24 -3.72 114.28 119.87 1ea9 n THR 205 Ca 0.54 -0.06 -0.21 0.00 -3.05 0.00 0.00 64.05 61.26 1ea9 n THR 205 Cb 0.30 -1.27 -0.13 0.00 -1.55 0.00 0.00 70.33 67.69 1ea9 n THR 205 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 175.07 173.23 1ea9 n GLU 206 N 5.60 0.71 -3.67 1.09 2.13 0.34 -1.18 120.64 125.66 1ea9 n GLU 206 Ca 0.27 0.29 -0.20 0.00 0.66 0.00 0.00 57.16 58.18 1ea9 n GLU 206 Cb 0.14 -1.68 -0.18 0.00 0.27 0.00 0.00 31.44 29.99 1ea9 n GLU 206 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 1ea9 s ASP 207 N -6.96 1.07 0.00 4.31 3.68 -1.09 -3.83 116.67 113.85 1ea9 s ASP 207 Ca -0.26 0.11 0.11 0.00 2.13 0.00 0.00 52.55 54.63 1ea9 s ASP 207 Cb 0.07 -0.10 0.63 0.00 -1.45 0.00 0.00 42.92 42.08 1ea9 s ASP 207 CO 0.71 -0.25 1.25 -1.22 0.13 0.00 0.00 175.17 175.79 1ea9 n TYR 208 N 5.27 0.00 -1.27 -5.34 4.02 -1.26 -3.14 117.16 115.44 1ea9 n TYR 208 Ca -0.04 0.00 0.08 0.00 -0.01 0.00 0.00 57.90 57.94 1ea9 n TYR 208 Cb 0.50 0.00 0.16 0.00 -0.02 0.00 0.00 39.34 39.98 1ea9 n TYR 208 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 1ea9 n PHE 209 N -0.71 0.00 -3.58 -0.72 3.72 -1.26 -4.93 117.46 109.99 1ea9 n PHE 209 Ca 0.08 -1.12 -0.17 0.00 -0.05 0.00 0.00 57.45 56.19 1ea9 n PHE 209 Cb 0.04 -0.18 -0.07 0.00 -0.94 0.00 0.00 39.48 38.33 1ea9 n PHE 209 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 176.76 175.57 1ea9 s GLN 210 N -2.89 0.96 -0.06 -1.08 0.74 -1.19 -5.07 119.66 111.08 1ea9 s GLN 210 Ca 0.33 0.21 -0.22 0.00 0.05 0.00 0.00 55.36 55.73 1ea9 s GLN 210 Cb 0.30 0.45 -0.04 0.00 1.10 0.00 0.00 33.01 34.82 1ea9 s GLN 210 CO -0.00 -0.29 0.63 0.42 -0.55 0.00 0.00 175.29 175.50 1ea9 s ILE 211 N -1.13 5.04 0.10 -2.34 -1.09 -1.26 0.57 121.20 121.09 1ea9 s ILE 211 Ca -0.11 1.29 -0.36 0.00 -2.23 0.00 0.00 60.65 59.25 1ea9 s ILE 211 Cb -0.01 -3.97 -0.17 0.00 -1.58 0.00 0.00 42.46 36.73 1ea9 s ILE 211 CO 0.08 0.31 1.14 -0.67 -1.23 0.00 0.00 174.94 174.57 1ea9 n ASP 212 N 3.48 0.85 -0.32 3.58 -0.08 -1.26 -4.47 116.55 118.33 1ea9 n ASP 212 Ca -0.04 1.14 0.15 0.00 -1.51 0.00 0.00 54.79 54.53 1ea9 n ASP 212 Cb 0.51 -1.10 0.34 0.00 2.34 0.00 0.00 41.12 43.21 1ea9 n ASP 212 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1ea9 h PRO 213 N 3.45 0.40 -0.19 -0.67 0.13 -1.95 -0.58 132.00 132.59 1ea9 h PRO 213 Ca -0.45 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1ea9 h PRO 213 Cb 1.37 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.40 1ea9 h PRO 213 CO 0.70 0.27 0.12 -0.56 -0.23 0.00 0.00 178.00 178.30 1ea9 h GLN 214 N 0.42 0.25 0.23 0.86 -0.00 -1.87 -3.06 115.11 111.94 1ea9 h GLN 214 Ca 0.60 -0.02 0.01 0.00 -0.00 0.00 0.00 58.65 59.24 1ea9 h GLN 214 Cb 1.17 -0.05 -0.02 0.00 -0.00 0.00 0.00 27.48 28.57 1ea9 h GLN 214 CO -0.54 0.19 -0.27 0.74 -0.00 0.00 0.00 178.83 178.96 1ea9 h PHE 215 N 0.24 -0.72 0.00 0.06 0.05 -1.44 -3.45 116.94 111.68 1ea9 h PHE 215 Ca 0.07 0.01 0.00 0.00 3.82 0.00 0.00 57.97 61.87 1ea9 h PHE 215 Cb 0.00 0.29 0.00 0.00 2.00 0.00 0.00 35.95 38.24 1ea9 h PHE 215 CO -0.06 -0.39 0.00 0.41 -0.18 0.00 0.00 178.31 178.10 1ea9 n GLY 216 N -1.39 -0.18 0.00 -1.45 0.00 -0.71 -3.68 105.19 97.77 1ea9 n GLY 216 Ca -0.08 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.42 1ea9 n GLY 216 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1ea9 n ASP 217 N 0.00 0.00 0.37 1.61 5.68 -1.26 -4.40 116.55 118.55 1ea9 n ASP 217 Ca 0.00 -0.80 -0.18 0.00 -0.50 0.00 0.00 54.79 53.31 1ea9 n ASP 217 Cb 0.00 0.00 -0.09 0.00 -1.14 0.00 0.00 41.12 39.89 1ea9 n ASP 217 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 1ea9 h LYS 218 N 0.00 -0.88 -0.37 0.11 2.10 -1.99 -2.52 116.57 113.03 1ea9 h LYS 218 Ca 0.00 0.06 0.04 0.00 -2.00 0.00 0.00 60.65 58.75 1ea9 h LYS 218 Cb 0.00 0.20 -0.07 0.00 -0.90 0.00 0.00 32.23 31.47 1ea9 h LYS 218 CO 0.00 -0.59 -0.42 -0.44 -2.00 0.00 0.00 179.45 176.00 1ea9 h ASP 219 N -0.92 -1.44 -0.91 7.07 3.32 -1.97 1.03 116.42 122.60 1ea9 h ASP 219 Ca -0.09 0.19 0.16 0.00 0.02 0.00 0.00 57.03 57.31 1ea9 h ASP 219 Cb 0.71 0.60 -0.16 0.00 0.22 0.00 0.00 39.33 40.70 1ea9 h ASP 219 CO 0.13 -0.29 -0.32 0.71 -1.72 0.00 0.00 179.24 177.75 1ea9 h THR 220 N -0.26 0.05 0.59 0.35 1.35 -1.96 3.71 112.91 116.73 1ea9 h THR 220 Ca 0.06 0.00 -0.02 0.00 -0.55 0.00 0.00 66.41 65.90 1ea9 h THR 220 Cb 0.43 0.05 -0.01 0.00 -1.73 0.00 0.00 68.15 66.89 1ea9 h THR 220 CO -0.48 0.00 -0.45 0.25 -0.25 0.00 0.00 175.52 174.59 1ea9 h LEU 221 N -0.03 -1.17 0.01 3.87 5.85 -0.31 0.35 115.31 123.89 1ea9 h LEU 221 Ca 0.37 0.08 0.03 0.00 0.84 0.00 0.00 57.88 59.20 1ea9 h LEU 221 Cb 0.62 0.36 -0.05 0.00 0.37 0.00 0.00 40.66 41.96 1ea9 h LEU 221 CO -0.93 -0.65 -0.36 0.50 -0.34 0.00 0.00 178.44 176.66 1ea9 h LYS 222 N -1.00 -0.50 -0.58 1.25 3.64 0.53 1.07 116.57 120.97 1ea9 h LYS 222 Ca -0.07 0.03 0.17 0.00 -1.27 0.00 0.00 60.65 59.51 1ea9 h LYS 222 Cb 0.84 0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.75 1ea9 h LYS 222 CO 0.02 -0.33 0.49 -0.22 -2.27 0.00 0.00 179.45 177.13 1ea9 h LYS 223 N -0.52 0.00 0.10 1.90 3.64 0.69 0.91 116.57 123.30 1ea9 h LYS 223 Ca 0.05 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 59.25 1ea9 h LYS 223 Cb 0.60 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.44 1ea9 h LYS 223 CO -0.28 0.00 -0.78 1.25 -2.27 0.00 0.00 179.45 177.36 1ea9 h LEU 224 N 0.00 0.52 0.40 5.20 6.46 0.39 -3.27 115.31 125.01 1ea9 h LEU 224 Ca 0.28 -0.89 -0.02 0.00 -0.12 0.00 0.00 57.88 57.13 1ea9 h LEU 224 Cb 1.25 -0.16 0.00 0.00 -0.73 0.00 0.00 40.66 41.02 1ea9 h LEU 224 CO -0.00 1.36 -0.19 0.58 -0.62 0.00 0.00 178.44 179.56 1ea9 h VAL 225 N -0.24 0.61 -0.91 1.05 2.07 0.57 -2.92 116.25 116.46 1ea9 h VAL 225 Ca -0.13 -0.10 0.26 0.00 0.82 0.00 0.00 66.70 67.56 1ea9 h VAL 225 Cb 1.57 0.66 -0.15 0.00 -1.52 0.00 0.00 31.29 31.84 1ea9 h VAL 225 CO 0.15 0.02 0.26 0.44 0.02 0.00 0.00 177.57 178.46 1ea9 h ASP 226 N -0.60 0.01 0.81 0.57 3.32 0.45 0.88 116.42 121.86 1ea9 h ASP 226 Ca -0.06 0.21 -0.11 0.00 0.02 0.00 0.00 57.03 57.10 1ea9 h ASP 226 Cb 0.45 0.28 -0.02 0.00 0.22 0.00 0.00 39.33 40.27 1ea9 h ASP 226 CO 0.09 -0.20 -0.51 0.25 -1.72 0.00 0.00 179.24 177.15 1ea9 h LEU 227 N 0.18 0.00 0.43 1.55 5.85 -1.60 -1.74 115.31 119.98 1ea9 h LEU 227 Ca 0.60 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 59.30 1ea9 h LEU 227 Cb 1.26 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.30 1ea9 h LEU 227 CO -0.69 0.51 -0.21 0.00 -0.34 0.00 0.00 178.44 177.71 1ea9 n HIS 229 N -5.18 0.00 -0.11 0.00 8.25 0.13 0.27 115.22 118.57 1ea9 n HIS 229 Ca -0.09 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.22 1ea9 n HIS 229 Cb 0.28 -0.03 -0.11 0.00 1.12 0.00 0.00 29.99 31.25 1ea9 n HIS 229 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 1ea9 n GLU 230 N -1.03 0.64 -0.19 -0.41 4.07 -0.66 -4.19 120.64 118.87 1ea9 n GLU 230 Ca 0.01 0.11 0.03 0.00 -0.06 0.00 0.00 57.16 57.26 1ea9 n GLU 230 Cb 0.01 -1.46 0.11 0.00 -0.06 0.00 0.00 31.44 30.04 1ea9 n GLU 230 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 1ea9 n ARG 231 N -3.10 1.85 -3.30 5.31 1.74 0.17 -4.89 116.66 114.44 1ea9 n ARG 231 Ca -0.39 -0.89 -0.16 0.00 -0.77 0.00 0.00 57.85 55.64 1ea9 n ARG 231 Cb 0.96 -1.45 0.08 0.00 -1.02 0.00 0.00 32.46 31.03 1ea9 n ARG 231 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ea9 n GLY 232 N 0.54 -0.63 2.68 -0.13 0.00 -0.02 -5.01 105.19 102.62 1ea9 n GLY 232 Ca 0.08 0.27 -0.20 0.00 0.00 0.00 0.00 46.02 46.16 1ea9 n GLY 232 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ea9 s ILE 233 N -3.36 -0.12 1.27 -0.61 -4.36 -0.33 -4.67 121.20 109.02 1ea9 s ILE 233 Ca 0.18 0.37 -0.20 0.00 -0.26 0.00 0.00 60.65 60.73 1ea9 s ILE 233 Cb -0.02 -0.20 0.31 0.00 1.25 0.00 0.00 42.46 43.80 1ea9 s ILE 233 CO 0.70 0.14 1.06 -0.13 0.24 0.00 0.00 174.94 176.95 1ea9 s ARG 234 N 2.18 -1.76 -0.08 0.37 1.81 -0.59 -3.59 118.95 117.28 1ea9 s ARG 234 Ca 0.05 -0.03 -0.10 0.00 -1.72 0.00 0.00 55.73 53.92 1ea9 s ARG 234 Cb -0.12 -1.53 0.02 0.00 -0.45 0.00 0.00 34.95 32.87 1ea9 s ARG 234 CO -0.04 -4.07 0.27 0.08 -0.68 0.00 0.00 175.30 170.86 1ea9 s VAL 235 N -2.81 0.01 0.01 3.52 1.01 -1.26 -2.47 120.40 118.41 1ea9 s VAL 235 Ca 0.71 -0.12 0.06 0.00 0.00 0.00 0.00 61.98 62.63 1ea9 s VAL 235 Cb -0.10 -0.42 -0.02 0.00 0.00 0.00 0.00 36.38 35.84 1ea9 s VAL 235 CO 0.57 -0.06 -0.20 -0.22 0.00 0.00 0.00 175.10 175.18 1ea9 s LEU 236 N -0.17 2.10 0.02 3.92 2.96 0.13 0.11 118.68 127.75 1ea9 s LEU 236 Ca -0.03 -0.43 0.09 0.00 -0.22 0.00 0.00 54.13 53.54 1ea9 s LEU 236 Cb -0.03 -0.97 -0.03 0.00 0.50 0.00 0.00 46.19 45.66 1ea9 s LEU 236 CO 0.01 0.20 -0.26 -0.76 -1.32 0.00 0.00 176.35 174.22 1ea9 s LEU 237 N -0.78 2.13 0.12 -0.68 1.02 -0.84 0.09 118.68 119.75 1ea9 s LEU 237 Ca 0.07 -0.54 -0.30 0.00 0.02 0.00 0.00 54.13 53.38 1ea9 s LEU 237 Cb -0.08 -1.26 -0.07 0.00 0.02 0.00 0.00 46.19 44.80 1ea9 s LEU 237 CO 0.00 0.27 1.22 -0.62 0.02 0.00 0.00 176.35 177.24 1ea9 s ASP 238 N -1.03 7.06 -0.59 2.29 -1.08 -1.01 -1.33 116.67 120.97 1ea9 s ASP 238 Ca 0.11 2.15 -0.06 0.00 -0.52 0.00 0.00 52.55 54.23 1ea9 s ASP 238 Cb -0.10 -2.59 0.15 0.00 -1.46 0.00 0.00 42.92 38.92 1ea9 s ASP 238 CO 0.01 -0.44 0.43 0.00 0.52 0.00 0.00 175.17 175.69 1ea9 s ALA 239 N 0.54 3.55 -0.96 3.66 0.00 0.43 -4.77 121.76 124.21 1ea9 s ALA 239 Ca 0.57 -3.00 -0.08 0.00 0.00 0.00 0.00 51.96 49.44 1ea9 s ALA 239 Cb -0.32 -2.78 -0.15 0.00 0.00 0.00 0.00 23.12 19.87 1ea9 s ALA 239 CO 0.33 -2.04 3.12 0.28 0.00 0.00 0.00 175.76 177.45 1ea9 n VAL 240 N 4.04 3.65 1.22 0.00 0.31 -1.26 -3.03 118.33 123.26 1ea9 n VAL 240 Ca 0.04 -2.07 0.01 0.00 -0.01 0.00 0.00 64.34 62.31 1ea9 n VAL 240 Cb 0.40 -2.34 0.05 0.00 -0.91 0.00 0.00 33.84 31.04 1ea9 n VAL 240 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1ea9 n PHE 241 N 3.21 0.19 -0.06 3.52 3.01 -1.26 -4.01 117.46 122.06 1ea9 n PHE 241 Ca 0.62 -0.08 -0.12 0.00 1.01 0.00 0.00 57.45 58.89 1ea9 n PHE 241 Cb 0.48 -0.08 -0.04 0.00 -0.01 0.00 0.00 39.48 39.83 1ea9 n PHE 241 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 1ea9 n ASN 242 N -0.07 1.05 -4.30 4.37 5.15 -1.26 -4.82 115.26 115.38 1ea9 n ASN 242 Ca 0.03 0.12 -0.24 0.00 -0.60 0.00 0.00 54.58 53.90 1ea9 n ASN 242 Cb 0.23 -0.32 -0.12 0.00 -0.53 0.00 0.00 39.78 39.04 1ea9 n ASN 242 CO 0.00 0.00 0.00 -1.38 1.40 0.00 0.00 177.26 177.28 1ea9 s HIS 243 N -2.21 1.82 -0.04 1.20 -3.43 -1.26 0.16 115.29 111.54 1ea9 s HIS 243 Ca -0.16 -0.43 0.05 0.00 -0.80 0.00 0.00 55.06 53.72 1ea9 s HIS 243 Cb 0.06 -0.97 -0.01 0.00 -1.43 0.00 0.00 32.58 30.23 1ea9 s HIS 243 CO 0.21 0.24 -0.19 -1.54 -2.00 0.00 0.00 174.74 171.46 1ea9 s SER 244 N -2.12 2.35 0.42 7.38 1.04 -0.39 -4.78 113.70 117.60 1ea9 s SER 244 Ca 0.09 -0.38 -0.24 0.00 0.48 0.00 0.00 55.95 55.90 1ea9 s SER 244 Cb -0.09 -0.54 -0.11 0.00 0.10 0.00 0.00 66.02 65.39 1ea9 s SER 244 CO 0.05 0.20 0.98 0.61 0.98 0.00 0.00 173.24 176.05 1ea9 n GLY 245 N 2.95 -0.29 0.49 7.32 0.00 -0.32 -2.88 105.19 112.45 1ea9 n GLY 245 Ca -0.17 0.14 0.41 0.00 0.00 0.00 0.00 46.02 46.40 1ea9 n GLY 245 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1ea9 h ARG 246 N 1.50 0.01 0.46 1.61 9.65 -1.65 0.98 114.38 126.94 1ea9 h ARG 246 Ca -0.44 -0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 58.43 1ea9 h ARG 246 Cb 1.34 -0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.90 1ea9 h ARG 246 CO 0.57 0.00 -0.45 1.15 2.80 0.00 0.00 179.97 184.04 1ea9 h THR 247 N 0.01 0.11 0.00 0.20 2.02 -1.86 -3.39 112.91 110.00 1ea9 h THR 247 Ca 0.89 0.00 0.00 0.00 0.77 0.00 0.00 66.41 68.07 1ea9 h THR 247 Cb 2.90 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 69.42 1ea9 h THR 247 CO -0.44 0.00 0.00 0.33 0.37 0.00 0.00 175.52 175.78 1ea9 n PHE 248 N -5.53 0.00 -0.00 3.16 7.35 0.34 -4.38 117.46 118.40 1ea9 n PHE 248 Ca -0.11 0.00 -0.00 0.00 -0.76 0.00 0.00 57.45 56.58 1ea9 n PHE 248 Cb 0.43 0.00 -0.00 0.00 0.35 0.00 0.00 39.48 40.26 1ea9 n PHE 248 CO 0.00 0.00 0.00 -2.30 -0.76 0.00 0.00 176.76 173.70 1ea9 n PRO 249 N 0.00 -0.00 -0.57 -7.13 -0.02 -1.26 -1.38 135.00 124.64 1ea9 n PRO 249 Ca 0.00 0.95 0.46 0.00 -2.02 0.00 0.00 63.50 62.89 1ea9 n PRO 249 Cb 0.00 -1.43 0.76 0.00 -0.02 0.00 0.00 33.50 32.82 1ea9 n PRO 249 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1ea9 h PRO 250 N 0.00 0.02 0.50 0.52 0.11 -1.95 0.27 132.00 131.47 1ea9 h PRO 250 Ca 0.00 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.08 1ea9 h PRO 250 Cb 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1ea9 h PRO 250 CO -0.00 0.02 -0.24 0.35 -0.21 0.00 0.00 178.00 177.92 1ea9 h PHE 251 N 0.03 -0.62 -0.92 0.65 3.57 -1.53 -2.90 116.94 115.22 1ea9 h PHE 251 Ca 0.85 -0.01 0.16 0.00 3.53 0.00 0.00 57.97 62.50 1ea9 h PHE 251 Cb 3.18 0.20 -0.16 0.00 2.79 0.00 0.00 35.95 41.96 1ea9 h PHE 251 CO -0.00 -0.33 -0.29 0.28 -2.23 0.00 0.00 178.31 175.74 1ea9 n VAL 252 N -5.23 -0.43 -0.11 1.41 0.31 0.87 0.53 118.33 115.68 1ea9 n VAL 252 Ca -0.09 2.13 -0.12 0.00 -0.01 0.00 0.00 64.34 66.24 1ea9 n VAL 252 Cb 0.29 -2.88 -0.07 0.00 -0.91 0.00 0.00 33.84 30.27 1ea9 n VAL 252 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 1ea9 h ASP 253 N 0.00 -1.62 -0.93 4.52 1.82 -1.34 0.54 116.42 119.41 1ea9 h ASP 253 Ca 0.38 0.22 0.09 0.00 -0.39 0.00 0.00 57.03 57.34 1ea9 h ASP 253 Cb 0.61 0.68 -0.07 0.00 0.68 0.00 0.00 39.33 41.23 1ea9 h ASP 253 CO -0.93 -0.40 0.60 0.58 -1.61 0.00 0.00 179.24 177.48 1ea9 h VAL 254 N -0.39 0.98 0.63 2.25 2.07 0.30 0.59 116.25 122.68 1ea9 h VAL 254 Ca 0.10 -0.33 -0.03 0.00 0.82 0.00 0.00 66.70 67.26 1ea9 h VAL 254 Cb 0.60 -0.06 0.01 0.00 -1.52 0.00 0.00 31.29 30.32 1ea9 h VAL 254 CO -0.56 0.18 -0.30 -0.07 0.02 0.00 0.00 177.57 176.83 1ea9 h LEU 255 N 0.96 -0.72 -1.98 2.57 3.38 0.65 0.29 115.31 120.47 1ea9 h LEU 255 Ca 0.43 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.39 1ea9 h LEU 255 Cb 0.37 0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 1ea9 h LEU 255 CO -0.19 -0.36 0.05 0.29 0.09 0.00 0.00 178.44 178.32 1ea9 n LYS 256 N -5.12 1.19 0.00 1.13 5.02 0.17 -2.91 118.16 117.64 1ea9 n LYS 256 Ca -0.10 -0.30 0.00 0.00 -2.02 0.00 0.00 58.31 55.88 1ea9 n LYS 256 Cb 0.33 -1.22 0.00 0.00 -0.02 0.00 0.00 35.03 34.12 1ea9 n LYS 256 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1ea9 n ASN 257 N 0.27 0.00 0.00 4.39 3.02 0.18 -4.94 115.26 118.18 1ea9 n ASN 257 Ca 0.05 -1.00 0.00 0.00 -0.03 0.00 0.00 54.58 53.60 1ea9 n ASN 257 Cb 0.55 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.72 1ea9 n ASN 257 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ea9 n GLY 258 N 0.00 2.42 0.18 7.41 0.00 0.10 -2.85 105.19 112.45 1ea9 n GLY 258 Ca 0.00 0.21 -0.07 0.00 0.00 0.00 0.00 46.02 46.16 1ea9 n GLY 258 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1ea9 h GLU 259 N 0.00 -0.43 0.00 1.61 4.81 -1.81 -3.21 114.58 115.55 1ea9 h GLU 259 Ca 0.00 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1ea9 h GLU 259 Cb 0.00 0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.48 1ea9 h GLU 259 CO 0.00 -0.28 0.90 0.87 -0.73 0.00 0.00 179.01 179.76 1ea9 h LYS 260 N -0.51 0.00 -5.96 1.92 1.57 -1.93 -3.43 116.57 108.23 1ea9 h LYS 260 Ca -0.05 0.00 -0.75 0.00 -1.87 0.00 0.00 60.65 57.99 1ea9 h LYS 260 Cb 0.34 0.00 0.07 0.00 0.08 0.00 0.00 32.23 32.72 1ea9 h LYS 260 CO 0.07 0.00 -0.13 0.43 -0.57 0.00 0.00 179.45 179.26 1ea9 n SER 261 N -2.52 -0.41 0.04 0.86 7.64 -1.13 -4.81 113.62 113.29 1ea9 n SER 261 Ca -0.00 1.14 0.12 0.00 1.01 0.00 0.00 58.87 61.14 1ea9 n SER 261 Cb 0.90 -0.92 0.50 0.00 -1.01 0.00 0.00 64.21 63.68 1ea9 n SER 261 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1ea9 n LYS 262 N 1.33 0.09 -1.01 1.43 4.81 -1.26 -3.03 118.16 120.52 1ea9 n LYS 262 Ca 0.19 0.14 -0.12 0.00 -0.87 0.00 0.00 58.31 57.65 1ea9 n LYS 262 Cb 0.13 -1.62 0.18 0.00 0.02 0.00 0.00 35.03 33.75 1ea9 n LYS 262 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1ea9 n TYR 263 N -1.77 1.83 -0.23 5.64 4.02 -1.26 -4.70 117.16 120.68 1ea9 n TYR 263 Ca 0.06 -1.77 0.01 0.00 -0.01 0.00 0.00 57.90 56.19 1ea9 n TYR 263 Cb 0.33 -0.67 0.13 0.00 -0.02 0.00 0.00 39.34 39.11 1ea9 n TYR 263 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 176.86 175.63 1ea9 h LYS 264 N 1.08 0.52 -0.01 -0.72 3.64 -1.84 -2.48 116.57 116.75 1ea9 h LYS 264 Ca 0.37 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.72 1ea9 h LYS 264 Cb 1.99 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 33.69 1ea9 h LYS 264 CO 0.67 0.34 -0.26 -0.25 -2.27 0.00 0.00 179.45 177.69 1ea9 n ASP 265 N -4.91 1.57 0.09 4.20 9.92 -1.26 -4.13 116.55 122.03 1ea9 n ASP 265 Ca 0.11 -1.27 0.07 0.00 -0.53 0.00 0.00 54.79 53.17 1ea9 n ASP 265 Cb 0.29 0.20 0.34 0.00 -0.64 0.00 0.00 41.12 41.31 1ea9 n ASP 265 CO 0.00 0.00 0.00 0.79 0.13 0.00 0.00 177.20 178.12 1ea9 n TRP 266 N -0.16 0.43 0.00 1.24 7.02 -0.93 -4.60 117.44 120.43 1ea9 n TRP 266 Ca 0.13 0.22 0.00 0.00 -1.02 0.00 0.00 57.50 56.82 1ea9 n TRP 266 Cb 0.41 -0.85 0.00 0.00 -2.42 0.00 0.00 31.31 28.45 1ea9 n TRP 266 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 177.69 176.86 1ea9 n PHE 267 N -1.93 0.00 -3.37 -5.99 3.72 -1.26 -0.94 117.46 107.68 1ea9 n PHE 267 Ca -0.01 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.27 1ea9 n PHE 267 Cb 0.04 0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 38.49 1ea9 n PHE 267 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 176.76 175.70 1ea9 s HIS 268 N 3.42 -0.70 0.13 1.38 3.76 -1.26 -4.03 115.29 117.99 1ea9 s HIS 268 Ca 0.00 0.46 -0.24 0.00 -0.15 0.00 0.00 55.06 55.13 1ea9 s HIS 268 Cb 0.00 -0.16 -0.07 0.00 1.11 0.00 0.00 32.58 33.45 1ea9 s HIS 268 CO 0.00 -0.78 0.72 0.96 -0.85 0.00 0.00 174.74 174.79 1ea9 s ILE 269 N 2.48 4.50 0.00 0.60 -4.36 -1.26 -3.33 121.20 119.82 1ea9 s ILE 269 Ca 0.11 1.57 0.00 0.00 -0.26 0.00 0.00 60.65 62.07 1ea9 s ILE 269 Cb -0.15 -4.08 0.00 0.00 1.25 0.00 0.00 42.46 39.49 1ea9 s ILE 269 CO -0.21 0.52 0.00 0.54 0.24 0.00 0.00 174.94 176.03 1ea9 n ARG 270 N 1.75 0.16 -4.33 0.37 1.74 -0.82 -4.98 116.66 110.54 1ea9 n ARG 270 Ca -0.07 0.00 -0.20 0.00 -0.77 0.00 0.00 57.85 56.82 1ea9 n ARG 270 Cb 0.49 -0.76 -0.16 0.00 -1.02 0.00 0.00 32.46 31.02 1ea9 n ARG 270 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1ea9 s SER 271 N -3.41 1.11 0.15 0.55 0.15 -1.14 -5.05 113.70 106.06 1ea9 s SER 271 Ca 0.00 -0.17 -0.29 0.00 0.70 0.00 0.00 55.95 56.19 1ea9 s SER 271 Cb 0.00 -0.33 -0.07 0.00 -1.71 0.00 0.00 66.02 63.91 1ea9 s SER 271 CO 0.00 0.04 1.51 -0.07 1.20 0.00 0.00 173.24 175.92 1ea9 h LEU 272 N 6.51 -2.03-10.35 3.45 3.38 -1.98 -3.39 115.31 110.89 1ea9 h LEU 272 Ca -0.34 0.31 -0.50 0.00 0.09 0.00 0.00 57.88 57.44 1ea9 h LEU 272 Cb 1.17 0.90 0.12 0.00 0.09 0.00 0.00 40.66 42.93 1ea9 h LEU 272 CO 0.49 -0.23 0.33 -2.84 0.09 0.00 0.00 178.44 176.28 1ea9 s PRO 273 N -5.37 2.27 -0.41 1.13 0.02 -1.26 -4.42 135.00 126.95 1ea9 s PRO 273 Ca -0.11 0.89 0.05 0.00 0.02 0.00 0.00 61.00 61.85 1ea9 s PRO 273 Cb 0.10 -1.92 0.62 0.00 0.02 0.00 0.00 34.50 33.32 1ea9 s PRO 273 CO 0.59 -1.56 1.79 1.28 -0.33 0.00 0.00 177.00 178.77 1ea9 n LEU 274 N -3.43 6.01 -4.75 -5.54 7.99 -1.26 -4.87 117.00 111.14 1ea9 n LEU 274 Ca 0.08 -3.68 -0.29 0.00 -0.01 0.00 0.00 56.01 52.10 1ea9 n LEU 274 Cb 0.54 -0.78 0.13 0.00 -0.11 0.00 0.00 43.42 43.20 1ea9 n LEU 274 CO 0.55 1.13 0.69 -1.61 -1.51 0.00 0.00 177.39 176.64 1ea9 s GLU 275 N -3.30 1.28 0.21 3.23 2.02 -1.26 -4.81 118.70 116.08 1ea9 s GLU 275 Ca 0.54 0.54 0.00 0.00 0.02 0.00 0.00 54.97 56.07 1ea9 s GLU 275 Cb 0.46 -1.83 0.00 0.00 0.10 0.00 0.00 34.13 32.86 1ea9 s GLU 275 CO 0.07 -2.15 0.00 0.28 0.02 0.00 0.00 175.26 173.48 1ea9 n VAL 276 N -3.78 0.00 0.00 2.63 0.31 -1.26 -3.18 118.33 113.05 1ea9 n VAL 276 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 1ea9 n VAL 276 Cb 0.57 -0.02 0.00 0.00 -0.91 0.00 0.00 33.84 33.48 1ea9 n VAL 276 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 1ea9 n VAL 277 N -2.93 0.00 0.00 2.52 0.31 -1.26 0.14 118.33 117.10 1ea9 n VAL 277 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1ea9 n VAL 277 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 1ea9 n VAL 277 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1ea9 n ASP 278 N 1.57 2.41 0.00 4.52 2.03 -1.26 -4.97 116.55 120.85 1ea9 n ASP 278 Ca 0.00 -0.04 0.00 0.00 0.52 0.00 0.00 54.79 55.27 1ea9 n ASP 278 Cb 0.00 0.56 0.00 0.00 -0.72 0.00 0.00 41.12 40.96 1ea9 n ASP 278 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1ea9 n GLY 279 N 1.28 -2.25 3.26 0.27 0.00 0.12 -5.01 105.19 102.86 1ea9 n GLY 279 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 1ea9 n GLY 279 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ea9 s ILE 280 N 0.00 0.01 -0.52 -0.61 1.01 -1.22 -5.08 121.20 114.79 1ea9 s ILE 280 Ca 0.00 -0.05 -0.34 0.00 0.00 0.00 0.00 60.65 60.26 1ea9 s ILE 280 Cb 0.00 -0.53 -0.14 0.00 0.01 0.00 0.00 42.46 41.80 1ea9 s ILE 280 CO 0.00 -0.03 2.32 -2.65 0.00 0.00 0.00 174.94 174.58 1ea9 n PRO 281 N 2.69 0.72 0.00 2.79 -0.02 -1.26 -4.57 135.00 135.35 1ea9 n PRO 281 Ca -0.14 0.15 0.00 0.00 -2.02 0.00 0.00 63.50 61.49 1ea9 n PRO 281 Cb 0.57 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 1ea9 n PRO 281 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 1ea9 n THR 282 N 7.30 0.00 -3.79 3.45 5.66 -1.19 -4.47 114.28 121.24 1ea9 n THR 282 Ca 0.47 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 61.35 1ea9 n THR 282 Cb 0.21 -0.61 -0.11 0.00 -1.55 0.00 0.00 70.33 68.26 1ea9 n THR 282 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 1ea9 s TYR 283 N -1.61 -0.23 -0.26 1.09 1.13 -1.26 -1.94 117.35 114.26 1ea9 s TYR 283 Ca 0.00 0.54 -0.28 0.00 -1.41 0.00 0.00 57.07 55.92 1ea9 s TYR 283 Cb 0.00 0.08 -0.06 0.00 -1.10 0.00 0.00 41.96 40.88 1ea9 s TYR 283 CO 0.00 -0.19 2.25 -0.25 -2.51 0.00 0.00 175.55 174.86 1ea9 n ASP 284 N 2.56 3.08 -4.93 -0.18 9.92 -1.21 -4.88 116.55 120.91 1ea9 n ASP 284 Ca -0.15 0.11 -0.25 0.00 -0.53 0.00 0.00 54.79 53.97 1ea9 n ASP 284 Cb 0.58 -1.55 0.01 0.00 -0.64 0.00 0.00 41.12 39.52 1ea9 n ASP 284 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 1ea9 s THR 285 N 8.81 1.70 0.00 -3.53 -4.23 -1.26 0.99 115.64 118.12 1ea9 s THR 285 Ca 1.01 -1.39 0.00 0.00 -1.18 0.00 0.00 61.69 60.13 1ea9 s THR 285 Cb -0.34 -2.09 0.00 0.00 1.34 0.00 0.00 72.50 71.41 1ea9 s THR 285 CO 0.35 0.00 0.00 0.33 -0.54 0.00 0.00 174.62 174.76 1ea9 n PHE 286 N -1.88 0.00 0.00 3.99 7.35 -0.24 -4.66 117.46 122.02 1ea9 n PHE 286 Ca 0.02 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.71 1ea9 n PHE 286 Cb 0.64 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.47 1ea9 n PHE 286 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1ea9 n ALA 287 N -3.00 0.35 -2.70 3.13 0.00 -1.26 -4.93 120.51 112.10 1ea9 n ALA 287 Ca 0.00 -0.20 -0.07 0.00 0.00 0.00 0.00 53.44 53.16 1ea9 n ALA 287 Cb 0.00 0.00 0.10 0.00 0.00 0.00 0.00 19.45 19.55 1ea9 n ALA 287 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1ea9 n PHE 288 N -2.43 -2.33 -3.90 0.00 3.01 -1.26 -5.07 117.46 105.48 1ea9 n PHE 288 Ca 0.00 -1.83 -0.30 0.00 1.01 0.00 0.00 57.45 56.33 1ea9 n PHE 288 Cb 0.00 1.56 -0.15 0.00 -0.01 0.00 0.00 39.48 40.89 1ea9 n PHE 288 CO 0.00 0.00 0.00 -2.00 1.01 0.00 0.00 176.76 175.77 1ea9 s GLU 289 N 0.20 1.21 0.44 -1.08 2.56 -1.26 -4.99 118.70 115.77 1ea9 s GLU 289 Ca 0.20 -1.61 0.25 0.00 0.00 0.00 0.00 54.97 53.81 1ea9 s GLU 289 Cb 0.34 -2.74 1.26 0.00 2.00 0.00 0.00 34.13 34.99 1ea9 s GLU 289 CO -0.08 -0.97 1.77 -1.35 -0.56 0.00 0.00 175.26 174.07 1ea9 h PRO 290 N 7.72 0.25 -1.10 4.30 0.11 -1.97 -0.14 132.00 141.16 1ea9 h PRO 290 Ca -0.08 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.02 1ea9 h PRO 290 Cb 1.01 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.07 1ea9 h PRO 290 CO 0.51 0.16 0.00 1.28 -0.21 0.00 0.00 178.00 179.74 1ea9 n LEU 291 N -4.51 1.31 -2.75 2.35 4.32 -1.26 -3.80 117.00 112.67 1ea9 n LEU 291 Ca 0.26 -0.66 -0.06 0.00 -0.02 0.00 0.00 56.01 55.54 1ea9 n LEU 291 Cb 1.03 -0.29 0.03 0.00 -1.62 0.00 0.00 43.42 42.57 1ea9 n LEU 291 CO 0.29 0.24 0.20 0.23 -1.22 0.00 0.00 177.39 177.13 1ea9 n MET 292 N 0.52 0.59 -2.56 3.23 2.81 -0.07 -1.87 117.12 119.77 1ea9 n MET 292 Ca 0.00 -1.77 -0.35 0.00 -1.81 0.00 0.00 57.70 53.77 1ea9 n MET 292 Cb 0.24 -1.30 -0.04 0.00 -0.71 0.00 0.00 33.22 31.41 1ea9 n MET 292 CO 0.00 0.00 0.00 -2.14 1.51 0.00 0.00 175.97 175.34 1ea9 s PRO 293 N 0.77 3.95 0.00 0.03 0.02 -1.14 -1.08 135.00 137.56 1ea9 s PRO 293 Ca 0.30 1.41 -0.27 0.00 0.02 0.00 0.00 61.00 62.46 1ea9 s PRO 293 Cb 0.11 -2.26 -0.04 0.00 0.02 0.00 0.00 34.50 32.33 1ea9 s PRO 293 CO -0.13 -0.31 0.85 0.21 -0.33 0.00 0.00 177.00 177.29 1ea9 s LYS 294 N -2.96 4.53 0.26 5.54 2.20 0.28 -1.27 119.74 128.32 1ea9 s LYS 294 Ca 0.64 1.20 -0.30 0.00 -0.36 0.00 0.00 55.97 57.15 1ea9 s LYS 294 Cb -0.18 -3.43 -0.09 0.00 -1.51 0.00 0.00 37.83 32.62 1ea9 s LYS 294 CO 0.22 0.08 1.08 -0.51 -0.36 0.00 0.00 175.35 175.86 1ea9 s LEU 295 N 0.60 4.56 -1.09 5.43 2.01 0.43 -4.15 118.68 126.47 1ea9 s LEU 295 Ca 0.44 2.19 -0.19 0.00 0.01 0.00 0.00 54.13 56.59 1ea9 s LEU 295 Cb -0.20 -3.62 -0.07 0.00 0.01 0.00 0.00 46.19 42.31 1ea9 s LEU 295 CO 0.24 -0.11 2.02 -3.20 1.01 0.00 0.00 176.35 176.31 1ea9 n ASN 296 N 1.43 3.23 0.30 2.29 4.05 -0.12 -4.72 115.26 121.73 1ea9 n ASN 296 Ca -0.01 -2.76 0.08 0.00 0.45 0.00 0.00 54.58 52.34 1ea9 n ASN 296 Cb 0.45 -1.41 0.41 0.00 1.23 0.00 0.00 39.78 40.46 1ea9 n ASN 296 CO 0.00 0.00 0.00 0.74 -3.05 0.00 0.00 177.26 174.95 1ea9 h THR 297 N 4.55 0.00 0.00 -0.44 2.02 -1.90 1.02 112.91 118.15 1ea9 h THR 297 Ca 0.46 0.00 -0.17 0.00 0.77 0.00 0.00 66.41 67.47 1ea9 h THR 297 Cb 0.70 0.33 -0.03 0.00 -1.74 0.00 0.00 68.15 67.41 1ea9 h THR 297 CO 1.83 0.00 -1.00 -0.08 0.37 0.00 0.00 175.52 176.64 1ea9 h GLU 298 N 0.00 0.00 -6.60 6.66 4.81 -1.98 -3.42 114.58 114.05 1ea9 h GLU 298 Ca 0.00 0.00 -0.56 0.00 -0.13 0.00 0.00 59.36 58.67 1ea9 h GLU 298 Cb 1.22 0.00 0.07 0.00 0.63 0.00 0.00 28.75 30.67 1ea9 h GLU 298 CO 0.00 0.56 0.80 1.58 -0.73 0.00 0.00 179.01 181.22 1ea9 n HIS 299 N -3.14 2.43 0.12 0.92 -0.00 0.35 -4.88 115.22 111.02 1ea9 n HIS 299 Ca -0.04 0.27 -0.11 0.00 0.46 0.00 0.00 57.72 58.30 1ea9 n HIS 299 Cb 0.85 -2.55 -0.06 0.00 -0.12 0.00 0.00 29.99 28.10 1ea9 n HIS 299 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1ea9 h PRO 300 N 5.42 -0.53 -0.54 1.57 0.13 -1.89 0.07 132.00 136.22 1ea9 h PRO 300 Ca -0.45 0.04 0.06 0.00 -0.87 0.00 0.00 66.00 64.78 1ea9 h PRO 300 Cb 1.25 0.12 -0.05 0.00 0.13 0.00 0.00 31.00 32.44 1ea9 h PRO 300 CO 0.85 -0.35 0.24 -0.44 -0.23 0.00 0.00 178.00 178.07 1ea9 h ASP 301 N -0.55 0.31 -0.77 1.44 3.32 -1.96 -0.78 116.42 117.44 1ea9 h ASP 301 Ca -0.02 0.05 0.13 0.00 0.02 0.00 0.00 57.03 57.21 1ea9 h ASP 301 Cb 0.52 -0.00 -0.09 0.00 0.22 0.00 0.00 39.33 39.98 1ea9 h ASP 301 CO -0.13 0.21 0.34 0.58 -1.72 0.00 0.00 179.24 178.53 1ea9 h VAL 302 N 0.46 0.71 0.00 -1.35 2.07 -1.82 -2.05 116.25 114.28 1ea9 h VAL 302 Ca 0.25 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.60 1ea9 h VAL 302 Cb 0.22 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.14 1ea9 h VAL 302 CO -0.21 0.09 0.00 0.29 0.02 0.00 0.00 177.57 177.76 1ea9 n LYS 303 N -4.94 0.00 -0.33 1.57 5.02 -0.01 -2.45 118.16 117.02 1ea9 n LYS 303 Ca 0.14 0.56 0.01 0.00 -2.02 0.00 0.00 58.31 57.00 1ea9 n LYS 303 Cb 0.39 -1.36 0.07 0.00 -0.02 0.00 0.00 35.03 34.11 1ea9 n LYS 303 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 1ea9 n GLU 304 N -1.92 -0.16 -0.08 1.97 4.07 -1.06 0.46 120.64 123.92 1ea9 n GLU 304 Ca 0.00 1.37 -0.05 0.00 -0.06 0.00 0.00 57.16 58.42 1ea9 n GLU 304 Cb 0.00 -2.04 -0.04 0.00 -0.06 0.00 0.00 31.44 29.30 1ea9 n GLU 304 CO 0.00 0.00 0.00 -0.92 -0.06 0.00 0.00 177.13 176.15 1ea9 h TYR 305 N 0.00 -0.67 -0.92 4.31 3.20 -1.21 0.78 116.97 122.46 1ea9 h TYR 305 Ca 0.35 0.04 0.01 0.00 3.14 0.00 0.00 58.73 62.27 1ea9 h TYR 305 Cb 0.57 0.32 -0.05 0.00 1.54 0.00 0.00 36.73 39.11 1ea9 h TYR 305 CO -0.74 -0.18 0.61 -0.07 -1.64 0.00 0.00 178.16 176.14 1ea9 h LEU 306 N -0.12 1.05 0.00 2.82 3.38 -0.79 0.46 115.31 122.12 1ea9 h LEU 306 Ca 0.03 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1ea9 h LEU 306 Cb 0.21 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.70 1ea9 h LEU 306 CO -0.26 0.76 0.00 0.18 0.09 0.00 0.00 178.44 179.21 1ea9 n LEU 307 N -4.45 0.00 -0.22 1.67 4.77 0.17 0.63 117.00 119.57 1ea9 n LEU 307 Ca 0.10 0.71 0.31 0.00 -0.03 0.00 0.00 56.01 57.11 1ea9 n LEU 307 Cb 0.02 -0.21 0.69 0.00 -2.33 0.00 0.00 43.42 41.59 1ea9 n LEU 307 CO 0.36 -0.21 1.29 0.11 -1.33 0.00 0.00 177.39 177.61 1ea9 h LYS 308 N 0.00 0.00 0.50 3.23 1.79 0.50 0.18 116.57 122.78 1ea9 h LYS 308 Ca 0.00 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.45 1ea9 h LYS 308 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 1ea9 h LYS 308 CO 0.00 0.00 -0.24 0.00 -1.08 0.00 0.00 179.45 178.13 1ea9 h ALA 309 N 1.20 -0.97 -0.67 3.86 0.00 0.02 0.64 119.26 123.34 1ea9 h ALA 309 Ca 0.48 -0.15 0.10 0.00 0.00 0.00 0.00 54.91 55.35 1ea9 h ALA 309 Cb 2.23 0.26 -0.12 0.00 0.00 0.00 0.00 17.79 20.16 1ea9 h ALA 309 CO -0.01 -0.92 -0.40 0.00 0.00 0.00 0.00 179.25 177.92 1ea9 h ALA 310 N -1.56 -0.17 -0.79 0.00 0.00 0.32 0.60 119.26 117.67 1ea9 h ALA 310 Ca -0.07 0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1ea9 h ALA 310 Cb 0.52 0.93 -0.03 0.00 0.00 0.00 0.00 17.79 19.21 1ea9 h ALA 310 CO 0.11 -0.76 0.30 1.05 0.00 0.00 0.00 179.25 179.96 1ea9 h GLU 311 N -0.16 1.18 0.00 0.00 4.11 -1.36 -3.19 114.58 115.16 1ea9 h GLU 311 Ca 0.22 -0.22 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1ea9 h GLU 311 Cb 0.56 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.62 1ea9 h GLU 311 CO -0.75 0.97 0.00 0.98 0.07 0.00 0.00 179.01 180.28 1ea9 n TYR 312 N -4.27 0.00 -0.21 2.06 -0.00 0.22 0.16 117.16 115.13 1ea9 n TYR 312 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.97 1ea9 n TYR 312 Cb 0.20 -0.08 0.08 0.00 -0.00 0.00 0.00 39.34 39.54 1ea9 n TYR 312 CO 0.00 0.00 0.00 -1.49 -0.00 0.00 0.00 176.86 175.37 1ea9 h TRP 313 N 0.00 -0.21 -0.35 2.98 4.06 -1.64 0.41 115.95 121.21 1ea9 h TRP 313 Ca 0.00 0.05 0.08 0.00 2.06 0.00 0.00 58.89 61.08 1ea9 h TRP 313 Cb 0.00 0.19 -0.08 0.00 -1.00 0.00 0.00 29.16 28.27 1ea9 h TRP 313 CO -0.16 -0.23 -0.21 0.82 -3.56 0.00 0.00 178.44 175.10 1ea9 h ILE 314 N 0.05 0.42 0.25 1.49 2.04 -1.29 1.96 117.51 122.43 1ea9 h ILE 314 Ca 0.32 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.19 1ea9 h ILE 314 Cb 0.51 0.42 -0.03 0.00 -0.74 0.00 0.00 36.82 36.98 1ea9 h ILE 314 CO -0.61 0.00 -0.32 -0.09 0.00 0.00 0.00 178.15 177.13 1ea9 h ARG 315 N -0.16 -0.61 0.06 2.37 2.43 0.55 0.03 114.38 119.05 1ea9 h ARG 315 Ca 0.17 0.04 -0.34 0.00 -0.81 0.00 0.00 59.98 59.05 1ea9 h ARG 315 Cb 0.43 0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 30.08 1ea9 h ARG 315 CO -0.44 -0.40 -1.90 0.39 -1.51 0.00 0.00 179.97 176.10 1ea9 n GLU 316 N -5.43 0.67 0.16 0.20 1.02 0.99 -4.23 120.64 114.03 1ea9 n GLU 316 Ca -0.08 0.34 0.02 0.00 -0.02 0.00 0.00 57.16 57.41 1ea9 n GLU 316 Cb 0.34 -1.68 0.26 0.00 -0.02 0.00 0.00 31.44 30.34 1ea9 n GLU 316 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 1ea9 h THR 317 N -0.36 1.23 -1.17 2.62 2.02 0.29 -3.47 112.91 114.08 1ea9 h THR 317 Ca -0.45 -1.77 -0.22 0.00 0.77 0.00 0.00 66.41 64.75 1ea9 h THR 317 Cb 1.76 1.99 -0.04 0.00 -1.74 0.00 0.00 68.15 70.12 1ea9 h THR 317 CO -0.07 0.48 -0.25 0.61 0.37 0.00 0.00 175.52 176.66 1ea9 n GLY 318 N 0.10 0.39 3.20 2.16 0.00 -0.00 -4.82 105.19 106.21 1ea9 n GLY 318 Ca -0.01 -0.47 -0.26 0.00 0.00 0.00 0.00 46.02 45.27 1ea9 n GLY 318 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1ea9 n ILE 319 N -3.53 0.00 -0.36 -0.61 -5.35 -1.25 -4.94 119.36 103.31 1ea9 n ILE 319 Ca -0.12 -0.12 0.07 0.00 -0.27 0.00 0.00 62.75 62.31 1ea9 n ILE 319 Cb 0.51 -0.80 0.22 0.00 -1.74 0.00 0.00 39.64 37.83 1ea9 n ILE 319 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1ea9 n ASP 320 N -3.86 3.43 0.00 7.28 8.00 0.12 -4.88 116.55 126.64 1ea9 n ASP 320 Ca 0.08 -2.17 0.00 0.00 0.71 0.00 0.00 54.79 53.41 1ea9 n ASP 320 Cb 0.52 -0.35 0.00 0.00 -0.02 0.00 0.00 41.12 41.26 1ea9 n ASP 320 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ea9 n GLY 321 N 0.66 2.62 3.31 0.44 0.00 -1.07 -2.52 105.19 108.64 1ea9 n GLY 321 Ca 0.17 -1.52 -0.31 0.00 0.00 0.00 0.00 46.02 44.35 1ea9 n GLY 321 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1ea9 s TRP 322 N -1.95 2.40 -0.09 1.61 0.52 0.71 -1.99 118.94 120.15 1ea9 s TRP 322 Ca 0.00 -0.51 -0.05 0.00 0.02 0.00 0.00 56.10 55.56 1ea9 s TRP 322 Cb 0.00 -1.55 -0.04 0.00 -1.15 0.00 0.00 33.47 30.73 1ea9 s TRP 322 CO 0.00 -0.08 0.12 0.50 0.02 0.00 0.00 176.95 177.51 1ea9 s ARG 323 N -0.46 3.33 -0.62 4.98 3.00 -0.44 -0.01 118.95 128.73 1ea9 s ARG 323 Ca 0.05 -0.23 -0.13 0.00 -1.00 0.00 0.00 55.73 54.43 1ea9 s ARG 323 Cb -0.11 -3.09 0.16 0.00 0.00 0.00 0.00 34.95 31.91 1ea9 s ARG 323 CO 0.01 0.74 0.54 -0.51 0.00 0.00 0.00 175.30 176.09 1ea9 s LEU 324 N -1.16 6.18 0.03 -0.88 1.43 0.55 -0.43 118.68 124.41 1ea9 s LEU 324 Ca 0.17 -2.18 -0.04 0.00 -1.03 0.00 0.00 54.13 51.05 1ea9 s LEU 324 Cb -0.12 -2.14 0.01 0.00 0.03 0.00 0.00 46.19 43.97 1ea9 s LEU 324 CO 0.06 -0.70 0.23 -0.90 0.23 0.00 0.00 176.35 175.27 1ea9 n ASP 325 N 4.64 -0.13 -3.24 2.29 5.75 -1.17 0.10 116.55 124.81 1ea9 n ASP 325 Ca -0.02 0.26 -0.03 0.00 -0.01 0.00 0.00 54.79 54.99 1ea9 n ASP 325 Cb 0.42 -0.05 -0.04 0.00 -1.03 0.00 0.00 41.12 40.43 1ea9 n ASP 325 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1ea9 s VAL 326 N -5.11 -0.81 -0.16 2.12 1.01 -1.26 -4.45 120.40 111.75 1ea9 s VAL 326 Ca -0.02 -0.09 0.17 0.00 0.00 0.00 0.00 61.98 62.04 1ea9 s VAL 326 Cb 0.02 -0.95 -0.24 0.00 0.00 0.00 0.00 36.38 35.21 1ea9 s VAL 326 CO 0.10 -0.10 0.12 0.00 0.00 0.00 0.00 175.10 175.22 1ea9 n ALA 327 N 5.39 1.72 0.18 5.51 0.00 -1.22 -4.49 120.51 127.61 1ea9 n ALA 327 Ca 0.00 -1.13 0.00 0.00 0.00 0.00 0.00 53.44 52.32 1ea9 n ALA 327 Cb 0.51 -0.23 0.00 0.00 0.00 0.00 0.00 19.45 19.73 1ea9 n ALA 327 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1ea9 n ASN 328 N -2.62 0.76 0.00 0.00 2.04 -1.26 -0.76 115.26 113.42 1ea9 n ASN 328 Ca -0.26 -0.58 0.00 0.00 -0.44 0.00 0.00 54.58 53.29 1ea9 n ASN 328 Cb 1.02 -0.13 0.00 0.00 -2.53 0.00 0.00 39.78 38.14 1ea9 n ASN 328 CO 0.00 0.00 0.00 -0.62 -0.44 0.00 0.00 177.26 176.20 1ea9 n GLU 329 N 1.03 0.00 -4.33 -3.83 1.02 -1.26 -5.11 120.64 108.17 1ea9 n GLU 329 Ca 0.00 -0.02 -0.35 0.00 -0.02 0.00 0.00 57.16 56.77 1ea9 n GLU 329 Cb 0.11 -0.13 -0.10 0.00 -0.02 0.00 0.00 31.44 31.31 1ea9 n GLU 329 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1ea9 s VAL 330 N 0.00 4.30 0.00 2.62 1.01 0.06 -5.04 120.40 123.36 1ea9 s VAL 330 Ca 0.00 -0.24 -0.26 0.00 0.00 0.00 0.00 61.98 61.48 1ea9 s VAL 330 Cb 0.00 -2.84 -0.13 0.00 0.00 0.00 0.00 36.38 33.41 1ea9 s VAL 330 CO 0.00 0.56 0.70 -1.54 0.00 0.00 0.00 175.10 174.83 1ea9 n SER 331 N 2.60 -0.02 0.23 3.32 3.41 -1.26 -4.77 113.62 117.13 1ea9 n SER 331 Ca -0.18 0.77 0.10 0.00 -0.26 0.00 0.00 58.87 59.29 1ea9 n SER 331 Cb 0.53 -0.61 0.55 0.00 -0.26 0.00 0.00 64.21 64.42 1ea9 n SER 331 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 175.04 175.33 1ea9 h HIS 332 N 1.97 0.00 0.77 7.33 3.86 -1.96 -2.64 115.15 124.48 1ea9 h HIS 332 Ca -0.34 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 58.84 1ea9 h HIS 332 Cb 0.95 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.42 1ea9 h HIS 332 CO 0.38 0.22 -0.37 0.37 0.86 0.00 0.00 177.93 179.38 1ea9 h GLN 333 N 0.00 -1.00 -1.01 2.45 5.75 -1.98 -1.15 115.11 118.17 1ea9 h GLN 333 Ca -0.00 0.07 0.27 0.00 -0.15 0.00 0.00 58.65 58.84 1ea9 h GLN 333 Cb 0.58 0.23 -0.13 0.00 1.07 0.00 0.00 27.48 29.23 1ea9 h GLN 333 CO 0.03 -0.67 0.60 0.35 -2.65 0.00 0.00 178.83 176.49 1ea9 h PHE 334 N -1.25 0.97 -0.98 3.99 3.04 -1.82 1.42 116.94 122.31 1ea9 h PHE 334 Ca -0.11 0.04 0.05 0.00 3.98 0.00 0.00 57.97 61.93 1ea9 h PHE 334 Cb 0.80 -0.27 -0.06 0.00 2.56 0.00 0.00 35.95 38.97 1ea9 h PHE 334 CO 0.01 -0.01 0.64 -1.49 -2.02 0.00 0.00 178.31 175.44 1ea9 h TRP 335 N 0.50 1.18 0.06 0.41 -0.00 -1.17 0.77 115.95 117.70 1ea9 h TRP 335 Ca 0.67 0.03 -0.00 0.00 -0.00 0.00 0.00 58.89 59.59 1ea9 h TRP 335 Cb 1.38 -0.39 0.00 0.00 -0.00 0.00 0.00 29.16 30.15 1ea9 h TRP 335 CO -0.01 0.65 -0.03 0.00 -0.00 0.00 0.00 178.44 179.06 1ea9 h ARG 336 N 1.19 -0.08 -1.10 0.49 2.47 0.32 -2.76 114.38 114.91 1ea9 h ARG 336 Ca 0.40 0.01 0.32 0.00 -1.26 0.00 0.00 59.98 59.44 1ea9 h ARG 336 Cb 0.08 0.02 -0.11 0.00 -1.65 0.00 0.00 29.97 28.30 1ea9 h ARG 336 CO -0.14 -0.06 0.70 0.93 0.56 0.00 0.00 179.97 181.96 1ea9 h GLU 337 N -0.09 0.31 0.16 0.04 5.08 -1.04 -1.66 114.58 117.38 1ea9 h GLU 337 Ca -0.01 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1ea9 h GLU 337 Cb 0.07 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.21 1ea9 h GLU 337 CO 0.01 0.20 -0.42 0.35 -1.00 0.00 0.00 179.01 178.16 1ea9 h PHE 338 N 0.32 -1.20 -0.07 4.33 3.57 0.70 -2.51 116.94 122.07 1ea9 h PHE 338 Ca 0.68 0.03 0.02 0.00 3.53 0.00 0.00 57.97 62.22 1ea9 h PHE 338 Cb 1.79 0.50 -0.04 0.00 2.79 0.00 0.00 35.95 40.99 1ea9 h PHE 338 CO -0.00 -0.49 -0.35 -0.09 -2.23 0.00 0.00 178.31 175.14 1ea9 h ARG 339 N -0.65 -0.37 -0.88 1.11 2.43 -1.01 0.11 114.38 115.12 1ea9 h ARG 339 Ca -0.02 0.03 0.21 0.00 -0.81 0.00 0.00 59.98 59.39 1ea9 h ARG 339 Cb 0.63 0.09 -0.17 0.00 -0.42 0.00 0.00 29.97 30.10 1ea9 h ARG 339 CO -0.19 -0.25 -0.08 -2.13 -1.51 0.00 0.00 179.97 175.81 1ea9 n ARG 340 N -4.42 -0.07 0.24 0.20 3.00 -1.20 -0.15 116.66 114.27 1ea9 n ARG 340 Ca -0.04 1.34 -0.09 0.00 -0.00 0.00 0.00 57.85 59.05 1ea9 n ARG 340 Cb 0.25 -2.07 -0.05 0.00 0.00 0.00 0.00 32.46 30.59 1ea9 n ARG 340 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 1ea9 h VAL 341 N 0.00 0.00 0.00 5.15 2.07 -0.73 -0.71 116.25 122.03 1ea9 h VAL 341 Ca 0.49 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.94 1ea9 h VAL 341 Cb 0.91 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.68 1ea9 h VAL 341 CO -0.86 0.00 0.01 1.33 0.02 0.00 0.00 177.57 178.07 1ea9 n VAL 342 N -3.86 0.42 -0.12 2.57 0.24 -0.11 -0.79 118.33 116.68 1ea9 n VAL 342 Ca -0.08 0.12 -0.24 0.00 -2.04 0.00 0.00 64.34 62.10 1ea9 n VAL 342 Cb 0.24 -1.12 -0.11 0.00 -1.47 0.00 0.00 33.84 31.39 1ea9 n VAL 342 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1ea9 n LYS 343 N -1.07 0.62 0.00 7.34 4.76 0.79 -3.19 118.16 127.42 1ea9 n LYS 343 Ca 0.00 0.24 0.07 0.00 -2.87 0.00 0.00 58.31 55.76 1ea9 n LYS 343 Cb 0.01 -1.54 0.41 0.00 -1.84 0.00 0.00 35.03 32.07 1ea9 n LYS 343 CO 0.00 0.00 0.00 0.94 -1.37 0.00 0.00 177.40 176.97 1ea9 n GLN 344 N -3.82 0.36 -0.11 1.97 7.27 0.03 -1.13 117.38 121.96 1ea9 n GLN 344 Ca -0.48 0.06 -0.17 0.00 0.07 0.00 0.00 57.00 56.49 1ea9 n GLN 344 Cb 0.92 -1.50 -0.09 0.00 2.41 0.00 0.00 30.24 31.98 1ea9 n GLN 344 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1ea9 n ALA 345 N -1.11 1.54 -3.21 1.69 0.00 -0.93 -4.91 120.51 113.58 1ea9 n ALA 345 Ca 0.09 -0.90 -0.01 0.00 0.00 0.00 0.00 53.44 52.62 1ea9 n ALA 345 Cb 0.08 0.05 -0.02 0.00 0.00 0.00 0.00 19.45 19.55 1ea9 n ALA 345 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1ea9 s ASN 346 N -6.24 -0.82 0.13 0.00 3.84 -0.88 -4.85 114.94 106.11 1ea9 s ASN 346 Ca -0.29 -0.04 -0.30 0.00 0.21 0.00 0.00 52.86 52.43 1ea9 s ASN 346 Cb 0.08 1.66 -0.07 0.00 -0.55 0.00 0.00 41.25 42.37 1ea9 s ASN 346 CO 0.47 -0.32 1.57 -0.65 -2.79 0.00 0.00 177.10 175.38 1ea9 h PRO 347 N 8.06 -0.49 0.00 0.43 0.11 -1.33 0.17 132.00 138.95 1ea9 h PRO 347 Ca -0.04 0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.10 1ea9 h PRO 347 Cb 1.16 0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1ea9 h PRO 347 CO 0.20 -0.33 0.00 -0.25 -0.21 0.00 0.00 178.00 177.41 1ea9 n ASP 348 N -5.44 0.00 -4.69 -2.05 9.92 -1.26 -4.74 116.55 108.30 1ea9 n ASP 348 Ca -0.04 0.00 -0.43 0.00 -0.53 0.00 0.00 54.79 53.79 1ea9 n ASP 348 Cb 0.37 0.00 -0.01 0.00 -0.64 0.00 0.00 41.12 40.84 1ea9 n ASP 348 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1ea9 n ALA 349 N -0.74 1.13 -2.89 2.24 0.00 0.60 -4.77 120.51 116.07 1ea9 n ALA 349 Ca 0.00 0.36 -0.38 0.00 0.00 0.00 0.00 53.44 53.41 1ea9 n ALA 349 Cb 0.00 -2.23 -0.12 0.00 0.00 0.00 0.00 19.45 17.10 1ea9 n ALA 349 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1ea9 s TYR 350 N -1.10 3.17 -0.84 0.00 5.04 -1.05 -4.72 117.35 117.85 1ea9 s TYR 350 Ca 0.56 -0.58 -0.14 0.00 -2.44 0.00 0.00 57.07 54.47 1ea9 s TYR 350 Cb -0.58 -2.35 0.22 0.00 0.35 0.00 0.00 41.96 39.60 1ea9 s TYR 350 CO 0.62 -0.46 0.80 0.42 -1.34 0.00 0.00 175.55 175.60 1ea9 s ILE 351 N 1.61 5.57 -0.10 3.14 1.01 -1.26 -0.21 121.20 130.96 1ea9 s ILE 351 Ca 0.05 -2.44 -0.10 0.00 0.00 0.00 0.00 60.65 58.15 1ea9 s ILE 351 Cb -0.17 -4.50 -0.05 0.00 0.01 0.00 0.00 42.46 37.76 1ea9 s ILE 351 CO 0.06 -1.07 0.24 -0.22 0.00 0.00 0.00 174.94 173.95 1ea9 s LEU 352 N 0.29 4.38 0.19 2.97 2.96 0.99 -1.03 118.68 129.43 1ea9 s LEU 352 Ca 0.19 0.60 0.08 0.00 -0.22 0.00 0.00 54.13 54.78 1ea9 s LEU 352 Cb -0.10 -2.26 -0.04 0.00 0.50 0.00 0.00 46.19 44.29 1ea9 s LEU 352 CO -0.09 0.33 -0.16 -0.83 -1.32 0.00 0.00 176.35 174.28 1ea9 s GLY 353 N -0.74 1.41 -0.69 7.98 0.00 -0.88 0.21 107.32 114.60 1ea9 s GLY 353 Ca 0.17 -1.59 -0.18 0.00 0.00 0.00 0.00 44.72 43.11 1ea9 s GLY 353 CO 0.06 -1.68 0.81 1.85 0.00 0.00 0.00 173.10 174.15 1ea9 s GLU 354 N -3.34 3.23 -0.23 2.90 2.12 0.12 -2.16 118.70 121.34 1ea9 s GLU 354 Ca 0.20 -1.54 -0.01 0.00 0.36 0.00 0.00 54.97 53.98 1ea9 s GLU 354 Cb -0.03 -4.41 0.07 0.00 0.26 0.00 0.00 34.13 30.02 1ea9 s GLU 354 CO 0.07 -1.57 0.01 0.08 -0.54 0.00 0.00 175.26 173.31 1ea9 s VAL 355 N 2.41 0.97 -0.43 3.70 1.01 -1.26 -3.37 120.40 123.44 1ea9 s VAL 355 Ca 0.17 -0.97 0.25 0.00 0.00 0.00 0.00 61.98 61.43 1ea9 s VAL 355 Cb -0.18 -1.44 0.33 0.00 0.00 0.00 0.00 36.38 35.09 1ea9 s VAL 355 CO 0.01 -0.26 1.70 -0.50 0.00 0.00 0.00 175.10 176.06 1ea9 h TRP 356 N 8.10 0.00 -1.57 5.22 4.06 -1.94 -3.35 115.95 126.48 1ea9 h TRP 356 Ca -0.16 0.00 -0.48 0.00 2.06 0.00 0.00 58.89 60.30 1ea9 h TRP 356 Cb 1.08 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 29.22 1ea9 h TRP 356 CO 0.38 0.00 -0.38 -3.38 -3.56 0.00 0.00 178.44 171.50 1ea9 s HIS 357 N -3.25 2.76 -0.39 0.49 -3.43 -1.26 -3.88 115.29 106.32 1ea9 s HIS 357 Ca 0.07 -0.45 -0.43 0.00 -0.80 0.00 0.00 55.06 53.45 1ea9 s HIS 357 Cb 0.07 -2.13 -0.17 0.00 -1.43 0.00 0.00 32.58 28.92 1ea9 s HIS 357 CO 0.63 -0.10 1.74 -1.91 -2.00 0.00 0.00 174.74 173.09 1ea9 n GLU 358 N -1.55 0.60 -1.92 -0.38 0.00 -1.26 -4.87 120.64 111.26 1ea9 n GLU 358 Ca 0.03 0.22 -0.14 0.00 0.00 0.00 0.00 57.16 57.27 1ea9 n GLU 358 Cb 0.61 -1.83 0.05 0.00 0.00 0.00 0.00 31.44 30.27 1ea9 n GLU 358 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.13 176.00 1ea9 n SER 359 N 5.21 3.69 0.15 4.31 3.41 -1.26 -4.77 113.62 124.35 1ea9 n SER 359 Ca 0.31 -3.40 0.10 0.00 -0.26 0.00 0.00 58.87 55.62 1ea9 n SER 359 Cb 0.04 -0.39 0.53 0.00 -0.26 0.00 0.00 64.21 64.13 1ea9 n SER 359 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1ea9 n SER 360 N -0.70 0.51 -0.00 4.04 3.41 -1.26 -1.80 113.62 117.81 1ea9 n SER 360 Ca 0.32 0.73 -0.13 0.00 -0.26 0.00 0.00 58.87 59.54 1ea9 n SER 360 Cb 0.91 -0.80 -0.09 0.00 -0.26 0.00 0.00 64.21 63.97 1ea9 n SER 360 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 1ea9 h ILE 361 N 0.00 1.26 0.00 -1.33 5.03 -1.98 -3.13 117.51 117.36 1ea9 h ILE 361 Ca 0.00 -0.79 0.00 0.00 -0.12 0.00 0.00 64.86 63.95 1ea9 h ILE 361 Cb 0.01 1.75 0.00 0.00 -3.03 0.00 0.00 36.82 35.55 1ea9 h ILE 361 CO 0.00 0.21 0.00 -0.50 -0.68 0.00 0.00 178.15 177.18 1ea9 h TRP 362 N -0.28 0.00 -2.31 1.37 6.55 -1.75 -3.35 115.95 116.18 1ea9 h TRP 362 Ca 0.01 0.00 -0.80 0.00 0.95 0.00 0.00 58.89 59.05 1ea9 h TRP 362 Cb 0.34 0.00 -0.25 0.00 -0.86 0.00 0.00 29.16 28.39 1ea9 h TRP 362 CO 0.04 0.00 1.16 1.28 -1.05 0.00 0.00 178.44 179.87 1ea9 n LEU 363 N -2.93 7.05 -0.04 -4.49 4.77 -1.05 -1.44 117.00 118.86 1ea9 n LEU 363 Ca 0.04 -5.22 0.03 0.00 -0.03 0.00 0.00 56.01 50.83 1ea9 n LEU 363 Cb 0.49 -1.25 0.04 0.00 -2.33 0.00 0.00 43.42 40.37 1ea9 n LEU 363 CO 0.32 1.88 0.48 1.21 -1.33 0.00 0.00 177.39 179.95 1ea9 n GLU 364 N 0.90 2.07 -0.99 3.23 4.07 -1.26 -4.88 120.64 123.79 1ea9 n GLU 364 Ca 0.40 -1.70 0.00 0.00 -0.06 0.00 0.00 57.16 55.81 1ea9 n GLU 364 Cb 0.29 -1.08 0.00 0.00 -0.06 0.00 0.00 31.44 30.60 1ea9 n GLU 364 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1ea9 n GLY 365 N -0.70 0.30 0.00 8.31 0.00 -1.26 -4.80 105.19 107.04 1ea9 n GLY 365 Ca 0.05 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.14 1ea9 n GLY 365 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1ea9 n ASP 366 N -0.41 0.93 0.10 1.61 5.75 -1.26 -4.81 116.55 118.46 1ea9 n ASP 366 Ca 0.00 -0.61 0.00 0.00 -0.01 0.00 0.00 54.79 54.17 1ea9 n ASP 366 Cb 0.20 1.19 0.00 0.00 -1.03 0.00 0.00 41.12 41.49 1ea9 n ASP 366 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ea9 n GLN 367 N -1.54 0.00 -3.17 0.11 6.02 -1.23 -4.29 117.38 113.28 1ea9 n GLN 367 Ca 0.01 0.00 -0.20 0.00 -0.01 0.00 0.00 57.00 56.80 1ea9 n GLN 367 Cb 0.28 0.00 0.03 0.00 1.02 0.00 0.00 30.24 31.57 1ea9 n GLN 367 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 1ea9 n PHE 368 N -3.14 -1.59 -0.03 1.08 3.72 -0.52 -4.62 117.46 112.37 1ea9 n PHE 368 Ca 0.00 -2.01 -0.04 0.00 -0.05 0.00 0.00 57.45 55.35 1ea9 n PHE 368 Cb 0.00 -0.46 -0.03 0.00 -0.94 0.00 0.00 39.48 38.05 1ea9 n PHE 368 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1ea9 n ASP 369 N -2.14 3.62 -2.41 4.37 8.00 -0.20 -4.56 116.55 123.22 1ea9 n ASP 369 Ca 0.07 -0.02 -0.04 0.00 0.71 0.00 0.00 54.79 55.51 1ea9 n ASP 369 Cb 0.56 0.11 0.02 0.00 -0.02 0.00 0.00 41.12 41.78 1ea9 n ASP 369 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ea9 n ALA 370 N -2.53 -1.57 -3.07 2.24 0.00 -1.11 -4.85 120.51 109.61 1ea9 n ALA 370 Ca -0.10 -0.76 -0.14 0.00 0.00 0.00 0.00 53.44 52.45 1ea9 n ALA 370 Cb 0.63 0.50 -0.03 0.00 0.00 0.00 0.00 19.45 20.55 1ea9 n ALA 370 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1ea9 s VAL 371 N -2.29 0.00 -0.51 0.00 -7.23 -1.26 -2.07 120.40 107.03 1ea9 s VAL 371 Ca 0.14 -1.48 -0.28 0.00 -1.81 0.00 0.00 61.98 58.54 1ea9 s VAL 371 Cb -0.02 -2.68 0.02 0.00 0.56 0.00 0.00 36.38 34.25 1ea9 s VAL 371 CO 0.05 0.00 1.33 -0.04 -0.31 0.00 0.00 175.10 176.14 1ea9 s MET 372 N -2.91 3.47 -0.14 4.82 -1.94 -0.92 -3.48 119.30 118.20 1ea9 s MET 372 Ca 0.28 0.56 -0.04 0.00 -1.71 0.00 0.00 55.69 54.77 1ea9 s MET 372 Cb -0.01 -4.05 -0.16 0.00 2.01 0.00 0.00 34.83 32.62 1ea9 s MET 372 CO 0.19 -1.72 2.47 -1.71 -0.01 0.00 0.00 175.02 174.25 1ea9 n ASN 373 N 8.93 3.65 -0.31 3.03 2.85 -1.20 -4.41 115.26 127.80 1ea9 n ASN 373 Ca 0.13 -2.16 0.16 0.00 -0.11 0.00 0.00 54.58 52.59 1ea9 n ASN 373 Cb 0.49 -0.95 0.41 0.00 1.24 0.00 0.00 39.78 40.97 1ea9 n ASN 373 CO 0.00 0.00 0.00 1.88 -2.11 0.00 0.00 177.26 177.03 1ea9 h TYR 374 N 4.34 0.83 -0.35 1.20 0.05 -1.80 0.17 116.97 121.41 1ea9 h TYR 374 Ca 0.18 0.03 0.07 0.00 0.05 0.00 0.00 58.73 59.06 1ea9 h TYR 374 Cb 0.87 -0.25 -0.07 0.00 1.01 0.00 0.00 36.73 38.29 1ea9 h TYR 374 CO 1.56 0.20 -0.10 -1.00 -1.05 0.00 0.00 178.16 177.78 1ea9 h PRO 375 N 0.61 -0.01 0.30 4.88 0.13 -1.80 2.36 132.00 138.48 1ea9 h PRO 375 Ca 0.53 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.66 1ea9 h PRO 375 Cb 1.02 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.12 1ea9 h PRO 375 CO -0.28 -0.01 -0.45 0.35 -0.23 0.00 0.00 178.00 177.38 1ea9 h PHE 376 N -0.01 -1.28 -0.78 1.56 3.57 -1.11 -1.70 116.94 117.19 1ea9 h PHE 376 Ca 0.17 0.02 0.17 0.00 3.53 0.00 0.00 57.97 61.86 1ea9 h PHE 376 Cb 0.27 0.52 -0.14 0.00 2.79 0.00 0.00 35.95 39.39 1ea9 h PHE 376 CO -0.33 -0.56 -0.08 1.15 -2.23 0.00 0.00 178.31 176.26 1ea9 h THR 377 N -0.79 0.26 0.00 4.41 2.02 0.04 1.18 112.91 120.03 1ea9 h THR 377 Ca -0.04 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 67.13 1ea9 h THR 377 Cb 0.72 0.21 0.00 0.00 -1.74 0.00 0.00 68.15 67.34 1ea9 h THR 377 CO -0.14 0.01 0.09 -3.20 0.37 0.00 0.00 175.52 172.65 1ea9 n ASN 378 N -5.43 0.34 -0.03 4.18 5.15 0.79 -2.17 115.26 118.08 1ea9 n ASN 378 Ca 0.13 0.61 -0.02 0.00 -0.60 0.00 0.00 54.58 54.71 1ea9 n ASN 378 Cb 0.46 -0.63 -0.01 0.00 -0.53 0.00 0.00 39.78 39.07 1ea9 n ASN 378 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ea9 n ALA 379 N -1.62 0.17 -0.19 5.20 0.00 0.40 -3.39 120.51 121.08 1ea9 n ALA 379 Ca -0.01 -0.23 -0.11 0.00 0.00 0.00 0.00 53.44 53.09 1ea9 n ALA 379 Cb 0.11 0.01 -0.08 0.00 0.00 0.00 0.00 19.45 19.49 1ea9 n ALA 379 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1ea9 h VAL 380 N -0.38 0.00 -0.74 0.00 2.07 -1.29 0.25 116.25 116.16 1ea9 h VAL 380 Ca 0.00 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.65 1ea9 h VAL 380 Cb 0.19 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 29.87 1ea9 h VAL 380 CO 0.00 0.00 0.32 -0.07 0.02 0.00 0.00 177.57 177.84 1ea9 h LEU 381 N -0.23 0.35 0.00 2.57 3.38 -1.68 1.13 115.31 120.83 1ea9 h LEU 381 Ca 0.08 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1ea9 h LEU 381 Cb 0.44 0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1ea9 h LEU 381 CO -0.58 0.16 0.00 0.47 0.09 0.00 0.00 178.44 178.58 1ea9 n ASP 382 N -4.95 0.00 0.02 -0.43 9.92 0.56 -1.11 116.55 120.56 1ea9 n ASP 382 Ca 0.13 0.03 -0.01 0.00 -0.53 0.00 0.00 54.79 54.42 1ea9 n ASP 382 Cb 0.37 -0.23 -0.00 0.00 -0.64 0.00 0.00 41.12 40.61 1ea9 n ASP 382 CO 0.00 0.00 0.00 0.33 0.13 0.00 0.00 177.20 177.66 1ea9 n PHE 383 N -1.23 0.00 -0.01 1.24 7.35 0.32 -2.65 117.46 122.46 1ea9 n PHE 383 Ca 0.06 0.00 -0.17 0.00 -0.76 0.00 0.00 57.45 56.58 1ea9 n PHE 383 Cb 0.08 -0.07 -0.09 0.00 0.35 0.00 0.00 39.48 39.76 1ea9 n PHE 383 CO 0.00 0.00 0.00 0.74 -0.76 0.00 0.00 176.76 176.74 1ea9 h PHE 384 N -0.13 0.84 0.00 -5.13 -1.00 0.51 -2.34 116.94 109.69 1ea9 h PHE 384 Ca 0.00 -0.39 0.00 0.00 2.81 0.00 0.00 57.97 60.39 1ea9 h PHE 384 Cb 0.13 -0.12 0.00 0.00 3.61 0.00 0.00 35.95 39.57 1ea9 h PHE 384 CO -0.06 1.20 0.00 -0.89 -1.61 0.00 0.00 178.31 176.95 1ea9 n ILE 385 N -4.11 0.00 0.28 -0.55 -0.00 -0.99 -4.18 119.36 109.81 1ea9 n ILE 385 Ca -0.09 0.46 0.16 0.00 -0.00 0.00 0.00 62.75 63.29 1ea9 n ILE 385 Cb 0.68 -1.22 0.80 0.00 -0.00 0.00 0.00 39.64 39.90 1ea9 n ILE 385 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.55 177.00 1ea9 h HIS 386 N 0.00 0.00 -6.90 1.39 3.86 -1.35 -3.46 115.15 108.70 1ea9 h HIS 386 Ca 0.00 0.00 -0.56 0.00 -1.16 0.00 0.00 60.37 58.65 1ea9 h HIS 386 Cb 0.00 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.46 1ea9 h HIS 386 CO 0.02 0.07 -1.04 1.04 0.86 0.00 0.00 177.93 178.88 1ea9 n GLN 387 N -3.36 -0.71 0.00 2.45 6.02 -0.88 -4.84 117.38 116.06 1ea9 n GLN 387 Ca -0.01 0.31 0.00 0.00 -0.01 0.00 0.00 57.00 57.28 1ea9 n GLN 387 Cb 0.24 -2.29 0.00 0.00 1.02 0.00 0.00 30.24 29.20 1ea9 n GLN 387 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 1ea9 n ILE 388 N -4.11 0.00 -4.11 5.09 2.08 -1.22 -5.01 119.36 112.08 1ea9 n ILE 388 Ca -0.19 0.00 -0.33 0.00 0.56 0.00 0.00 62.75 62.79 1ea9 n ILE 388 Cb 0.60 0.38 -0.07 0.00 -0.75 0.00 0.00 39.64 39.80 1ea9 n ILE 388 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1ea9 s ALA 389 N -1.93 3.56 0.75 -1.39 0.00 -1.09 -5.08 121.76 116.59 1ea9 s ALA 389 Ca 0.00 -0.87 0.00 0.00 0.00 0.00 0.00 51.96 51.09 1ea9 s ALA 389 Cb 0.00 -1.57 0.00 0.00 0.00 0.00 0.00 23.12 21.55 1ea9 s ALA 389 CO 0.00 0.69 0.00 -0.40 0.00 0.00 0.00 175.76 176.05 1ea9 n ASP 390 N 1.22 0.00 0.00 0.00 5.68 -1.26 -4.71 116.55 117.48 1ea9 n ASP 390 Ca -0.13 0.00 -0.01 0.00 -0.50 0.00 0.00 54.79 54.15 1ea9 n ASP 390 Cb 0.53 0.00 -0.00 0.00 -1.14 0.00 0.00 41.12 40.50 1ea9 n ASP 390 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1ea9 h ALA 391 N -1.75 -0.11 -0.77 2.12 0.00 -1.53 -3.22 119.26 114.01 1ea9 h ALA 391 Ca 0.00 -0.01 0.16 0.00 0.00 0.00 0.00 54.91 55.06 1ea9 h ALA 391 Cb 0.00 0.02 -0.14 0.00 0.00 0.00 0.00 17.79 17.67 1ea9 h ALA 391 CO 0.00 -0.11 -0.11 1.05 0.00 0.00 0.00 179.25 180.08 1ea9 h GLU 392 N -0.40 0.03 -0.61 0.00 4.11 -1.49 0.36 114.58 116.58 1ea9 h GLU 392 Ca -0.01 -0.00 0.13 0.00 0.07 0.00 0.00 59.36 59.55 1ea9 h GLU 392 Cb 0.04 -0.01 -0.11 0.00 0.50 0.00 0.00 28.75 29.17 1ea9 h GLU 392 CO 0.01 0.02 -0.08 -0.22 0.07 0.00 0.00 179.01 178.81 1ea9 h LYS 393 N 0.03 0.05 0.37 1.06 3.11 -1.88 1.47 116.57 120.77 1ea9 h LYS 393 Ca 0.39 -0.00 -0.00 0.00 -2.81 0.00 0.00 60.65 58.22 1ea9 h LYS 393 Cb 0.64 -0.01 -0.03 0.00 -1.00 0.00 0.00 32.23 31.83 1ea9 h LYS 393 CO -0.75 0.03 -0.52 0.35 -2.81 0.00 0.00 179.45 175.76 1ea9 h PHE 394 N 0.05 -1.46 -0.74 1.91 3.57 -0.33 0.82 116.94 120.76 1ea9 h PHE 394 Ca 0.31 0.02 0.14 0.00 3.53 0.00 0.00 57.97 61.97 1ea9 h PHE 394 Cb 0.49 0.59 -0.05 0.00 2.79 0.00 0.00 35.95 39.76 1ea9 h PHE 394 CO -0.44 -0.65 0.49 0.66 -2.23 0.00 0.00 178.31 176.14 1ea9 h SER 395 N -0.92 0.38 -0.25 0.41 4.64 -0.12 0.68 113.55 118.36 1ea9 h SER 395 Ca -0.04 0.02 -0.04 0.00 -0.47 0.00 0.00 61.79 61.26 1ea9 h SER 395 Cb 0.84 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.86 1ea9 h SER 395 CO -0.14 0.20 0.02 -0.26 -0.87 0.00 0.00 176.83 175.77 1ea9 h PHE 396 N 0.41 0.47 0.00 4.77 0.05 0.44 -2.15 116.94 120.93 1ea9 h PHE 396 Ca 0.36 -0.08 -0.03 0.00 3.82 0.00 0.00 57.97 62.05 1ea9 h PHE 396 Cb 0.83 -0.13 -0.00 0.00 2.00 0.00 0.00 35.95 38.65 1ea9 h PHE 396 CO -0.00 0.58 -0.12 0.52 -0.18 0.00 0.00 178.31 179.11 1ea9 h MET 397 N 0.23 0.00 -1.39 1.51 2.86 0.22 -1.46 114.93 116.89 1ea9 h MET 397 Ca 0.07 0.00 -0.44 0.00 -2.06 0.00 0.00 59.70 57.28 1ea9 h MET 397 Cb 0.38 0.00 -0.18 0.00 0.06 0.00 0.00 31.60 31.86 1ea9 h MET 397 CO 0.01 0.12 0.56 1.28 1.06 0.00 0.00 176.91 179.94 1ea9 n LEU 398 N -3.44 6.85 0.04 1.22 4.77 0.06 -3.68 117.00 122.82 1ea9 n LEU 398 Ca -0.01 -3.63 0.00 0.00 -0.03 0.00 0.00 56.01 52.34 1ea9 n LEU 398 Cb 0.29 -1.04 0.00 0.00 -2.33 0.00 0.00 43.42 40.34 1ea9 n LEU 398 CO 0.30 1.32 0.00 0.61 -1.33 0.00 0.00 177.39 178.29 1ea9 n GLY 399 N -0.01 -0.24 0.34 -0.72 0.00 -0.58 -4.25 105.19 99.74 1ea9 n GLY 399 Ca 0.40 0.03 0.17 0.00 0.00 0.00 0.00 46.02 46.62 1ea9 n GLY 399 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1ea9 h LYS 400 N 0.00 0.00 0.00 1.61 3.64 -1.61 -1.82 116.57 118.39 1ea9 h LYS 400 Ca 0.00 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 1ea9 h LYS 400 Cb 0.00 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1ea9 h LYS 400 CO 0.00 0.00 -1.44 0.00 -2.27 0.00 0.00 179.45 175.74 1ea9 n GLN 401 N -4.09 0.63 -0.34 1.90 10.64 -1.24 -3.28 117.38 121.61 1ea9 n GLN 401 Ca 0.04 -0.07 -0.03 0.00 -1.83 0.00 0.00 57.00 55.11 1ea9 n GLN 401 Cb 0.39 -1.22 0.12 0.00 -0.86 0.00 0.00 30.24 28.67 1ea9 n GLN 401 CO 0.00 0.00 0.00 1.25 -1.83 0.00 0.00 177.06 176.48 1ea9 h LEU 402 N 0.00 1.10 0.02 2.61 5.85 -1.56 -2.93 115.31 120.40 1ea9 h LEU 402 Ca -0.03 -0.06 -0.33 0.00 0.84 0.00 0.00 57.88 58.29 1ea9 h LEU 402 Cb 0.58 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 41.28 1ea9 h LEU 402 CO 0.00 0.84 -1.96 0.00 -0.34 0.00 0.00 178.44 176.98 1ea9 n ALA 403 N -2.40 1.40 -0.66 1.25 0.00 -0.75 -4.32 120.51 115.03 1ea9 n ALA 403 Ca 0.10 -0.89 0.51 0.00 0.00 0.00 0.00 53.44 53.16 1ea9 n ALA 403 Cb 0.06 -0.62 0.81 0.00 0.00 0.00 0.00 19.45 19.69 1ea9 n ALA 403 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1ea9 h GLY 404 N 3.16 0.18 -2.25 0.00 0.00 -1.50 -3.40 103.07 99.26 1ea9 h GLY 404 Ca -0.39 -0.01 -0.58 0.00 0.00 0.00 0.00 47.33 46.35 1ea9 h GLY 404 CO 0.06 -0.06 -0.63 -0.19 0.00 0.00 0.00 176.54 175.71 1ea9 s TYR 405 N -4.92 2.57 0.65 5.60 4.12 -1.23 -4.35 117.35 119.78 1ea9 s TYR 405 Ca -0.05 -0.37 -0.14 0.00 0.02 0.00 0.00 57.07 56.53 1ea9 s TYR 405 Cb 0.27 -1.37 -0.01 0.00 -1.52 0.00 0.00 41.96 39.33 1ea9 s TYR 405 CO 0.89 0.53 1.08 -1.25 0.02 0.00 0.00 175.55 176.81 1ea9 s PRO 406 N -3.69 2.98 0.29 -1.71 0.04 -1.26 -4.81 135.00 126.83 1ea9 s PRO 406 Ca 0.34 1.22 -0.00 0.00 0.04 0.00 0.00 61.00 62.59 1ea9 s PRO 406 Cb -0.02 -1.99 0.67 0.00 0.04 0.00 0.00 34.50 33.20 1ea9 s PRO 406 CO 0.19 -1.08 1.61 -0.09 0.04 0.00 0.00 177.00 177.67 1ea9 h ARG 407 N -0.04 0.10 0.00 4.56 2.43 -1.92 -1.53 114.38 117.97 1ea9 h ARG 407 Ca -0.46 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.70 1ea9 h ARG 407 Cb 1.23 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.76 1ea9 h ARG 407 CO 0.56 0.06 0.00 0.00 -1.51 0.00 0.00 179.97 179.08 1ea9 n GLN 408 N -5.36 0.00 -0.32 0.20 0.00 -1.26 -2.67 117.38 107.97 1ea9 n GLN 408 Ca 0.20 0.42 0.12 0.00 0.00 0.00 0.00 57.00 57.74 1ea9 n GLN 408 Cb 0.67 -1.19 0.24 0.00 0.00 0.00 0.00 30.24 29.95 1ea9 n GLN 408 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1ea9 n ALA 409 N -1.76 0.41 -0.13 2.61 0.00 -1.18 0.20 120.51 120.66 1ea9 n ALA 409 Ca 0.00 0.99 -0.04 0.00 0.00 0.00 0.00 53.44 54.38 1ea9 n ALA 409 Cb 0.00 -0.69 0.02 0.00 0.00 0.00 0.00 19.45 18.78 1ea9 n ALA 409 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1ea9 h SER 410 N 0.00 -0.37 0.18 0.00 0.02 -1.37 0.16 113.55 112.17 1ea9 h SER 410 Ca 0.53 0.12 0.00 0.00 -0.84 0.00 0.00 61.79 61.60 1ea9 h SER 410 Cb 1.04 0.25 0.00 0.00 0.14 0.00 0.00 62.40 63.83 1ea9 h SER 410 CO -0.88 -0.13 0.00 -0.62 -1.14 0.00 0.00 176.83 174.06 1ea9 n GLU 411 N -5.31 0.07 -0.43 3.45 1.02 0.53 -1.96 120.64 118.02 1ea9 n GLU 411 Ca 0.03 0.49 0.07 0.00 -0.02 0.00 0.00 57.16 57.73 1ea9 n GLU 411 Cb 0.23 -1.69 0.19 0.00 -0.02 0.00 0.00 31.44 30.15 1ea9 n GLU 411 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1ea9 n VAL 412 N -1.83 2.10 -2.44 2.62 0.31 0.51 -2.54 118.33 117.07 1ea9 n VAL 412 Ca 0.00 -2.93 -0.42 0.00 -0.01 0.00 0.00 64.34 60.98 1ea9 n VAL 412 Cb 0.07 -0.24 -0.03 0.00 -0.91 0.00 0.00 33.84 32.73 1ea9 n VAL 412 CO 0.00 0.00 0.00 -0.04 -1.32 0.00 0.00 176.83 175.47 1ea9 s MET 413 N -3.12 4.37 -0.86 5.55 -1.94 -0.83 -4.39 119.30 118.09 1ea9 s MET 413 Ca 0.36 1.71 -0.11 0.00 -1.71 0.00 0.00 55.69 55.94 1ea9 s MET 413 Cb 0.34 -3.50 -0.09 0.00 2.01 0.00 0.00 34.83 33.59 1ea9 s MET 413 CO -0.04 -0.39 2.03 0.34 -0.01 0.00 0.00 175.02 176.94 1ea9 n PHE 414 N 4.85 1.55 -2.07 -0.03 7.35 -1.23 0.16 117.46 128.03 1ea9 n PHE 414 Ca 0.10 -1.90 -0.32 0.00 -0.76 0.00 0.00 57.45 54.57 1ea9 n PHE 414 Cb 0.46 -1.68 -0.04 0.00 0.35 0.00 0.00 39.48 38.57 1ea9 n PHE 414 CO 0.00 0.00 0.00 -0.80 -0.76 0.00 0.00 176.76 175.20 1ea9 s ASN 415 N 3.99 5.26 0.00 -2.13 0.02 0.31 -3.25 114.94 119.15 1ea9 s ASN 415 Ca 0.45 -0.29 0.00 0.00 -1.02 0.00 0.00 52.86 52.00 1ea9 s ASN 415 Cb 0.12 -2.55 0.00 0.00 0.02 0.00 0.00 41.25 38.84 1ea9 s ASN 415 CO 0.02 -2.53 0.00 0.00 0.02 0.00 0.00 177.10 174.60 1ea9 n LEU 416 N 13.21 0.00 0.00 0.60 -0.00 -1.26 -3.36 117.00 126.18 1ea9 n LEU 416 Ca 0.31 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.32 1ea9 n LEU 416 Cb 0.49 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.91 1ea9 n LEU 416 CO 0.65 -0.05 0.00 0.18 -0.00 0.00 0.00 177.39 178.17 1ea9 n LEU 417 N 0.00 0.00 -3.47 1.47 4.77 -1.26 -4.46 117.00 114.05 1ea9 n LEU 417 Ca 0.00 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.86 1ea9 n LEU 417 Cb 0.00 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.06 1ea9 n LEU 417 CO 0.00 0.00 0.51 1.51 -1.33 0.00 0.00 177.39 178.08 1ea9 s ASP 418 N 0.00 -0.51 0.02 -1.43 -4.77 -1.26 -4.65 116.67 104.06 1ea9 s ASP 418 Ca 0.00 0.15 -0.01 0.00 -3.30 0.00 0.00 52.55 49.39 1ea9 s ASP 418 Cb 0.00 0.51 0.00 0.00 -1.09 0.00 0.00 42.92 42.34 1ea9 s ASP 418 CO 0.00 -0.76 0.06 -1.54 0.70 0.00 0.00 175.17 173.63 1ea9 n SER 419 N -0.04 -0.13 0.24 2.11 3.41 -1.25 -4.60 113.62 113.36 1ea9 n SER 419 Ca -0.15 -1.08 0.14 0.00 -0.26 0.00 0.00 58.87 57.53 1ea9 n SER 419 Cb 0.62 0.22 0.41 0.00 -0.26 0.00 0.00 64.21 65.20 1ea9 n SER 419 CO 0.00 0.00 0.00 1.12 -0.16 0.00 0.00 175.04 176.00 1ea9 h HIS 420 N 1.07 0.00 0.00 7.33 2.07 -1.92 -3.07 115.15 120.63 1ea9 h HIS 420 Ca -0.02 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.50 1ea9 h HIS 420 Cb 0.08 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.06 1ea9 h HIS 420 CO 0.00 0.00 -0.15 -0.44 -3.07 0.00 0.00 177.93 174.27 1ea9 h ASP 421 N 0.00 0.00 -3.09 3.10 3.45 -1.96 -3.37 116.42 114.55 1ea9 h ASP 421 Ca 0.00 -0.03 -0.16 0.00 0.43 0.00 0.00 57.03 57.27 1ea9 h ASP 421 Cb 0.76 0.00 -0.04 0.00 -0.56 0.00 0.00 39.33 39.50 1ea9 h ASP 421 CO 0.00 0.01 -0.14 0.35 -1.57 0.00 0.00 179.24 177.89 1ea9 n THR 422 N -2.53 0.00 -1.39 0.35 -2.24 -1.16 -4.74 114.28 102.57 1ea9 n THR 422 Ca 0.04 -0.72 -0.25 0.00 -2.27 0.00 0.00 64.05 60.86 1ea9 n THR 422 Cb 0.47 0.29 0.19 0.00 -2.10 0.00 0.00 70.33 69.18 1ea9 n THR 422 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ea9 n ALA 423 N -2.39 -2.05 -2.84 6.98 0.00 -1.15 -4.48 120.51 114.58 1ea9 n ALA 423 Ca -0.04 -1.42 -0.34 0.00 0.00 0.00 0.00 53.44 51.64 1ea9 n ALA 423 Cb 0.18 -0.08 -0.06 0.00 0.00 0.00 0.00 19.45 19.49 1ea9 n ALA 423 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1ea9 s ARG 424 N -5.28 3.27 0.17 0.00 0.52 -1.25 -3.92 118.95 112.46 1ea9 s ARG 424 Ca 0.62 -0.36 -0.24 0.00 -0.52 0.00 0.00 55.73 55.23 1ea9 s ARG 424 Cb -0.04 -3.00 0.07 0.00 0.52 0.00 0.00 34.95 32.50 1ea9 s ARG 424 CO 0.45 0.68 1.58 1.25 0.02 0.00 0.00 175.30 179.28 1ea9 h LEU 425 N 4.18 -1.34 -0.39 2.53 5.85 -1.92 0.15 115.31 124.37 1ea9 h LEU 425 Ca -0.50 0.23 0.04 0.00 0.84 0.00 0.00 57.88 58.50 1ea9 h LEU 425 Cb 1.19 0.63 -0.07 0.00 0.37 0.00 0.00 40.66 42.78 1ea9 h LEU 425 CO 0.64 -0.33 -0.46 0.25 -0.34 0.00 0.00 178.44 178.20 1ea9 h LEU 426 N -0.21 -1.56 -1.18 2.25 5.85 -1.95 -1.01 115.31 117.50 1ea9 h LEU 426 Ca 0.20 0.21 -0.02 0.00 0.84 0.00 0.00 57.88 59.10 1ea9 h LEU 426 Cb 0.56 0.64 -0.03 0.00 0.37 0.00 0.00 40.66 42.21 1ea9 h LEU 426 CO -0.67 -0.31 0.27 0.71 -0.34 0.00 0.00 178.44 178.10 1ea9 h THR 427 N -0.29 1.20 -1.03 1.05 1.35 -1.76 0.53 112.91 113.96 1ea9 h THR 427 Ca 0.07 -0.58 0.27 0.00 -0.55 0.00 0.00 66.41 65.62 1ea9 h THR 427 Cb 0.47 0.45 -0.12 0.00 -1.73 0.00 0.00 68.15 67.22 1ea9 h THR 427 CO -0.52 0.24 0.63 1.56 -0.25 0.00 0.00 175.52 177.18 1ea9 h GLN 428 N 0.84 0.45 0.00 4.72 1.08 0.32 -3.11 115.11 119.41 1ea9 h GLN 428 Ca 0.21 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.38 1ea9 h GLN 428 Cb 0.11 -0.10 0.00 0.00 -0.05 0.00 0.00 27.48 27.44 1ea9 h GLN 428 CO -0.03 0.30 0.00 0.00 -0.95 0.00 0.00 178.83 178.15 1ea9 n ALA 429 N -2.38 0.00 0.00 3.87 0.00 -0.31 -4.66 120.51 117.03 1ea9 n ALA 429 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.71 1ea9 n ALA 429 Cb 0.86 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.31 1ea9 n ALA 429 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1ea9 n ASP 430 N -0.58 0.00 0.00 0.00 9.92 0.17 -4.87 116.55 121.20 1ea9 n ASP 430 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 1ea9 n ASP 430 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 1ea9 n ASP 430 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1ea9 n GLY 431 N 0.00 0.00 2.72 0.44 0.00 -1.25 -4.80 105.19 102.30 1ea9 n GLY 431 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1ea9 n GLY 431 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ea9 n ASP 432 N 0.22 5.52 -0.30 1.61 -0.08 -1.26 -4.75 116.55 117.51 1ea9 n ASP 432 Ca 0.00 -2.99 0.17 0.00 -1.51 0.00 0.00 54.79 50.46 1ea9 n ASP 432 Cb 0.22 -1.52 0.33 0.00 2.34 0.00 0.00 41.12 42.49 1ea9 n ASP 432 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1ea9 n LYS 433 N 4.14 -0.07 0.05 -0.67 5.02 -1.26 -0.07 118.16 125.30 1ea9 n LYS 433 Ca 0.50 1.31 -0.07 0.00 -2.02 0.00 0.00 58.31 58.03 1ea9 n LYS 433 Cb 0.34 -2.15 -0.04 0.00 -0.02 0.00 0.00 35.03 33.16 1ea9 n LYS 433 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ea9 h ARG 434 N 0.00 -0.30 -0.99 1.97 3.08 -1.97 0.50 114.38 116.66 1ea9 h ARG 434 Ca 0.60 0.02 0.22 0.00 0.07 0.00 0.00 59.98 60.88 1ea9 h ARG 434 Cb 1.34 0.07 -0.12 0.00 0.08 0.00 0.00 29.97 31.34 1ea9 h ARG 434 CO -0.80 -0.20 0.59 -0.22 -1.07 0.00 0.00 179.97 178.26 1ea9 h LYS 435 N -0.31 0.64 0.64 0.04 3.64 -0.86 -1.52 116.57 118.83 1ea9 h LYS 435 Ca -0.00 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.31 1ea9 h LYS 435 Cb 0.31 -0.14 0.01 0.00 -0.41 0.00 0.00 32.23 32.00 1ea9 h LYS 435 CO -0.11 0.42 -0.31 1.98 -2.27 0.00 0.00 179.45 179.16 1ea9 h MET 436 N 0.66 -0.83 -0.95 1.90 4.05 -0.43 -3.18 114.93 116.15 1ea9 h MET 436 Ca 0.61 0.06 0.22 0.00 -0.28 0.00 0.00 59.70 60.30 1ea9 h MET 436 Cb 1.05 0.19 -0.18 0.00 -0.80 0.00 0.00 31.60 31.86 1ea9 h MET 436 CO -0.43 -0.51 -0.12 0.87 0.23 0.00 0.00 176.91 176.95 1ea9 h LYS 437 N -1.10 0.01 0.00 0.39 1.57 1.00 0.55 116.57 118.99 1ea9 h LYS 437 Ca -0.09 -0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1ea9 h LYS 437 Cb 0.70 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.01 1ea9 h LYS 437 CO 0.14 0.01 -0.01 -0.07 -0.57 0.00 0.00 179.45 178.95 1ea9 h LEU 438 N 0.01 0.00 0.02 2.94 3.38 -1.43 -0.64 115.31 119.59 1ea9 h LEU 438 Ca 0.50 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.47 1ea9 h LEU 438 Cb 0.89 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.64 1ea9 h LEU 438 CO -0.93 0.01 -0.01 0.00 0.09 0.00 0.00 178.44 177.60 1ea9 h ALA 439 N 1.99 -0.03 -1.44 1.53 0.00 0.05 -3.01 119.26 118.34 1ea9 h ALA 439 Ca -0.00 -0.01 0.48 0.00 0.00 0.00 0.00 54.91 55.39 1ea9 h ALA 439 Cb 0.03 0.01 -0.13 0.00 0.00 0.00 0.00 17.79 17.70 1ea9 h ALA 439 CO 0.00 -0.03 0.94 0.28 0.00 0.00 0.00 179.25 180.45 1ea9 h VAL 440 N -0.74 0.03 0.59 0.00 2.07 -1.03 0.33 116.25 117.51 1ea9 h VAL 440 Ca -0.00 -0.01 -0.03 0.00 0.82 0.00 0.00 66.70 67.48 1ea9 h VAL 440 Cb 0.02 0.01 0.01 0.00 -1.52 0.00 0.00 31.29 29.80 1ea9 h VAL 440 CO 0.00 0.00 -0.28 0.25 0.02 0.00 0.00 177.57 177.56 1ea9 h LEU 441 N 0.02 -0.67 -0.97 2.57 5.85 -1.18 -1.69 115.31 119.24 1ea9 h LEU 441 Ca 0.88 0.02 0.32 0.00 0.84 0.00 0.00 57.88 59.94 1ea9 h LEU 441 Cb 2.91 0.17 -0.16 0.00 0.37 0.00 0.00 40.66 43.95 1ea9 h LEU 441 CO -0.41 -0.41 0.41 0.15 -0.34 0.00 0.00 178.44 177.84 1ea9 h PHE 442 N -0.94 0.63 0.36 1.25 3.57 -0.24 1.08 116.94 122.65 1ea9 h PHE 442 Ca -0.08 0.05 -0.00 0.00 3.53 0.00 0.00 57.97 61.46 1ea9 h PHE 442 Cb 0.61 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 39.20 1ea9 h PHE 442 CO 0.05 -0.29 -0.50 0.37 -2.23 0.00 0.00 178.31 175.71 1ea9 h GLN 443 N 0.18 -0.87 -1.26 1.11 4.15 -1.06 0.44 115.11 117.80 1ea9 h GLN 443 Ca 0.70 0.06 -0.08 0.00 0.77 0.00 0.00 58.65 60.10 1ea9 h GLN 443 Cb 1.60 0.20 -0.04 0.00 0.21 0.00 0.00 27.48 29.45 1ea9 h GLN 443 CO -0.70 -0.58 0.10 1.19 -1.93 0.00 0.00 178.83 176.91 1ea9 n PHE 444 N -5.53 0.42 0.00 3.99 3.01 0.34 -2.96 117.46 116.72 1ea9 n PHE 444 Ca -0.11 -0.86 0.00 0.00 1.01 0.00 0.00 57.45 57.50 1ea9 n PHE 444 Cb 0.44 -0.43 0.00 0.00 -0.01 0.00 0.00 39.48 39.48 1ea9 n PHE 444 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 1ea9 n THR 445 N 0.55 0.00 -2.55 4.37 -1.04 0.76 -4.65 114.28 111.72 1ea9 n THR 445 Ca 0.08 -0.00 -0.24 0.00 -2.04 0.00 0.00 64.05 61.84 1ea9 n THR 445 Cb 0.62 0.13 0.13 0.00 -1.82 0.00 0.00 70.33 69.39 1ea9 n THR 445 CO 0.00 0.00 0.00 -0.47 -0.64 0.00 0.00 175.07 173.96 1ea9 s TYR 446 N -0.37 1.23 0.32 -1.42 5.04 0.13 -4.84 117.35 117.44 1ea9 s TYR 446 Ca 0.00 -0.33 0.07 0.00 -2.44 0.00 0.00 57.07 54.36 1ea9 s TYR 446 Cb 0.00 -3.12 -0.02 0.00 0.35 0.00 0.00 41.96 39.17 1ea9 s TYR 446 CO 0.00 -1.98 0.39 -0.59 -1.34 0.00 0.00 175.55 172.03 1ea9 s PHE 447 N -3.28 3.10 0.00 4.97 -0.12 -1.26 -4.76 117.98 116.64 1ea9 s PHE 447 Ca 0.69 -0.21 0.00 0.00 -0.05 0.00 0.00 56.93 57.36 1ea9 s PHE 447 Cb -0.04 -1.84 0.00 0.00 -0.63 0.00 0.00 43.02 40.51 1ea9 s PHE 447 CO 0.46 0.14 0.00 0.41 -0.05 0.00 0.00 175.22 176.18 1ea9 n GLY 448 N -1.50 -1.23 3.62 1.99 0.00 -1.05 -4.68 105.19 102.34 1ea9 n GLY 448 Ca -0.02 -2.11 -0.35 0.00 0.00 0.00 0.00 46.02 43.54 1ea9 n GLY 448 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ea9 s THR 449 N 0.00 4.85 0.42 2.61 2.01 0.43 -4.78 115.64 121.17 1ea9 s THR 449 Ca 0.00 -0.01 -0.08 0.00 0.31 0.00 0.00 61.69 61.91 1ea9 s THR 449 Cb 0.00 -3.21 -0.05 0.00 0.01 0.00 0.00 72.50 69.25 1ea9 s THR 449 CO 0.00 0.42 0.75 -2.16 -0.69 0.00 0.00 174.62 172.94 1ea9 s PRO 450 N 0.66 3.67 -0.04 4.92 0.04 -1.26 0.12 135.00 143.12 1ea9 s PRO 450 Ca 0.04 0.32 -0.00 0.00 0.04 0.00 0.00 61.00 61.40 1ea9 s PRO 450 Cb -0.13 -2.41 0.03 0.00 0.04 0.00 0.00 34.50 32.02 1ea9 s PRO 450 CO 0.01 -0.07 0.01 0.00 0.04 0.00 0.00 177.00 176.99 1ea9 s ILE 452 N 1.34 4.89 0.13 0.00 -1.09 -1.24 -4.53 121.20 120.70 1ea9 s ILE 452 Ca -0.05 -0.67 -0.31 0.00 -2.23 0.00 0.00 60.65 57.38 1ea9 s ILE 452 Cb -0.13 -3.68 -0.10 0.00 -1.58 0.00 0.00 42.46 36.97 1ea9 s ILE 452 CO -0.02 -0.20 1.67 -0.47 -1.23 0.00 0.00 174.94 174.69 1ea9 s TYR 453 N 1.62 2.62 0.81 3.97 5.04 -1.26 0.11 117.35 130.26 1ea9 s TYR 453 Ca 0.04 0.34 -0.16 0.00 -2.44 0.00 0.00 57.07 54.85 1ea9 s TYR 453 Cb -0.19 -4.02 -0.07 0.00 0.35 0.00 0.00 41.96 38.03 1ea9 s TYR 453 CO 0.08 -4.01 0.06 2.48 -1.34 0.00 0.00 175.55 172.83 1ea9 n TYR 454 N 4.91 -2.39 -2.45 4.97 0.18 0.18 -4.24 117.16 118.33 1ea9 n TYR 454 Ca 0.16 0.24 -0.02 0.00 1.88 0.00 0.00 57.90 60.16 1ea9 n TYR 454 Cb 0.39 -1.73 -0.01 0.00 -0.38 0.00 0.00 39.34 37.60 1ea9 n TYR 454 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1ea9 n GLY 455 N 2.22 -3.76 0.00 -7.48 0.00 -1.26 -4.89 105.19 90.02 1ea9 n GLY 455 Ca 0.06 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.60 1ea9 n GLY 455 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ea9 n ASP 456 N 1.95 0.00 0.16 1.61 10.43 -1.26 -4.60 116.55 124.84 1ea9 n ASP 456 Ca -0.11 0.00 0.18 0.00 2.57 0.00 0.00 54.79 57.42 1ea9 n ASP 456 Cb 0.18 0.00 0.78 0.00 1.84 0.00 0.00 41.12 43.92 1ea9 n ASP 456 CO 0.00 0.00 0.00 -0.33 -1.07 0.00 0.00 177.20 175.80 1ea9 h GLU 457 N 0.00 0.00 0.00 -1.24 3.07 -1.90 0.39 114.58 114.90 1ea9 h GLU 457 Ca 0.00 0.00 -0.14 0.00 -0.50 0.00 0.00 59.36 58.72 1ea9 h GLU 457 Cb 0.00 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 27.88 1ea9 h GLU 457 CO 0.00 0.00 -1.91 1.55 -1.40 0.00 0.00 179.01 177.25 1ea9 n VAL 458 N -3.91 0.70 0.00 3.13 3.14 -1.26 -1.01 118.33 119.11 1ea9 n VAL 458 Ca 0.04 -0.65 0.00 0.00 -2.96 0.00 0.00 64.34 60.77 1ea9 n VAL 458 Cb 0.40 -0.32 0.00 0.00 -1.06 0.00 0.00 33.84 32.87 1ea9 n VAL 458 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1ea9 n GLY 459 N 1.42 0.43 2.77 7.55 0.00 0.14 -1.15 105.19 116.35 1ea9 n GLY 459 Ca -0.13 -0.87 -0.17 0.00 0.00 0.00 0.00 46.02 44.85 1ea9 n GLY 459 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ea9 s LEU 460 N 0.00 0.93 -0.43 0.99 1.43 -1.26 -4.80 118.68 115.53 1ea9 s LEU 460 Ca 0.00 0.02 -0.19 0.00 -1.03 0.00 0.00 54.13 52.93 1ea9 s LEU 460 Cb 0.00 -0.13 0.02 0.00 0.03 0.00 0.00 46.19 46.11 1ea9 s LEU 460 CO 0.00 -0.14 0.56 -0.62 0.23 0.00 0.00 176.35 176.38 1ea9 s ASP 461 N 1.27 6.28 0.00 2.29 -1.08 -1.26 -4.71 116.67 119.46 1ea9 s ASP 461 Ca -0.06 -0.45 0.00 0.00 -0.52 0.00 0.00 52.55 51.51 1ea9 s ASP 461 Cb -0.13 -2.28 0.00 0.00 -1.46 0.00 0.00 42.92 39.05 1ea9 s ASP 461 CO -0.03 -0.69 0.00 0.61 0.52 0.00 0.00 175.17 175.58 1ea9 n GLY 462 N 5.05 4.05 0.00 2.66 0.00 -1.26 -4.89 105.19 110.79 1ea9 n GLY 462 Ca -0.04 -2.03 0.00 0.00 0.00 0.00 0.00 46.02 43.95 1ea9 n GLY 462 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ea9 n GLY 463 N 5.00 3.15 0.00 -0.02 0.00 -1.25 -4.56 105.19 107.50 1ea9 n GLY 463 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1ea9 n GLY 463 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1ea9 n HIS 464 N 0.00 -1.60 -0.20 1.61 8.25 -1.26 -2.95 115.22 119.08 1ea9 n HIS 464 Ca 0.00 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.52 1ea9 n HIS 464 Cb 0.00 0.00 0.12 0.00 1.12 0.00 0.00 29.99 31.23 1ea9 n HIS 464 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 1ea9 n ASP 465 N -1.69 -0.13 -0.05 0.41 5.75 -1.26 0.88 116.55 120.46 1ea9 n ASP 465 Ca 0.00 0.95 -0.14 0.00 -0.01 0.00 0.00 54.79 55.59 1ea9 n ASP 465 Cb 0.00 -0.32 -0.12 0.00 -1.03 0.00 0.00 41.12 39.66 1ea9 n ASP 465 CO 0.00 0.00 0.00 -0.65 -0.11 0.00 0.00 177.20 176.44 1ea9 h PRO 466 N 0.00 0.01 0.00 0.11 0.11 -1.91 -3.22 132.00 127.09 1ea9 h PRO 466 Ca 0.30 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.40 1ea9 h PRO 466 Cb 0.55 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.66 1ea9 h PRO 466 CO -0.55 0.80 0.00 0.41 -0.21 0.00 0.00 178.00 178.45 1ea9 n GLY 467 N 1.06 -2.02 0.22 -0.55 0.00 0.93 -3.53 105.19 101.30 1ea9 n GLY 467 Ca -0.09 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.09 1ea9 n GLY 467 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ea9 n ARG 469 N -4.69 1.91 -2.25 0.00 1.74 -1.22 -4.70 116.66 107.45 1ea9 n ARG 469 Ca 0.21 -1.35 -0.38 0.00 -0.77 0.00 0.00 57.85 55.57 1ea9 n ARG 469 Cb 0.71 -1.80 -0.01 0.00 -1.02 0.00 0.00 32.46 30.34 1ea9 n ARG 469 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 1ea9 s LYS 470 N -0.54 3.89 0.86 5.56 2.20 0.22 -4.91 119.74 127.01 1ea9 s LYS 470 Ca 0.46 1.84 -0.13 0.00 -0.36 0.00 0.00 55.97 57.78 1ea9 s LYS 470 Cb 0.27 -2.55 0.04 0.00 -1.51 0.00 0.00 37.83 34.08 1ea9 s LYS 470 CO -0.07 -0.46 0.68 0.00 -0.36 0.00 0.00 175.35 175.14 1ea9 s MET 472 N -3.62 4.14 -0.52 0.00 1.75 -1.18 -4.92 119.30 114.96 1ea9 s MET 472 Ca 0.63 1.02 -0.13 0.00 -1.25 0.00 0.00 55.69 55.97 1ea9 s MET 472 Cb -0.26 -2.20 0.13 0.00 2.84 0.00 0.00 34.83 35.33 1ea9 s MET 472 CO 0.61 -0.06 0.45 -2.00 -0.65 0.00 0.00 175.02 173.36 1ea9 s GLU 473 N -3.35 2.80 0.00 4.11 -6.30 -1.26 -4.59 118.70 110.11 1ea9 s GLU 473 Ca 0.60 -1.76 0.23 0.00 -2.50 0.00 0.00 54.97 51.55 1ea9 s GLU 473 Cb -0.09 -4.15 0.61 0.00 0.00 0.00 0.00 34.13 30.50 1ea9 s GLU 473 CO 0.17 -1.27 1.49 0.91 0.02 0.00 0.00 175.26 176.58 1ea9 n TRP 474 N 5.07 0.22 -2.92 5.30 5.03 -1.26 -4.80 117.44 124.08 1ea9 n TRP 474 Ca -0.11 -0.11 -0.43 0.00 3.03 0.00 0.00 57.50 59.88 1ea9 n TRP 474 Cb 0.40 0.00 -0.04 0.00 -1.03 0.00 0.00 31.31 30.64 1ea9 n TRP 474 CO 0.00 0.00 0.00 0.34 -0.03 0.00 0.00 177.69 178.00 1ea9 s ASP 475 N -1.69 6.24 0.41 -0.99 3.68 -1.26 -4.90 116.67 118.17 1ea9 s ASP 475 Ca 0.34 -0.77 0.37 0.00 2.13 0.00 0.00 52.55 54.62 1ea9 s ASP 475 Cb 0.20 -2.40 1.28 0.00 -1.45 0.00 0.00 42.92 40.55 1ea9 s ASP 475 CO 0.30 -1.25 1.16 -0.62 0.13 0.00 0.00 175.17 174.88 1ea9 n GLU 476 N 7.27 -0.00 0.07 4.34 -0.58 -1.26 -0.68 120.64 129.80 1ea9 n GLU 476 Ca -0.03 0.81 -0.08 0.00 -0.42 0.00 0.00 57.16 57.44 1ea9 n GLU 476 Cb 0.46 -1.86 -0.05 0.00 -0.57 0.00 0.00 31.44 29.42 1ea9 n GLU 476 CO 0.00 0.00 0.00 1.79 -0.48 0.00 0.00 177.13 178.44 1ea9 h THR 477 N 0.00 0.00 -1.37 2.62 1.35 -1.97 -3.27 112.91 110.27 1ea9 h THR 477 Ca 0.70 0.00 -0.39 0.00 -0.55 0.00 0.00 66.41 66.17 1ea9 h THR 477 Cb 2.78 0.00 -0.03 0.00 -1.73 0.00 0.00 68.15 69.16 1ea9 h THR 477 CO -0.03 0.00 1.06 -0.75 -0.25 0.00 0.00 175.52 175.55 1ea9 s LYS 478 N -4.37 2.49 -0.45 4.72 2.47 0.14 -4.79 119.74 119.96 1ea9 s LYS 478 Ca -0.08 0.33 0.07 0.00 -1.56 0.00 0.00 55.97 54.72 1ea9 s LYS 478 Cb 0.03 -4.68 0.18 0.00 -1.46 0.00 0.00 37.83 31.90 1ea9 s LYS 478 CO 0.30 -3.13 0.61 -1.58 0.16 0.00 0.00 175.35 171.71 1ea9 s HIS 479 N 10.08 -1.30 -1.12 4.03 2.46 -1.23 -4.75 115.29 123.45 1ea9 s HIS 479 Ca 0.72 -0.38 -0.25 0.00 0.47 0.00 0.00 55.06 55.63 1ea9 s HIS 479 Cb -0.11 0.14 -0.17 0.00 -0.13 0.00 0.00 32.58 32.31 1ea9 s HIS 479 CO 0.12 -1.16 2.02 -3.47 -2.47 0.00 0.00 174.74 169.77 1ea9 n ASP 480 N 3.73 2.20 -0.06 9.88 -0.08 -0.30 -4.68 116.55 127.26 1ea9 n ASP 480 Ca 0.15 -2.60 -0.09 0.00 -1.51 0.00 0.00 54.79 50.75 1ea9 n ASP 480 Cb 0.54 -1.71 -0.02 0.00 2.34 0.00 0.00 41.12 42.27 1ea9 n ASP 480 CO 0.00 0.00 0.00 0.50 0.12 0.00 0.00 177.20 177.82 1ea9 h LYS 481 N 10.62 0.21 -0.01 -0.67 1.63 -1.87 0.60 116.57 127.08 1ea9 h LYS 481 Ca 0.12 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.91 1ea9 h LYS 481 Cb 0.96 -0.05 -0.00 0.00 -0.60 0.00 0.00 32.23 32.54 1ea9 h LYS 481 CO 1.14 0.14 0.23 0.22 -3.45 0.00 0.00 179.45 177.73 1ea9 h ASP 482 N 0.22 0.00 0.10 4.20 -0.00 -1.94 2.35 116.42 121.35 1ea9 h ASP 482 Ca 0.10 0.00 -0.34 0.00 -0.00 0.00 0.00 57.03 56.79 1ea9 h ASP 482 Cb 0.05 0.00 -0.02 0.00 -0.00 0.00 0.00 39.33 39.36 1ea9 h ASP 482 CO -0.09 0.00 -1.86 -0.11 -0.00 0.00 0.00 179.24 177.19 1ea9 n LEU 483 N -2.99 2.49 -0.07 2.28 7.94 0.27 -2.48 117.00 124.44 1ea9 n LEU 483 Ca -0.02 0.25 -0.11 0.00 -1.11 0.00 0.00 56.01 55.02 1ea9 n LEU 483 Cb 0.29 -1.09 -0.04 0.00 0.53 0.00 0.00 43.42 43.10 1ea9 n LEU 483 CO 0.16 0.74 0.82 0.15 -1.11 0.00 0.00 177.39 178.15 1ea9 h PHE 484 N -0.14 0.37 -0.41 1.96 3.57 0.35 -0.80 116.94 121.83 1ea9 h PHE 484 Ca -0.41 -0.04 0.07 0.00 3.53 0.00 0.00 57.97 61.11 1ea9 h PHE 484 Cb 1.89 -0.10 -0.06 0.00 2.79 0.00 0.00 35.95 40.47 1ea9 h PHE 484 CO 0.08 0.46 0.08 0.00 -2.23 0.00 0.00 178.31 176.69 1ea9 h ALA 485 N 0.87 0.44 -0.41 2.41 0.00 0.36 0.19 119.26 123.13 1ea9 h ALA 485 Ca 0.07 0.09 0.07 0.00 0.00 0.00 0.00 54.91 55.14 1ea9 h ALA 485 Cb 0.28 0.12 -0.09 0.00 0.00 0.00 0.00 17.79 18.09 1ea9 h ALA 485 CO 0.00 -0.33 -0.39 0.35 0.00 0.00 0.00 179.25 178.88 1ea9 h PHE 486 N 0.20 -1.13 0.05 0.00 3.57 -1.11 0.94 116.94 119.45 1ea9 h PHE 486 Ca 0.20 0.07 -0.00 0.00 3.53 0.00 0.00 57.97 61.77 1ea9 h PHE 486 Cb 0.25 0.56 -0.00 0.00 2.79 0.00 0.00 35.95 39.54 1ea9 h PHE 486 CO -0.21 -0.42 -0.07 1.88 -2.23 0.00 0.00 178.31 177.25 1ea9 h TYR 487 N -0.30 -0.21 -0.87 0.41 -1.99 0.50 0.18 116.97 114.70 1ea9 h TYR 487 Ca 0.15 0.00 0.09 0.00 2.00 0.00 0.00 58.73 60.98 1ea9 h TYR 487 Cb 0.57 0.08 -0.11 0.00 2.00 0.00 0.00 36.73 39.27 1ea9 h TYR 487 CO -0.60 -0.09 -0.46 1.04 -0.00 0.00 0.00 178.16 178.05 1ea9 n GLN 488 N -2.79 -0.33 0.03 4.88 6.02 0.47 0.19 117.38 125.86 1ea9 n GLN 488 Ca -0.01 1.32 -0.12 0.00 -0.01 0.00 0.00 57.00 58.17 1ea9 n GLN 488 Cb 0.06 -1.94 -0.07 0.00 1.02 0.00 0.00 30.24 29.31 1ea9 n GLN 488 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 177.06 177.20 1ea9 h THR 489 N 0.00 0.00 -1.00 5.09 2.02 -0.62 0.41 112.91 118.81 1ea9 h THR 489 Ca 0.19 0.00 0.22 0.00 0.77 0.00 0.00 66.41 67.59 1ea9 h THR 489 Cb 0.40 0.00 -0.11 0.00 -1.74 0.00 0.00 68.15 66.71 1ea9 h THR 489 CO -0.83 0.00 0.62 0.58 0.37 0.00 0.00 175.52 176.26 1ea9 h VAL 490 N -0.49 0.62 0.00 3.16 2.07 0.27 0.63 116.25 122.51 1ea9 h VAL 490 Ca 0.01 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 67.32 1ea9 h VAL 490 Cb 0.53 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.25 1ea9 h VAL 490 CO -0.27 0.11 0.00 -0.38 0.02 0.00 0.00 177.57 177.05 1ea9 n ILE 491 N -4.75 0.00 -0.36 4.57 5.41 0.51 -0.26 119.36 124.47 1ea9 n ILE 491 Ca 0.24 1.12 0.27 0.00 1.00 0.00 0.00 62.75 65.38 1ea9 n ILE 491 Cb 0.69 -2.05 0.54 0.00 -0.71 0.00 0.00 39.64 38.10 1ea9 n ILE 491 CO 0.00 0.00 0.00 0.03 0.00 0.00 0.00 176.55 176.58 1ea9 h ARG 492 N 0.00 0.30 -0.19 0.38 2.47 -0.10 1.01 114.38 118.24 1ea9 h ARG 492 Ca 0.00 -0.02 0.01 0.00 -1.26 0.00 0.00 59.98 58.71 1ea9 h ARG 492 Cb 0.00 -0.07 -0.01 0.00 -1.65 0.00 0.00 29.97 28.24 1ea9 h ARG 492 CO 0.00 0.20 0.11 1.25 0.56 0.00 0.00 179.97 182.08 1ea9 h LEU 493 N 0.31 0.17 -2.32 3.04 6.46 0.35 3.46 115.31 126.78 1ea9 h LEU 493 Ca 0.68 0.00 0.03 0.00 -0.12 0.00 0.00 57.88 58.47 1ea9 h LEU 493 Cb 1.81 -0.04 -0.00 0.00 -0.73 0.00 0.00 40.66 41.70 1ea9 h LEU 493 CO -0.39 0.13 0.12 -0.09 -0.62 0.00 0.00 178.44 177.60 1ea9 h ARG 494 N 0.22 0.00 0.09 1.25 9.65 0.42 -1.99 114.38 124.01 1ea9 h ARG 494 Ca 0.07 0.00 -0.30 0.00 -1.10 0.00 0.00 59.98 58.65 1ea9 h ARG 494 Cb -0.01 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 28.56 1ea9 h ARG 494 CO -0.03 0.00 -1.61 1.96 2.80 0.00 0.00 179.97 183.09 1ea9 h GLN 495 N 0.00 0.18 -0.95 0.20 1.08 0.72 -3.38 115.11 112.97 1ea9 h GLN 495 Ca 0.05 -0.31 0.28 0.00 -1.45 0.00 0.00 58.65 57.22 1ea9 h GLN 495 Cb 0.30 0.12 -0.04 0.00 -0.05 0.00 0.00 27.48 27.81 1ea9 h GLN 495 CO -0.00 1.15 0.90 0.00 -0.95 0.00 0.00 178.83 179.92 1ea9 h ALA 496 N -0.13 2.81 -2.24 3.87 0.00 0.70 -3.42 119.26 120.85 1ea9 h ALA 496 Ca -0.37 -0.03 -0.36 0.00 0.00 0.00 0.00 54.91 54.15 1ea9 h ALA 496 Cb 1.74 0.07 -0.14 0.00 0.00 0.00 0.00 17.79 19.45 1ea9 h ALA 496 CO -0.01 -1.39 -0.64 -1.01 0.00 0.00 0.00 179.25 176.20 1ea9 s HIS 497 N -4.65 1.52 -0.08 0.00 3.76 -1.16 -5.06 115.29 109.61 1ea9 s HIS 497 Ca -0.04 -1.02 0.12 0.00 -0.15 0.00 0.00 55.06 53.97 1ea9 s HIS 497 Cb 0.18 -0.89 -0.18 0.00 1.11 0.00 0.00 32.58 32.79 1ea9 s HIS 497 CO 0.61 -0.16 0.15 0.00 -0.85 0.00 0.00 174.74 174.50 1ea9 n ALA 498 N -0.42 2.03 -0.18 -1.40 0.00 -1.26 -4.03 120.51 115.25 1ea9 n ALA 498 Ca -0.04 -0.63 -0.06 0.00 0.00 0.00 0.00 53.44 52.71 1ea9 n ALA 498 Cb 0.65 -0.21 0.03 0.00 0.00 0.00 0.00 19.45 19.92 1ea9 n ALA 498 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ea9 h ALA 499 N 0.89 0.68 -0.20 0.00 0.00 -1.88 0.47 119.26 119.22 1ea9 h ALA 499 Ca -0.20 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.56 1ea9 h ALA 499 Cb 1.31 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1ea9 h ALA 499 CO 0.01 0.08 -0.40 -0.07 0.00 0.00 0.00 179.25 178.88 1ea9 h LEU 500 N 0.69 0.48 0.00 0.00 3.38 -1.88 1.40 115.31 119.37 1ea9 h LEU 500 Ca 0.20 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ea9 h LEU 500 Cb -0.04 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.57 1ea9 h LEU 500 CO -0.06 0.83 0.00 0.54 0.09 0.00 0.00 178.44 179.83 1ea9 n ARG 501 N -4.03 0.00 -2.79 1.13 1.74 -0.30 -4.35 116.66 108.07 1ea9 n ARG 501 Ca -0.01 0.41 -0.02 0.00 -0.77 0.00 0.00 57.85 57.46 1ea9 n ARG 501 Cb 0.50 -1.39 0.06 0.00 -1.02 0.00 0.00 32.46 30.60 1ea9 n ARG 501 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1ea9 n THR 502 N -1.71 1.03 -0.45 0.55 -2.24 0.15 -4.07 114.28 107.54 1ea9 n THR 502 Ca 0.00 -2.65 0.00 0.00 -2.27 0.00 0.00 64.05 59.13 1ea9 n THR 502 Cb 0.00 1.17 0.00 0.00 -2.10 0.00 0.00 70.33 69.40 1ea9 n THR 502 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ea9 n GLY 503 N -0.64 -0.80 0.00 3.38 0.00 0.48 -4.91 105.19 102.70 1ea9 n GLY 503 Ca 0.04 -1.66 0.00 0.00 0.00 0.00 0.00 46.02 44.40 1ea9 n GLY 503 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ea9 n THR 504 N -0.75 0.00 0.00 2.61 -2.24 -1.24 -4.81 114.28 107.85 1ea9 n THR 504 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1ea9 n THR 504 Cb 0.00 -0.32 0.00 0.00 -2.10 0.00 0.00 70.33 67.91 1ea9 n THR 504 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 1ea9 n PHE 505 N -0.26 0.00 -1.41 4.78 7.35 -0.98 -4.56 117.46 122.38 1ea9 n PHE 505 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 1ea9 n PHE 505 Cb 0.00 0.00 0.00 0.00 0.35 0.00 0.00 39.48 39.83 1ea9 n PHE 505 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 1ea9 n LYS 506 N 0.00 2.87 -3.62 -4.13 5.02 0.14 -4.86 118.16 113.58 1ea9 n LYS 506 Ca 0.00 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.15 1ea9 n LYS 506 Cb 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 35.03 34.94 1ea9 n LYS 506 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1ea9 s PHE 507 N 1.77 -0.77 0.00 2.13 0.08 -1.26 -3.24 117.98 116.68 1ea9 s PHE 507 Ca 0.00 1.83 0.00 0.00 0.12 0.00 0.00 56.93 58.88 1ea9 s PHE 507 Cb 0.00 0.29 0.00 0.00 -0.57 0.00 0.00 43.02 42.74 1ea9 s PHE 507 CO 0.00 -0.41 0.91 1.28 -0.10 0.00 0.00 175.22 176.91 1ea9 n LEU 508 N 2.48 1.71 -3.64 -0.37 4.32 -0.36 -4.95 117.00 116.19 1ea9 n LEU 508 Ca -0.15 -1.71 -0.01 0.00 -0.02 0.00 0.00 56.01 54.12 1ea9 n LEU 508 Cb 0.55 0.00 -0.06 0.00 -1.62 0.00 0.00 43.42 42.29 1ea9 n LEU 508 CO 0.05 0.43 0.75 0.42 -1.22 0.00 0.00 177.39 177.82 1ea9 s THR 509 N -0.83 -0.00 0.00 -5.08 -4.23 -1.24 -4.96 115.64 99.29 1ea9 s THR 509 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.51 1ea9 s THR 509 Cb 0.00 -1.00 0.00 0.00 1.34 0.00 0.00 72.50 72.84 1ea9 s THR 509 CO 0.00 0.00 0.00 0.00 -0.54 0.00 0.00 174.62 174.08 1ea9 n ALA 510 N 3.57 0.00 0.00 3.99 0.00 -1.26 -3.93 120.51 122.88 1ea9 n ALA 510 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1ea9 n ALA 510 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.02 1ea9 n ALA 510 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1ea9 n GLU 511 N 0.00 0.00 0.00 0.00 0.00 -1.26 -1.59 120.64 117.79 1ea9 n GLU 511 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 1ea9 n GLU 511 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.44 1ea9 n GLU 511 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1ea9 n LYS 512 N 0.00 0.00 -0.53 3.44 5.02 -1.26 -2.71 118.16 122.12 1ea9 n LYS 512 Ca 0.00 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.86 1ea9 n LYS 512 Cb 0.00 0.00 -0.11 0.00 -0.02 0.00 0.00 35.03 34.90 1ea9 n LYS 512 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1ea9 n ASN 513 N 0.00 1.09 -4.09 4.39 3.02 -1.26 -4.03 115.26 114.38 1ea9 n ASN 513 Ca 0.00 -2.49 -0.09 0.00 -0.03 0.00 0.00 54.58 51.97 1ea9 n ASN 513 Cb 0.00 -0.55 -0.09 0.00 -0.61 0.00 0.00 39.78 38.52 1ea9 n ASN 513 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1ea9 s SER 514 N 6.72 0.31 -0.01 6.41 0.01 -1.10 -5.05 113.70 120.98 1ea9 s SER 514 Ca 0.64 -1.08 0.02 0.00 1.31 0.00 0.00 55.95 56.85 1ea9 s SER 514 Cb 0.14 0.29 0.03 0.00 0.21 0.00 0.00 66.02 66.70 1ea9 s SER 514 CO 0.31 -0.72 0.89 0.54 0.41 0.00 0.00 173.24 174.67 1ea9 n ARG 515 N -0.06 0.29 -4.14 12.44 1.74 -1.26 -1.96 116.66 123.71 1ea9 n ARG 515 Ca -0.08 -1.07 -0.35 0.00 -0.77 0.00 0.00 57.85 55.58 1ea9 n ARG 515 Cb 0.63 -0.64 -0.13 0.00 -1.02 0.00 0.00 32.46 31.30 1ea9 n ARG 515 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1ea9 s GLN 516 N -0.37 3.51 0.07 5.56 1.11 -1.26 -0.21 119.66 128.07 1ea9 s GLN 516 Ca 0.04 -0.58 0.09 0.00 0.01 0.00 0.00 55.36 54.92 1ea9 s GLN 516 Cb 0.03 -2.98 -0.03 0.00 -1.01 0.00 0.00 33.01 29.02 1ea9 s GLN 516 CO 0.00 -0.01 -0.23 -1.50 0.01 0.00 0.00 175.29 173.56 1ea9 s ILE 517 N 1.01 2.45 -0.19 1.08 1.10 0.12 -4.50 121.20 122.27 1ea9 s ILE 517 Ca 0.01 -1.43 -0.12 0.00 -0.51 0.00 0.00 60.65 58.60 1ea9 s ILE 517 Cb -0.15 -2.03 0.06 0.00 0.15 0.00 0.00 42.46 40.49 1ea9 s ILE 517 CO 0.01 0.26 0.47 0.00 -2.11 0.00 0.00 174.94 173.57 1ea9 s ALA 518 N -0.94 -1.23 0.21 1.50 0.00 -1.25 0.78 121.76 120.83 1ea9 s ALA 518 Ca 0.14 1.66 -0.03 0.00 0.00 0.00 0.00 51.96 53.73 1ea9 s ALA 518 Cb -0.10 -0.99 -0.03 0.00 0.00 0.00 0.00 23.12 21.99 1ea9 s ALA 518 CO 0.05 -0.28 0.20 1.52 0.00 0.00 0.00 175.76 177.25 1ea9 s TYR 519 N 1.21 1.04 0.04 0.00 -0.85 -0.44 -1.22 117.35 117.13 1ea9 s TYR 519 Ca -0.08 -1.28 0.04 0.00 -0.52 0.00 0.00 57.07 55.24 1ea9 s TYR 519 Cb -0.07 -0.43 -0.02 0.00 0.38 0.00 0.00 41.96 41.82 1ea9 s TYR 519 CO -0.11 -0.71 -0.13 -1.17 -1.52 0.00 0.00 175.55 171.90 1ea9 s LEU 520 N -3.14 2.18 0.05 -3.49 1.98 -1.20 -1.95 118.68 113.10 1ea9 s LEU 520 Ca 0.36 -0.47 -0.09 0.00 -2.89 0.00 0.00 54.13 51.05 1ea9 s LEU 520 Cb 0.05 -0.53 0.00 0.00 0.66 0.00 0.00 46.19 46.38 1ea9 s LEU 520 CO 0.12 -0.00 0.19 -0.13 -1.89 0.00 0.00 176.35 174.64 1ea9 s ARG 521 N -1.20 0.70 -0.28 1.98 0.52 -1.05 -0.69 118.95 118.94 1ea9 s ARG 521 Ca 0.00 -0.68 -0.36 0.00 -0.52 0.00 0.00 55.73 54.17 1ea9 s ARG 521 Cb -0.08 0.29 0.16 0.00 0.52 0.00 0.00 34.95 35.84 1ea9 s ARG 521 CO 0.01 -0.20 1.37 -1.83 0.02 0.00 0.00 175.30 174.67 1ea9 s GLU 522 N -2.73 0.05 0.13 3.54 -1.05 -1.26 -2.34 118.70 115.04 1ea9 s GLU 522 Ca -0.04 -0.01 0.00 0.00 -0.15 0.00 0.00 54.97 54.77 1ea9 s GLU 522 Cb -0.00 0.02 -0.00 0.00 -0.44 0.00 0.00 34.13 33.71 1ea9 s GLU 522 CO -0.05 -0.02 0.01 -0.25 0.95 0.00 0.00 175.26 175.90 1ea9 n ASP 523 N 0.09 2.00 -2.38 0.83 9.92 -1.08 -3.73 116.55 122.20 1ea9 n ASP 523 Ca 0.04 -1.60 -0.23 0.00 -0.53 0.00 0.00 54.79 52.47 1ea9 n ASP 523 Cb 0.57 0.15 -0.09 0.00 -0.64 0.00 0.00 41.12 41.11 1ea9 n ASP 523 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 1ea9 n ASP 524 N -1.32 6.16 0.00 -2.24 -0.08 -1.26 -3.96 116.55 113.86 1ea9 n ASP 524 Ca -0.05 -2.99 0.00 0.00 -1.51 0.00 0.00 54.79 50.25 1ea9 n ASP 524 Cb 0.17 -1.29 0.00 0.00 2.34 0.00 0.00 41.12 42.34 1ea9 n ASP 524 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1ea9 n GLN 525 N 1.39 0.00 -4.41 -0.67 -0.00 -1.26 -5.13 117.38 107.30 1ea9 n GLN 525 Ca 0.48 0.00 -0.22 0.00 -0.00 0.00 0.00 57.00 57.26 1ea9 n GLN 525 Cb 0.65 0.00 -0.16 0.00 -0.00 0.00 0.00 30.24 30.73 1ea9 n GLN 525 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.06 177.22 1ea9 s ASP 526 N -1.92 1.35 -0.26 2.61 -4.77 -1.25 -5.02 116.67 107.41 1ea9 s ASP 526 Ca 0.00 -0.21 0.01 0.00 -3.30 0.00 0.00 52.55 49.04 1ea9 s ASP 526 Cb 0.00 -0.53 0.04 0.00 -1.09 0.00 0.00 42.92 41.35 1ea9 s ASP 526 CO 0.00 0.03 -0.09 -0.89 0.70 0.00 0.00 175.17 174.92 1ea9 s THR 527 N 0.52 2.50 0.27 2.11 2.01 -1.26 -2.64 115.64 119.15 1ea9 s THR 527 Ca -0.09 -1.35 0.08 0.00 0.31 0.00 0.00 61.69 60.65 1ea9 s THR 527 Cb -0.13 -2.36 -0.04 0.00 0.01 0.00 0.00 72.50 69.98 1ea9 s THR 527 CO 0.02 0.08 0.10 0.27 -0.69 0.00 0.00 174.62 174.40 1ea9 s ILE 528 N 1.21 3.84 -0.06 1.82 -0.00 -0.99 -0.90 121.20 126.12 1ea9 s ILE 528 Ca -0.04 -1.67 -0.03 0.00 -0.00 0.00 0.00 60.65 58.91 1ea9 s ILE 528 Cb -0.18 -3.10 0.04 0.00 -0.00 0.00 0.00 42.46 39.22 1ea9 s ILE 528 CO -0.05 -0.34 0.12 -1.48 -0.00 0.00 0.00 174.94 173.19 1ea9 s LEU 529 N -3.77 0.29 -0.01 0.37 2.34 0.18 -2.53 118.68 115.54 1ea9 s LEU 529 Ca 0.33 0.24 -0.01 0.00 0.06 0.00 0.00 54.13 54.75 1ea9 s LEU 529 Cb -0.07 0.17 -0.04 0.00 -0.56 0.00 0.00 46.19 45.70 1ea9 s LEU 529 CO 0.22 -0.21 0.09 -0.69 -1.06 0.00 0.00 176.35 174.70 1ea9 s VAL 530 N 1.86 4.80 0.01 1.48 1.01 -0.82 -1.91 120.40 126.83 1ea9 s VAL 530 Ca -0.01 -0.36 -0.00 0.00 0.00 0.00 0.00 61.98 61.61 1ea9 s VAL 530 Cb -0.12 -3.18 -0.01 0.00 0.00 0.00 0.00 36.38 33.07 1ea9 s VAL 530 CO -0.05 0.37 -0.01 -0.69 0.00 0.00 0.00 175.10 174.73 1ea9 s VAL 531 N -1.18 0.04 0.02 2.92 1.01 -1.19 -1.33 120.40 120.68 1ea9 s VAL 531 Ca 0.22 -0.31 -0.00 0.00 0.00 0.00 0.00 61.98 61.90 1ea9 s VAL 531 Cb -0.12 -0.10 -0.02 0.00 0.00 0.00 0.00 36.38 36.14 1ea9 s VAL 531 CO 0.13 -0.17 -0.02 -0.04 0.00 0.00 0.00 175.10 175.00 1ea9 s MET 532 N -0.50 0.25 -0.19 2.72 -1.94 0.23 -4.03 119.30 115.84 1ea9 s MET 532 Ca -0.05 -0.48 0.01 0.00 -1.71 0.00 0.00 55.69 53.45 1ea9 s MET 532 Cb -0.03 0.09 0.04 0.00 2.01 0.00 0.00 34.83 36.93 1ea9 s MET 532 CO -0.00 -0.04 -0.14 1.21 -0.01 0.00 0.00 175.02 176.04 1ea9 s ASN 533 N -1.16 3.37 0.24 3.03 2.47 -1.26 0.13 114.94 121.76 1ea9 s ASN 533 Ca -0.13 -0.84 0.23 0.00 0.42 0.00 0.00 52.86 52.54 1ea9 s ASN 533 Cb -0.08 -1.34 0.10 0.00 -1.45 0.00 0.00 41.25 38.49 1ea9 s ASN 533 CO -0.01 -0.10 1.18 0.78 -3.72 0.00 0.00 177.10 175.23 1ea9 h ASN 534 N 7.95 0.00 -1.24 -4.21 -0.26 -0.78 -3.18 115.58 113.85 1ea9 h ASN 534 Ca -0.33 -0.02 -0.44 0.00 -0.56 0.00 0.00 56.30 54.94 1ea9 h ASN 534 Cb 1.11 0.00 0.12 0.00 -1.06 0.00 0.00 38.32 38.48 1ea9 h ASN 534 CO 0.52 0.01 -0.70 0.47 -1.06 0.00 0.00 177.43 176.67 1ea9 n ASP 535 N -2.69 -2.15 0.10 5.81 9.92 -1.25 -4.65 116.55 121.64 1ea9 n ASP 535 Ca 0.01 0.57 0.06 0.00 -0.53 0.00 0.00 54.79 54.90 1ea9 n ASP 535 Cb 0.53 -0.63 0.34 0.00 -0.64 0.00 0.00 41.12 40.73 1ea9 n ASP 535 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1ea9 n LYS 536 N 0.98 0.08 -0.03 -1.24 5.02 -1.26 -4.56 118.16 117.15 1ea9 n LYS 536 Ca 0.08 0.57 0.00 0.00 -2.02 0.00 0.00 58.31 56.93 1ea9 n LYS 536 Cb 0.29 -1.81 0.00 0.00 -0.02 0.00 0.00 35.03 33.50 1ea9 n LYS 536 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ea9 n ALA 537 N -1.64 0.00 -0.91 7.82 0.00 -1.26 -4.96 120.51 119.56 1ea9 n ALA 537 Ca -0.01 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.08 1ea9 n ALA 537 Cb 0.06 0.00 0.07 0.00 0.00 0.00 0.00 19.45 19.58 1ea9 n ALA 537 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ea9 n GLY 538 N 0.00 -3.53 0.00 0.00 0.00 -0.93 -3.87 105.19 96.87 1ea9 n GLY 538 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.29 1ea9 n GLY 538 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1ea9 n HIS 539 N -3.05 0.00 -3.80 1.61 -0.00 -0.19 -4.82 115.22 104.97 1ea9 n HIS 539 Ca 0.01 0.00 -0.33 0.00 -0.00 0.00 0.00 57.72 57.40 1ea9 n HIS 539 Cb 0.57 0.00 -0.05 0.00 -0.00 0.00 0.00 29.99 30.51 1ea9 n HIS 539 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.34 177.33 1ea9 s THR 540 N 0.00 5.30 0.31 3.57 2.01 -1.26 -1.58 115.64 124.00 1ea9 s THR 540 Ca 0.00 -0.06 0.09 0.00 0.31 0.00 0.00 61.69 62.04 1ea9 s THR 540 Cb 0.00 -3.60 -0.06 0.00 0.01 0.00 0.00 72.50 68.85 1ea9 s THR 540 CO 0.00 0.21 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.27 1ea9 s LEU 541 N -2.22 2.65 -0.05 4.42 1.43 0.19 -4.98 118.68 120.11 1ea9 s LEU 541 Ca 0.33 -1.16 -0.02 0.00 -1.03 0.00 0.00 54.13 52.25 1ea9 s LEU 541 Cb -0.13 -0.93 0.04 0.00 0.03 0.00 0.00 46.19 45.20 1ea9 s LEU 541 CO 0.22 -0.19 0.10 -0.89 0.23 0.00 0.00 176.35 175.83 1ea9 s THR 542 N -2.69 -0.09 -0.20 5.49 2.01 -1.26 -1.86 115.64 117.04 1ea9 s THR 542 Ca 0.31 0.25 -0.28 0.00 0.31 0.00 0.00 61.69 62.28 1ea9 s THR 542 Cb 0.01 -0.19 0.11 0.00 0.01 0.00 0.00 72.50 72.44 1ea9 s THR 542 CO 0.15 0.10 0.93 -1.48 -0.69 0.00 0.00 174.62 173.64 1ea9 s LEU 543 N 1.44 -0.48 0.69 4.42 2.34 -1.17 -4.99 118.68 120.93 1ea9 s LEU 543 Ca -0.05 0.72 -0.11 0.00 0.06 0.00 0.00 54.13 54.74 1ea9 s LEU 543 Cb -0.12 2.03 0.00 0.00 -0.56 0.00 0.00 46.19 47.55 1ea9 s LEU 543 CO -0.05 -0.31 1.07 -2.16 -1.06 0.00 0.00 176.35 173.85 1ea9 s PRO 544 N -0.50 2.99 0.12 1.48 0.04 -1.26 -0.41 135.00 137.46 1ea9 s PRO 544 Ca -0.01 0.66 -0.01 0.00 0.04 0.00 0.00 61.00 61.67 1ea9 s PRO 544 Cb -0.02 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.50 1ea9 s PRO 544 CO 0.00 -0.99 0.18 1.33 0.04 0.00 0.00 177.00 177.56 1ea9 n VAL 545 N -3.01 0.00 -3.39 -0.36 0.24 -1.26 -4.88 118.33 105.68 1ea9 n VAL 545 Ca 0.07 -0.60 -0.19 0.00 -2.04 0.00 0.00 64.34 61.57 1ea9 n VAL 545 Cb 0.55 0.38 -0.01 0.00 -1.47 0.00 0.00 33.84 33.29 1ea9 n VAL 545 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 1ea9 s ARG 546 N -2.26 2.74 -0.22 7.34 0.52 -1.26 -5.03 118.95 120.78 1ea9 s ARG 546 Ca 0.10 -1.33 0.06 0.00 -0.52 0.00 0.00 55.73 54.04 1ea9 s ARG 546 Cb -0.00 -2.58 -0.21 0.00 0.52 0.00 0.00 34.95 32.68 1ea9 s ARG 546 CO 0.07 -0.15 -0.04 0.72 0.02 0.00 0.00 175.30 175.92 1ea9 n HIS 547 N -1.64 0.17 -0.18 -0.53 8.25 -1.26 -4.59 115.22 115.43 1ea9 n HIS 547 Ca 0.04 0.04 0.09 0.00 -0.26 0.00 0.00 57.72 57.63 1ea9 n HIS 547 Cb 0.60 -1.02 0.18 0.00 1.12 0.00 0.00 29.99 30.86 1ea9 n HIS 547 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ea9 n ALA 548 N -3.05 0.31 -1.00 -1.41 0.00 -1.26 -4.23 120.51 109.86 1ea9 n ALA 548 Ca -0.39 0.57 0.00 0.00 0.00 0.00 0.00 53.44 53.62 1ea9 n ALA 548 Cb 1.05 -0.44 0.00 0.00 0.00 0.00 0.00 19.45 20.06 1ea9 n ALA 548 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1ea9 n GLN 549 N -4.60 1.49 0.00 0.00 3.00 -1.26 -5.05 117.38 110.96 1ea9 n GLN 549 Ca 0.14 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.13 1ea9 n GLN 549 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.69 1ea9 n GLN 549 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.06 177.97 1ea9 n TRP 550 N -0.48 0.00 -1.59 1.08 7.02 -1.26 -5.06 117.44 117.16 1ea9 n TRP 550 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 1ea9 n TRP 550 Cb 0.00 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 28.89 1ea9 n TRP 550 CO 0.00 0.00 0.00 2.41 -2.02 0.00 0.00 177.69 178.08 1ea9 n THR 551 N -1.66 0.00 -3.37 -0.99 -1.04 -1.26 -4.93 114.28 101.02 1ea9 n THR 551 Ca 0.00 0.00 -0.18 0.00 -2.04 0.00 0.00 64.05 61.83 1ea9 n THR 551 Cb 0.25 0.00 -0.08 0.00 -1.82 0.00 0.00 70.33 68.68 1ea9 n THR 551 CO 0.00 0.00 0.00 -1.00 -0.64 0.00 0.00 175.07 173.43 1ea9 s HIS 552 N -2.00 -0.28 -0.31 -1.42 3.76 -1.17 -3.54 115.29 110.33 1ea9 s HIS 552 Ca 0.00 -0.73 -0.19 0.00 -0.15 0.00 0.00 55.06 53.99 1ea9 s HIS 552 Cb 0.00 -0.44 -0.01 0.00 1.11 0.00 0.00 32.58 33.23 1ea9 s HIS 552 CO 0.00 -0.95 0.55 -0.51 -0.85 0.00 0.00 174.74 172.98 1ea9 s LEU 553 N 1.60 4.18 -0.14 0.89 1.02 -1.23 0.20 118.68 125.20 1ea9 s LEU 553 Ca 0.15 0.29 -0.35 0.00 0.02 0.00 0.00 54.13 54.25 1ea9 s LEU 553 Cb -0.15 -2.68 -0.12 0.00 0.02 0.00 0.00 46.19 43.25 1ea9 s LEU 553 CO -0.09 -0.42 1.91 1.87 0.02 0.00 0.00 176.35 179.64 1ea9 n TRP 554 N 5.73 2.23 0.00 0.29 -0.00 0.41 -3.29 117.44 122.82 1ea9 n TRP 554 Ca -0.03 0.06 0.00 0.00 -0.00 0.00 0.00 57.50 57.53 1ea9 n TRP 554 Cb 0.49 -2.64 0.00 0.00 -0.00 0.00 0.00 31.31 29.16 1ea9 n TRP 554 CO 0.00 0.00 0.00 0.94 -0.00 0.00 0.00 177.69 178.63 1ea9 n GLN 555 N 6.74 0.00 0.00 5.87 -0.06 -1.15 -0.92 117.38 127.87 1ea9 n GLN 555 Ca 0.25 0.01 0.00 0.00 -2.00 0.00 0.00 57.00 55.26 1ea9 n GLN 555 Cb 0.28 -0.66 0.00 0.00 -4.06 0.00 0.00 30.24 25.80 1ea9 n GLN 555 CO 0.00 0.00 0.00 -0.25 -0.20 0.00 0.00 177.06 176.61 1ea9 n ASP 556 N -0.17 0.00 0.00 1.69 9.92 -1.26 0.14 116.55 126.87 1ea9 n ASP 556 Ca 0.00 0.61 0.06 0.00 -0.53 0.00 0.00 54.79 54.93 1ea9 n ASP 556 Cb 0.00 -0.28 0.33 0.00 -0.64 0.00 0.00 41.12 40.52 1ea9 n ASP 556 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1ea9 n ASP 557 N -2.41 0.00 -1.94 -2.24 8.00 -1.26 -4.81 116.55 111.88 1ea9 n ASP 557 Ca 0.00 -0.81 -0.09 0.00 0.71 0.00 0.00 54.79 54.60 1ea9 n ASP 557 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.08 1ea9 n ASP 557 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1ea9 n VAL 558 N -0.80 -0.25 -1.28 2.53 0.31 0.38 -4.91 118.33 114.31 1ea9 n VAL 558 Ca 0.08 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.33 1ea9 n VAL 558 Cb 0.04 -1.12 0.06 0.00 -0.91 0.00 0.00 33.84 31.91 1ea9 n VAL 558 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1ea9 n LEU 559 N -2.24 0.00 -3.73 7.52 0.00 -0.44 -4.73 117.00 113.37 1ea9 n LEU 559 Ca -0.10 -0.42 -0.20 0.00 0.00 0.00 0.00 56.01 55.29 1ea9 n LEU 559 Cb 0.46 -0.29 -0.17 0.00 0.00 0.00 0.00 43.42 43.42 1ea9 n LEU 559 CO 0.13 -0.77 -0.36 -0.89 0.00 0.00 0.00 177.39 175.50 1ea9 s THR 560 N -1.81 0.07 -0.02 1.96 2.01 -1.26 0.16 115.64 116.74 1ea9 s THR 560 Ca 0.22 0.27 -0.03 0.00 0.31 0.00 0.00 61.69 62.46 1ea9 s THR 560 Cb -0.01 -0.26 -0.04 0.00 0.01 0.00 0.00 72.50 72.20 1ea9 s THR 560 CO 0.15 0.19 0.16 0.00 -0.69 0.00 0.00 174.62 174.43 1ea9 s ALA 561 N 1.82 3.88 0.04 7.40 0.00 0.53 -4.81 121.76 130.62 1ea9 s ALA 561 Ca 0.01 -0.77 0.05 0.00 0.00 0.00 0.00 51.96 51.25 1ea9 s ALA 561 Cb -0.12 -1.84 -0.04 0.00 0.00 0.00 0.00 23.12 21.12 1ea9 s ALA 561 CO -0.03 0.73 -0.08 0.00 0.00 0.00 0.00 175.76 176.38 1ea9 s ALA 562 N -1.27 3.00 0.31 0.00 0.00 -1.26 -3.05 121.76 119.49 1ea9 s ALA 562 Ca 0.25 -1.09 0.04 0.00 0.00 0.00 0.00 51.96 51.16 1ea9 s ALA 562 Cb -0.12 -1.06 0.66 0.00 0.00 0.00 0.00 23.12 22.60 1ea9 s ALA 562 CO 0.16 0.63 1.84 0.45 0.00 0.00 0.00 175.76 178.84 1ea9 h HIS 563 N 4.19 1.03 0.00 0.00 3.86 -1.93 -3.41 115.15 118.89 1ea9 h HIS 563 Ca -0.48 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 58.76 1ea9 h HIS 563 Cb 1.17 -0.32 0.00 0.00 1.06 0.00 0.00 27.41 29.31 1ea9 h HIS 563 CO 0.58 0.38 0.00 0.41 0.86 0.00 0.00 177.93 180.16 1ea9 n GLY 564 N -1.37 4.09 1.22 2.45 0.00 -1.26 -3.33 105.19 106.99 1ea9 n GLY 564 Ca 0.19 0.12 -0.11 0.00 0.00 0.00 0.00 46.02 46.21 1ea9 n GLY 564 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1ea9 n GLN 565 N 14.00 -2.70 0.00 1.61 6.02 -1.26 -4.71 117.38 130.35 1ea9 n GLN 565 Ca 0.00 -0.58 0.00 0.00 -0.01 0.00 0.00 57.00 56.41 1ea9 n GLN 565 Cb 0.00 -0.68 0.00 0.00 1.02 0.00 0.00 30.24 30.58 1ea9 n GLN 565 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1ea9 n LEU 566 N 0.00 0.08 -3.80 1.08 4.77 -1.26 -4.51 117.00 113.35 1ea9 n LEU 566 Ca 0.05 -0.04 -0.13 0.00 -0.03 0.00 0.00 56.01 55.87 1ea9 n LEU 566 Cb 0.22 -0.04 -0.13 0.00 -2.33 0.00 0.00 43.42 41.15 1ea9 n LEU 566 CO 0.15 0.02 -0.17 0.42 -1.33 0.00 0.00 177.39 176.48 1ea9 s THR 567 N -1.84 -0.01 -0.09 -5.08 -4.23 -1.26 -4.13 115.64 99.00 1ea9 s THR 567 Ca 0.00 0.03 -0.21 0.00 -1.18 0.00 0.00 61.69 60.33 1ea9 s THR 567 Cb 0.00 -0.27 -0.04 0.00 1.34 0.00 0.00 72.50 73.54 1ea9 s THR 567 CO 0.00 0.01 0.59 -0.69 -0.54 0.00 0.00 174.62 173.99 1ea9 s VAL 568 N 0.29 5.12 -0.06 2.29 1.01 0.45 -4.58 120.40 124.92 1ea9 s VAL 568 Ca -0.02 1.19 -0.26 0.00 0.00 0.00 0.00 61.98 62.90 1ea9 s VAL 568 Cb -0.03 -3.93 -0.03 0.00 0.00 0.00 0.00 36.38 32.39 1ea9 s VAL 568 CO -0.01 0.29 0.81 -0.75 0.00 0.00 0.00 175.10 175.44 1ea9 s LYS 569 N 0.72 4.45 -0.08 2.72 2.20 -1.26 -3.06 119.74 125.43 1ea9 s LYS 569 Ca 0.32 1.07 -0.01 0.00 -0.36 0.00 0.00 55.97 56.99 1ea9 s LYS 569 Cb -0.16 -3.47 0.03 0.00 -1.51 0.00 0.00 37.83 32.71 1ea9 s LYS 569 CO 0.14 -0.04 -0.01 -1.17 -0.36 0.00 0.00 175.35 173.90 1ea9 s LEU 570 N 1.11 0.71 -0.00 5.43 0.20 -0.78 -4.94 118.68 120.42 1ea9 s LEU 570 Ca 0.42 -0.12 -0.16 0.00 0.69 0.00 0.00 54.13 54.96 1ea9 s LEU 570 Cb -0.19 -0.51 -0.06 0.00 -0.43 0.00 0.00 46.19 45.01 1ea9 s LEU 570 CO 0.20 -0.18 0.43 -2.84 -0.29 0.00 0.00 176.35 173.68 1ea9 s PRO 571 N 1.90 3.99 -0.17 0.98 0.02 -1.26 0.53 135.00 140.99 1ea9 s PRO 571 Ca 0.05 0.45 0.00 0.00 0.02 0.00 0.00 61.00 61.52 1ea9 s PRO 571 Cb -0.12 -3.24 0.03 0.00 0.02 0.00 0.00 34.50 31.18 1ea9 s PRO 571 CO -0.06 0.64 -0.12 0.00 -0.33 0.00 0.00 177.00 177.13 1ea9 s ALA 572 N -0.93 1.89 0.54 -1.55 0.00 -0.61 -4.99 121.76 116.11 1ea9 s ALA 572 Ca 0.24 -1.00 0.23 0.00 0.00 0.00 0.00 51.96 51.43 1ea9 s ALA 572 Cb -0.17 -1.13 1.41 0.00 0.00 0.00 0.00 23.12 23.23 1ea9 s ALA 572 CO 0.14 -0.54 2.07 -0.92 0.00 0.00 0.00 175.76 176.50 1ea9 h TYR 573 N 8.03 0.00 0.00 0.00 3.20 -1.90 -0.49 116.97 125.81 1ea9 h TYR 573 Ca -0.34 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.53 1ea9 h TYR 573 Cb 1.12 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.39 1ea9 h TYR 573 CO 0.48 0.00 0.00 0.41 -1.64 0.00 0.00 178.16 177.41 1ea9 n GLY 574 N -1.56 1.12 2.43 1.82 0.00 -1.25 -2.19 105.19 105.56 1ea9 n GLY 574 Ca 0.04 -0.07 -0.14 0.00 0.00 0.00 0.00 46.02 45.85 1ea9 n GLY 574 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1ea9 n PHE 575 N 0.00 -1.11 -1.31 1.61 3.01 -1.20 -3.86 117.46 114.60 1ea9 n PHE 575 Ca 0.00 -3.09 -0.09 0.00 1.01 0.00 0.00 57.45 55.28 1ea9 n PHE 575 Cb 0.00 0.46 -0.08 0.00 -0.01 0.00 0.00 39.48 39.85 1ea9 n PHE 575 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1ea9 n ALA 576 N 0.30 0.50 0.67 4.37 0.00 -1.24 -4.70 120.51 120.42 1ea9 n ALA 576 Ca 0.17 -1.36 0.00 0.00 0.00 0.00 0.00 53.44 52.25 1ea9 n ALA 576 Cb 0.68 -1.92 0.00 0.00 0.00 0.00 0.00 19.45 18.21 1ea9 n ALA 576 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1ea9 n VAL 577 N 6.43 0.00 -2.85 0.00 0.31 -1.26 -4.01 118.33 116.95 1ea9 n VAL 577 Ca 0.28 0.00 -0.41 0.00 -0.01 0.00 0.00 64.34 64.20 1ea9 n VAL 577 Cb 0.42 -0.29 -0.04 0.00 -0.91 0.00 0.00 33.84 33.02 1ea9 n VAL 577 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1ea9 s LEU 578 N -0.10 4.23 0.02 7.52 1.02 -1.26 -5.03 118.68 125.09 1ea9 s LEU 578 Ca 0.00 1.30 -0.13 0.00 0.02 0.00 0.00 54.13 55.32 1ea9 s LEU 578 Cb 0.00 -3.31 0.02 0.00 0.02 0.00 0.00 46.19 42.92 1ea9 s LEU 578 CO 0.00 -0.35 0.29 -1.59 0.02 0.00 0.00 176.35 174.71 1ea9 s LYS 579 N 1.80 0.74 0.21 1.70 0.00 -1.26 -3.14 119.74 119.79 1ea9 s LYS 579 Ca 0.42 -0.43 -0.18 0.00 0.00 0.00 0.00 55.97 55.78 1ea9 s LYS 579 Cb -0.17 0.32 0.03 0.00 0.00 0.00 0.00 37.83 38.00 1ea9 s LYS 579 CO 0.16 -0.22 0.54 0.00 0.00 0.00 0.00 175.35 175.82 1ea9 s ALA 580 N -2.15 -0.92 0.15 0.59 0.00 -0.80 -2.91 121.76 115.72 1ea9 s ALA 580 Ca -0.08 -0.27 0.00 0.00 0.00 0.00 0.00 51.96 51.61 1ea9 s ALA 580 Cb -0.02 0.87 0.00 0.00 0.00 0.00 0.00 23.12 23.97 1ea9 s ALA 580 CO -0.01 -0.83 0.00 -1.13 0.00 0.00 0.00 175.76 173.79 1ea9 n SER 581 N -0.36 0.00 -2.93 0.00 3.41 -1.21 0.47 113.62 113.01 1ea9 n SER 581 Ca -0.09 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 58.51 1ea9 n SER 581 Cb 0.62 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.58 1ea9 n SER 581 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1ea9 s SER 582 N -1.00 -1.19 0.00 4.04 1.04 -0.07 -3.51 113.70 113.01 1ea9 s SER 582 Ca 0.00 -0.97 0.00 0.00 0.48 0.00 0.00 55.95 55.46 1ea9 s SER 582 Cb 0.00 1.54 0.00 0.00 0.10 0.00 0.00 66.02 67.66 1ea9 s SER 582 CO 0.00 -0.09 0.00 -0.67 0.98 0.00 0.00 173.24 173.46