#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qjm s LYS 2 N 0.00 0.45 -0.13 2.12 1.02 -1.26 -4.08 119.74 117.85 2qjm s LYS 2 Ca 0.00 -0.83 -0.26 0.00 0.02 0.00 0.00 55.97 54.90 2qjm s LYS 2 Cb 0.00 0.06 -0.02 0.00 -0.52 0.00 0.00 37.83 37.36 2qjm s LYS 2 CO 0.00 -0.05 0.85 0.42 -0.92 0.00 0.00 175.35 175.65 2qjm s ILE 3 N -2.21 4.89 -0.28 2.17 1.01 0.03 -1.43 121.20 125.39 2qjm s ILE 3 Ca -0.08 1.69 0.19 0.00 0.00 0.00 0.00 60.65 62.45 2qjm s ILE 3 Cb -0.05 -4.16 -0.26 0.00 0.01 0.00 0.00 42.46 38.00 2qjm s ILE 3 CO -0.03 0.07 0.52 0.35 0.00 0.00 0.00 174.94 175.85 2qjm n THR 4 N 4.48 0.00 -3.57 2.92 -2.24 0.96 -0.73 114.28 116.09 2qjm n THR 4 Ca 0.04 -0.32 -0.12 0.00 -2.27 0.00 0.00 64.05 61.38 2qjm n THR 4 Cb 0.49 0.35 -0.06 0.00 -2.10 0.00 0.00 70.33 69.02 2qjm n THR 4 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qjm s ALA 5 N -3.13 -1.90 -0.34 6.98 0.00 -1.12 -4.95 121.76 117.30 2qjm s ALA 5 Ca -0.03 1.58 -0.01 0.00 0.00 0.00 0.00 51.96 53.50 2qjm s ALA 5 Cb 0.13 -0.66 0.13 0.00 0.00 0.00 0.00 23.12 22.71 2qjm s ALA 5 CO 0.77 -0.31 0.18 0.00 0.00 0.00 0.00 175.76 176.40 2qjm s ALA 6 N -0.92 1.08 -0.01 0.00 0.00 -1.26 -0.05 121.76 120.61 2qjm s ALA 6 Ca -0.03 -1.75 -0.02 0.00 0.00 0.00 0.00 51.96 50.15 2qjm s ALA 6 Cb -0.01 -1.59 -0.04 0.00 0.00 0.00 0.00 23.12 21.48 2qjm s ALA 6 CO 0.03 -1.95 0.16 1.03 0.00 0.00 0.00 175.76 175.03 2qjm s ARG 7 N 1.28 3.35 -0.17 0.00 0.52 -0.42 -4.87 118.95 118.64 2qjm s ARG 7 Ca 0.15 -0.36 -0.06 0.00 -0.52 0.00 0.00 55.73 54.94 2qjm s ARG 7 Cb -0.21 -3.04 -0.04 0.00 0.52 0.00 0.00 34.95 32.18 2qjm s ARG 7 CO -0.11 0.67 0.03 0.08 0.02 0.00 0.00 175.30 175.99 2qjm s VAL 8 N -1.29 4.51 -0.12 3.52 1.01 -1.26 -0.57 120.40 126.20 2qjm s VAL 8 Ca 0.26 -0.13 0.03 0.00 0.00 0.00 0.00 61.98 62.14 2qjm s VAL 8 Cb -0.12 -3.02 0.01 0.00 0.00 0.00 0.00 36.38 33.24 2qjm s VAL 8 CO 0.18 0.47 -0.22 -0.63 0.00 0.00 0.00 175.10 174.90 2qjm s ILE 9 N 0.35 1.98 -0.12 2.22 1.01 0.11 -4.97 121.20 121.78 2qjm s ILE 9 Ca 0.01 -0.95 0.00 0.00 0.00 0.00 0.00 60.65 59.71 2qjm s ILE 9 Cb -0.13 -1.74 -0.02 0.00 0.01 0.00 0.00 42.46 40.59 2qjm s ILE 9 CO 0.01 0.54 -0.13 -0.63 0.00 0.00 0.00 174.94 174.73 2qjm s ILE 10 N 0.62 3.12 0.05 2.92 1.01 -1.26 -0.84 121.20 126.82 2qjm s ILE 10 Ca -0.12 -0.65 -0.10 0.00 0.00 0.00 0.00 60.65 59.78 2qjm s ILE 10 Cb -0.17 -2.30 0.00 0.00 0.01 0.00 0.00 42.46 40.01 2qjm s ILE 10 CO 0.03 0.54 0.21 0.28 0.00 0.00 0.00 174.94 175.99 2qjm s THR 11 N 0.15 0.11 -0.47 2.92 -1.32 -1.01 -4.73 115.64 111.29 2qjm s THR 11 Ca -0.06 -0.91 0.07 0.00 -1.21 0.00 0.00 61.69 59.58 2qjm s THR 11 Cb -0.15 -0.98 0.24 0.00 -1.51 0.00 0.00 72.50 70.11 2qjm s THR 11 CO 0.05 -0.50 0.57 0.00 -2.21 0.00 0.00 174.62 172.53 2qjm n PRO 13 N 1.36 3.67 0.00 0.00 -0.04 -1.26 -4.21 135.00 134.51 2qjm n PRO 13 Ca 0.24 -3.75 0.00 0.00 -0.04 0.00 0.00 63.50 59.95 2qjm n PRO 13 Cb 0.49 -2.89 0.00 0.00 -0.04 0.00 0.00 33.50 31.06 2qjm n PRO 13 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qjm n GLY 14 N 2.90 1.87 3.61 0.55 0.00 -1.26 -3.50 105.19 109.36 2qjm n GLY 14 Ca 0.37 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.38 2qjm n GLY 14 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2qjm s ARG 15 N -0.09 0.38 0.28 1.61 1.70 -1.26 -5.09 118.95 116.48 2qjm s ARG 15 Ca 0.00 -0.19 -0.29 0.00 -0.47 0.00 0.00 55.73 54.78 2qjm s ARG 15 Cb 0.00 0.15 -0.10 0.00 -0.57 0.00 0.00 34.95 34.43 2qjm s ARG 15 CO 0.00 -0.17 1.14 -0.80 -1.08 0.00 0.00 175.30 174.39 2qjm s ASN 16 N -2.63 7.17 -0.06 -2.89 0.01 -1.26 -4.17 114.94 111.10 2qjm s ASN 16 Ca 0.12 2.34 -0.03 0.00 -0.71 0.00 0.00 52.86 54.58 2qjm s ASN 16 Cb 0.02 -2.63 0.03 0.00 0.41 0.00 0.00 41.25 39.09 2qjm s ASN 16 CO -0.04 -0.23 0.14 -0.36 -1.51 0.00 0.00 177.10 175.10 2qjm s PHE 17 N -1.06 -0.16 -0.12 2.20 0.08 -0.53 -4.98 117.98 113.40 2qjm s PHE 17 Ca 0.46 0.45 -0.00 0.00 0.12 0.00 0.00 56.93 57.96 2qjm s PHE 17 Cb -0.33 -0.07 -0.02 0.00 -0.57 0.00 0.00 43.02 42.03 2qjm s PHE 17 CO 0.43 -0.15 -0.12 0.08 -0.10 0.00 0.00 175.22 175.36 2qjm s VAL 18 N 1.02 3.18 0.06 -0.44 1.01 -1.26 -2.39 120.40 121.57 2qjm s VAL 18 Ca -0.08 -0.63 0.06 0.00 0.00 0.00 0.00 61.98 61.34 2qjm s VAL 18 Cb -0.10 -2.33 -0.03 0.00 0.00 0.00 0.00 36.38 33.92 2qjm s VAL 18 CO -0.05 0.53 -0.17 -0.89 0.00 0.00 0.00 175.10 174.52 2qjm s THR 19 N 0.16 1.37 -0.11 3.92 2.01 -0.02 -1.16 115.64 121.82 2qjm s THR 19 Ca -0.06 -1.21 0.02 0.00 0.31 0.00 0.00 61.69 60.75 2qjm s THR 19 Cb -0.15 -1.24 -0.01 0.00 0.01 0.00 0.00 72.50 71.11 2qjm s THR 19 CO 0.05 0.00 -0.17 -0.22 -0.69 0.00 0.00 174.62 173.59 2qjm s LEU 20 N -1.41 2.50 -0.20 4.42 2.96 0.27 0.05 118.68 127.28 2qjm s LEU 20 Ca 0.03 -0.39 -0.00 0.00 -0.22 0.00 0.00 54.13 53.55 2qjm s LEU 20 Cb -0.09 -1.53 0.02 0.00 0.50 0.00 0.00 46.19 45.09 2qjm s LEU 20 CO 0.02 0.19 -0.15 -0.75 -1.32 0.00 0.00 176.35 174.35 2qjm s LYS 21 N 0.17 3.03 -0.27 1.98 2.20 0.26 -0.03 119.74 127.08 2qjm s LYS 21 Ca -0.10 -0.82 -0.10 0.00 -0.36 0.00 0.00 55.97 54.59 2qjm s LYS 21 Cb -0.16 -2.72 -0.04 0.00 -1.51 0.00 0.00 37.83 33.40 2qjm s LYS 21 CO 0.06 -0.24 0.15 0.42 -0.36 0.00 0.00 175.35 175.38 2qjm s ILE 22 N 1.33 4.99 0.05 5.43 1.01 0.25 -1.31 121.20 132.94 2qjm s ILE 22 Ca 0.04 0.04 0.02 0.00 0.00 0.00 0.00 60.65 60.75 2qjm s ILE 22 Cb -0.14 -3.38 -0.04 0.00 0.01 0.00 0.00 42.46 38.92 2qjm s ILE 22 CO -0.10 0.26 0.07 -1.61 0.00 0.00 0.00 174.94 173.57 2qjm s GLU 23 N 1.71 2.92 0.26 2.79 2.02 0.93 -1.10 118.70 128.23 2qjm s GLU 23 Ca 0.07 -0.62 0.10 0.00 0.02 0.00 0.00 54.97 54.53 2qjm s GLU 23 Cb -0.16 -2.76 -0.05 0.00 0.10 0.00 0.00 34.13 31.27 2qjm s GLU 23 CO 0.09 0.60 -0.17 0.95 0.02 0.00 0.00 175.26 176.75 2qjm s THR 24 N -1.30 2.17 -1.20 3.63 -4.23 -1.14 -0.03 115.64 113.54 2qjm s THR 24 Ca 0.26 -2.31 0.14 0.00 -1.18 0.00 0.00 61.69 58.59 2qjm s THR 24 Cb -0.12 -2.25 0.17 0.00 1.34 0.00 0.00 72.50 71.64 2qjm s THR 24 CO 0.18 -0.44 1.40 -0.90 -0.54 0.00 0.00 174.62 174.32 2qjm n ASP 25 N -0.55 0.00 0.04 3.99 5.75 -0.51 -1.89 116.55 123.37 2qjm n ASP 25 Ca -0.06 0.30 0.08 0.00 -0.01 0.00 0.00 54.79 55.11 2qjm n ASP 25 Cb 0.61 -0.40 -0.08 0.00 -1.03 0.00 0.00 41.12 40.22 2qjm n ASP 25 CO 0.00 0.00 0.00 1.67 -0.11 0.00 0.00 177.20 178.76 2qjm n GLN 26 N -1.40 0.63 0.00 0.11 0.00 -1.26 -5.00 117.38 110.46 2qjm n GLN 26 Ca 0.05 0.02 0.00 0.00 -0.00 0.00 0.00 57.00 57.07 2qjm n GLN 26 Cb 0.13 -1.70 0.00 0.00 0.00 0.00 0.00 30.24 28.67 2qjm n GLN 26 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2qjm n GLY 27 N 1.28 3.29 3.67 1.69 0.00 -0.79 -5.08 105.19 109.24 2qjm n GLY 27 Ca -0.05 -1.02 -0.40 0.00 0.00 0.00 0.00 46.02 44.55 2qjm n GLY 27 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2qjm n VAL 28 N 0.00 3.15 -4.18 1.61 3.14 -1.26 -4.63 118.33 116.16 2qjm n VAL 28 Ca 0.00 -0.50 -0.11 0.00 -2.96 0.00 0.00 64.34 60.77 2qjm n VAL 28 Cb 0.00 -1.38 -0.10 0.00 -1.06 0.00 0.00 33.84 31.30 2qjm n VAL 28 CO 0.00 0.00 0.00 -0.72 -6.46 0.00 0.00 176.83 169.65 2qjm s TYR 29 N -1.33 1.02 0.02 1.45 -0.85 -1.26 -2.91 117.35 113.50 2qjm s TYR 29 Ca 0.68 -1.29 -0.05 0.00 -0.52 0.00 0.00 57.07 55.89 2qjm s TYR 29 Cb -0.47 -0.53 -0.01 0.00 0.38 0.00 0.00 41.96 41.33 2qjm s TYR 29 CO 0.53 -0.55 0.09 0.20 -1.52 0.00 0.00 175.55 174.29 2qjm s GLY 30 N -3.11 0.15 0.08 5.49 0.00 -0.26 -4.47 107.32 105.21 2qjm s GLY 30 Ca 0.31 -0.44 0.07 0.00 0.00 0.00 0.00 44.72 44.65 2qjm s GLY 30 CO 0.06 -0.57 -0.18 -0.26 0.00 0.00 0.00 173.10 172.16 2qjm s ILE 31 N -2.10 1.44 0.05 0.90 -4.36 -1.26 0.84 121.20 116.71 2qjm s ILE 31 Ca -0.09 -1.39 0.01 0.00 -0.26 0.00 0.00 60.65 58.92 2qjm s ILE 31 Cb -0.04 -1.33 -0.03 0.00 1.25 0.00 0.00 42.46 42.31 2qjm s ILE 31 CO -0.02 -0.10 -0.06 -0.83 0.24 0.00 0.00 174.94 174.17 2qjm s GLY 32 N -1.73 0.51 0.12 6.27 0.00 0.96 -3.38 107.32 110.08 2qjm s GLY 32 Ca 0.03 -0.93 -0.20 0.00 0.00 0.00 0.00 44.72 43.62 2qjm s GLY 32 CO 0.03 -1.00 0.64 -0.35 0.00 0.00 0.00 173.10 172.42 2qjm s ASP 33 N -2.07 7.13 -0.02 1.64 2.15 -1.26 -0.57 116.67 123.67 2qjm s ASP 33 Ca -0.04 1.37 0.02 0.00 0.43 0.00 0.00 52.55 54.33 2qjm s ASP 33 Cb -0.04 -2.40 0.03 0.00 -0.30 0.00 0.00 42.92 40.21 2qjm s ASP 33 CO -0.02 0.21 0.92 0.00 -0.17 0.00 0.00 175.17 176.11 2qjm n ALA 34 N 1.47 1.84 -2.12 3.66 0.00 -0.31 -3.24 120.51 121.81 2qjm n ALA 34 Ca -0.08 -1.10 -0.42 0.00 0.00 0.00 0.00 53.44 51.84 2qjm n ALA 34 Cb 0.50 -0.38 -0.03 0.00 0.00 0.00 0.00 19.45 19.55 2qjm n ALA 34 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2qjm s THR 35 N -0.37 3.61 -0.35 0.00 2.01 -1.22 -4.78 115.64 114.55 2qjm s THR 35 Ca 0.04 0.90 0.03 0.00 0.31 0.00 0.00 61.69 62.97 2qjm s THR 35 Cb 0.03 -3.58 0.10 0.00 0.01 0.00 0.00 72.50 69.06 2qjm s THR 35 CO 0.00 -0.04 0.08 -0.22 -0.69 0.00 0.00 174.62 173.76 2qjm s LEU 36 N 3.11 4.03 -0.24 4.42 2.96 -1.26 -4.92 118.68 126.78 2qjm s LEU 36 Ca 0.68 -2.10 -0.37 0.00 -0.22 0.00 0.00 54.13 52.12 2qjm s LEU 36 Cb -0.32 -1.42 -0.13 0.00 0.50 0.00 0.00 46.19 44.82 2qjm s LEU 36 CO 0.27 -0.38 1.90 -3.20 -1.32 0.00 0.00 176.35 173.63 2qjm n ASN 37 N 4.31 2.68 0.00 3.68 5.15 -1.26 -0.91 115.26 128.91 2qjm n ASN 37 Ca 0.03 0.88 0.00 0.00 -0.60 0.00 0.00 54.58 54.89 2qjm n ASN 37 Cb 0.41 -1.24 0.00 0.00 -0.53 0.00 0.00 39.78 38.42 2qjm n ASN 37 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2qjm n GLY 38 N 4.84 1.34 1.04 8.20 0.00 -1.26 -4.79 105.19 114.57 2qjm n GLY 38 Ca 0.29 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.32 2qjm n GLY 38 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qjm n ARG 39 N -2.00 0.00 -0.30 1.61 5.12 -0.54 -4.89 116.66 115.66 2qjm n ARG 39 Ca 0.00 -1.43 0.12 0.00 -1.93 0.00 0.00 57.85 54.61 2qjm n ARG 39 Cb 0.00 -0.12 0.26 0.00 -1.16 0.00 0.00 32.46 31.44 2qjm n ARG 39 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 2qjm h GLU 40 N 0.49 0.12 0.00 5.56 3.07 -1.33 -1.82 114.58 120.67 2qjm h GLU 40 Ca -0.17 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.69 2qjm h GLU 40 Cb 1.62 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 29.50 2qjm h GLU 40 CO 0.02 0.08 0.00 -0.07 -1.40 0.00 0.00 179.01 177.64 2qjm h LEU 41 N 0.12 0.00 -0.55 1.33 3.38 -1.94 -2.91 115.31 114.74 2qjm h LEU 41 Ca 0.54 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.38 2qjm h LEU 41 Cb 1.08 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 2qjm h LEU 41 CO -0.73 0.00 -0.22 -1.28 0.09 0.00 0.00 178.44 176.30 2qjm h SER 42 N 0.00 0.96 0.15 -0.43 0.87 -1.73 -2.11 113.55 111.27 2qjm h SER 42 Ca 0.00 -0.36 -0.20 0.00 -1.23 0.00 0.00 61.79 60.00 2qjm h SER 42 Cb 0.43 -0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 62.13 2qjm h SER 42 CO 0.00 1.14 -0.76 0.58 -0.53 0.00 0.00 176.83 177.26 2qjm h VAL 43 N 0.81 1.35 -0.34 2.23 2.07 -1.64 -1.94 116.25 118.79 2qjm h VAL 43 Ca 0.11 -2.12 0.04 0.00 0.82 0.00 0.00 66.70 65.55 2qjm h VAL 43 Cb 0.78 2.10 -0.04 0.00 -1.52 0.00 0.00 31.29 32.61 2qjm h VAL 43 CO 0.06 0.65 0.11 0.58 0.02 0.00 0.00 177.57 178.99 2qjm h VAL 44 N 0.34 0.90 -0.47 2.57 2.07 -1.40 0.07 116.25 120.33 2qjm h VAL 44 Ca -0.04 -0.09 -0.08 0.00 0.82 0.00 0.00 66.70 67.31 2qjm h VAL 44 Cb 1.36 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 31.73 2qjm h VAL 44 CO 0.14 0.05 -0.00 0.00 0.02 0.00 0.00 177.57 177.77 2qjm h ALA 45 N 1.22 0.63 -0.77 1.67 0.00 -1.35 0.11 119.26 120.78 2qjm h ALA 45 Ca 0.15 -0.28 0.08 0.00 0.00 0.00 0.00 54.91 54.86 2qjm h ALA 45 Cb 0.13 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 17.68 2qjm h ALA 45 CO -0.16 0.44 0.44 -0.92 0.00 0.00 0.00 179.25 179.04 2qjm h TYR 46 N 0.69 0.80 0.08 0.00 3.20 -0.84 0.26 116.97 121.16 2qjm h TYR 46 Ca 0.13 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.03 2qjm h TYR 46 Cb 0.51 -0.25 0.00 0.00 1.54 0.00 0.00 36.73 38.54 2qjm h TYR 46 CO 0.04 0.36 -0.04 -0.07 -1.64 0.00 0.00 178.16 176.81 2qjm h LEU 47 N 0.77 -0.09 -0.03 2.82 3.38 -0.76 -1.81 115.31 119.59 2qjm h LEU 47 Ca 0.36 -0.47 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 2qjm h LEU 47 Cb 0.27 0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 2qjm h LEU 47 CO -0.21 0.57 0.01 1.56 0.09 0.00 0.00 178.44 180.45 2qjm h GLN 48 N -0.91 0.04 0.00 1.13 4.20 -0.74 0.40 115.11 119.23 2qjm h GLN 48 Ca -0.01 -0.01 -0.17 0.00 0.06 0.00 0.00 58.65 58.52 2qjm h GLN 48 Cb 0.56 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.31 2qjm h GLN 48 CO 0.02 0.26 -0.81 0.93 -0.67 0.00 0.00 178.83 178.55 2qjm h GLU 49 N -0.18 0.00 0.00 1.46 4.39 -1.13 -3.41 114.58 115.71 2qjm h GLU 49 Ca 0.01 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.71 2qjm h GLU 49 Cb 0.24 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.89 2qjm h GLU 49 CO 0.00 0.81 -0.15 0.72 -1.16 0.00 0.00 179.01 179.23 2qjm n HIS 50 N -3.35 0.00 0.07 4.33 8.25 -1.06 -4.85 115.22 118.61 2qjm n HIS 50 Ca 0.00 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.34 2qjm n HIS 50 Cb 0.85 -0.02 -0.09 0.00 1.12 0.00 0.00 29.99 31.85 2qjm n HIS 50 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2qjm h VAL 51 N -0.03 1.01 -0.83 1.59 2.07 -1.26 -3.35 116.25 115.44 2qjm h VAL 51 Ca -0.00 -0.82 0.12 0.00 0.82 0.00 0.00 66.70 66.82 2qjm h VAL 51 Cb 0.15 1.51 -0.13 0.00 -1.52 0.00 0.00 31.29 31.29 2qjm h VAL 51 CO -0.00 0.19 -0.43 0.00 0.02 0.00 0.00 177.57 177.35 2qjm h ALA 52 N 0.17 -0.11 -0.33 1.67 0.00 -0.44 0.14 119.26 120.35 2qjm h ALA 52 Ca -0.02 0.19 0.10 0.00 0.00 0.00 0.00 54.91 55.18 2qjm h ALA 52 Cb 0.46 1.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.26 2qjm h ALA 52 CO 0.03 -0.74 0.29 -1.35 0.00 0.00 0.00 179.25 177.48 2qjm h PRO 53 N -0.08 0.00 0.02 0.00 0.11 -1.79 -1.27 132.00 128.98 2qjm h PRO 53 Ca 0.26 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 66.15 2qjm h PRO 53 Cb 0.55 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.64 2qjm h PRO 53 CO -0.86 0.00 -1.03 0.00 -0.21 0.00 0.00 178.00 175.90 2qjm h LEU 55 N 0.01 0.19 -9.37 0.00 3.38 -0.90 -3.43 115.31 105.18 2qjm h LEU 55 Ca -0.03 -0.07 -0.61 0.00 0.09 0.00 0.00 57.88 57.25 2qjm h LEU 55 Cb 1.78 -0.05 0.04 0.00 0.09 0.00 0.00 40.66 42.52 2qjm h LEU 55 CO 0.14 0.56 0.88 -0.38 0.09 0.00 0.00 178.44 179.73 2qjm n ILE 56 N -4.06 0.24 0.00 1.22 2.08 -1.15 -1.32 119.36 116.36 2qjm n ILE 56 Ca -0.01 -0.04 0.00 0.00 0.56 0.00 0.00 62.75 63.25 2qjm n ILE 56 Cb 0.45 -1.57 0.00 0.00 -0.75 0.00 0.00 39.64 37.76 2qjm n ILE 56 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2qjm n GLY 57 N 3.75 2.29 3.83 7.39 0.00 0.09 -4.95 105.19 117.59 2qjm n GLY 57 Ca 0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.91 2qjm n GLY 57 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2qjm s MET 58 N -0.70 3.22 -0.55 1.61 -1.94 -0.44 -4.54 119.30 115.96 2qjm s MET 58 Ca 0.00 0.93 -0.25 0.00 -1.71 0.00 0.00 55.69 54.66 2qjm s MET 58 Cb 0.00 -2.03 0.04 0.00 2.01 0.00 0.00 34.83 34.85 2qjm s MET 58 CO 0.00 -0.87 0.99 0.34 -0.01 0.00 0.00 175.02 175.47 2qjm s ASP 59 N -3.73 6.37 0.54 3.03 3.68 -1.26 -0.79 116.67 124.51 2qjm s ASP 59 Ca 0.58 -0.24 0.27 0.00 2.13 0.00 0.00 52.55 55.28 2qjm s ASP 59 Cb -0.13 -2.46 1.46 0.00 -1.45 0.00 0.00 42.92 40.34 2qjm s ASP 59 CO 0.51 -1.27 1.80 1.55 0.13 0.00 0.00 175.17 177.88 2qjm h PRO 60 N 9.35 0.00 0.00 4.34 0.13 -1.89 -1.70 132.00 142.23 2qjm h PRO 60 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 2qjm h PRO 60 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 2qjm h PRO 60 CO 1.11 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.88 2qjm h ARG 61 N 0.00 0.00 -3.13 0.86 3.08 -1.92 -3.36 114.38 109.91 2qjm h ARG 61 Ca 0.00 0.00 -0.75 0.00 0.07 0.00 0.00 59.98 59.30 2qjm h ARG 61 Cb 0.48 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 30.38 2qjm h ARG 61 CO 0.00 0.00 2.12 0.54 -1.07 0.00 0.00 179.97 181.56 2qjm n ARG 62 N -2.48 4.04 -0.07 0.04 1.74 -0.64 -4.80 116.66 114.49 2qjm n ARG 62 Ca 0.04 -3.55 -0.07 0.00 -0.77 0.00 0.00 57.85 53.49 2qjm n ARG 62 Cb 0.36 -2.79 -0.01 0.00 -1.02 0.00 0.00 32.46 29.00 2qjm n ARG 62 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 2qjm h ILE 63 N 3.29 0.75 -0.40 0.55 2.04 -1.85 -1.46 117.51 120.43 2qjm h ILE 63 Ca 0.50 -0.01 -0.01 0.00 1.00 0.00 0.00 64.86 66.34 2qjm h ILE 63 Cb 0.50 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 37.29 2qjm h ILE 63 CO 1.56 0.00 0.20 -0.08 0.00 0.00 0.00 178.15 179.83 2qjm h GLU 64 N 0.02 0.57 -0.66 2.37 4.57 -1.96 -0.81 114.58 118.69 2qjm h GLU 64 Ca 0.13 -0.08 -0.02 0.00 -1.18 0.00 0.00 59.36 58.21 2qjm h GLU 64 Cb 0.19 -0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 28.65 2qjm h GLU 64 CO -0.26 0.49 0.33 0.22 -1.18 0.00 0.00 179.01 178.62 2qjm h ASP 65 N 0.50 0.84 0.31 1.04 3.58 -1.91 -1.22 116.42 119.57 2qjm h ASP 65 Ca 0.14 -0.12 -0.13 0.00 0.42 0.00 0.00 57.03 57.34 2qjm h ASP 65 Cb 0.11 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 40.93 2qjm h ASP 65 CO -0.02 0.72 -0.52 0.40 -2.88 0.00 0.00 179.24 176.94 2qjm h ILE 66 N 0.90 1.35 0.09 2.25 2.04 -1.16 0.39 117.51 123.38 2qjm h ILE 66 Ca 0.23 -1.79 -0.00 0.00 1.00 0.00 0.00 64.86 64.30 2qjm h ILE 66 Cb 0.09 1.87 0.00 0.00 -0.74 0.00 0.00 36.82 38.03 2qjm h ILE 66 CO -0.03 0.53 -0.04 -0.25 0.00 0.00 0.00 178.15 178.35 2qjm h TRP 67 N 0.19 -0.12 -0.84 1.37 7.01 -0.78 -1.18 115.95 121.60 2qjm h TRP 67 Ca 0.00 -0.00 -0.01 0.00 2.11 0.00 0.00 58.89 60.99 2qjm h TRP 67 Cb 0.98 0.04 -0.04 0.00 -2.10 0.00 0.00 29.16 28.04 2qjm h TRP 67 CO 0.02 0.14 0.49 1.96 -2.79 0.00 0.00 178.44 178.26 2qjm h GLN 68 N -0.36 1.15 -0.18 2.65 1.08 -1.13 0.76 115.11 119.08 2qjm h GLN 68 Ca -0.01 -0.11 -0.00 0.00 -1.45 0.00 0.00 58.65 57.07 2qjm h GLN 68 Cb 0.31 -0.24 -0.01 0.00 -0.05 0.00 0.00 27.48 27.49 2qjm h GLN 68 CO 0.02 0.82 0.10 -0.92 -0.95 0.00 0.00 178.83 177.90 2qjm h TYR 69 N 1.17 0.25 -0.06 2.96 3.20 -0.73 0.29 116.97 124.04 2qjm h TYR 69 Ca 0.30 -0.01 -0.18 0.00 3.14 0.00 0.00 58.73 61.98 2qjm h TYR 69 Cb -0.02 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.16 2qjm h TYR 69 CO 0.01 0.24 -0.75 0.28 -1.64 0.00 0.00 178.16 176.30 2qjm h VAL 70 N 0.19 1.40 0.39 1.81 2.07 -0.96 0.15 116.25 121.30 2qjm h VAL 70 Ca 0.06 -2.21 -0.02 0.00 0.82 0.00 0.00 66.70 65.35 2qjm h VAL 70 Cb 0.07 2.17 0.00 0.00 -1.52 0.00 0.00 31.29 32.02 2qjm h VAL 70 CO -0.01 0.66 -0.19 0.22 0.02 0.00 0.00 177.57 178.27 2qjm h TYR 71 N 0.23 -0.49 -0.28 1.57 3.20 -0.68 -3.15 116.97 117.37 2qjm h TYR 71 Ca -0.03 -0.01 -0.14 0.00 3.14 0.00 0.00 58.73 61.69 2qjm h TYR 71 Cb 1.32 0.16 -0.00 0.00 1.54 0.00 0.00 36.73 39.75 2qjm h TYR 71 CO 0.04 -0.25 -0.36 0.00 -1.64 0.00 0.00 178.16 175.95 2qjm h ARG 72 N -1.11 0.74 -0.20 1.82 3.08 -0.55 -3.27 114.38 114.90 2qjm h ARG 72 Ca -0.05 -0.42 0.06 0.00 0.07 0.00 0.00 59.98 59.63 2qjm h ARG 72 Cb 0.45 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.52 2qjm h ARG 72 CO 0.09 1.05 0.15 0.78 -1.07 0.00 0.00 179.97 180.96 2qjm h GLY 73 N 0.49 0.00 2.00 0.04 0.00 -0.77 -1.53 103.07 103.31 2qjm h GLY 73 Ca 0.04 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.36 2qjm h GLY 73 CO 0.09 0.00 -0.01 0.00 0.00 0.00 0.00 176.54 176.62 2qjm h ALA 74 N 1.89 1.07 0.00 3.60 0.00 -1.59 -3.45 119.26 120.78 2qjm h ALA 74 Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2qjm h ALA 74 Cb 0.39 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2qjm h ALA 74 CO -0.00 0.01 0.00 0.98 0.00 0.00 0.00 179.25 180.24 2qjm n TYR 75 N -3.20 0.00 -2.84 0.00 9.36 -0.58 -4.73 117.16 115.17 2qjm n TYR 75 Ca -0.02 0.00 -0.43 0.00 3.32 0.00 0.00 57.90 60.77 2qjm n TYR 75 Cb 0.12 0.00 -0.04 0.00 -0.63 0.00 0.00 39.34 38.80 2qjm n TYR 75 CO 0.00 0.00 0.00 -1.58 0.22 0.00 0.00 176.86 175.50 2qjm s TRP 76 N 0.00 2.69 0.49 2.98 0.52 -1.26 -5.01 118.94 119.34 2qjm s TRP 76 Ca 0.00 -0.39 -0.05 0.00 0.02 0.00 0.00 56.10 55.68 2qjm s TRP 76 Cb 0.00 -4.23 -0.04 0.00 -1.15 0.00 0.00 33.47 28.05 2qjm s TRP 76 CO 0.00 -1.58 0.79 1.03 0.02 0.00 0.00 176.95 177.21 2qjm s ARG 77 N 4.09 3.55 1.01 4.98 0.52 -1.26 -4.99 118.95 126.84 2qjm s ARG 77 Ca 0.25 0.22 0.00 0.00 -0.52 0.00 0.00 55.73 55.68 2qjm s ARG 77 Cb -0.15 -2.37 0.00 0.00 0.52 0.00 0.00 34.95 32.95 2qjm s ARG 77 CO 0.13 -0.22 0.00 0.54 0.02 0.00 0.00 175.30 175.77 2qjm n ARG 78 N -2.27 -1.10 0.00 3.54 1.74 -1.26 -5.09 116.66 112.23 2qjm n ARG 78 Ca 0.01 0.72 0.00 0.00 -0.77 0.00 0.00 57.85 57.81 2qjm n ARG 78 Cb 0.55 -1.34 0.00 0.00 -1.02 0.00 0.00 32.46 30.65 2qjm n ARG 78 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2qjm n GLY 79 N -1.72 2.73 0.13 -0.13 0.00 -1.26 -4.52 105.19 100.43 2qjm n GLY 79 Ca 0.00 -1.76 -0.09 0.00 0.00 0.00 0.00 46.02 44.18 2qjm n GLY 79 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2qjm h PRO 80 N 0.00 -0.06 0.01 1.61 0.11 -1.93 -0.98 132.00 130.76 2qjm h PRO 80 Ca 0.00 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.11 2qjm h PRO 80 Cb 0.00 0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.12 2qjm h PRO 80 CO 0.00 -0.04 -0.01 0.28 -0.21 0.00 0.00 178.00 178.02 2qjm h VAL 81 N -0.06 1.29 -0.01 3.15 2.07 -1.98 -2.65 116.25 118.06 2qjm h VAL 81 Ca 0.10 -0.93 0.02 0.00 0.82 0.00 0.00 66.70 66.71 2qjm h VAL 81 Cb 0.21 1.92 -0.03 0.00 -1.52 0.00 0.00 31.29 31.87 2qjm h VAL 81 CO -0.22 0.24 -0.15 0.74 0.02 0.00 0.00 177.57 178.21 2qjm h THR 82 N -0.42 0.64 0.00 2.57 2.02 -1.78 -2.63 112.91 113.31 2qjm h THR 82 Ca -0.00 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.12 2qjm h THR 82 Cb 0.41 0.64 -0.01 0.00 -1.74 0.00 0.00 68.15 67.45 2qjm h THR 82 CO 0.00 0.00 -0.28 0.24 0.37 0.00 0.00 175.52 175.85 2qjm h MET 83 N -0.24 0.00 -0.39 6.66 2.86 -1.27 -2.16 114.93 120.40 2qjm h MET 83 Ca 0.05 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.63 2qjm h MET 83 Cb 0.31 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.95 2qjm h MET 83 CO -0.15 0.28 0.01 -0.09 1.06 0.00 0.00 176.91 178.02 2qjm h ARG 84 N 0.00 0.68 -0.33 1.72 9.65 -1.17 0.28 114.38 125.21 2qjm h ARG 84 Ca -0.00 -0.21 -0.03 0.00 -1.10 0.00 0.00 59.98 58.63 2qjm h ARG 84 Cb 0.64 -0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 29.14 2qjm h ARG 84 CO 0.04 0.77 0.09 0.00 2.80 0.00 0.00 179.97 183.67 2qjm h ALA 85 N 0.88 0.43 -0.84 2.80 0.00 -1.19 -1.27 119.26 120.08 2qjm h ALA 85 Ca 0.11 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2qjm h ALA 85 Cb 0.46 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 2qjm h ALA 85 CO 0.02 0.08 0.44 0.82 0.00 0.00 0.00 179.25 180.62 2qjm h ILE 86 N 0.38 1.25 -0.56 0.00 2.04 -1.30 -2.20 117.51 117.12 2qjm h ILE 86 Ca 0.11 -0.64 -0.03 0.00 1.00 0.00 0.00 64.86 65.29 2qjm h ILE 86 Cb 0.27 0.14 -0.02 0.00 -0.74 0.00 0.00 36.82 36.47 2qjm h ILE 86 CO -0.00 0.28 0.21 0.00 0.00 0.00 0.00 178.15 178.65 2qjm h ALA 87 N 1.24 0.73 -0.73 1.87 0.00 -0.63 0.25 119.26 121.99 2qjm h ALA 87 Ca 0.29 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 55.05 2qjm h ALA 87 Cb 0.05 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 2qjm h ALA 87 CO -0.04 0.35 0.48 0.00 0.00 0.00 0.00 179.25 180.03 2qjm h ALA 88 N 1.07 0.93 0.06 0.00 0.00 -0.94 0.23 119.26 120.61 2qjm h ALA 88 Ca 0.19 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 2qjm h ALA 88 Cb 0.22 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2qjm h ALA 88 CO -0.01 0.31 -0.03 0.28 0.00 0.00 0.00 179.25 179.80 2qjm h VAL 89 N 0.96 1.11 -0.68 0.00 2.07 -1.12 -2.02 116.25 116.56 2qjm h VAL 89 Ca 0.28 -0.55 0.06 0.00 0.82 0.00 0.00 66.70 67.30 2qjm h VAL 89 Cb -0.07 1.47 -0.06 0.00 -1.52 0.00 0.00 31.29 31.12 2qjm h VAL 89 CO -0.08 0.14 0.38 -0.78 0.02 0.00 0.00 177.57 177.25 2qjm h ASP 90 N -0.32 0.56 -0.45 0.57 3.58 -0.51 -0.42 116.42 119.43 2qjm h ASP 90 Ca -0.01 0.03 -0.02 0.00 0.42 0.00 0.00 57.03 57.46 2qjm h ASP 90 Cb 0.29 -0.08 -0.02 0.00 1.72 0.00 0.00 39.33 41.24 2qjm h ASP 90 CO 0.01 0.36 0.22 0.24 -2.88 0.00 0.00 179.24 177.19 2qjm h MET 91 N 0.70 0.65 -0.77 0.28 2.86 -0.49 -1.39 114.93 116.76 2qjm h MET 91 Ca 0.31 -0.09 -0.02 0.00 -2.06 0.00 0.00 59.70 57.83 2qjm h MET 91 Cb 0.19 -0.12 -0.04 0.00 0.06 0.00 0.00 31.60 31.70 2qjm h MET 91 CO -0.19 0.55 0.39 0.00 1.06 0.00 0.00 176.91 178.73 2qjm h ALA 92 N 1.06 0.99 -0.55 6.32 0.00 -0.81 -1.26 119.26 125.02 2qjm h ALA 92 Ca 0.15 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.82 2qjm h ALA 92 Cb 0.11 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 2qjm h ALA 92 CO -0.02 0.53 -0.09 -0.07 0.00 0.00 0.00 179.25 179.60 2qjm h LEU 93 N 1.07 1.02 -0.80 0.00 3.38 -0.81 -1.32 115.31 117.84 2qjm h LEU 93 Ca 0.27 -0.32 -0.13 0.00 0.09 0.00 0.00 57.88 57.79 2qjm h LEU 93 Cb 0.08 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 2qjm h LEU 93 CO -0.04 1.11 -0.57 -0.50 0.09 0.00 0.00 178.44 178.54 2qjm h TRP 94 N 0.91 0.11 -0.10 1.13 4.06 -1.10 -1.06 115.95 119.90 2qjm h TRP 94 Ca 0.15 -0.04 -0.01 0.00 2.06 0.00 0.00 58.89 61.05 2qjm h TRP 94 Cb 0.65 -0.02 -0.00 0.00 -1.00 0.00 0.00 29.16 28.78 2qjm h TRP 94 CO 0.04 0.64 0.03 0.22 -3.56 0.00 0.00 178.44 175.81 2qjm h ASP 95 N 0.07 0.14 -0.57 -3.49 3.58 -0.98 -0.94 116.42 114.23 2qjm h ASP 95 Ca -0.00 -0.18 0.01 0.00 0.42 0.00 0.00 57.03 57.27 2qjm h ASP 95 Cb 1.03 -0.04 -0.03 0.00 1.72 0.00 0.00 39.33 42.01 2qjm h ASP 95 CO 0.08 0.28 0.37 0.40 -2.88 0.00 0.00 179.24 177.49 2qjm h ILE 96 N -0.01 1.13 -0.67 2.25 2.04 -1.06 -1.76 117.51 119.42 2qjm h ILE 96 Ca 0.03 -0.26 -0.07 0.00 1.00 0.00 0.00 64.86 65.56 2qjm h ILE 96 Cb 0.19 0.31 -0.03 0.00 -0.74 0.00 0.00 36.82 36.56 2qjm h ILE 96 CO -0.00 0.14 0.14 0.50 0.00 0.00 0.00 178.15 178.93 2qjm h LYS 97 N 0.75 1.09 -0.52 2.37 3.64 -0.97 -1.10 116.57 121.83 2qjm h LYS 97 Ca 0.21 -0.27 -0.10 0.00 -1.27 0.00 0.00 60.65 59.22 2qjm h LYS 97 Cb -0.06 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.60 2qjm h LYS 97 CO -0.06 0.97 -0.08 0.00 -2.27 0.00 0.00 179.45 178.01 2qjm h ALA 98 N 1.12 0.71 0.03 5.00 0.00 -0.92 -1.28 119.26 123.92 2qjm h ALA 98 Ca 0.21 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 2qjm h ALA 98 Cb 0.39 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 2qjm h ALA 98 CO 0.01 0.59 -0.02 0.87 0.00 0.00 0.00 179.25 180.70 2qjm h LYS 99 N 0.83 -0.05 -0.52 0.00 1.57 -1.05 0.17 116.57 117.53 2qjm h LYS 99 Ca 0.14 0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.95 2qjm h LYS 99 Cb 0.63 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.93 2qjm h LYS 99 CO 0.04 -0.03 0.34 0.52 -0.57 0.00 0.00 179.45 179.75 2qjm h MET 100 N -0.05 0.59 -0.00 3.15 2.86 -1.09 0.42 114.93 120.81 2qjm h MET 100 Ca -0.00 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 2qjm h MET 100 Cb 0.04 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 31.57 2qjm h MET 100 CO 0.00 0.39 -0.09 0.00 1.06 0.00 0.00 176.91 178.28 2qjm n ALA 101 N -2.47 2.55 -2.91 6.32 0.00 -0.50 -4.93 120.51 118.58 2qjm n ALA 101 Ca 0.06 -0.15 -0.15 0.00 0.00 0.00 0.00 53.44 53.19 2qjm n ALA 101 Cb 0.13 -1.41 0.03 0.00 0.00 0.00 0.00 19.45 18.20 2qjm n ALA 101 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qjm n GLY 102 N 1.49 -0.11 3.08 0.00 0.00 0.14 -5.03 105.19 104.75 2qjm n GLY 102 Ca 0.07 -0.13 -0.09 0.00 0.00 0.00 0.00 46.02 45.87 2qjm n GLY 102 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2qjm s MET 103 N -5.48 0.52 0.49 1.61 -1.94 -0.66 -4.85 119.30 108.98 2qjm s MET 103 Ca 0.26 -0.71 -0.22 0.00 -1.71 0.00 0.00 55.69 53.30 2qjm s MET 103 Cb -0.11 0.20 -0.07 0.00 2.01 0.00 0.00 34.83 36.86 2qjm s MET 103 CO 0.32 -0.12 1.22 -1.25 -0.01 0.00 0.00 175.02 175.18 2qjm s PRO 104 N -2.31 3.56 0.31 2.03 0.04 -1.26 -2.22 135.00 135.15 2qjm s PRO 104 Ca -0.08 1.89 0.06 0.00 0.04 0.00 0.00 61.00 62.92 2qjm s PRO 104 Cb -0.03 -2.34 0.83 0.00 0.04 0.00 0.00 34.50 33.00 2qjm s PRO 104 CO -0.03 -0.75 1.66 1.25 0.04 0.00 0.00 177.00 179.16 2qjm h LEU 105 N 1.83 0.19 -2.09 -3.56 5.85 -1.36 -1.47 115.31 114.71 2qjm h LEU 105 Ca -0.50 0.19 0.09 0.00 0.84 0.00 0.00 57.88 58.51 2qjm h LEU 105 Cb 1.26 0.21 -0.01 0.00 0.37 0.00 0.00 40.66 42.50 2qjm h LEU 105 CO 0.59 -0.14 0.29 0.10 -0.34 0.00 0.00 178.44 178.95 2qjm h TYR 106 N 0.26 0.00 -0.19 1.25 -0.00 -1.88 0.46 116.97 116.88 2qjm h TYR 106 Ca 0.61 0.00 -0.10 0.00 0.00 0.00 0.00 58.73 59.24 2qjm h TYR 106 Cb 1.29 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 38.00 2qjm h TYR 106 CO -0.17 0.00 -0.32 1.96 -0.00 0.00 0.00 178.16 179.62 2qjm h GLN 107 N 0.00 0.38 -0.05 0.10 1.08 -1.56 0.47 115.11 115.52 2qjm h GLN 107 Ca 0.15 -0.16 -0.16 0.00 -1.45 0.00 0.00 58.65 57.04 2qjm h GLN 107 Cb 0.74 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 28.14 2qjm h GLN 107 CO -0.00 0.66 -0.69 -0.07 -0.95 0.00 0.00 178.83 177.78 2qjm h LEU 108 N 0.33 0.26 -1.21 1.46 4.07 -1.03 -3.04 115.31 116.14 2qjm h LEU 108 Ca 0.04 -0.16 -0.01 0.00 0.08 0.00 0.00 57.88 57.83 2qjm h LEU 108 Cb 0.73 -0.08 -0.00 0.00 1.08 0.00 0.00 40.66 42.39 2qjm h LEU 108 CO 0.06 0.86 -0.03 -0.07 -1.08 0.00 0.00 178.44 178.18 2qjm h LEU 109 N 0.15 0.00 0.00 1.67 3.38 -1.27 -3.45 115.31 115.79 2qjm h LEU 109 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2qjm h LEU 109 Cb 1.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.98 2qjm h LEU 109 CO 0.10 0.03 0.00 0.61 0.09 0.00 0.00 178.44 179.28 2qjm n GLY 110 N 0.20 -0.84 0.00 0.83 0.00 -1.07 -5.03 105.19 99.29 2qjm n GLY 110 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2qjm n GLY 110 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qjm n GLY 111 N 0.00 -0.95 3.81 -0.02 0.00 0.13 -4.94 105.19 103.22 2qjm n GLY 111 Ca 0.00 -1.66 -0.36 0.00 0.00 0.00 0.00 46.02 44.00 2qjm n GLY 111 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2qjm s ARG 112 N -1.57 4.34 -0.00 1.61 1.70 -1.26 -4.16 118.95 119.61 2qjm s ARG 112 Ca 0.00 1.00 0.09 0.00 -0.47 0.00 0.00 55.73 56.36 2qjm s ARG 112 Cb 0.00 -2.83 -0.11 0.00 -0.57 0.00 0.00 34.95 31.43 2qjm s ARG 112 CO 0.00 0.35 0.35 0.43 -1.08 0.00 0.00 175.30 175.35 2qjm n SER 113 N 0.62 1.03 -3.70 -2.89 7.64 0.52 -4.95 113.62 111.89 2qjm n SER 113 Ca -0.01 -0.54 -0.09 0.00 1.01 0.00 0.00 58.87 59.24 2qjm n SER 113 Cb 0.51 1.11 -0.03 0.00 -1.01 0.00 0.00 64.21 64.79 2qjm n SER 113 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2qjm s ARG 114 N -2.08 1.76 0.00 1.43 1.70 -1.21 -5.07 118.95 115.49 2qjm s ARG 114 Ca 0.02 -1.29 0.00 0.00 -0.47 0.00 0.00 55.73 53.99 2qjm s ARG 114 Cb 0.07 0.52 0.00 0.00 -0.57 0.00 0.00 34.95 34.97 2qjm s ARG 114 CO 0.39 -0.77 0.00 -0.25 -1.08 0.00 0.00 175.30 173.59 2qjm n ASP 115 N -0.70 0.00 -4.90 -2.89 9.92 -1.26 -4.95 116.55 111.77 2qjm n ASP 115 Ca -0.03 0.02 -0.28 0.00 -0.53 0.00 0.00 54.79 53.97 2qjm n ASP 115 Cb 0.61 -0.08 0.01 0.00 -0.64 0.00 0.00 41.12 41.01 2qjm n ASP 115 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 2qjm s GLY 116 N -1.29 1.54 -0.32 0.44 0.00 -1.26 -4.79 107.32 101.63 2qjm s GLY 116 Ca 0.00 -0.50 -0.06 0.00 0.00 0.00 0.00 44.72 44.16 2qjm s GLY 116 CO 0.00 -0.29 0.08 -0.42 0.00 0.00 0.00 173.10 172.47 2qjm s ILE 117 N -2.86 3.68 0.31 0.90 -1.09 0.10 -4.91 121.20 117.34 2qjm s ILE 117 Ca 0.50 -1.08 -0.29 0.00 -2.23 0.00 0.00 60.65 57.54 2qjm s ILE 117 Cb -0.10 -3.05 -0.11 0.00 -1.58 0.00 0.00 42.46 37.62 2qjm s ILE 117 CO 0.46 -0.11 1.44 -0.32 -1.23 0.00 0.00 174.94 175.18 2qjm s MET 118 N 1.40 4.22 0.34 2.79 -2.45 -1.26 -0.84 119.30 123.50 2qjm s MET 118 Ca -0.01 2.40 0.03 0.00 -1.25 0.00 0.00 55.69 56.86 2qjm s MET 118 Cb -0.19 -3.05 -0.04 0.00 1.25 0.00 0.00 34.83 32.80 2qjm s MET 118 CO 0.02 -0.43 0.11 0.14 1.05 0.00 0.00 175.02 175.91 2qjm s VAL 119 N -0.59 0.72 0.05 10.11 -7.23 -1.19 -1.45 120.40 120.82 2qjm s VAL 119 Ca 0.56 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.77 2qjm s VAL 119 Cb -0.44 -2.56 -0.02 0.00 0.56 0.00 0.00 36.38 33.92 2qjm s VAL 119 CO 0.52 0.00 -0.13 -0.72 -0.31 0.00 0.00 175.10 174.45 2qjm s TYR 120 N -3.40 1.15 0.49 2.82 -0.85 -1.15 -4.05 117.35 112.35 2qjm s TYR 120 Ca 0.32 -0.40 0.09 0.00 -0.52 0.00 0.00 57.07 56.56 2qjm s TYR 120 Cb 0.06 -0.67 0.04 0.00 0.38 0.00 0.00 41.96 41.77 2qjm s TYR 120 CO 0.15 0.03 0.67 0.20 -1.52 0.00 0.00 175.55 175.08 2qjm s GLY 121 N -1.39 1.85 -0.57 5.49 0.00 -0.89 -3.34 107.32 108.47 2qjm s GLY 121 Ca -0.01 -1.88 -0.07 0.00 0.00 0.00 0.00 44.72 42.76 2qjm s GLY 121 CO 0.02 -1.58 0.42 0.30 0.00 0.00 0.00 173.10 172.26 2qjm s HIS 122 N -2.49 3.49 -0.42 1.90 3.76 -1.26 -0.62 115.29 119.65 2qjm s HIS 122 Ca 0.58 -2.24 -0.19 0.00 -0.15 0.00 0.00 55.06 53.06 2qjm s HIS 122 Cb -0.08 -3.42 0.02 0.00 1.11 0.00 0.00 32.58 30.21 2qjm s HIS 122 CO 0.36 -0.94 0.56 0.00 -0.85 0.00 0.00 174.74 173.86 2qjm s ALA 123 N 0.68 3.39 0.15 -1.40 0.00 -0.03 -5.00 121.76 119.56 2qjm s ALA 123 Ca 0.12 -1.27 0.09 0.00 0.00 0.00 0.00 51.96 50.89 2qjm s ALA 123 Cb -0.21 -3.18 -0.04 0.00 0.00 0.00 0.00 23.12 19.69 2qjm s ALA 123 CO -0.03 -1.63 -0.13 -0.80 0.00 0.00 0.00 175.76 173.17 2qjm s ASN 124 N 1.90 4.13 -0.05 0.00 0.01 -1.26 -1.55 114.94 118.12 2qjm s ASN 124 Ca 0.19 -0.56 -0.30 0.00 -0.71 0.00 0.00 52.86 51.47 2qjm s ASN 124 Cb -0.15 -0.67 0.07 0.00 0.41 0.00 0.00 41.25 40.91 2qjm s ASN 124 CO 0.16 0.14 0.67 -0.83 -1.51 0.00 0.00 177.10 175.73 2qjm s GLY 125 N -2.54 -0.57 0.49 0.66 0.00 -1.00 -4.48 107.32 99.89 2qjm s GLY 125 Ca 0.22 1.29 0.28 0.00 0.00 0.00 0.00 44.72 46.52 2qjm s GLY 125 CO 0.13 0.94 1.87 1.48 0.00 0.00 0.00 173.10 177.52 2qjm h SER 126 N 3.04 0.00 -3.75 1.64 4.64 -1.89 0.50 113.55 117.72 2qjm h SER 126 Ca -0.27 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 60.81 2qjm h SER 126 Cb 1.14 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.18 2qjm h SER 126 CO 0.39 0.10 -0.09 -0.90 -0.87 0.00 0.00 176.83 175.45 2qjm n ASP 127 N -3.21 -1.40 0.03 4.97 5.68 -1.26 -3.43 116.55 117.92 2qjm n ASP 127 Ca 0.01 -2.77 -0.12 0.00 -0.50 0.00 0.00 54.79 51.41 2qjm n ASP 127 Cb 0.39 2.57 -0.07 0.00 -1.14 0.00 0.00 41.12 42.86 2qjm n ASP 127 CO 0.00 0.00 0.00 0.40 -1.33 0.00 0.00 177.20 176.27 2qjm h ILE 128 N 1.96 1.04 -0.46 2.12 2.04 -1.89 -0.50 117.51 121.82 2qjm h ILE 128 Ca -0.27 -0.11 0.09 0.00 1.00 0.00 0.00 64.86 65.58 2qjm h ILE 128 Cb 1.13 1.10 -0.08 0.00 -0.74 0.00 0.00 36.82 38.23 2qjm h ILE 128 CO 0.36 0.03 -0.07 0.00 0.00 0.00 0.00 178.15 178.47 2qjm h ALA 129 N 0.96 0.36 -0.43 1.87 0.00 -1.99 0.32 119.26 120.34 2qjm h ALA 129 Ca 0.00 0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.99 2qjm h ALA 129 Cb 0.04 0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 2qjm h ALA 129 CO -0.00 -0.43 -0.09 1.49 0.00 0.00 0.00 179.25 180.23 2qjm h GLU 130 N 0.04 0.76 -0.26 0.00 4.81 -1.91 -2.35 114.58 115.67 2qjm h GLU 130 Ca 0.22 -0.24 -0.17 0.00 -0.13 0.00 0.00 59.36 59.04 2qjm h GLU 130 Cb 0.34 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.65 2qjm h GLU 130 CO -0.44 0.83 -0.53 1.15 -0.73 0.00 0.00 179.01 179.29 2qjm h THR 131 N 0.70 1.29 -0.54 0.32 2.02 -0.04 -2.18 112.91 114.49 2qjm h THR 131 Ca 0.12 -1.74 0.01 0.00 0.77 0.00 0.00 66.41 65.57 2qjm h THR 131 Cb 0.55 1.66 -0.03 0.00 -1.74 0.00 0.00 68.15 68.60 2qjm h THR 131 CO 0.03 0.56 0.36 0.58 0.37 0.00 0.00 175.52 177.42 2qjm h VAL 132 N 0.59 1.14 -0.73 3.16 2.07 -0.26 -1.01 116.25 121.20 2qjm h VAL 132 Ca 0.02 -0.25 -0.03 0.00 0.82 0.00 0.00 66.70 67.25 2qjm h VAL 132 Cb 1.12 0.34 -0.03 0.00 -1.52 0.00 0.00 31.29 31.20 2qjm h VAL 132 CO 0.11 0.13 0.32 -0.08 0.02 0.00 0.00 177.57 178.08 2qjm h GLU 133 N 0.73 1.05 -0.66 1.57 4.22 -1.34 -2.15 114.58 118.00 2qjm h GLU 133 Ca 0.20 -0.16 -0.06 0.00 0.08 0.00 0.00 59.36 59.42 2qjm h GLU 133 Cb -0.08 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 28.95 2qjm h GLU 133 CO -0.04 0.83 0.18 0.00 -2.18 0.00 0.00 179.01 177.80 2qjm h ALA 134 N 1.31 1.07 -0.53 2.92 0.00 -0.70 -1.97 119.26 121.35 2qjm h ALA 134 Ca 0.25 -0.22 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 2qjm h ALA 134 Cb 0.15 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 2qjm h ALA 134 CO -0.03 0.62 -0.05 0.28 0.00 0.00 0.00 179.25 180.08 2qjm h VAL 135 N 0.99 1.26 -0.78 0.00 2.07 -0.80 -2.09 116.25 116.90 2qjm h VAL 135 Ca 0.21 -1.16 0.01 0.00 0.82 0.00 0.00 66.70 66.58 2qjm h VAL 135 Cb 0.32 0.90 -0.04 0.00 -1.52 0.00 0.00 31.29 30.95 2qjm h VAL 135 CO -0.00 0.41 0.52 1.23 0.02 0.00 0.00 177.57 179.75 2qjm h GLY 136 N 0.98 1.10 0.98 2.17 0.00 -0.99 -0.20 103.07 107.11 2qjm h GLY 136 Ca 0.15 -0.41 -0.02 0.00 0.00 0.00 0.00 47.33 47.05 2qjm h GLY 136 CO 0.03 0.40 0.25 0.84 0.00 0.00 0.00 176.54 178.07 2qjm h HIS 137 N 1.06 0.73 0.00 5.60 6.17 -0.70 -0.24 115.15 127.77 2qjm h HIS 137 Ca 0.29 -0.03 -0.10 0.00 0.71 0.00 0.00 60.37 61.23 2qjm h HIS 137 Cb -0.12 -0.23 -0.01 0.00 2.52 0.00 0.00 27.41 29.57 2qjm h HIS 137 CO -0.00 0.57 -0.49 1.88 0.71 0.00 0.00 177.93 180.60 2qjm h TYR 138 N 0.69 0.00 -0.45 5.26 0.05 -0.90 -2.33 116.97 119.28 2qjm h TYR 138 Ca 0.18 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.86 2qjm h TYR 138 Cb 0.10 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.83 2qjm h TYR 138 CO -0.01 0.49 -0.10 0.82 -1.05 0.00 0.00 178.16 178.32 2qjm h ILE 139 N 0.00 1.27 -0.93 -2.88 2.04 -0.52 -2.37 117.51 114.12 2qjm h ILE 139 Ca -0.00 -1.21 0.02 0.00 1.00 0.00 0.00 64.86 64.66 2qjm h ILE 139 Cb 0.90 1.12 -0.05 0.00 -0.74 0.00 0.00 36.82 38.05 2qjm h ILE 139 CO 0.06 0.41 0.61 0.44 0.00 0.00 0.00 178.15 179.68 2qjm h ASP 140 N 0.70 1.05 0.13 1.72 3.32 -0.71 -2.20 116.42 120.44 2qjm h ASP 140 Ca 0.12 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.14 2qjm h ASP 140 Cb 0.64 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.93 2qjm h ASP 140 CO 0.04 0.75 0.00 0.23 -1.72 0.00 0.00 179.24 178.55 2qjm n MET 141 N -4.45 0.38 -0.23 3.56 2.81 -0.91 -4.85 117.12 113.43 2qjm n MET 141 Ca 0.11 0.06 0.00 0.00 -1.81 0.00 0.00 57.70 56.06 2qjm n MET 141 Cb 0.03 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.04 2qjm n MET 141 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2qjm n GLY 142 N 0.01 0.85 3.71 3.03 0.00 -0.83 -4.18 105.19 107.79 2qjm n GLY 142 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 2qjm n GLY 142 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qjm s TYR 143 N -2.05 3.27 -0.47 1.61 1.51 -0.91 -3.62 117.35 116.68 2qjm s TYR 143 Ca 0.00 1.12 0.24 0.00 -1.01 0.00 0.00 57.07 57.42 2qjm s TYR 143 Cb 0.00 -3.53 0.36 0.00 -0.11 0.00 0.00 41.96 38.67 2qjm s TYR 143 CO 0.00 -1.77 1.49 0.87 -1.11 0.00 0.00 175.55 175.03 2qjm h LYS 144 N 7.02 0.00 -3.82 -0.62 1.57 -1.82 -3.42 116.57 115.48 2qjm h LYS 144 Ca -0.40 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.10 2qjm h LYS 144 Cb 1.20 0.00 -0.30 0.00 0.08 0.00 0.00 32.23 33.22 2qjm h LYS 144 CO 0.85 0.00 -0.73 0.00 -0.57 0.00 0.00 179.45 178.99 2qjm s ALA 145 N -3.22 0.14 -0.02 3.86 0.00 -1.26 -1.58 121.76 119.69 2qjm s ALA 145 Ca 0.06 0.02 0.01 0.00 0.00 0.00 0.00 51.96 52.05 2qjm s ALA 145 Cb 0.08 -0.10 0.01 0.00 0.00 0.00 0.00 23.12 23.11 2qjm s ALA 145 CO 0.69 -0.00 -0.04 0.42 0.00 0.00 0.00 175.76 176.83 2qjm s ILE 146 N 0.25 0.36 -0.15 0.00 1.09 -0.27 -2.11 121.20 120.37 2qjm s ILE 146 Ca -0.02 -0.13 -0.16 0.00 -1.10 0.00 0.00 60.65 59.24 2qjm s ILE 146 Cb -0.04 -0.35 -0.04 0.00 -1.06 0.00 0.00 42.46 40.96 2qjm s ILE 146 CO -0.01 0.14 0.38 -0.60 -0.10 0.00 0.00 174.94 174.75 2qjm s ARG 147 N 0.32 4.27 -0.23 2.79 3.52 0.21 -1.13 118.95 128.69 2qjm s ARG 147 Ca -0.03 0.25 -0.04 0.00 -0.13 0.00 0.00 55.73 55.78 2qjm s ARG 147 Cb -0.07 -3.45 -0.00 0.00 -1.56 0.00 0.00 34.95 29.87 2qjm s ARG 147 CO -0.00 0.15 -0.03 0.00 -0.81 0.00 0.00 175.30 174.60 2qjm s ALA 148 N 0.70 2.82 -0.05 6.12 0.00 -0.46 -0.85 121.76 130.04 2qjm s ALA 148 Ca 0.21 -1.24 0.05 0.00 0.00 0.00 0.00 51.96 50.97 2qjm s ALA 148 Cb -0.14 -1.74 -0.01 0.00 0.00 0.00 0.00 23.12 21.23 2qjm s ALA 148 CO 0.07 -0.54 -0.19 -0.65 0.00 0.00 0.00 175.76 174.44 2qjm s GLN 149 N 1.45 1.98 0.06 0.00 -1.52 -0.60 -4.69 119.66 116.34 2qjm s GLN 149 Ca 0.05 -0.70 0.04 0.00 -1.95 0.00 0.00 55.36 52.80 2qjm s GLN 149 Cb -0.15 -1.71 -0.03 0.00 -0.22 0.00 0.00 33.01 30.90 2qjm s GLN 149 CO -0.03 0.29 -0.12 -0.08 -0.25 0.00 0.00 175.29 175.10 2qjm s THR 150 N -0.05 0.92 0.60 -0.19 -1.32 -1.26 -2.37 115.64 111.97 2qjm s THR 150 Ca -0.03 -1.17 -0.16 0.00 -1.21 0.00 0.00 61.69 59.12 2qjm s THR 150 Cb -0.12 -0.91 -0.03 0.00 -1.51 0.00 0.00 72.50 69.93 2qjm s THR 150 CO 0.02 -0.23 1.06 -0.83 -2.21 0.00 0.00 174.62 172.43 2qjm s GLY 151 N -1.57 2.14 -0.35 6.08 0.00 0.17 -4.96 107.32 108.83 2qjm s GLY 151 Ca -0.04 0.41 -0.05 0.00 0.00 0.00 0.00 44.72 45.05 2qjm s GLY 151 CO 0.02 0.74 0.12 0.14 0.00 0.00 0.00 173.10 174.11 2qjm s VAL 152 N -2.43 3.57 0.00 1.40 1.01 -1.26 -4.35 120.40 118.34 2qjm s VAL 152 Ca 0.64 -1.39 -0.34 0.00 0.00 0.00 0.00 61.98 60.89 2qjm s VAL 152 Cb -0.16 -3.13 -0.12 0.00 0.00 0.00 0.00 36.38 32.97 2qjm s VAL 152 CO 0.37 -0.30 1.80 -2.65 0.00 0.00 0.00 175.10 174.32 2qjm n PRO 153 N 4.74 2.26 0.00 2.72 -0.02 -1.26 -1.13 135.00 142.31 2qjm n PRO 153 Ca -0.11 0.82 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 2qjm n PRO 153 Cb 0.43 -2.66 0.00 0.00 -0.02 0.00 0.00 33.50 31.26 2qjm n PRO 153 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qjm n GLY 154 N 4.14 2.35 0.00 -1.23 0.00 -1.26 -5.06 105.19 104.12 2qjm n GLY 154 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 2qjm n GLY 154 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2qjm n ILE 155 N -0.30 0.00 0.00 -0.61 2.08 -0.28 -5.04 119.36 115.21 2qjm n ILE 155 Ca 0.00 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.31 2qjm n ILE 155 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 38.89 2qjm n ILE 155 CO 0.00 0.00 0.00 -1.54 0.56 0.00 0.00 176.55 175.57 2qjm n SER 174 N 0.00 0.00 -4.48 4.38 3.41 -1.26 -4.90 113.62 110.76 2qjm n SER 174 Ca 0.00 0.00 -0.23 0.00 -0.26 0.00 0.00 58.87 58.38 2qjm n SER 174 Cb 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 63.84 2qjm n SER 174 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2qjm s LEU 175 N 0.00 2.47 0.22 1.04 1.43 -1.26 -4.73 118.68 117.85 2qjm s LEU 175 Ca 0.00 -1.29 -0.32 0.00 -1.03 0.00 0.00 54.13 51.49 2qjm s LEU 175 Cb 0.00 -0.62 -0.12 0.00 0.03 0.00 0.00 46.19 45.48 2qjm s LEU 175 CO 0.00 -0.45 1.69 -2.65 0.23 0.00 0.00 176.35 175.17 2qjm n PRO 176 N -0.71 2.71 -1.79 1.29 -0.02 -1.26 -4.74 135.00 130.48 2qjm n PRO 176 Ca -0.04 0.97 -0.32 0.00 -2.02 0.00 0.00 63.50 62.09 2qjm n PRO 176 Cb 0.65 -2.80 0.03 0.00 -0.02 0.00 0.00 33.50 31.36 2qjm n PRO 176 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 2qjm s SER 177 N 1.03 5.48 -0.21 2.55 0.01 -1.26 -4.82 113.70 116.48 2qjm s SER 177 Ca 0.73 1.76 -0.02 0.00 1.31 0.00 0.00 55.95 59.74 2qjm s SER 177 Cb -0.52 -2.52 0.01 0.00 0.21 0.00 0.00 66.02 63.20 2qjm s SER 177 CO 0.36 -1.37 -0.10 -0.69 0.41 0.00 0.00 173.24 171.84 2qjm s VAL 178 N -2.70 2.81 0.05 3.43 1.01 -1.26 -0.96 120.40 122.79 2qjm s VAL 178 Ca 0.62 -0.75 0.04 0.00 0.00 0.00 0.00 61.98 61.89 2qjm s VAL 178 Cb -0.16 -2.28 -0.04 0.00 0.00 0.00 0.00 36.38 33.91 2qjm s VAL 178 CO 0.45 0.43 -0.02 0.42 0.00 0.00 0.00 175.10 176.38 2qjm s THR 179 N 1.38 3.95 0.47 3.92 -4.23 0.30 -4.97 115.64 116.45 2qjm s THR 179 Ca 0.04 -0.88 0.01 0.00 -1.18 0.00 0.00 61.69 59.69 2qjm s THR 179 Cb -0.14 -2.83 0.01 0.00 1.34 0.00 0.00 72.50 70.88 2qjm s THR 179 CO -0.07 0.23 0.68 -0.83 -0.54 0.00 0.00 174.62 174.08 2qjm s GLY 180 N -1.98 1.66 -0.16 3.99 0.00 -1.26 -1.21 107.32 108.36 2qjm s GLY 180 Ca 0.23 -1.19 -0.28 0.00 0.00 0.00 0.00 44.72 43.47 2qjm s GLY 180 CO 0.14 -1.00 0.70 0.86 0.00 0.00 0.00 173.10 173.81 2qjm s TRP 181 N -2.57 -0.72 -0.17 1.90 -0.11 -0.99 -4.83 118.94 111.45 2qjm s TRP 181 Ca 0.51 1.51 -0.05 0.00 1.22 0.00 0.00 56.10 59.30 2qjm s TRP 181 Cb -0.10 0.34 0.08 0.00 -1.50 0.00 0.00 33.47 32.29 2qjm s TRP 181 CO 0.37 -0.49 0.29 0.34 -4.62 0.00 0.00 176.95 172.84 2qjm s ASP 182 N -0.42 0.47 0.15 5.86 2.15 -1.26 -3.54 116.67 120.09 2qjm s ASP 182 Ca -0.05 0.43 -0.13 0.00 0.43 0.00 0.00 52.55 53.22 2qjm s ASP 182 Cb -0.02 0.77 0.04 0.00 -0.30 0.00 0.00 42.92 43.40 2qjm s ASP 182 CO 0.05 -0.26 1.68 0.74 -0.17 0.00 0.00 175.17 177.21 2qjm h THR 183 N 6.26 1.23 -0.86 1.71 2.02 -2.00 -2.83 112.91 118.45 2qjm h THR 183 Ca -0.16 -0.77 0.01 0.00 0.77 0.00 0.00 66.41 66.27 2qjm h THR 183 Cb 1.13 0.77 -0.04 0.00 -1.74 0.00 0.00 68.15 68.26 2qjm h THR 183 CO 0.18 0.28 0.57 -0.09 0.37 0.00 0.00 175.52 176.84 2qjm h ARG 184 N 0.70 1.12 -0.53 6.66 9.65 -1.98 0.21 114.38 130.20 2qjm h ARG 184 Ca 0.17 -0.07 -0.10 0.00 -1.10 0.00 0.00 59.98 58.88 2qjm h ARG 184 Cb 0.27 -0.25 -0.02 0.00 -1.39 0.00 0.00 29.97 28.58 2qjm h ARG 184 CO -0.01 0.74 -0.04 0.87 2.80 0.00 0.00 179.97 184.34 2qjm h LYS 185 N 1.15 0.97 -0.44 0.20 1.57 -1.97 -2.20 116.57 115.85 2qjm h LYS 185 Ca 0.32 -0.33 -0.07 0.00 -1.87 0.00 0.00 60.65 58.70 2qjm h LYS 185 Cb -0.10 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.11 2qjm h LYS 185 CO -0.08 1.00 -0.01 0.00 -0.57 0.00 0.00 179.45 179.80 2qjm h ALA 186 N 0.94 0.59 -0.35 3.86 0.00 -1.15 -1.79 119.26 121.36 2qjm h ALA 186 Ca 0.15 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.79 2qjm h ALA 186 Cb 0.59 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 2qjm h ALA 186 CO 0.04 0.39 0.23 -0.07 0.00 0.00 0.00 179.25 179.84 2qjm h LEU 187 N 0.62 0.39 0.00 0.00 3.38 -0.45 0.06 115.31 119.32 2qjm h LEU 187 Ca 0.12 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.97 2qjm h LEU 187 Cb 0.50 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 2qjm h LEU 187 CO 0.02 0.28 -0.78 0.78 0.09 0.00 0.00 178.44 178.84 2qjm h ASN 188 N 0.46 0.00 0.00 -0.43 2.35 -1.16 -3.39 115.58 113.41 2qjm h ASN 188 Ca 0.13 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.69 2qjm h ASN 188 Cb -0.03 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.31 2qjm h ASN 188 CO -0.03 0.48 -1.35 0.00 -1.65 0.00 0.00 177.43 174.87 2qjm n TYR 189 N -3.09 0.55 -0.26 1.19 9.36 -0.69 -4.48 117.16 119.73 2qjm n TYR 189 Ca -0.01 0.24 0.07 0.00 3.32 0.00 0.00 57.90 61.52 2qjm n TYR 189 Cb 0.75 -0.88 0.20 0.00 -0.63 0.00 0.00 39.34 38.77 2qjm n TYR 189 CO 0.00 0.00 0.00 0.28 0.22 0.00 0.00 176.86 177.36 2qjm h VAL 190 N -1.00 0.41 0.00 2.97 2.07 -1.23 0.17 116.25 119.63 2qjm h VAL 190 Ca -0.29 -0.07 -0.02 0.00 0.82 0.00 0.00 66.70 67.15 2qjm h VAL 190 Cb 1.13 0.19 -0.00 0.00 -1.52 0.00 0.00 31.29 31.09 2qjm h VAL 190 CO -0.18 0.04 -0.08 1.55 0.02 0.00 0.00 177.57 178.92 2qjm h PRO 191 N 0.20 0.00 0.00 1.57 0.13 -1.78 -1.51 132.00 130.61 2qjm h PRO 191 Ca 0.45 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.47 2qjm h PRO 191 Cb 0.82 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.93 2qjm h PRO 191 CO -0.60 0.08 -0.54 0.87 -0.23 0.00 0.00 178.00 177.58 2qjm h LYS 192 N 0.00 0.00 0.18 0.86 1.57 -0.88 -2.40 116.57 115.89 2qjm h LYS 192 Ca -0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 2qjm h LYS 192 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.50 2qjm h LYS 192 CO 0.01 0.54 -0.09 1.25 -0.57 0.00 0.00 179.45 180.59 2qjm h LEU 193 N 0.00 -0.21 -1.21 2.94 5.85 -1.01 -1.83 115.31 119.85 2qjm h LEU 193 Ca -0.01 -0.04 -0.06 0.00 0.84 0.00 0.00 57.88 58.61 2qjm h LEU 193 Cb 0.98 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.05 2qjm h LEU 193 CO 0.07 -0.10 -0.30 -0.26 -0.34 0.00 0.00 178.44 177.51 2qjm h PHE 194 N -0.30 0.00 -0.38 1.25 0.04 -1.48 -0.47 116.94 115.60 2qjm h PHE 194 Ca -0.02 0.00 -0.14 0.00 2.80 0.00 0.00 57.97 60.61 2qjm h PHE 194 Cb 0.23 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.38 2qjm h PHE 194 CO -0.05 0.30 -0.31 1.49 -0.60 0.00 0.00 178.31 179.15 2qjm h GLU 195 N 0.00 0.88 -0.26 1.51 4.81 -1.29 -1.94 114.58 118.29 2qjm h GLU 195 Ca -0.00 -0.44 -0.12 0.00 -0.13 0.00 0.00 59.36 58.67 2qjm h GLU 195 Cb 0.73 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.10 2qjm h GLU 195 CO 0.04 1.08 -0.35 1.49 -0.73 0.00 0.00 179.01 180.54 2qjm h GLU 196 N 0.68 0.56 -0.48 1.92 4.57 -0.86 -1.64 114.58 119.34 2qjm h GLU 196 Ca 0.07 -0.26 -0.04 0.00 -1.18 0.00 0.00 59.36 57.94 2qjm h GLU 196 Cb 0.89 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.45 2qjm h GLU 196 CO 0.08 0.84 0.14 -0.07 -1.18 0.00 0.00 179.01 178.81 2qjm h LEU 197 N 0.48 0.71 -0.32 1.64 3.38 -0.94 -1.38 115.31 118.88 2qjm h LEU 197 Ca 0.05 -0.22 -0.15 0.00 0.09 0.00 0.00 57.88 57.65 2qjm h LEU 197 Cb 0.83 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.39 2qjm h LEU 197 CO 0.07 0.74 -0.39 0.03 0.09 0.00 0.00 178.44 178.98 2qjm h ARG 198 N 0.65 0.83 -0.53 1.13 2.47 -1.23 0.11 114.38 117.82 2qjm h ARG 198 Ca 0.15 -0.47 -0.02 0.00 -1.26 0.00 0.00 59.98 58.38 2qjm h ARG 198 Cb 0.29 0.03 -0.03 0.00 -1.65 0.00 0.00 29.97 28.62 2qjm h ARG 198 CO -0.00 1.10 0.23 0.87 0.56 0.00 0.00 179.97 182.73 2qjm h LYS 199 N 0.62 0.75 0.17 0.04 1.57 -1.24 0.17 116.57 118.64 2qjm h LYS 199 Ca 0.04 -0.10 -0.30 0.00 -1.87 0.00 0.00 60.65 58.42 2qjm h LYS 199 Cb 0.98 -0.14 0.01 0.00 0.08 0.00 0.00 32.23 33.17 2qjm h LYS 199 CO 0.09 0.60 -1.45 1.15 -0.57 0.00 0.00 179.45 179.27 2qjm h THR 200 N 0.75 1.12 -0.01 -0.16 2.02 -1.11 -3.40 112.91 112.11 2qjm h THR 200 Ca 0.18 -2.52 0.00 0.00 0.77 0.00 0.00 66.41 64.84 2qjm h THR 200 Cb 0.12 2.87 0.00 0.00 -1.74 0.00 0.00 68.15 69.40 2qjm h THR 200 CO -0.02 0.78 -0.04 -1.22 0.37 0.00 0.00 175.52 175.39 2qjm n TYR 201 N -3.80 0.00 -2.07 3.16 4.01 0.38 -5.09 117.16 113.75 2qjm n TYR 201 Ca -0.22 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.55 2qjm n TYR 201 Cb 0.99 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 40.02 2qjm n TYR 201 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2qjm n GLY 202 N 0.52 -2.04 1.27 2.72 0.00 0.58 -4.46 105.19 103.79 2qjm n GLY 202 Ca 0.04 -1.40 0.11 0.00 0.00 0.00 0.00 46.02 44.77 2qjm n GLY 202 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2qjm n PHE 203 N -1.14 0.90 1.48 1.61 3.72 -1.26 -4.50 117.46 118.26 2qjm n PHE 203 Ca 0.00 -0.45 0.11 0.00 -0.05 0.00 0.00 57.45 57.06 2qjm n PHE 203 Cb 0.08 0.00 0.66 0.00 -0.94 0.00 0.00 39.48 39.28 2qjm n PHE 203 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 2qjm n ASP 204 N 1.53 0.00 -4.35 4.37 -0.08 -1.26 -4.79 116.55 111.97 2qjm n ASP 204 Ca 0.23 -0.79 -0.28 0.00 -1.51 0.00 0.00 54.79 52.44 2qjm n ASP 204 Cb 0.59 0.00 -0.13 0.00 2.34 0.00 0.00 41.12 43.91 2qjm n ASP 204 CO 0.00 0.00 0.00 -1.00 0.12 0.00 0.00 177.20 176.32 2qjm s HIS 205 N -2.00 2.18 -0.11 -0.67 3.76 -1.26 -5.07 115.29 112.12 2qjm s HIS 205 Ca 0.33 -0.39 -0.30 0.00 -0.15 0.00 0.00 55.06 54.55 2qjm s HIS 205 Cb 0.15 -1.22 -0.02 0.00 1.11 0.00 0.00 32.58 32.61 2qjm s HIS 205 CO 0.26 0.26 1.13 -1.01 -0.85 0.00 0.00 174.74 174.53 2qjm s HIS 206 N -1.01 3.25 -0.15 1.40 3.76 -0.61 -4.96 115.29 116.96 2qjm s HIS 206 Ca 0.12 1.32 -0.00 0.00 -0.15 0.00 0.00 55.06 56.35 2qjm s HIS 206 Cb -0.10 -3.35 -0.01 0.00 1.11 0.00 0.00 32.58 30.24 2qjm s HIS 206 CO 0.05 -0.95 -0.13 -0.51 -0.85 0.00 0.00 174.74 172.34 2qjm s LEU 207 N 2.48 2.61 0.22 0.89 1.43 -1.26 -1.11 118.68 123.94 2qjm s LEU 207 Ca 0.52 -0.40 0.11 0.00 -1.03 0.00 0.00 54.13 53.33 2qjm s LEU 207 Cb -0.21 -1.60 -0.05 0.00 0.03 0.00 0.00 46.19 44.36 2qjm s LEU 207 CO 0.18 0.11 -0.18 -0.76 0.23 0.00 0.00 176.35 175.93 2qjm s LEU 208 N 0.69 2.66 -0.07 1.79 1.02 -0.29 0.58 118.68 125.06 2qjm s LEU 208 Ca -0.07 -0.83 -0.05 0.00 0.02 0.00 0.00 54.13 53.20 2qjm s LEU 208 Cb -0.15 -1.30 0.02 0.00 0.02 0.00 0.00 46.19 44.78 2qjm s LEU 208 CO 0.02 0.08 0.16 -2.28 0.02 0.00 0.00 176.35 174.36 2qjm s HIS 209 N -1.97 -0.19 -0.37 0.29 2.46 -0.91 -1.35 115.29 113.25 2qjm s HIS 209 Ca 0.25 0.47 -0.08 0.00 0.47 0.00 0.00 55.06 56.17 2qjm s HIS 209 Cb -0.07 0.03 0.05 0.00 -0.13 0.00 0.00 32.58 32.45 2qjm s HIS 209 CO 0.13 -0.12 0.18 0.34 -2.47 0.00 0.00 174.74 172.81 2qjm s ASP 210 N 0.44 5.52 0.31 9.88 -1.08 -1.26 -0.30 116.67 130.18 2qjm s ASP 210 Ca -0.03 -1.23 0.26 0.00 -0.52 0.00 0.00 52.55 51.03 2qjm s ASP 210 Cb -0.04 -1.94 1.02 0.00 -1.46 0.00 0.00 42.92 40.50 2qjm s ASP 210 CO -0.02 -0.41 1.76 1.23 0.52 0.00 0.00 175.17 178.25 2qjm h GLY 211 N 8.33 0.00 -6.52 2.66 0.00 -0.83 -3.48 103.07 103.23 2qjm h GLY 211 Ca -0.23 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.59 2qjm h GLY 211 CO 0.67 0.00 -0.89 1.57 0.00 0.00 0.00 176.54 177.89 2qjm n HIS 212 N -2.40 -1.63 -1.17 5.60 -0.00 -1.18 -2.40 115.22 112.04 2qjm n HIS 212 Ca 0.02 0.74 -0.09 0.00 0.46 0.00 0.00 57.72 58.86 2qjm n HIS 212 Cb 0.26 -3.71 -0.04 0.00 -0.12 0.00 0.00 29.99 26.39 2qjm n HIS 212 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 2qjm n HIS 213 N -4.41 -0.08 0.38 1.57 8.25 0.16 -4.66 115.22 116.44 2qjm n HIS 213 Ca -0.31 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.27 2qjm n HIS 213 Cb 0.69 -2.41 0.26 0.00 1.12 0.00 0.00 29.99 29.65 2qjm n HIS 213 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2qjm h ARG 214 N 0.00 0.00 -6.22 -0.41 2.47 -1.64 -3.39 114.38 105.19 2qjm h ARG 214 Ca -0.18 0.00 -0.58 0.00 -1.26 0.00 0.00 59.98 57.96 2qjm h ARG 214 Cb 0.99 0.00 -0.08 0.00 -1.65 0.00 0.00 29.97 29.23 2qjm h ARG 214 CO 0.26 0.00 -0.58 0.71 0.56 0.00 0.00 179.97 180.91 2qjm s TYR 215 N -3.17 3.10 0.69 3.04 2.02 -1.09 -4.94 117.35 117.00 2qjm s TYR 215 Ca 0.08 -0.03 -0.09 0.00 -0.37 0.00 0.00 57.07 56.67 2qjm s TYR 215 Cb 0.08 -1.50 0.04 0.00 -0.40 0.00 0.00 41.96 40.18 2qjm s TYR 215 CO 0.64 0.52 1.03 0.95 -1.57 0.00 0.00 175.55 177.12 2qjm s THR 216 N -1.72 2.94 0.21 -0.71 -4.23 -1.26 -4.13 115.64 106.73 2qjm s THR 216 Ca 0.30 0.05 -0.09 0.00 -1.18 0.00 0.00 61.69 60.77 2qjm s THR 216 Cb -0.10 -3.25 0.15 0.00 1.34 0.00 0.00 72.50 70.63 2qjm s THR 216 CO 0.22 -0.30 1.79 -0.65 -0.54 0.00 0.00 174.62 175.15 2qjm h PRO 217 N -0.57 0.61 -0.44 3.99 0.11 -1.92 0.14 132.00 133.92 2qjm h PRO 217 Ca -0.45 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 2qjm h PRO 217 Cb 1.29 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 2qjm h PRO 217 CO 0.62 0.41 0.24 0.37 -0.21 0.00 0.00 178.00 179.43 2qjm h GLN 218 N 0.63 0.62 -0.43 1.05 -0.00 -1.93 0.78 115.11 115.83 2qjm h GLN 218 Ca 0.31 -0.07 -0.07 0.00 -0.00 0.00 0.00 58.65 58.81 2qjm h GLN 218 Cb 0.25 -0.12 -0.02 0.00 0.00 0.00 0.00 27.48 27.58 2qjm h GLN 218 CO -0.21 0.50 -0.03 0.93 0.00 0.00 0.00 178.83 180.02 2qjm h GLU 219 N 0.58 0.71 -0.61 1.69 5.08 -1.82 0.12 114.58 120.33 2qjm h GLU 219 Ca 0.16 -0.19 -0.10 0.00 -1.00 0.00 0.00 59.36 58.23 2qjm h GLU 219 Cb 0.06 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 2qjm h GLU 219 CO -0.02 0.75 0.01 0.00 -1.00 0.00 0.00 179.01 178.74 2qjm h ALA 220 N 1.30 0.86 -0.63 3.43 0.00 -0.51 0.23 119.26 123.93 2qjm h ALA 220 Ca 0.13 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.66 2qjm h ALA 220 Cb 0.46 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 2qjm h ALA 220 CO 0.02 0.67 0.11 0.00 0.00 0.00 0.00 179.25 180.05 2qjm h ALA 221 N 1.02 1.00 0.13 0.00 0.00 -0.33 0.21 119.26 121.29 2qjm h ALA 221 Ca 0.18 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2qjm h ALA 221 Cb 0.55 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2qjm h ALA 221 CO 0.03 0.63 -0.06 -0.97 0.00 0.00 0.00 179.25 178.88 2qjm h ASN 222 N 0.96 -0.15 -0.21 0.00 -1.24 -0.47 -1.53 115.58 112.95 2qjm h ASN 222 Ca 0.20 -0.20 0.01 0.00 0.71 0.00 0.00 56.30 57.02 2qjm h ASN 222 Cb 0.40 0.04 -0.02 0.00 0.73 0.00 0.00 38.32 39.47 2qjm h ASN 222 CO 0.01 0.12 0.10 0.25 -1.29 0.00 0.00 177.43 176.62 2qjm h LEU 223 N -0.42 0.14 -0.72 0.34 5.85 -0.36 -1.65 115.31 118.48 2qjm h LEU 223 Ca -0.02 0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.78 2qjm h LEU 223 Cb 0.34 -0.01 -0.06 0.00 0.37 0.00 0.00 40.66 41.30 2qjm h LEU 223 CO 0.03 0.11 0.42 1.23 -0.34 0.00 0.00 178.44 179.89 2qjm h GLY 224 N 0.21 1.07 1.38 3.75 0.00 -0.55 -0.69 103.07 108.25 2qjm h GLY 224 Ca 0.08 -0.29 -0.08 0.00 0.00 0.00 0.00 47.33 47.04 2qjm h GLY 224 CO -0.06 0.18 -0.07 1.70 0.00 0.00 0.00 176.54 178.29 2qjm h LYS 225 N 0.76 0.74 0.00 4.80 3.64 -1.01 -2.06 116.57 123.44 2qjm h LYS 225 Ca 0.32 -0.22 -0.04 0.00 -1.27 0.00 0.00 60.65 59.44 2qjm h LYS 225 Cb 0.19 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.93 2qjm h LYS 225 CO -0.18 0.80 -0.20 0.52 -2.27 0.00 0.00 179.45 178.11 2qjm h MET 226 N 0.68 0.00 0.00 1.90 2.86 -0.48 -2.88 114.93 117.01 2qjm h MET 226 Ca 0.12 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.76 2qjm h MET 226 Cb 0.52 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.18 2qjm h MET 226 CO 0.03 0.20 -0.53 1.28 1.06 0.00 0.00 176.91 178.95 2qjm n LEU 227 N -3.37 0.60 -0.28 1.22 4.77 -0.34 -4.42 117.00 115.18 2qjm n LEU 227 Ca 0.00 0.19 0.10 0.00 -0.03 0.00 0.00 56.01 56.27 2qjm n LEU 227 Cb 0.42 -0.23 0.25 0.00 -2.33 0.00 0.00 43.42 41.53 2qjm n LEU 227 CO 0.33 -0.01 1.00 -0.33 -1.33 0.00 0.00 177.39 177.05 2qjm h GLU 228 N 0.00 0.35 0.00 3.23 5.08 -1.16 -0.15 114.58 121.93 2qjm h GLU 228 Ca 0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2qjm h GLU 228 Cb 0.66 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.83 2qjm h GLU 228 CO 0.00 0.23 0.00 -0.35 -1.00 0.00 0.00 179.01 177.89 2qjm n PRO 229 N -5.08 0.00 -0.17 2.33 -0.04 -1.26 -2.15 135.00 128.63 2qjm n PRO 229 Ca 0.19 0.30 0.12 0.00 -0.04 0.00 0.00 63.50 64.07 2qjm n PRO 229 Cb 0.56 -1.50 0.22 0.00 -0.04 0.00 0.00 33.50 32.74 2qjm n PRO 229 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2qjm n TYR 230 N -1.50 0.44 -3.78 0.54 4.01 -0.07 -5.01 117.16 111.79 2qjm n TYR 230 Ca 0.03 -0.22 -0.29 0.00 -0.16 0.00 0.00 57.90 57.26 2qjm n TYR 230 Cb 0.13 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.17 2qjm n TYR 230 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 2qjm n GLN 231 N 1.40 -1.16 -2.32 -0.72 1.13 -0.91 -4.93 117.38 109.87 2qjm n GLN 231 Ca 0.19 0.62 -0.33 0.00 -1.94 0.00 0.00 57.00 55.54 2qjm n GLN 231 Cb 0.59 -2.87 -0.02 0.00 0.11 0.00 0.00 30.24 28.05 2qjm n GLN 231 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2qjm s LEU 232 N -5.66 3.65 0.20 1.08 1.02 -1.26 -4.66 118.68 113.05 2qjm s LEU 232 Ca 0.18 1.77 -0.05 0.00 0.02 0.00 0.00 54.13 56.05 2qjm s LEU 232 Cb -0.09 -4.53 0.14 0.00 0.02 0.00 0.00 46.19 41.73 2qjm s LEU 232 CO 0.90 -0.86 1.60 0.15 0.02 0.00 0.00 176.35 178.15 2qjm h PHE 233 N 0.96 0.90 -1.58 0.29 3.57 -0.22 -3.40 116.94 117.46 2qjm h PHE 233 Ca -0.48 -0.22 0.24 0.00 3.53 0.00 0.00 57.97 61.04 2qjm h PHE 233 Cb 1.21 -0.21 -0.18 0.00 2.79 0.00 0.00 35.95 39.56 2qjm h PHE 233 CO 0.60 0.97 0.77 1.67 -2.23 0.00 0.00 178.31 180.08 2qjm s TRP 234 N -4.52 -0.16 -0.20 0.41 -2.14 -1.25 -4.61 118.94 106.47 2qjm s TRP 234 Ca -0.09 0.09 0.01 0.00 2.66 0.00 0.00 56.10 58.77 2qjm s TRP 234 Cb 0.13 0.52 0.03 0.00 -3.10 0.00 0.00 33.47 31.04 2qjm s TRP 234 CO 0.84 -0.25 -0.18 -1.17 -2.66 0.00 0.00 176.95 173.54 2qjm s LEU 235 N -2.23 2.39 -0.01 -4.66 2.96 0.63 -2.13 118.68 115.64 2qjm s LEU 235 Ca 0.09 -0.81 -0.02 0.00 -0.22 0.00 0.00 54.13 53.17 2qjm s LEU 235 Cb -0.01 -1.48 -0.04 0.00 0.50 0.00 0.00 46.19 45.16 2qjm s LEU 235 CO -0.05 -0.04 0.14 -0.70 -1.32 0.00 0.00 176.35 174.38 2qjm s GLU 236 N 1.26 3.29 -1.48 1.98 2.12 0.59 -1.44 118.70 125.01 2qjm s GLU 236 Ca 0.02 -0.38 -0.00 0.00 0.36 0.00 0.00 54.97 54.97 2qjm s GLU 236 Cb -0.15 -3.01 0.00 0.00 0.26 0.00 0.00 34.13 31.24 2qjm s GLU 236 CO -0.11 0.67 0.00 -0.25 -0.54 0.00 0.00 175.26 175.03 2qjm n ASP 237 N 1.06 0.91 0.21 -1.70 9.92 0.29 -0.27 116.55 126.96 2qjm n ASP 237 Ca -0.12 -1.23 0.06 0.00 -0.53 0.00 0.00 54.79 52.98 2qjm n ASP 237 Cb 0.53 -1.52 0.54 0.00 -0.64 0.00 0.00 41.12 40.03 2qjm n ASP 237 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2qjm s THR 239 N -4.89 0.05 0.23 0.00 -1.32 -1.26 -2.67 115.64 105.78 2qjm s THR 239 Ca -0.05 -0.43 -0.31 0.00 -1.21 0.00 0.00 61.69 59.70 2qjm s THR 239 Cb 0.16 -0.63 -0.15 0.00 -1.51 0.00 0.00 72.50 70.38 2qjm s THR 239 CO 0.69 -0.24 1.15 -2.65 -2.21 0.00 0.00 174.62 171.36 2qjm n PRO 240 N 1.32 1.38 -0.38 7.08 -0.02 -1.26 -4.85 135.00 138.27 2qjm n PRO 240 Ca -0.21 0.49 0.08 0.00 -2.02 0.00 0.00 63.50 61.84 2qjm n PRO 240 Cb 0.56 -1.97 0.23 0.00 -0.02 0.00 0.00 33.50 32.31 2qjm n PRO 240 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qjm n ALA 241 N 1.07 2.80 -0.35 3.55 0.00 -1.26 -4.63 120.51 121.69 2qjm n ALA 241 Ca 0.12 -2.05 0.10 0.00 0.00 0.00 0.00 53.44 51.61 2qjm n ALA 241 Cb 0.29 -0.64 0.28 0.00 0.00 0.00 0.00 19.45 19.37 2qjm n ALA 241 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2qjm h GLU 242 N 1.81 0.81 -4.17 0.00 3.07 -1.95 -3.13 114.58 111.02 2qjm h GLU 242 Ca 0.00 -0.05 -0.75 0.00 -0.50 0.00 0.00 59.36 58.06 2qjm h GLU 242 Cb 1.28 -0.18 -0.23 0.00 -0.84 0.00 0.00 28.75 28.77 2qjm h GLU 242 CO 0.17 0.54 -0.22 1.21 -1.40 0.00 0.00 179.01 179.31 2qjm s ASN 243 N -5.52 6.18 0.64 1.42 3.84 -1.26 -4.94 114.94 115.30 2qjm s ASN 243 Ca -0.12 -1.69 0.35 0.00 0.21 0.00 0.00 52.86 51.62 2qjm s ASN 243 Cb 0.24 -2.21 1.98 0.00 -0.55 0.00 0.00 41.25 40.70 2qjm s ASN 243 CO 0.80 -0.84 2.18 1.56 -2.79 0.00 0.00 177.10 178.01 2qjm h GLN 244 N 8.89 0.00 0.00 0.43 4.20 -1.91 -0.29 115.11 126.43 2qjm h GLN 244 Ca -0.30 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.41 2qjm h GLN 244 Cb 1.10 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.88 2qjm h GLN 244 CO 1.02 0.00 0.00 0.39 -0.67 0.00 0.00 178.83 179.57 2qjm n GLU 245 N -3.31 0.07 0.20 1.46 1.02 -1.26 -3.14 120.64 115.69 2qjm n GLU 245 Ca -0.01 0.29 0.16 0.00 -0.02 0.00 0.00 57.16 57.57 2qjm n GLU 245 Cb 0.22 -1.63 0.80 0.00 -0.02 0.00 0.00 31.44 30.80 2qjm n GLU 245 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2qjm h ALA 246 N 2.46 1.87 0.00 0.62 0.00 -1.38 -0.98 119.26 121.85 2qjm h ALA 246 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2qjm h ALA 246 Cb 0.32 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2qjm h ALA 246 CO 0.00 -0.25 -0.15 1.19 0.00 0.00 0.00 179.25 180.04 2qjm n PHE 247 N -3.98 0.27 -0.13 0.00 3.01 -1.19 -4.06 117.46 111.39 2qjm n PHE 247 Ca 0.01 0.08 -0.07 0.00 1.01 0.00 0.00 57.45 58.48 2qjm n PHE 247 Cb 0.29 -0.57 0.01 0.00 -0.01 0.00 0.00 39.48 39.20 2qjm n PHE 247 CO 0.00 0.00 0.00 -0.09 1.01 0.00 0.00 176.76 177.68 2qjm h ARG 248 N 0.00 0.46 -0.69 -1.08 2.43 -1.40 0.53 114.38 114.64 2qjm h ARG 248 Ca 0.00 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.11 2qjm h ARG 248 Cb 0.58 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.99 2qjm h ARG 248 CO 0.00 0.31 0.31 1.25 -1.51 0.00 0.00 179.97 180.33 2qjm h LEU 249 N 0.48 0.91 -0.13 3.80 7.12 -1.75 -1.01 115.31 124.73 2qjm h LEU 249 Ca 0.16 -0.15 -0.01 0.00 0.13 0.00 0.00 57.88 58.02 2qjm h LEU 249 Cb 0.02 -0.24 -0.01 0.00 -0.53 0.00 0.00 40.66 39.90 2qjm h LEU 249 CO -0.08 0.81 0.04 0.58 -0.13 0.00 0.00 178.44 179.66 2qjm h VAL 250 N 0.96 1.17 -0.47 1.05 2.07 -1.65 -2.68 116.25 116.70 2qjm h VAL 250 Ca 0.23 -0.53 -0.02 0.00 0.82 0.00 0.00 66.70 67.20 2qjm h VAL 250 Cb 0.15 1.29 -0.02 0.00 -1.52 0.00 0.00 31.29 31.18 2qjm h VAL 250 CO -0.03 0.16 0.22 -0.09 0.02 0.00 0.00 177.57 177.85 2qjm h ARG 251 N 0.03 0.66 0.00 1.57 9.65 -0.71 -2.50 114.38 123.08 2qjm h ARG 251 Ca 0.04 -0.08 -0.10 0.00 -1.10 0.00 0.00 59.98 58.74 2qjm h ARG 251 Cb 0.21 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 28.65 2qjm h ARG 251 CO -0.00 0.52 -0.48 0.37 2.80 0.00 0.00 179.97 183.18 2qjm h GLN 252 N 0.66 0.00 -0.05 0.20 4.15 -1.01 -3.31 115.11 115.75 2qjm h GLN 252 Ca 0.17 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.59 2qjm h GLN 252 Cb 0.09 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.78 2qjm h GLN 252 CO -0.02 0.48 0.00 0.72 -1.93 0.00 0.00 178.83 178.08 2qjm n HIS 253 N -3.82 0.03 -3.66 3.99 8.25 -0.97 -5.01 115.22 114.03 2qjm n HIS 253 Ca -0.01 -0.02 -0.14 0.00 -0.26 0.00 0.00 57.72 57.29 2qjm n HIS 253 Cb 0.52 -0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.56 2qjm n HIS 253 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 2qjm s THR 254 N -1.75 0.04 -2.17 1.59 -1.32 -1.03 -4.67 115.64 106.34 2qjm s THR 254 Ca 0.25 -0.37 0.22 0.00 -1.21 0.00 0.00 61.69 60.58 2qjm s THR 254 Cb 0.18 -0.87 0.45 0.00 -1.51 0.00 0.00 72.50 70.75 2qjm s THR 254 CO 0.27 -0.20 1.40 1.33 -2.21 0.00 0.00 174.62 175.20 2qjm n VAL 255 N 0.76 0.64 -2.02 5.08 0.24 -1.26 -4.73 118.33 117.04 2qjm n VAL 255 Ca -0.19 -0.82 -0.42 0.00 -2.04 0.00 0.00 64.34 60.87 2qjm n VAL 255 Cb 0.58 0.85 -0.03 0.00 -1.47 0.00 0.00 33.84 33.77 2qjm n VAL 255 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 2qjm s THR 256 N -1.30 2.75 0.45 3.34 2.01 -1.26 -4.93 115.64 116.69 2qjm s THR 256 Ca 0.39 0.59 -0.25 0.00 0.31 0.00 0.00 61.69 62.73 2qjm s THR 256 Cb 0.22 -3.38 -0.08 0.00 0.01 0.00 0.00 72.50 69.27 2qjm s THR 256 CO 0.30 0.08 1.41 -2.84 -0.69 0.00 0.00 174.62 172.88 2qjm s PRO 257 N 0.21 3.72 -0.04 4.92 0.02 -1.26 -4.87 135.00 137.70 2qjm s PRO 257 Ca 0.63 2.39 0.05 0.00 0.02 0.00 0.00 61.00 64.09 2qjm s PRO 257 Cb -0.41 -2.67 -0.02 0.00 0.02 0.00 0.00 34.50 31.41 2qjm s PRO 257 CO 0.38 -0.78 -0.19 -0.51 -0.33 0.00 0.00 177.00 175.57 2qjm s LEU 258 N -2.69 2.45 0.07 -5.54 1.43 -1.26 -0.26 118.68 112.87 2qjm s LEU 258 Ca 0.60 -0.31 0.04 0.00 -1.03 0.00 0.00 54.13 53.43 2qjm s LEU 258 Cb -0.43 -1.46 -0.03 0.00 0.03 0.00 0.00 46.19 44.30 2qjm s LEU 258 CO 0.55 0.33 -0.11 0.00 0.23 0.00 0.00 176.35 177.36 2qjm s ALA 259 N -0.68 0.91 -0.06 4.21 0.00 -0.52 -0.51 121.76 125.11 2qjm s ALA 259 Ca 0.11 -0.95 -0.31 0.00 0.00 0.00 0.00 51.96 50.81 2qjm s ALA 259 Cb -0.10 -0.01 0.11 0.00 0.00 0.00 0.00 23.12 23.12 2qjm s ALA 259 CO -0.00 0.04 1.01 0.54 0.00 0.00 0.00 175.76 177.35 2qjm s VAL 260 N -1.61 0.00 0.00 0.00 0.11 -1.12 -0.55 120.40 117.23 2qjm s VAL 260 Ca -0.03 -0.03 0.00 0.00 -2.93 0.00 0.00 61.98 58.99 2qjm s VAL 260 Cb -0.08 -1.06 0.00 0.00 -1.53 0.00 0.00 36.38 33.71 2qjm s VAL 260 CO 0.01 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 172.39 2qjm n GLY 261 N -0.20 0.76 0.31 6.54 0.00 -1.26 -0.60 105.19 110.73 2qjm n GLY 261 Ca -0.06 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.00 2qjm n GLY 261 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2qjm h GLU 262 N 0.00 0.57 -0.18 1.61 4.11 -1.94 -1.19 114.58 117.56 2qjm h GLU 262 Ca 0.00 -0.04 0.00 0.00 0.07 0.00 0.00 59.36 59.39 2qjm h GLU 262 Cb 0.00 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.13 2qjm h GLU 262 CO 0.00 0.40 0.00 0.44 0.07 0.00 0.00 179.01 179.92 2qjm n ILE 263 N -4.45 0.23 -2.32 -1.06 -5.35 -1.26 -4.74 119.36 100.42 2qjm n ILE 263 Ca 0.03 -0.37 -0.34 0.00 -0.27 0.00 0.00 62.75 61.80 2qjm n ILE 263 Cb 0.08 0.41 -0.01 0.00 -1.74 0.00 0.00 39.64 38.38 2qjm n ILE 263 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 2qjm s PHE 264 N -1.77 2.91 0.00 4.28 0.08 -0.46 -4.97 117.98 118.04 2qjm s PHE 264 Ca 0.33 1.55 0.00 0.00 0.12 0.00 0.00 56.93 58.93 2qjm s PHE 264 Cb 0.18 -3.10 0.00 0.00 -0.57 0.00 0.00 43.02 39.53 2qjm s PHE 264 CO 0.26 -1.09 0.00 0.27 -0.10 0.00 0.00 175.22 174.56 2qjm n ASN 265 N -1.39 0.31 -3.98 1.36 0.23 -1.26 -4.12 115.26 106.42 2qjm n ASN 265 Ca 0.10 -0.34 -0.10 0.00 -0.53 0.00 0.00 54.58 53.71 2qjm n ASN 265 Cb 0.52 0.73 -0.07 0.00 -2.08 0.00 0.00 39.78 38.89 2qjm n ASN 265 CO 0.00 0.00 0.00 0.42 -0.93 0.00 0.00 177.26 176.75 2qjm s THR 266 N -0.80 0.05 0.47 5.53 -4.23 -1.26 -4.09 115.64 111.32 2qjm s THR 266 Ca 0.00 -1.44 0.26 0.00 -1.18 0.00 0.00 61.69 59.33 2qjm s THR 266 Cb 0.00 -1.93 0.30 0.00 1.34 0.00 0.00 72.50 72.21 2qjm s THR 266 CO 0.00 -0.25 2.12 -0.29 -0.54 0.00 0.00 174.62 175.66 2qjm h ILE 267 N 2.52 0.62 0.00 2.99 2.10 -1.91 -2.33 117.51 121.51 2qjm h ILE 267 Ca -0.31 -0.37 0.00 0.00 1.08 0.00 0.00 64.86 65.25 2qjm h ILE 267 Cb 1.23 1.23 0.00 0.00 -1.09 0.00 0.00 36.82 38.20 2qjm h ILE 267 CO 0.47 0.09 0.00 -0.50 -1.08 0.00 0.00 178.15 177.13 2qjm h TRP 268 N 0.00 0.00 0.00 2.19 4.06 -2.00 -0.23 115.95 119.97 2qjm h TRP 268 Ca -0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 2qjm h TRP 268 Cb 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.39 2qjm h TRP 268 CO 0.00 0.00 0.00 -0.25 -3.56 0.00 0.00 178.44 174.63 2qjm n ASP 269 N -2.92 0.00 0.00 -3.49 8.00 -0.87 -4.15 116.55 113.12 2qjm n ASP 269 Ca -0.01 0.37 0.00 0.00 0.71 0.00 0.00 54.79 55.86 2qjm n ASP 269 Cb 0.17 -0.46 0.00 0.00 -0.02 0.00 0.00 41.12 40.82 2qjm n ASP 269 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2qjm n ALA 270 N -1.46 0.61 -0.32 2.24 0.00 -0.30 -4.86 120.51 116.43 2qjm n ALA 270 Ca 0.08 -0.06 0.09 0.00 0.00 0.00 0.00 53.44 53.55 2qjm n ALA 270 Cb 0.32 0.00 0.26 0.00 0.00 0.00 0.00 19.45 20.03 2qjm n ALA 270 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2qjm h GLU 271 N 0.00 0.67 0.06 0.00 4.11 -1.27 -0.04 114.58 118.11 2qjm h GLU 271 Ca 0.00 -0.04 -0.25 0.00 0.07 0.00 0.00 59.36 59.13 2qjm h GLU 271 Cb 0.16 -0.15 0.01 0.00 0.50 0.00 0.00 28.75 29.27 2qjm h GLU 271 CO 0.00 0.44 -1.09 -0.44 0.07 0.00 0.00 179.01 178.00 2qjm h ASP 272 N 0.69 0.59 -0.82 3.06 3.32 -1.88 -0.61 116.42 120.77 2qjm h ASP 272 Ca 0.50 -0.52 -0.03 0.00 0.02 0.00 0.00 57.03 56.99 2qjm h ASP 272 Cb 0.72 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 40.05 2qjm h ASP 272 CO -0.36 1.35 0.38 -0.07 -1.72 0.00 0.00 179.24 178.81 2qjm h LEU 273 N 0.20 1.09 0.05 1.55 3.38 -1.70 -0.96 115.31 118.93 2qjm h LEU 273 Ca -0.12 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.71 2qjm h LEU 273 Cb 1.75 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 42.22 2qjm h LEU 273 CO 0.19 0.93 -0.02 0.40 0.09 0.00 0.00 178.44 180.03 2qjm h ILE 274 N 1.18 1.29 0.00 1.22 2.04 -1.02 0.46 117.51 122.69 2qjm h ILE 274 Ca 0.28 -1.54 -0.03 0.00 1.00 0.00 0.00 64.86 64.57 2qjm h ILE 274 Cb 0.14 2.24 -0.00 0.00 -0.74 0.00 0.00 36.82 38.46 2qjm h ILE 274 CO -0.03 0.36 -0.17 1.56 0.00 0.00 0.00 178.15 179.88 2qjm h GLN 275 N -0.80 0.00 -0.62 2.37 4.20 -1.10 -1.61 115.11 117.56 2qjm h GLN 275 Ca -0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.70 2qjm h GLN 275 Cb 0.65 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.43 2qjm h GLN 275 CO 0.01 0.17 0.00 0.09 -0.67 0.00 0.00 178.83 178.43 2qjm n ASN 276 N -3.75 3.60 -3.89 1.46 3.02 -0.37 -4.95 115.26 110.39 2qjm n ASN 276 Ca -0.02 -2.18 -0.28 0.00 -0.03 0.00 0.00 54.58 52.07 2qjm n ASN 276 Cb 0.27 -0.46 -0.00 0.00 -0.61 0.00 0.00 39.78 38.98 2qjm n ASN 276 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qjm n GLN 277 N 1.07 -2.59 0.00 3.52 6.02 -0.61 -4.89 117.38 119.91 2qjm n GLN 277 Ca 0.21 0.40 0.11 0.00 -0.01 0.00 0.00 57.00 57.70 2qjm n GLN 277 Cb 0.63 -4.31 -0.05 0.00 1.02 0.00 0.00 30.24 27.52 2qjm n GLN 277 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2qjm n LEU 278 N -4.38 1.51 -4.11 1.08 4.77 0.15 -4.97 117.00 111.05 2qjm n LEU 278 Ca -0.24 -0.62 -0.08 0.00 -0.03 0.00 0.00 56.01 55.03 2qjm n LEU 278 Cb 0.66 -0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.64 2qjm n LEU 278 CO 0.73 0.31 -0.37 0.27 -1.33 0.00 0.00 177.39 177.00 2qjm s ILE 279 N -2.74 0.37 -0.06 -0.08 -4.36 -1.23 -4.81 121.20 108.30 2qjm s ILE 279 Ca 0.13 -1.78 0.12 0.00 -0.26 0.00 0.00 60.65 58.87 2qjm s ILE 279 Cb 0.17 -1.48 -0.18 0.00 1.25 0.00 0.00 42.46 42.22 2qjm s ILE 279 CO 0.72 -0.92 0.19 0.47 0.24 0.00 0.00 174.94 175.64 2qjm n ASP 280 N 0.18 2.04 -3.91 4.36 8.00 0.34 -4.82 116.55 122.74 2qjm n ASP 280 Ca -0.14 0.00 -0.19 0.00 0.71 0.00 0.00 54.79 55.17 2qjm n ASP 280 Cb 0.60 1.30 -0.16 0.00 -0.02 0.00 0.00 41.12 42.84 2qjm n ASP 280 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2qjm s TYR 281 N -2.67 0.64 -0.25 1.24 2.02 -1.04 -1.08 117.35 116.20 2qjm s TYR 281 Ca -0.05 -0.15 -0.10 0.00 -0.37 0.00 0.00 57.07 56.39 2qjm s TYR 281 Cb 0.07 -0.54 -0.05 0.00 -0.40 0.00 0.00 41.96 41.04 2qjm s TYR 281 CO 0.52 -0.12 0.16 -1.50 -1.57 0.00 0.00 175.55 173.04 2qjm s ILE 282 N 0.58 5.27 -2.59 2.71 1.10 0.05 -2.78 121.20 125.53 2qjm s ILE 282 Ca -0.07 0.15 0.27 0.00 -0.51 0.00 0.00 60.65 60.49 2qjm s ILE 282 Cb -0.11 -3.48 0.44 0.00 0.15 0.00 0.00 42.46 39.46 2qjm s ILE 282 CO -0.00 0.31 1.60 0.54 -2.11 0.00 0.00 174.94 175.28 2qjm n ARG 283 N 4.61 1.80 -1.56 3.50 5.12 0.24 -1.48 116.66 128.88 2qjm n ARG 283 Ca -0.15 -1.20 -0.39 0.00 -1.93 0.00 0.00 57.85 54.18 2qjm n ARG 283 Cb 0.52 -1.48 0.03 0.00 -1.16 0.00 0.00 32.46 30.38 2qjm n ARG 283 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2qjm n ALA 284 N 0.44 -0.31 -2.56 7.54 0.00 -1.16 -2.17 120.51 122.29 2qjm n ALA 284 Ca 0.17 0.09 -0.27 0.00 0.00 0.00 0.00 53.44 53.43 2qjm n ALA 284 Cb 0.42 -2.00 -0.09 0.00 0.00 0.00 0.00 19.45 17.78 2qjm n ALA 284 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2qjm s THR 285 N -1.49 2.05 0.25 0.00 -4.23 -1.26 -4.44 115.64 106.52 2qjm s THR 285 Ca 0.69 -1.89 -0.02 0.00 -1.18 0.00 0.00 61.69 59.28 2qjm s THR 285 Cb -0.49 -2.94 0.09 0.00 1.34 0.00 0.00 72.50 70.50 2qjm s THR 285 CO 0.53 0.00 1.72 0.58 -0.54 0.00 0.00 174.62 176.91 2qjm h VAL 286 N 1.62 1.25 0.11 2.29 2.07 -1.92 -0.89 116.25 120.78 2qjm h VAL 286 Ca -0.43 -1.12 -0.27 0.00 0.82 0.00 0.00 66.70 65.70 2qjm h VAL 286 Cb 1.25 1.01 -0.00 0.00 -1.52 0.00 0.00 31.29 32.02 2qjm h VAL 286 CO 0.77 0.38 -1.26 1.62 0.02 0.00 0.00 177.57 179.10 2qjm h VAL 287 N 0.70 1.47 0.08 2.57 3.04 -1.91 0.65 116.25 122.85 2qjm h VAL 287 Ca 0.12 -3.07 -0.25 0.00 -1.01 0.00 0.00 66.70 62.48 2qjm h VAL 287 Cb 0.55 2.89 0.00 0.00 -2.01 0.00 0.00 31.29 32.73 2qjm h VAL 287 CO 0.03 0.89 -1.12 1.23 -1.01 0.00 0.00 177.57 177.59 2qjm h GLY 288 N 1.85 0.38 -4.04 3.17 0.00 -1.84 -3.38 103.07 99.21 2qjm h GLY 288 Ca -0.13 -0.82 -0.62 0.00 0.00 0.00 0.00 47.33 45.75 2qjm h GLY 288 CO 0.18 0.72 0.01 0.00 0.00 0.00 0.00 176.54 177.45 2qjm n ALA 289 N -2.54 5.67 -2.75 3.60 0.00 -0.35 -4.11 120.51 120.03 2qjm n ALA 289 Ca -0.08 -3.76 -0.10 0.00 0.00 0.00 0.00 53.44 49.50 2qjm n ALA 289 Cb 0.94 -1.05 0.02 0.00 0.00 0.00 0.00 19.45 19.37 2qjm n ALA 289 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qjm n GLY 290 N -0.75 0.25 2.36 0.00 0.00 -1.24 -3.95 105.19 101.85 2qjm n GLY 290 Ca 0.52 -0.35 0.04 0.00 0.00 0.00 0.00 46.02 46.22 2qjm n GLY 290 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qjm n GLY 291 N -1.10 -2.07 0.28 -0.02 0.00 0.23 -3.50 105.19 99.01 2qjm n GLY 291 Ca -0.02 -1.40 -0.01 0.00 0.00 0.00 0.00 46.02 44.58 2qjm n GLY 291 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2qjm h LEU 292 N 0.00 0.65 -0.33 0.99 -0.00 -1.88 -0.61 115.31 114.12 2qjm h LEU 292 Ca 0.01 0.02 0.07 0.00 -0.00 0.00 0.00 57.88 57.98 2qjm h LEU 292 Cb 0.24 -0.11 -0.08 0.00 -0.00 0.00 0.00 40.66 40.72 2qjm h LEU 292 CO 0.00 0.42 -0.17 0.74 -0.00 0.00 0.00 178.44 179.43 2qjm h THR 293 N 0.78 0.48 0.18 0.22 2.02 -1.93 -1.11 112.91 113.56 2qjm h THR 293 Ca 0.32 0.00 -0.32 0.00 0.77 0.00 0.00 66.41 67.18 2qjm h THR 293 Cb 0.17 0.48 0.02 0.00 -1.74 0.00 0.00 68.15 67.08 2qjm h THR 293 CO -0.17 0.00 -1.51 -0.74 0.37 0.00 0.00 175.52 173.47 2qjm h HIS 294 N -0.12 0.71 -0.58 3.16 -0.00 -1.54 -3.29 115.15 113.49 2qjm h HIS 294 Ca 0.17 -0.52 0.00 0.00 -0.00 0.00 0.00 60.37 60.03 2qjm h HIS 294 Cb 0.38 -0.03 -0.03 0.00 -0.00 0.00 0.00 27.41 27.74 2qjm h HIS 294 CO -0.38 1.49 0.38 1.25 -0.00 0.00 0.00 177.93 180.67 2qjm h LEU 295 N 0.11 0.67 -0.76 0.26 5.85 -1.04 -1.37 115.31 119.02 2qjm h LEU 295 Ca -0.25 -0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.48 2qjm h LEU 295 Cb 2.08 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 42.90 2qjm h LEU 295 CO 0.21 0.49 0.48 -0.09 -0.34 0.00 0.00 178.44 179.19 2qjm h ARG 296 N 0.79 0.91 -0.70 1.25 2.43 -1.29 0.21 114.38 117.98 2qjm h ARG 296 Ca 0.21 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 59.26 2qjm h ARG 296 Cb -0.08 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 29.23 2qjm h ARG 296 CO -0.04 0.60 0.16 0.00 -1.51 0.00 0.00 179.97 179.18 2qjm h ARG 297 N 0.94 1.13 -0.50 0.20 3.08 -1.34 -0.03 114.38 117.85 2qjm h ARG 297 Ca 0.31 -0.28 -0.04 0.00 0.07 0.00 0.00 59.98 60.04 2qjm h ARG 297 Cb 0.02 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 29.91 2qjm h ARG 297 CO -0.12 1.00 0.16 0.82 -1.07 0.00 0.00 179.97 180.77 2qjm h ILE 298 N 1.06 1.23 -0.69 2.04 2.04 -0.60 -1.86 117.51 120.73 2qjm h ILE 298 Ca 0.22 -0.75 -0.06 0.00 1.00 0.00 0.00 64.86 65.27 2qjm h ILE 298 Cb 0.39 0.77 -0.03 0.00 -0.74 0.00 0.00 36.82 37.21 2qjm h ILE 298 CO 0.00 0.28 0.20 0.00 0.00 0.00 0.00 178.15 178.63 2qjm h ALA 299 N 1.02 1.04 0.15 1.87 0.00 -0.31 -2.08 119.26 120.96 2qjm h ALA 299 Ca 0.16 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2qjm h ALA 299 Cb 0.26 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2qjm h ALA 299 CO -0.01 0.64 -0.07 -0.44 0.00 0.00 0.00 179.25 179.37 2qjm h ASP 300 N 1.03 -0.17 -0.59 0.00 3.32 -0.72 -0.16 116.42 119.12 2qjm h ASP 300 Ca 0.22 -0.03 0.04 0.00 0.02 0.00 0.00 57.03 57.28 2qjm h ASP 300 Cb 0.32 0.05 -0.04 0.00 0.22 0.00 0.00 39.33 39.87 2qjm h ASP 300 CO -0.00 -0.09 0.35 0.25 -1.72 0.00 0.00 179.24 178.03 2qjm h LEU 301 N -0.25 0.55 -0.75 1.55 5.85 -1.24 -2.03 115.31 118.99 2qjm h LEU 301 Ca -0.02 0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.76 2qjm h LEU 301 Cb 0.19 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.07 2qjm h LEU 301 CO 0.03 0.38 0.46 0.00 -0.34 0.00 0.00 178.44 178.97 2qjm h ALA 302 N 1.28 1.00 -0.98 1.25 0.00 -1.16 -2.45 119.26 118.20 2qjm h ALA 302 Ca 0.25 -0.01 0.14 0.00 0.00 0.00 0.00 54.91 55.29 2qjm h ALA 302 Cb 0.07 -0.21 -0.09 0.00 0.00 0.00 0.00 17.79 17.56 2qjm h ALA 302 CO -0.12 0.21 0.62 1.03 0.00 0.00 0.00 179.25 180.99 2qjm h SER 303 N 0.87 0.83 -0.31 0.00 0.87 -0.28 -0.79 113.55 114.75 2qjm h SER 303 Ca 0.32 0.06 0.08 0.00 -1.23 0.00 0.00 61.79 61.01 2qjm h SER 303 Cb 0.09 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 61.93 2qjm h SER 303 CO -0.14 0.41 0.22 -0.07 -0.53 0.00 0.00 176.83 176.71 2qjm h LEU 304 N 0.87 0.07 -3.24 2.23 3.38 -1.28 -1.62 115.31 115.72 2qjm h LEU 304 Ca 0.50 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.48 2qjm h LEU 304 Cb 0.64 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.38 2qjm h LEU 304 CO -0.28 0.05 0.00 -1.22 0.09 0.00 0.00 178.44 177.08 2qjm n TYR 305 N -4.46 1.09 -2.15 1.13 4.01 -0.47 -4.95 117.16 111.35 2qjm n TYR 305 Ca 0.04 -0.78 -0.20 0.00 -0.16 0.00 0.00 57.90 56.80 2qjm n TYR 305 Cb 0.33 -0.30 -0.03 0.00 -0.31 0.00 0.00 39.34 39.03 2qjm n TYR 305 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 2qjm n GLN 306 N -0.08 -1.52 -3.19 -0.72 6.02 -0.61 -4.98 117.38 112.30 2qjm n GLN 306 Ca 0.21 1.02 -0.39 0.00 -0.01 0.00 0.00 57.00 57.84 2qjm n GLN 306 Cb 0.87 -5.55 -0.06 0.00 1.02 0.00 0.00 30.24 26.53 2qjm n GLN 306 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2qjm s VAL 307 N -2.91 4.65 0.30 5.09 1.01 -0.43 -4.99 120.40 123.12 2qjm s VAL 307 Ca 0.00 1.35 0.08 0.00 0.00 0.00 0.00 61.98 63.41 2qjm s VAL 307 Cb 0.00 -3.96 -0.04 0.00 0.00 0.00 0.00 36.38 32.38 2qjm s VAL 307 CO 0.00 0.54 0.14 -0.13 0.00 0.00 0.00 175.10 175.66 2qjm s ARG 308 N -1.07 2.53 0.28 2.72 0.52 -0.24 -3.83 118.95 119.86 2qjm s ARG 308 Ca 0.31 -1.37 -0.27 0.00 -0.52 0.00 0.00 55.73 53.88 2qjm s ARG 308 Cb -0.20 -2.31 -0.09 0.00 0.52 0.00 0.00 34.95 32.87 2qjm s ARG 308 CO 0.21 0.23 0.91 0.95 0.02 0.00 0.00 175.30 177.62 2qjm s THR 309 N -2.32 4.21 -0.38 0.02 -4.23 -0.33 -0.77 115.64 111.84 2qjm s THR 309 Ca 0.36 1.85 0.12 0.00 -1.18 0.00 0.00 61.69 62.83 2qjm s THR 309 Cb -0.05 -4.09 0.38 0.00 1.34 0.00 0.00 72.50 70.08 2qjm s THR 309 CO 0.23 0.27 1.00 0.61 -0.54 0.00 0.00 174.62 176.19 2qjm n GLY 310 N 0.88 1.90 3.55 3.99 0.00 -0.55 -0.26 105.19 114.71 2qjm n GLY 310 Ca 0.00 -0.87 -0.53 0.00 0.00 0.00 0.00 46.02 44.62 2qjm n GLY 310 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qjm s HIS 312 N 0.11 2.33 -0.37 0.00 2.46 -0.92 -1.86 115.29 117.04 2qjm s HIS 312 Ca 0.82 1.47 0.11 0.00 0.47 0.00 0.00 55.06 57.94 2qjm s HIS 312 Cb -1.01 -3.61 0.40 0.00 -0.13 0.00 0.00 32.58 28.22 2qjm s HIS 312 CO 0.51 -2.51 1.43 0.41 -2.47 0.00 0.00 174.74 172.11 2qjm n GLY 313 N 0.66 1.68 3.66 1.59 0.00 -1.26 -4.73 105.19 106.78 2qjm n GLY 313 Ca 0.13 -0.19 -0.29 0.00 0.00 0.00 0.00 46.02 45.67 2qjm n GLY 313 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qjm s ALA 314 N 0.01 0.87 -0.12 4.61 0.00 -1.26 -2.96 121.76 122.91 2qjm s ALA 314 Ca 0.16 -0.63 0.29 0.00 0.00 0.00 0.00 51.96 51.78 2qjm s ALA 314 Cb 0.42 -3.01 1.30 0.00 0.00 0.00 0.00 23.12 21.83 2qjm s ALA 314 CO -0.10 -3.11 1.88 1.79 0.00 0.00 0.00 175.76 176.21 2qjm h THR 315 N -2.15 0.00 0.00 0.00 1.35 -1.91 -2.88 112.91 107.33 2qjm h THR 315 Ca -0.51 -0.29 0.00 0.00 -0.55 0.00 0.00 66.41 65.07 2qjm h THR 315 Cb 1.32 1.12 0.00 0.00 -1.73 0.00 0.00 68.15 68.85 2qjm h THR 315 CO 0.49 0.00 0.00 -0.90 -0.25 0.00 0.00 175.52 174.86 2qjm n ASP 316 N -2.64 0.00 -4.25 5.36 5.75 -1.26 -4.37 116.55 115.13 2qjm n ASP 316 Ca 0.01 -1.24 -0.35 0.00 -0.01 0.00 0.00 54.79 53.20 2qjm n ASP 316 Cb 0.22 0.00 -0.14 0.00 -1.03 0.00 0.00 41.12 40.17 2qjm n ASP 316 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2qjm s LEU 317 N -1.22 2.94 0.88 -2.12 1.02 -1.09 -4.67 118.68 114.42 2qjm s LEU 317 Ca 0.07 -0.59 -0.11 0.00 0.02 0.00 0.00 54.13 53.53 2qjm s LEU 317 Cb 0.03 -1.69 0.12 0.00 0.02 0.00 0.00 46.19 44.68 2qjm s LEU 317 CO 0.06 -0.06 1.10 -0.94 0.02 0.00 0.00 176.35 176.52 2qjm s SER 318 N 1.41 3.49 0.57 2.29 1.04 -1.26 -4.75 113.70 116.48 2qjm s SER 318 Ca 0.04 1.71 0.29 0.00 0.48 0.00 0.00 55.95 58.46 2qjm s SER 318 Cb -0.15 -2.35 1.48 0.00 0.10 0.00 0.00 66.02 65.10 2qjm s SER 318 CO -0.05 -2.66 1.92 -0.65 0.98 0.00 0.00 173.24 172.78 2qjm h PRO 319 N -1.56 0.00 -0.41 4.02 0.11 -1.92 0.22 132.00 132.46 2qjm h PRO 319 Ca -0.48 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 2qjm h PRO 319 Cb 1.27 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.36 2qjm h PRO 319 CO 0.51 0.00 0.18 0.28 -0.21 0.00 0.00 178.00 178.76 2qjm h VAL 320 N 0.00 1.19 -0.34 3.15 2.07 -1.92 0.35 116.25 120.74 2qjm h VAL 320 Ca 0.25 -0.56 -0.03 0.00 0.82 0.00 0.00 66.70 67.18 2qjm h VAL 320 Cb 1.21 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 31.76 2qjm h VAL 320 CO -0.00 0.21 0.10 0.74 0.02 0.00 0.00 177.57 178.64 2qjm h THR 321 N 0.52 1.21 -0.90 2.57 2.02 -0.91 -1.30 112.91 116.12 2qjm h THR 321 Ca 0.14 -0.68 -0.00 0.00 0.77 0.00 0.00 66.41 66.64 2qjm h THR 321 Cb 0.16 1.02 -0.04 0.00 -1.74 0.00 0.00 68.15 67.54 2qjm h THR 321 CO -0.01 0.23 0.56 -0.03 0.37 0.00 0.00 175.52 176.64 2qjm h MET 322 N 0.39 1.20 0.65 6.66 -1.53 -1.03 0.72 114.93 121.99 2qjm h MET 322 Ca 0.11 -0.10 -0.03 0.00 -3.44 0.00 0.00 59.70 56.24 2qjm h MET 322 Cb 0.25 -0.26 0.00 0.00 -0.55 0.00 0.00 31.60 31.05 2qjm h MET 322 CO -0.00 0.83 -0.33 0.78 0.14 0.00 0.00 176.91 178.32 2qjm h GLY 323 N 1.24 -0.95 0.96 1.39 0.00 0.00 0.20 103.07 105.91 2qjm h GLY 323 Ca 0.32 0.36 0.05 0.00 0.00 0.00 0.00 47.33 48.07 2qjm h GLY 323 CO -0.06 -0.34 0.57 0.00 0.00 0.00 0.00 176.54 176.71 2qjm h ALA 325 N 1.50 0.87 -0.46 0.00 0.00 0.80 -1.26 119.26 120.72 2qjm h ALA 325 Ca 0.36 -0.20 -0.13 0.00 0.00 0.00 0.00 54.91 54.94 2qjm h ALA 325 Cb 0.10 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2qjm h ALA 325 CO -0.12 0.53 -0.22 -0.07 0.00 0.00 0.00 179.25 179.38 2qjm h LEU 326 N 0.96 0.95 -0.58 0.00 3.38 -0.41 0.50 115.31 120.10 2qjm h LEU 326 Ca 0.22 -0.35 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 2qjm h LEU 326 Cb 0.27 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 2qjm h LEU 326 CO -0.01 1.12 0.36 0.45 0.09 0.00 0.00 178.44 180.45 2qjm h HIS 327 N 0.80 0.76 0.05 1.13 3.86 -1.13 0.15 115.15 120.78 2qjm h HIS 327 Ca 0.11 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.32 2qjm h HIS 327 Cb 0.77 -0.25 0.00 0.00 1.06 0.00 0.00 27.41 28.99 2qjm h HIS 327 CO 0.05 0.52 -0.02 0.35 0.86 0.00 0.00 177.93 179.68 2qjm h PHE 328 N 0.79 -0.06 -0.14 2.45 3.57 -0.78 -2.77 116.94 120.00 2qjm h PHE 328 Ca 0.21 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.70 2qjm h PHE 328 Cb -0.03 0.02 -0.01 0.00 2.79 0.00 0.00 35.95 38.72 2qjm h PHE 328 CO -0.02 -0.02 0.06 -0.44 -2.23 0.00 0.00 178.31 175.66 2qjm h ASP 329 N -0.08 0.16 0.30 0.41 3.32 0.47 0.15 116.42 121.15 2qjm h ASP 329 Ca -0.01 -0.01 -0.11 0.00 0.02 0.00 0.00 57.03 56.93 2qjm h ASP 329 Cb 0.06 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 2qjm h ASP 329 CO 0.01 0.14 -0.43 0.74 -1.72 0.00 0.00 179.24 177.98 2qjm h THR 330 N 0.19 1.32 0.02 0.35 2.02 -0.44 -3.35 112.91 113.02 2qjm h THR 330 Ca 0.05 -1.56 -0.38 0.00 0.77 0.00 0.00 66.41 65.29 2qjm h THR 330 Cb 0.03 1.74 -0.05 0.00 -1.74 0.00 0.00 68.15 68.13 2qjm h THR 330 CO -0.01 0.46 -2.15 1.87 0.37 0.00 0.00 175.52 176.07 2qjm n TRP 331 N -4.01 0.46 -1.68 3.16 -0.00 -0.87 -0.35 117.44 114.15 2qjm n TRP 331 Ca -0.02 0.15 -0.57 0.00 -0.00 0.00 0.00 57.50 57.06 2qjm n TRP 331 Cb 0.49 -1.05 -0.07 0.00 -0.00 0.00 0.00 31.31 30.67 2qjm n TRP 331 CO 0.00 0.00 0.00 1.55 -0.00 0.00 0.00 177.69 179.24 2qjm n VAL 332 N -3.89 0.22 0.31 5.87 3.14 -0.02 -4.33 118.33 119.62 2qjm n VAL 332 Ca -0.43 -0.04 -0.17 0.00 -2.96 0.00 0.00 64.34 60.74 2qjm n VAL 332 Cb 0.90 -1.08 -0.09 0.00 -1.06 0.00 0.00 33.84 32.52 2qjm n VAL 332 CO 0.00 0.00 0.00 -0.65 -6.46 0.00 0.00 176.83 169.72 2qjm h PRO 333 N 6.45 -0.86 -1.95 1.45 0.11 -1.92 -3.15 132.00 132.13 2qjm h PRO 333 Ca -0.47 0.06 -0.13 0.00 0.11 0.00 0.00 66.00 65.57 2qjm h PRO 333 Cb 1.33 0.19 -0.05 0.00 0.11 0.00 0.00 31.00 32.58 2qjm h PRO 333 CO 0.92 -0.57 -0.07 0.27 -0.21 0.00 0.00 178.00 178.33 2qjm n ASN 334 N -5.51 5.49 -4.76 -2.05 6.94 -1.26 -4.94 115.26 109.18 2qjm n ASN 334 Ca -0.12 -2.55 -0.41 0.00 -0.02 0.00 0.00 54.58 51.49 2qjm n ASN 334 Cb 0.40 -1.23 -0.02 0.00 -2.36 0.00 0.00 39.78 36.56 2qjm n ASN 334 CO 0.00 0.00 0.00 0.12 -1.03 0.00 0.00 177.26 176.35 2qjm s PHE 335 N 0.07 3.13 -0.01 -2.53 5.36 -1.19 -1.19 117.98 121.62 2qjm s PHE 335 Ca 0.30 1.34 -0.07 0.00 -0.96 0.00 0.00 56.93 57.54 2qjm s PHE 335 Cb 0.16 -3.66 -0.02 0.00 -0.34 0.00 0.00 43.02 39.16 2qjm s PHE 335 CO -0.01 -1.89 -0.13 0.41 -1.46 0.00 0.00 175.22 172.13 2qjm n GLY 336 N 1.37 -0.23 3.61 13.12 0.00 0.65 -4.67 105.19 119.04 2qjm n GLY 336 Ca 0.02 -0.13 -0.05 0.00 0.00 0.00 0.00 46.02 45.87 2qjm n GLY 336 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2qjm s ILE 337 N -2.30 0.00 -0.08 -0.61 2.07 -0.28 -4.93 121.20 115.07 2qjm s ILE 337 Ca -0.11 -0.24 0.02 0.00 -1.41 0.00 0.00 60.65 58.90 2qjm s ILE 337 Cb 0.02 -1.44 0.01 0.00 0.13 0.00 0.00 42.46 41.18 2qjm s ILE 337 CO 0.16 0.00 -0.12 -1.58 -1.91 0.00 0.00 174.94 171.49 2qjm s GLN 338 N -3.01 1.76 0.33 3.50 2.00 -0.53 -3.10 119.66 120.61 2qjm s GLN 338 Ca 0.09 -0.42 -0.28 0.00 -2.00 0.00 0.00 55.36 52.76 2qjm s GLN 338 Cb -0.00 -1.50 -0.09 0.00 0.80 0.00 0.00 33.01 32.22 2qjm s GLN 338 CO -0.04 -0.02 1.14 -2.00 -0.50 0.00 0.00 175.29 173.87 2qjm s GLU 339 N 0.83 4.42 -0.12 1.67 2.12 -0.78 -2.95 118.70 123.90 2qjm s GLU 339 Ca -0.11 1.83 -0.03 0.00 0.36 0.00 0.00 54.97 57.02 2qjm s GLU 339 Cb -0.15 -2.98 0.05 0.00 0.26 0.00 0.00 34.13 31.30 2qjm s GLU 339 CO 0.02 0.00 0.06 -0.47 -0.54 0.00 0.00 175.26 174.32 2qjm s TYR 340 N -1.27 0.38 -0.13 5.30 5.04 -1.21 -4.25 117.35 121.20 2qjm s TYR 340 Ca 0.49 -0.21 0.02 0.00 -2.44 0.00 0.00 57.07 54.93 2qjm s TYR 340 Cb -0.32 -0.70 0.01 0.00 0.35 0.00 0.00 41.96 41.30 2qjm s TYR 340 CO 0.40 -0.40 -0.18 -1.64 -1.34 0.00 0.00 175.55 172.39 2qjm s MET 341 N 2.07 2.61 0.34 4.97 -1.94 -1.16 -4.72 119.30 121.47 2qjm s MET 341 Ca 0.03 -0.70 -0.28 0.00 -1.71 0.00 0.00 55.69 53.03 2qjm s MET 341 Cb -0.14 -2.17 -0.10 0.00 2.01 0.00 0.00 34.83 34.43 2qjm s MET 341 CO -0.06 -0.05 1.28 1.03 -0.01 0.00 0.00 175.02 177.20 2qjm s ARG 342 N 0.94 4.32 0.61 2.03 0.52 -1.26 -4.60 118.95 121.51 2qjm s ARG 342 Ca -0.06 2.15 -0.02 0.00 -0.52 0.00 0.00 55.73 57.29 2qjm s ARG 342 Cb -0.15 -3.02 0.04 0.00 0.52 0.00 0.00 34.95 32.34 2qjm s ARG 342 CO -0.03 -0.20 0.87 -1.01 0.02 0.00 0.00 175.30 174.96 2qjm s HIS 343 N -1.17 2.88 0.87 -0.53 3.76 -1.26 -4.90 115.29 114.93 2qjm s HIS 343 Ca 0.50 0.16 -0.12 0.00 -0.15 0.00 0.00 55.06 55.45 2qjm s HIS 343 Cb -0.38 -2.93 0.11 0.00 1.11 0.00 0.00 32.58 30.49 2qjm s HIS 343 CO 0.51 -1.08 1.14 0.95 -0.85 0.00 0.00 174.74 175.40 2qjm s THR 344 N -2.95 2.17 0.24 1.30 -4.23 -1.26 -4.89 115.64 106.02 2qjm s THR 344 Ca 0.58 0.05 -0.03 0.00 -1.18 0.00 0.00 61.69 61.12 2qjm s THR 344 Cb -0.10 -2.86 0.08 0.00 1.34 0.00 0.00 72.50 70.96 2qjm s THR 344 CO 0.41 -0.07 1.71 -0.08 -0.54 0.00 0.00 174.62 176.04 2qjm h GLU 345 N -1.33 0.80 -0.22 3.99 4.81 -1.98 -2.21 114.58 118.44 2qjm h GLU 345 Ca -0.49 -0.25 -0.00 0.00 -0.13 0.00 0.00 59.36 58.49 2qjm h GLU 345 Cb 1.32 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.62 2qjm h GLU 345 CO 0.63 0.86 0.13 0.93 -0.73 0.00 0.00 179.01 180.83 2qjm h GLU 346 N 0.73 0.30 -0.62 1.92 3.07 -1.93 -1.21 114.58 116.84 2qjm h GLU 346 Ca 0.13 -0.03 0.03 0.00 -0.50 0.00 0.00 59.36 59.00 2qjm h GLU 346 Cb 0.56 -0.06 -0.04 0.00 -0.84 0.00 0.00 28.75 28.36 2qjm h GLU 346 CO 0.03 0.24 0.37 1.15 -1.40 0.00 0.00 179.01 179.41 2qjm h THR 347 N 0.27 1.05 0.00 1.13 2.02 -1.56 -0.99 112.91 114.84 2qjm h THR 347 Ca 0.08 -0.25 -0.03 0.00 0.77 0.00 0.00 66.41 66.98 2qjm h THR 347 Cb 0.02 0.26 -0.00 0.00 -1.74 0.00 0.00 68.15 66.69 2qjm h THR 347 CO -0.01 0.13 -0.16 0.44 0.37 0.00 0.00 175.52 176.29 2qjm h ASP 348 N 0.72 0.00 0.03 4.18 3.32 -0.99 -1.05 116.42 122.64 2qjm h ASP 348 Ca 0.26 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 57.03 2qjm h ASP 348 Cb 0.05 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.63 2qjm h ASP 348 CO -0.12 0.16 -1.08 0.00 -1.72 0.00 0.00 179.24 176.48 2qjm h ALA 349 N 1.84 0.08 -0.13 3.45 0.00 -0.05 -3.20 119.26 121.25 2qjm h ALA 349 Ca -0.00 -0.71 -0.10 0.00 0.00 0.00 0.00 54.91 54.10 2qjm h ALA 349 Cb 0.35 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2qjm h ALA 349 CO 0.02 0.67 -0.35 0.28 0.00 0.00 0.00 179.25 179.86 2qjm h VAL 350 N 0.34 1.29 -2.55 0.00 2.07 -0.82 -3.35 116.25 113.22 2qjm h VAL 350 Ca -0.14 -1.39 -0.62 0.00 0.82 0.00 0.00 66.70 65.37 2qjm h VAL 350 Cb 1.74 1.58 -0.41 0.00 -1.52 0.00 0.00 31.29 32.68 2qjm h VAL 350 CO 0.21 0.42 -0.54 0.49 0.02 0.00 0.00 177.57 178.18 2qjm n PHE 351 N -4.07 3.52 -1.71 1.57 3.72 -0.44 -0.69 117.46 119.36 2qjm n PHE 351 Ca -0.01 -4.18 -0.43 0.00 -0.05 0.00 0.00 57.45 52.78 2qjm n PHE 351 Cb 0.44 -0.62 -0.03 0.00 -0.94 0.00 0.00 39.48 38.34 2qjm n PHE 351 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 2qjm n PRO 352 N 1.28 2.48 -4.09 -1.08 -0.04 -1.21 -4.75 135.00 127.60 2qjm n PRO 352 Ca 0.26 0.89 -0.08 0.00 -0.04 0.00 0.00 63.50 64.53 2qjm n PRO 352 Cb 0.39 -2.66 -0.10 0.00 -0.04 0.00 0.00 33.50 31.08 2qjm n PRO 352 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 2qjm s HIS 353 N 0.48 0.56 -0.88 0.54 -3.43 -1.26 -1.58 115.29 109.72 2qjm s HIS 353 Ca 0.71 -0.98 0.01 0.00 -0.80 0.00 0.00 55.06 53.99 2qjm s HIS 353 Cb -0.56 -0.39 0.32 0.00 -1.43 0.00 0.00 32.58 30.51 2qjm s HIS 353 CO 0.42 -0.32 1.42 -3.47 -2.00 0.00 0.00 174.74 170.79 2qjm n ASP 354 N 0.25 6.05 -3.68 7.38 2.03 0.12 -4.95 116.55 123.75 2qjm n ASP 354 Ca -0.15 -3.61 -0.15 0.00 0.52 0.00 0.00 54.79 51.40 2qjm n ASP 354 Cb 0.60 -0.98 -0.08 0.00 -0.72 0.00 0.00 41.12 39.95 2qjm n ASP 354 CO 0.00 0.00 0.00 -0.72 -1.92 0.00 0.00 177.20 174.56 2qjm s TYR 355 N -3.61 -0.38 0.14 -0.67 -0.85 -1.26 0.16 117.35 110.88 2qjm s TYR 355 Ca 0.40 0.67 -0.08 0.00 -0.52 0.00 0.00 57.07 57.54 2qjm s TYR 355 Cb 0.18 0.21 -0.01 0.00 0.38 0.00 0.00 41.96 42.72 2qjm s TYR 355 CO -0.07 -0.44 0.24 1.67 -1.52 0.00 0.00 175.55 175.42 2qjm s TRP 356 N -1.09 0.36 -0.03 -3.49 -2.14 -0.57 -4.97 118.94 107.02 2qjm s TRP 356 Ca -0.11 -0.74 -0.01 0.00 2.66 0.00 0.00 56.10 57.89 2qjm s TRP 356 Cb -0.03 -0.09 -0.04 0.00 -3.10 0.00 0.00 33.47 30.21 2qjm s TRP 356 CO 0.06 -0.65 0.08 0.12 -2.66 0.00 0.00 176.95 173.89 2qjm s PHE 357 N -3.94 3.31 -0.30 1.66 5.36 -1.26 -1.25 117.98 121.56 2qjm s PHE 357 Ca 0.14 0.24 -0.06 0.00 -0.96 0.00 0.00 56.93 56.29 2qjm s PHE 357 Cb 0.04 -1.77 0.15 0.00 -0.34 0.00 0.00 43.02 41.10 2qjm s PHE 357 CO -0.03 0.56 0.62 -2.00 -1.46 0.00 0.00 175.22 172.91 2qjm s GLU 358 N -1.53 0.56 -1.36 10.12 2.12 0.01 -4.99 118.70 123.64 2qjm s GLU 358 Ca 0.21 1.26 -0.12 0.00 0.36 0.00 0.00 54.97 56.68 2qjm s GLU 358 Cb -0.12 0.71 0.01 0.00 0.26 0.00 0.00 34.13 35.00 2qjm s GLU 358 CO 0.11 -0.37 0.42 1.63 -0.54 0.00 0.00 175.26 176.52 2qjm n LYS 359 N 5.44 -1.54 -1.02 4.30 4.76 -1.26 -1.86 118.16 126.97 2qjm n LYS 359 Ca -0.08 0.24 -0.01 0.00 -2.87 0.00 0.00 58.31 55.60 2qjm n LYS 359 Cb 0.50 -3.70 -0.00 0.00 -1.84 0.00 0.00 35.03 29.98 2qjm n LYS 359 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2qjm n GLY 360 N -2.14 0.47 2.98 0.72 0.00 -1.24 -4.60 105.19 101.38 2qjm n GLY 360 Ca -0.23 -0.76 -0.10 0.00 0.00 0.00 0.00 46.02 44.92 2qjm n GLY 360 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qjm s GLU 361 N -1.56 0.31 0.12 1.61 2.02 -0.78 -3.19 118.70 117.24 2qjm s GLU 361 Ca 0.00 -0.54 0.04 0.00 0.02 0.00 0.00 54.97 54.49 2qjm s GLU 361 Cb 0.00 0.00 -0.04 0.00 0.10 0.00 0.00 34.13 34.20 2qjm s GLU 361 CO 0.00 -0.02 0.08 -0.51 0.02 0.00 0.00 175.26 174.84 2qjm s LEU 362 N -1.24 3.71 -0.01 1.80 1.43 -0.02 -0.81 118.68 123.55 2qjm s LEU 362 Ca -0.12 -0.12 0.01 0.00 -1.03 0.00 0.00 54.13 52.87 2qjm s LEU 362 Cb -0.08 -2.37 0.00 0.00 0.03 0.00 0.00 46.19 43.77 2qjm s LEU 362 CO -0.01 0.12 -0.03 -0.36 0.23 0.00 0.00 176.35 176.31 2qjm s PHE 363 N -1.56 0.34 0.01 0.29 0.08 -0.38 0.01 117.98 116.77 2qjm s PHE 363 Ca 0.29 -0.06 -0.02 0.00 0.12 0.00 0.00 56.93 57.27 2qjm s PHE 363 Cb -0.11 -0.27 -0.04 0.00 -0.57 0.00 0.00 43.02 42.03 2qjm s PHE 363 CO 0.22 -0.04 0.18 0.54 -0.10 0.00 0.00 175.22 176.02 2qjm s VAL 364 N 0.19 5.39 0.61 -0.44 0.11 -1.26 -1.51 120.40 123.50 2qjm s VAL 364 Ca -0.02 -0.22 -0.08 0.00 -2.93 0.00 0.00 61.98 58.74 2qjm s VAL 364 Cb -0.05 -3.54 0.14 0.00 -1.53 0.00 0.00 36.38 31.40 2qjm s VAL 364 CO -0.00 0.29 0.84 0.61 -3.33 0.00 0.00 175.10 173.50 2qjm n GLY 365 N 0.82 -0.70 1.23 6.54 0.00 0.43 -4.93 105.19 108.57 2qjm n GLY 365 Ca -0.10 -1.80 0.12 0.00 0.00 0.00 0.00 46.02 44.24 2qjm n GLY 365 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2qjm n GLU 366 N -2.71 2.60 -1.90 1.61 -0.58 -1.26 -4.88 120.64 113.52 2qjm n GLU 366 Ca 0.11 -2.45 -0.42 0.00 -0.42 0.00 0.00 57.16 53.99 2qjm n GLU 366 Cb 0.40 -1.53 -0.03 0.00 -0.57 0.00 0.00 31.44 29.71 2qjm n GLU 366 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 2qjm s THR 367 N -1.25 2.54 0.61 2.62 2.01 -1.26 -4.06 115.64 116.85 2qjm s THR 367 Ca 0.43 0.37 -0.18 0.00 0.31 0.00 0.00 61.69 62.62 2qjm s THR 367 Cb 0.24 -3.24 -0.05 0.00 0.01 0.00 0.00 72.50 69.46 2qjm s THR 367 CO 0.32 0.03 0.86 -2.65 -0.69 0.00 0.00 174.62 172.49 2qjm n PRO 368 N 4.07 0.76 0.00 4.92 -0.02 -1.26 -4.06 135.00 139.41 2qjm n PRO 368 Ca 0.14 0.30 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 2qjm n PRO 368 Cb 0.38 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 31.79 2qjm n PRO 368 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qjm n GLY 369 N 1.40 -1.74 0.33 -1.23 0.00 -0.94 -3.91 105.19 99.09 2qjm n GLY 369 Ca 0.13 -1.60 0.11 0.00 0.00 0.00 0.00 46.02 44.67 2qjm n GLY 369 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2qjm n HIS 370 N 0.00 0.10 -0.91 1.61 1.44 -1.26 -1.12 115.22 115.08 2qjm n HIS 370 Ca 0.00 -0.05 0.00 0.00 -2.01 0.00 0.00 57.72 55.66 2qjm n HIS 370 Cb 0.00 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.11 2qjm n HIS 370 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2qjm n GLY 371 N 1.02 0.77 3.48 -1.39 0.00 -1.25 -4.52 105.19 103.30 2qjm n GLY 371 Ca 0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 2qjm n GLY 371 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qjm s VAL 372 N -3.02 2.70 0.28 1.61 1.01 -1.26 -0.70 120.40 121.02 2qjm s VAL 372 Ca 0.00 -1.75 -0.01 0.00 0.00 0.00 0.00 61.98 60.22 2qjm s VAL 372 Cb 0.00 -2.28 -0.02 0.00 0.00 0.00 0.00 36.38 34.08 2qjm s VAL 372 CO 0.00 -0.02 0.32 -0.62 0.00 0.00 0.00 175.10 174.78 2qjm s ASP 373 N -2.47 0.70 -0.06 3.32 -1.08 -0.61 -4.90 116.67 111.56 2qjm s ASP 373 Ca 0.20 -1.43 0.03 0.00 -0.52 0.00 0.00 52.55 50.82 2qjm s ASP 373 Cb -0.09 0.54 0.01 0.00 -1.46 0.00 0.00 42.92 41.91 2qjm s ASP 373 CO 0.11 -1.07 -0.13 -0.51 0.52 0.00 0.00 175.17 174.08 2qjm s ILE 374 N -3.65 1.19 -0.82 4.11 2.07 -1.26 -3.33 121.20 119.50 2qjm s ILE 374 Ca 0.34 -0.52 -0.19 0.00 -1.41 0.00 0.00 60.65 58.87 2qjm s ILE 374 Cb 0.03 -1.07 0.12 0.00 0.13 0.00 0.00 42.46 41.66 2qjm s ILE 374 CO 0.18 0.36 1.01 -0.62 -1.91 0.00 0.00 174.94 173.96 2qjm s ASP 375 N 0.54 6.49 0.28 4.50 -1.08 0.13 -4.90 116.67 122.63 2qjm s ASP 375 Ca -0.13 -1.80 -0.01 0.00 -0.52 0.00 0.00 52.55 50.10 2qjm s ASP 375 Cb -0.15 -2.38 0.48 0.00 -1.46 0.00 0.00 42.92 39.41 2qjm s ASP 375 CO 0.04 -1.11 1.88 -0.33 0.52 0.00 0.00 175.17 176.16 2qjm h GLU 376 N 8.96 1.06 -0.35 4.34 5.08 -1.98 0.27 114.58 131.96 2qjm h GLU 376 Ca 0.00 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 2qjm h GLU 376 Cb 1.04 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 30.04 2qjm h GLU 376 CO 1.10 0.70 0.14 1.49 -1.00 0.00 0.00 179.01 181.44 2qjm h GLU 377 N 1.09 0.52 -0.39 2.33 4.81 -1.99 -1.63 114.58 119.33 2qjm h GLU 377 Ca 0.44 -0.10 -0.15 0.00 -0.13 0.00 0.00 59.36 59.42 2qjm h GLU 377 Cb 0.27 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 2qjm h GLU 377 CO -0.19 0.51 -0.36 1.25 -0.73 0.00 0.00 179.01 179.49 2qjm h LEU 378 N 0.41 0.97 -0.93 1.64 5.85 -1.87 -3.09 115.31 118.29 2qjm h LEU 378 Ca 0.12 -0.43 0.07 0.00 0.84 0.00 0.00 57.88 58.48 2qjm h LEU 378 Cb 0.19 -0.27 -0.07 0.00 0.37 0.00 0.00 40.66 40.88 2qjm h LEU 378 CO -0.01 1.22 0.59 0.00 -0.34 0.00 0.00 178.44 179.89 2qjm h ALA 379 N 0.83 1.31 0.00 1.25 0.00 -0.74 -0.47 119.26 121.43 2qjm h ALA 379 Ca 0.07 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2qjm h ALA 379 Cb 0.94 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2qjm h ALA 379 CO 0.09 0.32 0.00 0.00 0.00 0.00 0.00 179.25 179.66 2qjm n ALA 380 N -2.36 1.09 1.59 0.00 0.00 -0.63 -1.65 120.51 118.55 2qjm n ALA 380 Ca 0.15 0.19 0.15 0.00 0.00 0.00 0.00 53.44 53.92 2qjm n ALA 380 Cb 0.21 -1.32 0.66 0.00 0.00 0.00 0.00 19.45 19.00 2qjm n ALA 380 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2qjm n LYS 381 N -2.25 1.11 -3.76 0.00 5.02 -0.18 -4.49 118.16 113.61 2qjm n LYS 381 Ca -0.01 -0.44 -0.29 0.00 -2.02 0.00 0.00 58.31 55.55 2qjm n LYS 381 Cb 0.05 -1.49 -0.13 0.00 -0.02 0.00 0.00 35.03 33.44 2qjm n LYS 381 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 2qjm s TYR 382 N -2.19 2.42 0.58 2.13 2.02 -0.66 -5.04 117.35 116.62 2qjm s TYR 382 Ca 0.37 -2.73 -0.19 0.00 -0.37 0.00 0.00 57.07 54.15 2qjm s TYR 382 Cb 0.21 -2.13 -0.04 0.00 -0.40 0.00 0.00 41.96 39.60 2qjm s TYR 382 CO 0.40 -0.74 1.20 -1.25 -1.57 0.00 0.00 175.55 173.59 2qjm s PRO 383 N -0.12 3.05 0.35 -1.71 0.04 -1.26 0.53 135.00 135.87 2qjm s PRO 383 Ca 0.20 1.80 -0.27 0.00 0.04 0.00 0.00 61.00 62.77 2qjm s PRO 383 Cb -0.19 -1.95 -0.12 0.00 0.04 0.00 0.00 34.50 32.28 2qjm s PRO 383 CO -0.05 -1.14 1.06 0.98 0.04 0.00 0.00 177.00 177.89 2qjm n TYR 384 N -1.52 1.41 -3.53 0.56 9.36 -1.26 -4.25 117.16 117.93 2qjm n TYR 384 Ca 0.13 0.62 -0.22 0.00 3.32 0.00 0.00 57.90 61.75 2qjm n TYR 384 Cb 0.50 -2.27 -0.14 0.00 -0.63 0.00 0.00 39.34 36.79 2qjm n TYR 384 CO 0.00 0.00 0.00 0.21 0.22 0.00 0.00 176.86 177.29 2qjm s LYS 385 N -1.79 0.16 0.21 2.98 2.20 -1.26 -5.02 119.74 117.22 2qjm s LYS 385 Ca 0.60 -0.02 -0.32 0.00 -0.36 0.00 0.00 55.97 55.87 2qjm s LYS 385 Cb -0.62 -1.37 -0.15 0.00 -1.51 0.00 0.00 37.83 34.18 2qjm s LYS 385 CO 0.59 -0.74 1.18 -0.35 -0.36 0.00 0.00 175.35 175.67 2qjm n PRO 386 N 5.30 1.36 -3.69 4.03 -0.04 -1.26 -4.77 135.00 135.93 2qjm n PRO 386 Ca -0.06 0.48 -0.11 0.00 -0.04 0.00 0.00 63.50 63.78 2qjm n PRO 386 Cb 0.48 -1.99 -0.10 0.00 -0.04 0.00 0.00 33.50 31.86 2qjm n PRO 386 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qjm s ALA 387 N -0.34 -1.27 0.19 0.55 0.00 -1.26 -4.31 121.76 115.32 2qjm s ALA 387 Ca 0.69 1.65 0.07 0.00 0.00 0.00 0.00 51.96 54.37 2qjm s ALA 387 Cb -0.78 -0.98 -0.04 0.00 0.00 0.00 0.00 23.12 21.32 2qjm s ALA 387 CO 0.53 -0.28 0.01 0.71 0.00 0.00 0.00 175.76 176.74 2qjm s TYR 388 N 1.02 2.86 0.54 0.00 2.02 -1.26 -4.02 117.35 118.51 2qjm s TYR 388 Ca -0.06 -0.14 -0.12 0.00 -0.37 0.00 0.00 57.07 56.38 2qjm s TYR 388 Cb -0.06 -1.37 -0.05 0.00 -0.40 0.00 0.00 41.96 40.08 2qjm s TYR 388 CO -0.09 0.53 0.95 -0.51 -1.57 0.00 0.00 175.55 174.86 2qjm s LEU 389 N -3.06 3.48 0.88 -1.29 1.43 -1.26 -4.74 118.68 114.11 2qjm s LEU 389 Ca 0.28 1.37 -0.12 0.00 -1.03 0.00 0.00 54.13 54.64 2qjm s LEU 389 Cb -0.09 -4.35 0.12 0.00 0.03 0.00 0.00 46.19 41.90 2qjm s LEU 389 CO 0.19 -0.69 1.09 -2.84 0.23 0.00 0.00 176.35 174.34 2qjm s PRO 390 N -4.62 1.40 0.17 1.29 0.02 -1.26 -4.37 135.00 127.63 2qjm s PRO 390 Ca 0.55 0.78 0.07 0.00 0.02 0.00 0.00 61.00 62.42 2qjm s PRO 390 Cb -0.10 -1.83 -0.04 0.00 0.02 0.00 0.00 34.50 32.54 2qjm s PRO 390 CO 0.43 -2.13 -0.16 0.14 -0.33 0.00 0.00 177.00 174.95 2qjm s VAL 391 N -2.98 1.65 0.05 3.83 -7.23 -0.13 -4.81 120.40 110.79 2qjm s VAL 391 Ca 0.63 -1.99 0.08 0.00 -1.81 0.00 0.00 61.98 58.89 2qjm s VAL 391 Cb -0.17 -1.85 -0.03 0.00 0.56 0.00 0.00 36.38 34.89 2qjm s VAL 391 CO 0.56 -0.46 -0.21 0.00 -0.31 0.00 0.00 175.10 174.68 2qjm s ALA 392 N -2.45 1.81 0.02 1.32 0.00 -1.26 -0.54 121.76 120.66 2qjm s ALA 392 Ca 0.17 -1.10 0.02 0.00 0.00 0.00 0.00 51.96 51.04 2qjm s ALA 392 Cb -0.03 -0.34 -0.01 0.00 0.00 0.00 0.00 23.12 22.73 2qjm s ALA 392 CO 0.06 0.40 -0.07 1.03 0.00 0.00 0.00 175.76 177.18 2qjm s ARG 393 N -1.28 0.51 1.02 0.00 0.52 -0.35 -0.36 118.95 119.01 2qjm s ARG 393 Ca 0.08 -0.49 -0.15 0.00 -0.52 0.00 0.00 55.73 54.65 2qjm s ARG 393 Cb -0.09 -0.40 0.20 0.00 0.52 0.00 0.00 34.95 35.18 2qjm s ARG 393 CO 0.02 0.09 1.15 -0.51 0.02 0.00 0.00 175.30 176.07 2qjm s LEU 394 N -0.85 1.65 0.56 2.53 1.43 0.08 -2.35 118.68 121.72 2qjm s LEU 394 Ca -0.03 0.80 0.29 0.00 -1.03 0.00 0.00 54.13 54.15 2qjm s LEU 394 Cb -0.06 -2.88 1.66 0.00 0.03 0.00 0.00 46.19 44.95 2qjm s LEU 394 CO 0.00 -3.15 2.18 -0.33 0.23 0.00 0.00 176.35 175.28 2qjm h GLU 395 N -1.91 0.00 -0.02 1.70 5.08 -1.90 -0.84 114.58 116.68 2qjm h GLU 395 Ca -0.49 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.87 2qjm h GLU 395 Cb 1.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.56 2qjm h GLU 395 CO 0.50 0.05 0.00 -0.40 -1.00 0.00 0.00 179.01 178.16 2qjm n ASP 396 N -3.78 1.25 0.00 1.42 5.75 -1.26 -4.91 116.55 115.02 2qjm n ASP 396 Ca -0.03 -1.42 0.00 0.00 -0.01 0.00 0.00 54.79 53.34 2qjm n ASP 396 Cb 0.15 -0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.23 2qjm n ASP 396 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2qjm n GLY 397 N 1.14 0.24 3.72 6.12 0.00 -0.32 -5.05 105.19 111.04 2qjm n GLY 397 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 2qjm n GLY 397 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2qjm s THR 398 N -2.00 2.05 0.17 2.61 2.01 -1.26 -4.65 115.64 114.57 2qjm s THR 398 Ca 0.00 0.03 -0.32 0.00 0.31 0.00 0.00 61.69 61.72 2qjm s THR 398 Cb 0.00 -3.02 -0.10 0.00 0.01 0.00 0.00 72.50 69.38 2qjm s THR 398 CO 0.00 0.00 1.59 -0.32 -0.69 0.00 0.00 174.62 175.21 2qjm s MET 399 N 1.09 4.20 0.01 4.92 1.75 -1.26 -0.74 119.30 129.26 2qjm s MET 399 Ca 0.74 2.40 0.00 0.00 -1.25 0.00 0.00 55.69 57.58 2qjm s MET 399 Cb -0.49 -3.15 -0.00 0.00 2.84 0.00 0.00 34.83 34.03 2qjm s MET 399 CO 0.33 -0.63 0.00 1.87 -0.65 0.00 0.00 175.02 175.94 2qjm n TRP 400 N 3.99 0.01 -3.54 4.11 -0.00 0.51 -4.87 117.44 117.66 2qjm n TRP 400 Ca 0.14 -0.04 -0.38 0.00 -0.00 0.00 0.00 57.50 57.22 2qjm n TRP 400 Cb 0.38 -0.00 -0.09 0.00 -0.00 0.00 0.00 31.31 31.59 2qjm n TRP 400 CO 0.00 0.00 0.00 -0.80 -0.00 0.00 0.00 177.69 176.89 2qjm s ASN 401 N -1.04 6.17 0.00 5.87 0.01 -1.26 -4.33 114.94 120.36 2qjm s ASN 401 Ca 0.00 0.18 0.31 0.00 -0.71 0.00 0.00 52.86 52.65 2qjm s ASN 401 Cb 0.00 -2.15 1.80 0.00 0.41 0.00 0.00 41.25 41.31 2qjm s ASN 401 CO 0.00 -0.04 2.17 1.87 -1.51 0.00 0.00 177.10 179.59