#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 0.67 -0.09 3.17 1.02 -1.26 -4.16 119.74 119.08 2qjm s LYS 2 Ca 0.00 -1.17 -0.29 0.00 0.02 0.00 0.00 55.97 54.52 2qjm s LYS 2 Cb 0.00 -0.01 -0.01 0.00 -0.52 0.00 0.00 37.83 37.29 2qjm s LYS 2 CO 0.00 -0.05 0.99 0.42 -0.92 0.00 0.00 175.35 175.78 2qjm s ILE 3 N -3.37 4.81 -0.10 2.17 1.01 0.81 -2.46 121.20 124.07 2qjm s ILE 3 Ca 0.05 2.01 0.20 0.00 0.00 0.00 0.00 60.65 62.92 2qjm s ILE 3 Cb 0.04 -4.30 -0.30 0.00 0.01 0.00 0.00 42.46 37.91 2qjm s ILE 3 CO -0.06 0.03 0.47 0.35 0.00 0.00 0.00 174.94 175.73 2qjm n THR 4 N 4.46 0.00 -3.54 2.92 -2.24 0.00 -0.29 114.28 115.60 2qjm n THR 4 Ca 0.08 -0.42 -0.14 0.00 -2.27 0.00 0.00 64.05 61.30 2qjm n THR 4 Cb 0.49 0.12 -0.05 0.00 -2.10 0.00 0.00 70.33 68.79 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 -3.35 -1.84 -0.35 6.98 0.00 -1.10 -4.93 121.76 117.17 2qjm s ALA 5 Ca -0.06 1.37 0.00 0.00 0.00 0.00 0.00 51.96 53.27 2qjm s ALA 5 Cb 0.13 -0.24 0.14 0.00 0.00 0.00 0.00 23.12 23.15 2qjm s ALA 5 CO 0.83 -0.39 0.22 0.00 0.00 0.00 0.00 175.76 176.42 2qjm s ALA 6 N -1.44 0.84 0.17 0.00 0.00 -1.26 -1.03 121.76 119.04 2qjm s ALA 6 Ca -0.05 -1.81 -0.03 0.00 0.00 0.00 0.00 51.96 50.07 2qjm s ALA 6 Cb -0.00 -1.63 -0.05 0.00 0.00 0.00 0.00 23.12 21.44 2qjm s ALA 6 CO 0.04 -2.11 0.39 1.03 0.00 0.00 0.00 175.76 175.11 2qjm s ARG 7 N 1.09 3.58 -0.21 0.00 0.52 -0.69 -4.86 118.95 118.38 2qjm s ARG 7 Ca 0.18 -0.17 -0.03 0.00 -0.52 0.00 0.00 55.73 55.19 2qjm s ARG 7 Cb -0.23 -2.83 -0.00 0.00 0.52 0.00 0.00 34.95 32.41 2qjm s ARG 7 CO 0.01 0.42 -0.06 0.08 0.02 0.00 0.00 175.30 175.77 2qjm s VAL 8 N -1.76 3.20 -0.15 3.52 1.01 -1.26 -0.87 120.40 124.08 2qjm s VAL 8 Ca 0.40 -0.55 -0.03 0.00 0.00 0.00 0.00 61.98 61.80 2qjm s VAL 8 Cb -0.12 -2.44 -0.03 0.00 0.00 0.00 0.00 36.38 33.79 2qjm s VAL 8 CO 0.27 0.44 -0.04 -0.63 0.00 0.00 0.00 175.10 175.13 2qjm s ILE 9 N 1.42 3.85 -0.10 2.22 1.09 0.11 -4.95 121.20 124.84 2qjm s ILE 9 Ca 0.05 -0.38 0.01 0.00 -1.10 0.00 0.00 60.65 59.24 2qjm s ILE 9 Cb -0.14 -2.68 -0.02 0.00 -1.06 0.00 0.00 42.46 38.56 2qjm s ILE 9 CO -0.04 0.50 -0.15 -0.63 -0.10 0.00 0.00 174.94 174.52 2qjm s ILE 10 N 0.34 2.95 0.09 2.92 1.01 -1.26 -0.96 121.20 126.29 2qjm s ILE 10 Ca -0.05 -0.72 -0.14 0.00 0.00 0.00 0.00 60.65 59.75 2qjm s ILE 10 Cb -0.14 -2.21 0.02 0.00 0.01 0.00 0.00 42.46 40.15 2qjm s ILE 10 CO 0.03 0.55 0.33 0.28 0.00 0.00 0.00 174.94 176.13 2qjm s THR 11 N 0.03 0.09 -0.41 2.92 -1.32 -0.95 -4.73 115.64 111.27 2qjm s THR 11 Ca -0.05 -0.71 0.09 0.00 -1.21 0.00 0.00 61.69 59.81 2qjm s THR 11 Cb -0.14 -1.12 0.27 0.00 -1.51 0.00 0.00 72.50 70.00 2qjm s THR 11 CO 0.04 -0.39 0.58 0.00 -2.21 0.00 0.00 174.62 172.64 2qjm n PRO 13 N 1.12 3.56 0.00 0.00 -0.04 -1.26 -4.15 135.00 134.23 2qjm n PRO 13 Ca 0.23 -2.71 0.00 0.00 -0.04 0.00 0.00 63.50 60.98 2qjm n PRO 13 Cb 0.54 -2.44 0.00 0.00 -0.04 0.00 0.00 33.50 31.56 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 1.79 0.96 3.61 0.55 0.00 -1.26 -2.86 105.19 107.99 2qjm n GLY 14 Ca 0.59 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.59 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 0.00 0.41 0.27 1.61 1.70 -1.26 -5.08 118.95 116.60 2qjm s ARG 15 Ca 0.00 -0.20 -0.29 0.00 -0.47 0.00 0.00 55.73 54.77 2qjm s ARG 15 Cb 0.00 0.16 -0.10 0.00 -0.57 0.00 0.00 34.95 34.44 2qjm s ARG 15 CO 0.00 -0.18 1.29 -0.80 -1.08 0.00 0.00 175.30 174.53 2qjm s ASN 16 N -2.63 6.87 -0.06 -2.89 0.01 -1.26 -4.05 114.94 110.93 2qjm s ASN 16 Ca 0.12 2.53 -0.03 0.00 -0.71 0.00 0.00 52.86 54.78 2qjm s ASN 16 Cb 0.02 -2.63 0.04 0.00 0.41 0.00 0.00 41.25 39.09 2qjm s ASN 16 CO -0.04 -0.49 0.14 -0.36 -1.51 0.00 0.00 177.10 174.83 2qjm s PHE 17 N -0.63 -0.15 -0.11 2.20 0.08 0.04 -4.98 117.98 114.44 2qjm s PHE 17 Ca 0.52 0.45 0.00 0.00 0.12 0.00 0.00 56.93 58.02 2qjm s PHE 17 Cb -0.38 -0.09 -0.02 0.00 -0.57 0.00 0.00 43.02 41.96 2qjm s PHE 17 CO 0.46 -0.16 -0.11 0.08 -0.10 0.00 0.00 175.22 175.39 2qjm s VAL 18 N 1.14 3.27 0.02 -0.44 1.01 -1.26 -2.23 120.40 121.91 2qjm s VAL 18 Ca -0.09 -0.60 0.04 0.00 0.00 0.00 0.00 61.98 61.33 2qjm s VAL 18 Cb -0.11 -2.37 -0.01 0.00 0.00 0.00 0.00 36.38 33.89 2qjm s VAL 18 CO -0.06 0.54 -0.11 -0.89 0.00 0.00 0.00 175.10 174.58 2qjm s THR 19 N 0.02 0.88 -0.10 3.92 2.01 -0.13 -1.17 115.64 121.06 2qjm s THR 19 Ca -0.03 -0.71 -0.01 0.00 0.31 0.00 0.00 61.69 61.24 2qjm s THR 19 Cb -0.14 -0.78 -0.03 0.00 0.01 0.00 0.00 72.50 71.56 2qjm s THR 19 CO 0.04 0.07 -0.05 -0.22 -0.69 0.00 0.00 174.62 173.77 2qjm s LEU 20 N -0.73 3.23 -0.16 4.42 2.96 0.27 0.08 118.68 128.75 2qjm s LEU 20 Ca 0.01 -0.05 0.00 0.00 -0.22 0.00 0.00 54.13 53.88 2qjm s LEU 20 Cb -0.06 -1.73 0.03 0.00 0.50 0.00 0.00 46.19 44.93 2qjm s LEU 20 CO 0.00 0.29 -0.11 -0.75 -1.32 0.00 0.00 176.35 174.46 2qjm s LYS 21 N -0.38 2.04 -0.33 1.98 2.20 -0.05 -0.66 119.74 124.54 2qjm s LYS 21 Ca 0.06 -0.62 -0.14 0.00 -0.36 0.00 0.00 55.97 54.91 2qjm s LYS 21 Cb -0.12 -2.15 -0.02 0.00 -1.51 0.00 0.00 37.83 34.02 2qjm s LYS 21 CO 0.02 -0.33 0.29 0.42 -0.36 0.00 0.00 175.35 175.40 2qjm s ILE 22 N 1.49 5.23 0.04 5.43 -1.09 0.20 -1.70 121.20 130.80 2qjm s ILE 22 Ca 0.02 -0.04 0.01 0.00 -2.23 0.00 0.00 60.65 58.41 2qjm s ILE 22 Cb -0.14 -3.75 -0.04 0.00 -1.58 0.00 0.00 42.46 36.95 2qjm s ILE 22 CO -0.09 -0.02 0.10 -1.61 -1.23 0.00 0.00 174.94 172.09 2qjm s GLU 23 N 1.86 3.05 0.48 2.79 2.02 -0.20 -0.80 118.70 127.91 2qjm s GLU 23 Ca 0.09 -0.55 0.02 0.00 0.02 0.00 0.00 54.97 54.55 2qjm s GLU 23 Cb -0.17 -2.84 -0.02 0.00 0.10 0.00 0.00 34.13 31.21 2qjm s GLU 23 CO 0.11 0.61 0.05 0.95 0.02 0.00 0.00 175.26 177.00 2qjm s THR 24 N -1.31 0.96 -0.47 3.63 -4.23 -1.15 -0.82 115.64 112.26 2qjm s THR 24 Ca 0.27 -2.00 0.10 0.00 -1.18 0.00 0.00 61.69 58.88 2qjm s THR 24 Cb -0.12 -2.22 0.57 0.00 1.34 0.00 0.00 72.50 72.07 2qjm s THR 24 CO 0.19 0.00 1.39 -0.90 -0.54 0.00 0.00 174.62 174.76 2qjm n ASP 25 N -1.29 4.31 -0.08 3.99 5.75 -1.03 -3.59 116.55 124.61 2qjm n ASP 25 Ca -0.15 -2.67 0.04 0.00 -0.01 0.00 0.00 54.79 52.01 2qjm n ASP 25 Cb 0.66 -0.64 0.06 0.00 -1.03 0.00 0.00 41.12 40.18 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 0.40 1.70 0.00 0.11 -0.06 -1.26 -4.95 117.38 113.32 2qjm n GLN 26 Ca 0.20 -1.83 0.00 0.00 -2.00 0.00 0.00 57.00 53.37 2qjm n GLN 26 Cb 0.93 -1.12 0.00 0.00 -4.06 0.00 0.00 30.24 25.99 2qjm n GLN 26 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2qjm n GLY 27 N -0.82 1.75 3.53 1.69 0.00 -1.24 -4.97 105.19 105.14 2qjm n GLY 27 Ca 0.07 -0.14 -0.38 0.00 0.00 0.00 0.00 46.02 45.56 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 2.76 -4.03 1.61 3.14 -1.26 -4.64 118.33 115.91 2qjm n VAL 28 Ca 0.00 -0.50 -0.09 0.00 -2.96 0.00 0.00 64.34 60.79 2qjm n VAL 28 Cb 0.00 -0.88 -0.08 0.00 -1.06 0.00 0.00 33.84 31.82 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 -1.59 0.55 0.06 1.45 -0.85 -1.26 -2.96 117.35 112.74 2qjm s TYR 29 Ca 0.70 -0.94 0.01 0.00 -0.52 0.00 0.00 57.07 56.32 2qjm s TYR 29 Cb -0.45 -0.25 -0.03 0.00 0.38 0.00 0.00 41.96 41.61 2qjm s TYR 29 CO 0.52 -0.58 -0.06 0.20 -1.52 0.00 0.00 175.55 174.11 2qjm s GLY 30 N -2.98 0.54 0.03 5.49 0.00 0.02 -4.50 107.32 105.93 2qjm s GLY 30 Ca 0.17 -0.96 0.04 0.00 0.00 0.00 0.00 44.72 43.97 2qjm s GLY 30 CO -0.02 -1.04 -0.13 -0.26 0.00 0.00 0.00 173.10 171.65 2qjm s ILE 31 N -2.35 0.99 0.07 0.90 -4.36 -1.26 0.61 121.20 115.80 2qjm s ILE 31 Ca -0.03 -0.91 0.02 0.00 -0.26 0.00 0.00 60.65 59.47 2qjm s ILE 31 Cb -0.03 -0.90 -0.03 0.00 1.25 0.00 0.00 42.46 42.74 2qjm s ILE 31 CO -0.03 -0.00 -0.07 -0.83 0.24 0.00 0.00 174.94 174.26 2qjm s GLY 32 N -1.03 0.62 0.07 6.27 0.00 0.17 -3.53 107.32 109.88 2qjm s GLY 32 Ca 0.01 -1.08 -0.18 0.00 0.00 0.00 0.00 44.72 43.47 2qjm s GLY 32 CO 0.01 -1.16 0.54 -0.35 0.00 0.00 0.00 173.10 172.13 2qjm s ASP 33 N -2.40 6.99 -0.03 1.64 2.15 -1.26 -0.56 116.67 123.20 2qjm s ASP 33 Ca 0.02 1.18 0.04 0.00 0.43 0.00 0.00 52.55 54.22 2qjm s ASP 33 Cb -0.01 -2.33 0.06 0.00 -0.30 0.00 0.00 42.92 40.34 2qjm s ASP 33 CO -0.03 0.26 0.97 0.00 -0.17 0.00 0.00 175.17 176.20 2qjm n ALA 34 N 1.61 1.93 -1.94 3.66 0.00 -0.32 -3.33 120.51 122.12 2qjm n ALA 34 Ca -0.10 -1.29 -0.42 0.00 0.00 0.00 0.00 53.44 51.62 2qjm n ALA 34 Cb 0.51 -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 -0.68 3.18 -0.48 0.00 2.01 -1.21 -4.77 115.64 113.69 2qjm s THR 35 Ca 0.07 0.52 0.03 0.00 0.31 0.00 0.00 61.69 62.62 2qjm s THR 35 Cb 0.06 -3.34 0.13 0.00 0.01 0.00 0.00 72.50 69.37 2qjm s THR 35 CO 0.01 -0.01 0.24 -0.22 -0.69 0.00 0.00 174.62 173.94 2qjm s LEU 36 N 3.07 3.60 -0.29 4.42 2.96 -1.26 -4.94 118.68 126.24 2qjm s LEU 36 Ca 0.74 -2.81 -0.43 0.00 -0.22 0.00 0.00 54.13 51.42 2qjm s LEU 36 Cb -0.38 -1.37 -0.18 0.00 0.50 0.00 0.00 46.19 44.76 2qjm s LEU 36 CO 0.32 -0.25 1.54 -3.20 -1.32 0.00 0.00 176.35 173.44 2qjm n ASN 37 N 3.35 1.48 0.00 3.68 5.15 -1.26 -1.06 115.26 126.60 2qjm n ASN 37 Ca 0.06 1.14 0.00 0.00 -0.60 0.00 0.00 54.58 55.18 2qjm n ASN 37 Cb 0.33 -1.01 0.00 0.00 -0.53 0.00 0.00 39.78 38.58 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 3.54 2.04 1.42 8.20 0.00 -1.26 -4.76 105.19 114.37 2qjm n GLY 38 Ca 0.26 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.31 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 -0.27 1.61 5.12 -0.22 -4.86 116.66 116.03 2qjm n ARG 39 Ca 0.00 -1.83 0.08 0.00 -1.93 0.00 0.00 57.85 54.17 2qjm n ARG 39 Cb 0.00 0.08 0.20 0.00 -1.16 0.00 0.00 32.46 31.59 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 0.83 0.15 0.00 5.56 3.07 -1.62 -2.65 114.58 119.92 2qjm h GLU 40 Ca -0.29 -0.01 -0.00 0.00 -0.50 0.00 0.00 59.36 58.56 2qjm h GLU 40 Cb 1.82 -0.03 -0.00 0.00 -0.84 0.00 0.00 28.75 29.69 2qjm h GLU 40 CO 0.03 0.10 -0.01 -0.07 -1.40 0.00 0.00 179.01 177.66 2qjm h LEU 41 N 0.15 0.00 -0.93 1.33 3.38 -1.94 -2.80 115.31 114.51 2qjm h LEU 41 Ca 0.46 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.32 2qjm h LEU 41 Cb 0.85 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.59 2qjm h LEU 41 CO -0.65 0.01 -0.45 0.77 0.09 0.00 0.00 178.44 178.21 2qjm h SER 42 N 0.00 0.20 0.83 -0.43 4.64 -1.88 -2.34 113.55 114.56 2qjm h SER 42 Ca -0.00 -0.09 -0.19 0.00 -0.47 0.00 0.00 61.79 61.05 2qjm h SER 42 Cb 0.46 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 62.47 2qjm h SER 42 CO 0.00 0.63 -0.88 0.58 -0.87 0.00 0.00 176.83 176.29 2qjm h VAL 43 N 0.15 1.60 -0.05 0.95 2.07 -1.63 -1.66 116.25 117.69 2qjm h VAL 43 Ca 0.01 -2.93 -0.00 0.00 0.82 0.00 0.00 66.70 64.59 2qjm h VAL 43 Cb 0.86 2.60 -0.00 0.00 -1.52 0.00 0.00 31.29 33.23 2qjm h VAL 43 CO 0.07 0.84 0.02 0.58 0.02 0.00 0.00 177.57 179.10 2qjm h VAL 44 N 0.02 1.13 -0.59 2.57 2.07 -1.37 -1.90 116.25 118.17 2qjm h VAL 44 Ca -0.02 -0.38 -0.05 0.00 0.82 0.00 0.00 66.70 67.08 2qjm h VAL 44 Cb 1.54 1.30 -0.02 0.00 -1.52 0.00 0.00 31.29 32.59 2qjm h VAL 44 CO 0.12 0.10 0.17 0.00 0.02 0.00 0.00 177.57 177.99 2qjm h ALA 45 N 0.87 0.78 -0.74 1.67 0.00 -1.44 0.16 119.26 120.57 2qjm h ALA 45 Ca 0.02 -0.21 0.11 0.00 0.00 0.00 0.00 54.91 54.82 2qjm h ALA 45 Cb 0.15 -0.23 -0.08 0.00 0.00 0.00 0.00 17.79 17.64 2qjm h ALA 45 CO -0.00 0.46 0.36 -0.92 0.00 0.00 0.00 179.25 179.14 2qjm h TYR 46 N 0.84 0.64 0.16 0.00 3.20 -1.11 0.05 116.97 120.75 2qjm h TYR 46 Ca 0.19 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 62.08 2qjm h TYR 46 Cb 0.31 -0.17 0.00 0.00 1.54 0.00 0.00 36.73 38.40 2qjm h TYR 46 CO 0.02 0.20 -0.08 -0.07 -1.64 0.00 0.00 178.16 176.60 2qjm h LEU 47 N 0.59 -0.18 -0.25 2.82 3.38 -1.06 -1.85 115.31 118.76 2qjm h LEU 47 Ca 0.37 0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.39 2qjm h LEU 47 Cb 0.44 0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.20 2qjm h LEU 47 CO -0.30 0.28 0.03 1.56 0.09 0.00 0.00 178.44 180.10 2qjm h GLN 48 N -1.03 0.11 0.00 1.13 4.20 -0.67 0.32 115.11 119.17 2qjm h GLN 48 Ca -0.02 -0.01 -0.14 0.00 0.06 0.00 0.00 58.65 58.54 2qjm h GLN 48 Cb 0.16 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 27.90 2qjm h GLN 48 CO 0.04 0.07 -0.70 0.93 -0.67 0.00 0.00 178.83 178.50 2qjm h GLU 49 N 0.12 0.00 0.00 1.46 4.39 -1.17 -3.41 114.58 115.97 2qjm h GLU 49 Ca 0.12 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.82 2qjm h GLU 49 Cb 0.13 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.78 2qjm h GLU 49 CO -0.17 0.63 -0.21 0.72 -1.16 0.00 0.00 179.01 178.82 2qjm n HIS 50 N -3.24 -0.31 0.03 4.33 8.25 -1.08 -4.86 115.22 118.34 2qjm n HIS 50 Ca 0.01 0.06 -0.13 0.00 -0.26 0.00 0.00 57.72 57.39 2qjm n HIS 50 Cb 0.80 0.09 -0.09 0.00 1.12 0.00 0.00 29.99 31.91 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 0.00 1.17 -0.33 1.59 2.07 -1.05 -3.34 116.25 116.36 2qjm h VAL 51 Ca 0.00 -0.81 0.06 0.00 0.82 0.00 0.00 66.70 66.77 2qjm h VAL 51 Cb 0.21 1.70 -0.08 0.00 -1.52 0.00 0.00 31.29 31.60 2qjm h VAL 51 CO 0.00 0.20 -0.42 0.00 0.02 0.00 0.00 177.57 177.38 2qjm h ALA 52 N 0.46 -0.45 -1.02 1.67 0.00 -0.61 -1.66 119.26 117.64 2qjm h ALA 52 Ca -0.01 0.05 0.26 0.00 0.00 0.00 0.00 54.91 55.21 2qjm h ALA 52 Cb 0.39 0.85 -0.12 0.00 0.00 0.00 0.00 17.79 18.91 2qjm h ALA 52 CO 0.01 -0.87 0.62 -1.35 0.00 0.00 0.00 179.25 177.67 2qjm h PRO 53 N -0.36 0.49 -0.08 0.00 0.11 -1.79 -0.29 132.00 130.07 2qjm h PRO 53 Ca 0.12 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 66.07 2qjm h PRO 53 Cb 0.59 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.58 2qjm h PRO 53 CO -0.52 0.32 -0.54 0.00 -0.21 0.00 0.00 178.00 177.05 2qjm h LEU 55 N 0.19 0.00 -9.35 0.00 3.38 -0.69 -3.44 115.31 105.40 2qjm h LEU 55 Ca 0.00 0.00 -0.62 0.00 0.09 0.00 0.00 57.88 57.36 2qjm h LEU 55 Cb 1.01 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.79 2qjm h LEU 55 CO 0.08 0.49 0.94 -0.38 0.09 0.00 0.00 178.44 179.66 2qjm n ILE 56 N -3.89 0.33 0.00 1.22 2.08 -1.11 -1.20 119.36 116.78 2qjm n ILE 56 Ca -0.01 -0.06 0.00 0.00 0.56 0.00 0.00 62.75 63.24 2qjm n ILE 56 Cb 0.51 -1.65 0.00 0.00 -0.75 0.00 0.00 39.64 37.75 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 3.94 2.25 3.83 7.39 0.00 0.60 -4.95 105.19 118.26 2qjm n GLY 57 Ca 0.21 0.00 -0.32 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 -0.81 3.46 -0.48 1.61 -1.94 -0.34 -4.48 119.30 116.32 2qjm s MET 58 Ca 0.00 0.98 -0.28 0.00 -1.71 0.00 0.00 55.69 54.67 2qjm s MET 58 Cb 0.00 -2.06 0.03 0.00 2.01 0.00 0.00 34.83 34.81 2qjm s MET 58 CO 0.00 -0.68 1.11 0.34 -0.01 0.00 0.00 175.02 175.78 2qjm s ASP 59 N -3.41 6.61 0.45 3.03 3.68 -1.26 -0.13 116.67 125.63 2qjm s ASP 59 Ca 0.59 0.40 0.30 0.00 2.13 0.00 0.00 52.55 55.97 2qjm s ASP 59 Cb -0.13 -2.54 1.61 0.00 -1.45 0.00 0.00 42.92 40.42 2qjm s ASP 59 CO 0.43 -1.24 1.93 1.55 0.13 0.00 0.00 175.17 177.98 2qjm h PRO 60 N 9.22 0.00 0.00 4.34 0.13 -1.89 -2.40 132.00 141.41 2qjm h PRO 60 Ca -0.23 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.86 2qjm h PRO 60 Cb 1.06 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.19 2qjm h PRO 60 CO 1.12 0.00 -0.16 0.00 -0.23 0.00 0.00 178.00 178.72 2qjm h ARG 61 N 0.00 0.00 -3.60 0.86 3.08 -1.91 -3.37 114.38 109.44 2qjm h ARG 61 Ca 0.00 0.00 -0.74 0.00 0.07 0.00 0.00 59.98 59.31 2qjm h ARG 61 Cb 0.04 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 29.99 2qjm h ARG 61 CO 0.00 0.16 2.52 0.54 -1.07 0.00 0.00 179.97 182.13 2qjm n ARG 62 N -3.24 3.41 -0.10 0.04 1.74 -0.90 -4.79 116.66 112.81 2qjm n ARG 62 Ca 0.01 -3.14 -0.07 0.00 -0.77 0.00 0.00 57.85 53.89 2qjm n ARG 62 Cb 0.45 -3.03 0.01 0.00 -1.02 0.00 0.00 32.46 28.87 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 3.73 0.97 0.30 0.55 2.04 -1.85 -1.70 117.51 121.55 2qjm h ILE 63 Ca 0.49 -0.12 -0.01 0.00 1.00 0.00 0.00 64.86 66.22 2qjm h ILE 63 Cb 0.60 0.59 0.00 0.00 -0.74 0.00 0.00 36.82 37.27 2qjm h ILE 63 CO 1.72 0.06 -0.14 -0.08 0.00 0.00 0.00 178.15 179.71 2qjm h GLU 64 N 0.35 -0.38 -0.72 2.37 4.57 -1.97 -1.29 114.58 117.51 2qjm h GLU 64 Ca 0.15 0.03 0.10 0.00 -1.18 0.00 0.00 59.36 58.46 2qjm h GLU 64 Cb 0.07 0.09 -0.08 0.00 -0.16 0.00 0.00 28.75 28.67 2qjm h GLU 64 CO -0.11 -0.16 0.34 0.22 -1.18 0.00 0.00 179.01 178.12 2qjm h ASP 65 N -0.55 0.42 -0.56 1.04 3.58 -1.94 -0.83 116.42 117.58 2qjm h ASP 65 Ca -0.04 0.07 -0.10 0.00 0.42 0.00 0.00 57.03 57.38 2qjm h ASP 65 Cb 0.40 0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.44 2qjm h ASP 65 CO 0.07 0.23 -0.05 0.40 -2.88 0.00 0.00 179.24 177.00 2qjm h ILE 66 N 0.57 1.27 -0.10 2.25 2.04 -1.22 0.59 117.51 122.90 2qjm h ILE 66 Ca 0.36 -1.20 0.01 0.00 1.00 0.00 0.00 64.86 65.03 2qjm h ILE 66 Cb 0.43 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 37.37 2qjm h ILE 66 CO -0.30 0.43 0.04 -0.25 0.00 0.00 0.00 178.15 178.07 2qjm h TRP 67 N 0.94 0.07 -0.73 1.37 7.01 -0.30 -0.50 115.95 123.81 2qjm h TRP 67 Ca 0.16 0.00 -0.04 0.00 2.11 0.00 0.00 58.89 61.12 2qjm h TRP 67 Cb 0.61 -0.02 -0.03 0.00 -2.10 0.00 0.00 29.16 27.62 2qjm h TRP 67 CO 0.04 0.04 0.28 1.96 -2.79 0.00 0.00 178.44 177.97 2qjm h GLN 68 N 0.09 1.08 -0.27 2.65 1.08 -1.02 0.14 115.11 118.86 2qjm h GLN 68 Ca 0.04 -0.19 -0.00 0.00 -1.45 0.00 0.00 58.65 57.04 2qjm h GLN 68 Cb 0.02 -0.18 -0.01 0.00 -0.05 0.00 0.00 27.48 27.26 2qjm h GLN 68 CO -0.04 0.88 0.15 -0.92 -0.95 0.00 0.00 178.83 177.96 2qjm h TYR 69 N 1.06 0.36 -0.12 2.96 3.20 -0.47 0.13 116.97 124.09 2qjm h TYR 69 Ca 0.24 -0.01 -0.21 0.00 3.14 0.00 0.00 58.73 61.90 2qjm h TYR 69 Cb 0.21 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 38.37 2qjm h TYR 69 CO 0.02 0.30 -0.76 0.28 -1.64 0.00 0.00 178.16 176.35 2qjm h VAL 70 N 0.33 1.32 0.32 1.81 2.07 -0.88 0.96 116.25 122.17 2qjm h VAL 70 Ca 0.10 -2.05 -0.02 0.00 0.82 0.00 0.00 66.70 65.55 2qjm h VAL 70 Cb 0.05 2.04 0.00 0.00 -1.52 0.00 0.00 31.29 31.86 2qjm h VAL 70 CO -0.02 0.63 -0.15 0.22 0.02 0.00 0.00 177.57 178.27 2qjm h TYR 71 N 0.42 -0.40 -0.05 1.57 3.20 -0.60 -3.20 116.97 117.91 2qjm h TYR 71 Ca -0.04 -0.01 -0.21 0.00 3.14 0.00 0.00 58.73 61.61 2qjm h TYR 71 Cb 1.36 0.13 0.01 0.00 1.54 0.00 0.00 36.73 39.78 2qjm h TYR 71 CO 0.07 -0.06 -0.77 0.00 -1.64 0.00 0.00 178.16 175.75 2qjm h ARG 72 N -0.93 0.61 -0.50 1.82 3.08 -0.88 -3.32 114.38 114.25 2qjm h ARG 72 Ca -0.04 -0.59 0.15 0.00 0.07 0.00 0.00 59.98 59.56 2qjm h ARG 72 Cb 0.52 0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.70 2qjm h ARG 72 CO 0.07 1.20 0.42 0.78 -1.07 0.00 0.00 179.97 181.38 2qjm h GLY 73 N 0.24 0.00 2.00 0.04 0.00 -0.86 -1.63 103.07 102.86 2qjm h GLY 73 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.25 2qjm h GLY 73 CO 0.15 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.69 2qjm h ALA 74 N 1.63 1.00 0.00 3.60 0.00 -1.65 -3.46 119.26 120.38 2qjm h ALA 74 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.15 2qjm h ALA 74 Cb 1.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.87 2qjm h ALA 74 CO -0.00 0.00 0.00 0.98 0.00 0.00 0.00 179.25 180.23 2qjm n TYR 75 N -2.95 0.00 -2.85 0.00 9.36 -0.61 -4.76 117.16 115.34 2qjm n TYR 75 Ca 0.00 0.00 -0.43 0.00 3.32 0.00 0.00 57.90 60.79 2qjm n TYR 75 Cb 0.26 0.00 -0.04 0.00 -0.63 0.00 0.00 39.34 38.93 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 2.68 0.54 2.98 0.52 -1.26 -5.02 118.94 119.38 2qjm s TRP 76 Ca 0.00 -0.57 -0.07 0.00 0.02 0.00 0.00 56.10 55.48 2qjm s TRP 76 Cb 0.00 -4.30 -0.03 0.00 -1.15 0.00 0.00 33.47 27.99 2qjm s TRP 76 CO 0.00 -1.65 0.87 1.03 0.02 0.00 0.00 176.95 177.21 2qjm s ARG 77 N 4.05 3.42 1.20 4.98 0.52 -1.26 -4.98 118.95 126.88 2qjm s ARG 77 Ca 0.23 0.28 0.00 0.00 -0.52 0.00 0.00 55.73 55.72 2qjm s ARG 77 Cb -0.16 -2.29 0.00 0.00 0.52 0.00 0.00 34.95 33.02 2qjm s ARG 77 CO 0.10 -0.39 0.00 0.54 0.02 0.00 0.00 175.30 175.56 2qjm n ARG 78 N -2.44 -0.91 0.00 3.54 1.74 -1.26 -5.08 116.66 112.24 2qjm n ARG 78 Ca 0.03 0.60 0.00 0.00 -0.77 0.00 0.00 57.85 57.71 2qjm n ARG 78 Cb 0.55 -1.12 0.00 0.00 -1.02 0.00 0.00 32.46 30.88 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 -1.41 2.69 0.18 -0.13 0.00 -1.26 -4.52 105.19 100.74 2qjm n GLY 79 Ca 0.00 -1.74 -0.08 0.00 0.00 0.00 0.00 46.02 44.21 2qjm n GLY 79 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qjm h PRO 80 N 0.00 0.54 -0.09 1.61 0.13 -1.93 -0.90 132.00 131.35 2qjm h PRO 80 Ca 0.00 -0.04 -0.02 0.00 -0.87 0.00 0.00 66.00 65.07 2qjm h PRO 80 Cb 0.00 -0.12 -0.00 0.00 0.13 0.00 0.00 31.00 31.01 2qjm h PRO 80 CO 0.00 0.38 -0.01 0.28 -0.23 0.00 0.00 178.00 178.42 2qjm h VAL 81 N 0.54 1.27 -0.07 1.56 2.07 -1.98 -2.31 116.25 117.32 2qjm h VAL 81 Ca 0.15 -0.86 0.02 0.00 0.82 0.00 0.00 66.70 66.83 2qjm h VAL 81 Cb -0.03 1.65 -0.02 0.00 -1.52 0.00 0.00 31.29 31.37 2qjm h VAL 81 CO -0.03 0.24 -0.06 0.74 0.02 0.00 0.00 177.57 178.48 2qjm h THR 82 N -0.13 0.81 0.00 2.57 2.02 -1.78 -2.60 112.91 113.81 2qjm h THR 82 Ca 0.03 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.14 2qjm h THR 82 Cb 0.38 0.81 -0.01 0.00 -1.74 0.00 0.00 68.15 67.59 2qjm h THR 82 CO 0.01 0.00 -0.29 0.24 0.37 0.00 0.00 175.52 175.84 2qjm h MET 83 N -0.08 0.00 -0.29 6.66 2.86 -1.21 -1.96 114.93 120.91 2qjm h MET 83 Ca 0.05 0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.53 2qjm h MET 83 Cb 0.15 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.81 2qjm h MET 83 CO -0.12 0.29 -0.47 -0.09 1.06 0.00 0.00 176.91 177.59 2qjm h ARG 84 N 0.00 0.76 -0.34 1.72 9.65 -1.22 0.94 114.38 125.89 2qjm h ARG 84 Ca -0.00 -0.44 -0.06 0.00 -1.10 0.00 0.00 59.98 58.38 2qjm h ARG 84 Cb 0.79 0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 29.39 2qjm h ARG 84 CO 0.04 1.06 -0.03 0.00 2.80 0.00 0.00 179.97 183.84 2qjm h ALA 85 N 0.86 0.46 -0.55 2.80 0.00 -1.22 -1.67 119.26 119.94 2qjm h ALA 85 Ca 0.03 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.64 2qjm h ALA 85 Cb 1.04 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 2qjm h ALA 85 CO 0.10 0.26 0.20 0.82 0.00 0.00 0.00 179.25 180.62 2qjm h ILE 86 N 0.42 1.23 -0.58 0.00 2.04 -1.21 -2.65 117.51 116.75 2qjm h ILE 86 Ca 0.09 -0.74 0.02 0.00 1.00 0.00 0.00 64.86 65.23 2qjm h ILE 86 Cb 0.50 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 37.23 2qjm h ILE 86 CO 0.02 0.28 0.37 0.00 0.00 0.00 0.00 178.15 178.83 2qjm h ALA 87 N 1.05 0.75 -0.57 1.87 0.00 -0.68 -0.19 119.26 121.49 2qjm h ALA 87 Ca 0.18 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.12 2qjm h ALA 87 Cb 0.24 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 2qjm h ALA 87 CO -0.01 0.14 0.27 0.00 0.00 0.00 0.00 179.25 179.64 2qjm h ALA 88 N 1.23 0.73 0.02 0.00 0.00 -1.10 0.14 119.26 120.29 2qjm h ALA 88 Ca 0.22 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 2qjm h ALA 88 Cb -0.04 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2qjm h ALA 88 CO -0.07 -0.10 -0.01 0.28 0.00 0.00 0.00 179.25 179.35 2qjm h VAL 89 N 0.51 1.13 -0.67 0.00 2.07 -1.10 -2.07 116.25 116.10 2qjm h VAL 89 Ca 0.26 -0.46 0.05 0.00 0.82 0.00 0.00 66.70 67.37 2qjm h VAL 89 Cb 0.22 1.44 -0.05 0.00 -1.52 0.00 0.00 31.29 31.37 2qjm h VAL 89 CO -0.21 0.12 0.40 -0.78 0.02 0.00 0.00 177.57 177.12 2qjm h ASP 90 N -0.23 0.62 -0.47 0.57 3.58 -0.50 -0.16 116.42 119.82 2qjm h ASP 90 Ca -0.00 0.02 -0.02 0.00 0.42 0.00 0.00 57.03 57.44 2qjm h ASP 90 Cb 0.22 -0.11 -0.02 0.00 1.72 0.00 0.00 39.33 41.14 2qjm h ASP 90 CO 0.01 0.41 0.21 0.24 -2.88 0.00 0.00 179.24 177.22 2qjm h MET 91 N 0.75 0.69 -0.29 0.28 2.86 -0.66 -1.19 114.93 117.37 2qjm h MET 91 Ca 0.29 -0.11 -0.00 0.00 -2.06 0.00 0.00 59.70 57.81 2qjm h MET 91 Cb 0.12 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 2qjm h MET 91 CO -0.15 0.61 0.16 0.00 1.06 0.00 0.00 176.91 178.59 2qjm h ALA 92 N 1.05 0.37 -0.88 6.32 0.00 -0.87 -1.28 119.26 123.97 2qjm h ALA 92 Ca 0.16 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2qjm h ALA 92 Cb 0.16 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 2qjm h ALA 92 CO -0.02 -0.11 0.46 -0.07 0.00 0.00 0.00 179.25 179.51 2qjm h LEU 93 N 0.35 1.12 -0.90 0.00 3.38 -0.82 -1.23 115.31 117.21 2qjm h LEU 93 Ca 0.10 -0.11 -0.11 0.00 0.09 0.00 0.00 57.88 57.85 2qjm h LEU 93 Cb 0.04 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 2qjm h LEU 93 CO -0.02 0.91 -0.43 -0.50 0.09 0.00 0.00 178.44 178.49 2qjm h TRP 94 N 1.24 0.29 -0.32 1.13 4.06 -1.06 -1.39 115.95 119.90 2qjm h TRP 94 Ca 0.31 -0.08 -0.02 0.00 2.06 0.00 0.00 58.89 61.16 2qjm h TRP 94 Cb 0.06 -0.06 -0.01 0.00 -1.00 0.00 0.00 29.16 28.15 2qjm h TRP 94 CO 0.01 0.64 0.14 0.22 -3.56 0.00 0.00 178.44 175.89 2qjm h ASP 95 N 0.20 0.44 -0.08 -3.49 3.58 -0.57 -0.05 116.42 116.45 2qjm h ASP 95 Ca 0.02 -0.16 -0.00 0.00 0.42 0.00 0.00 57.03 57.31 2qjm h ASP 95 Cb 0.85 -0.11 -0.00 0.00 1.72 0.00 0.00 39.33 41.79 2qjm h ASP 95 CO 0.07 0.48 0.05 0.40 -2.88 0.00 0.00 179.24 177.35 2qjm h ILE 96 N 0.38 1.08 -0.67 2.25 2.04 -1.03 -1.52 117.51 120.05 2qjm h ILE 96 Ca 0.11 -0.22 -0.02 0.00 1.00 0.00 0.00 64.86 65.72 2qjm h ILE 96 Cb 0.17 1.08 -0.03 0.00 -0.74 0.00 0.00 36.82 37.29 2qjm h ILE 96 CO -0.01 0.07 0.32 0.50 0.00 0.00 0.00 178.15 179.03 2qjm h LYS 97 N 0.05 0.95 -0.38 2.37 3.64 -1.07 0.12 116.57 122.24 2qjm h LYS 97 Ca 0.03 -0.13 -0.10 0.00 -1.27 0.00 0.00 60.65 59.19 2qjm h LYS 97 Cb 0.07 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.70 2qjm h LYS 97 CO -0.00 0.74 -0.13 0.00 -2.27 0.00 0.00 179.45 177.78 2qjm h ALA 98 N 1.40 0.53 0.14 5.00 0.00 -0.84 -1.18 119.26 124.32 2qjm h ALA 98 Ca 0.23 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 2qjm h ALA 98 Cb 0.10 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2qjm h ALA 98 CO -0.03 0.43 -0.07 0.87 0.00 0.00 0.00 179.25 180.46 2qjm h LYS 99 N 0.57 -0.18 -0.17 0.00 1.57 -0.74 0.58 116.57 118.19 2qjm h LYS 99 Ca 0.09 0.01 0.05 0.00 -1.87 0.00 0.00 60.65 58.94 2qjm h LYS 99 Cb 0.67 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.01 2qjm h LYS 99 CO 0.05 -0.08 0.14 0.52 -0.57 0.00 0.00 179.45 179.51 2qjm h MET 100 N -0.24 0.00 0.00 3.15 2.86 -0.72 0.25 114.93 120.24 2qjm h MET 100 Ca -0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2qjm h MET 100 Cb 0.19 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.85 2qjm h MET 100 CO 0.03 0.00 -0.25 0.00 1.06 0.00 0.00 176.91 177.75 2qjm h ALA 101 N 1.88 0.86 -0.85 6.32 0.00 -0.40 -3.48 119.26 123.59 2qjm h ALA 101 Ca 0.08 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.87 2qjm h ALA 101 Cb 0.37 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2qjm h ALA 101 CO -0.00 0.00 -0.15 0.41 0.00 0.00 0.00 179.25 179.50 2qjm n GLY 102 N 1.18 0.14 3.14 0.00 0.00 0.89 -5.04 105.19 105.50 2qjm n GLY 102 Ca 0.03 -0.64 -0.08 0.00 0.00 0.00 0.00 46.02 45.34 2qjm n GLY 102 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2qjm s MET 103 N -4.26 0.71 0.42 1.61 0.00 -0.88 -4.85 119.30 112.06 2qjm s MET 103 Ca 0.00 -1.04 -0.25 0.00 0.00 0.00 0.00 55.69 54.40 2qjm s MET 103 Cb 0.00 0.27 -0.08 0.00 0.00 0.00 0.00 34.83 35.02 2qjm s MET 103 CO 0.00 -0.18 1.21 -1.25 0.00 0.00 0.00 175.02 174.79 2qjm s PRO 104 N -3.72 3.92 0.30 3.16 0.04 -1.25 -2.11 135.00 135.33 2qjm s PRO 104 Ca 0.05 1.92 0.04 0.00 0.04 0.00 0.00 61.00 63.04 2qjm s PRO 104 Cb 0.05 -2.61 0.78 0.00 0.04 0.00 0.00 34.50 32.76 2qjm s PRO 104 CO -0.10 -0.46 1.62 1.25 0.04 0.00 0.00 177.00 179.35 2qjm h LEU 105 N 2.45 -0.11 -2.09 -3.56 5.85 -1.04 0.27 115.31 117.07 2qjm h LEU 105 Ca -0.49 0.23 0.08 0.00 0.84 0.00 0.00 57.88 58.54 2qjm h LEU 105 Cb 1.24 0.33 -0.01 0.00 0.37 0.00 0.00 40.66 42.59 2qjm h LEU 105 CO 0.62 -0.24 0.34 0.10 -0.34 0.00 0.00 178.44 178.91 2qjm h TYR 106 N 0.13 0.00 -0.30 1.25 -0.00 -1.86 0.54 116.97 116.72 2qjm h TYR 106 Ca 0.59 0.00 -0.13 0.00 0.00 0.00 0.00 58.73 59.19 2qjm h TYR 106 Cb 1.25 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.97 2qjm h TYR 106 CO -0.31 0.00 -0.35 1.96 -0.00 0.00 0.00 178.16 179.46 2qjm h GLN 107 N 0.00 0.68 0.00 0.10 1.08 -1.25 -1.19 115.11 114.54 2qjm h GLN 107 Ca 0.14 -0.33 -0.13 0.00 -1.45 0.00 0.00 58.65 56.88 2qjm h GLN 107 Cb 0.80 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.21 2qjm h GLN 107 CO -0.00 0.93 -0.61 -0.07 -0.95 0.00 0.00 178.83 178.13 2qjm h LEU 108 N 0.57 0.00 -1.40 1.46 4.07 -1.00 -3.04 115.31 115.97 2qjm h LEU 108 Ca 0.06 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.99 2qjm h LEU 108 Cb 0.87 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.61 2qjm h LEU 108 CO 0.08 0.61 -0.11 -0.07 -1.08 0.00 0.00 178.44 177.87 2qjm h LEU 109 N 0.00 0.00 0.00 1.67 3.38 -1.35 -3.45 115.31 115.56 2qjm h LEU 109 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2qjm h LEU 109 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 2qjm h LEU 109 CO 0.08 0.11 0.00 0.61 0.09 0.00 0.00 178.44 179.33 2qjm n GLY 110 N -0.03 -0.89 0.00 0.83 0.00 -1.15 -5.03 105.19 98.93 2qjm n GLY 110 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.88 3.72 -0.02 0.00 -0.46 -4.98 105.19 104.33 2qjm n GLY 111 Ca 0.00 -2.03 -0.42 0.00 0.00 0.00 0.00 46.02 43.57 2qjm n GLY 111 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2qjm s ARG 112 N -1.59 4.56 -0.01 1.61 3.52 -1.26 -4.12 118.95 121.65 2qjm s ARG 112 Ca 0.00 1.61 0.09 0.00 -0.13 0.00 0.00 55.73 57.30 2qjm s ARG 112 Cb 0.00 -3.36 -0.13 0.00 -1.56 0.00 0.00 34.95 29.90 2qjm s ARG 112 CO 0.00 -0.03 0.30 0.43 -0.81 0.00 0.00 175.30 175.19 2qjm n SER 113 N 3.28 1.68 -3.78 -2.12 7.64 0.61 -4.97 113.62 115.95 2qjm n SER 113 Ca 0.05 -0.34 -0.10 0.00 1.01 0.00 0.00 58.87 59.49 2qjm n SER 113 Cb 0.48 1.23 -0.04 0.00 -1.01 0.00 0.00 64.21 64.86 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 -2.29 1.34 0.00 1.43 1.70 -1.21 -5.06 118.95 114.86 2qjm s ARG 114 Ca -0.00 -0.92 0.00 0.00 -0.47 0.00 0.00 55.73 54.34 2qjm s ARG 114 Cb 0.07 0.50 0.00 0.00 -0.57 0.00 0.00 34.95 34.94 2qjm s ARG 114 CO 0.39 -0.56 0.17 -0.25 -1.08 0.00 0.00 175.30 173.97 2qjm n ASP 115 N -0.32 0.00 -4.86 -2.89 9.92 -1.26 -4.97 116.55 112.17 2qjm n ASP 115 Ca -0.09 0.24 -0.21 0.00 -0.53 0.00 0.00 54.79 54.19 2qjm n ASP 115 Cb 0.62 -0.09 -0.03 0.00 -0.64 0.00 0.00 41.12 40.98 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 -0.90 1.94 -0.39 0.44 0.00 -1.26 -4.87 107.32 102.28 2qjm s GLY 116 Ca 0.00 -1.76 -0.09 0.00 0.00 0.00 0.00 44.72 42.87 2qjm s GLY 116 CO 0.00 -1.64 0.21 -0.42 0.00 0.00 0.00 173.10 171.25 2qjm s ILE 117 N -2.38 4.20 0.25 0.90 -1.09 0.59 -4.92 121.20 118.76 2qjm s ILE 117 Ca 0.44 -1.20 -0.30 0.00 -2.23 0.00 0.00 60.65 57.35 2qjm s ILE 117 Cb -0.05 -3.47 -0.11 0.00 -1.58 0.00 0.00 42.46 37.26 2qjm s ILE 117 CO 0.27 -0.36 1.52 -0.32 -1.23 0.00 0.00 174.94 174.82 2qjm s MET 118 N 1.45 4.21 0.49 2.79 -2.45 -1.26 -0.78 119.30 123.74 2qjm s MET 118 Ca 0.02 2.41 0.01 0.00 -1.25 0.00 0.00 55.69 56.88 2qjm s MET 118 Cb -0.21 -3.08 -0.00 0.00 1.25 0.00 0.00 34.83 32.78 2qjm s MET 118 CO 0.03 -0.53 0.04 1.33 1.05 0.00 0.00 175.02 176.94 2qjm n VAL 119 N 2.56 0.00 -4.04 10.11 0.24 -1.10 -1.35 118.33 124.75 2qjm n VAL 119 Ca 0.08 -2.41 -0.12 0.00 -2.04 0.00 0.00 64.34 59.85 2qjm n VAL 119 Cb 0.39 0.58 -0.12 0.00 -1.47 0.00 0.00 33.84 33.22 2qjm n VAL 119 CO 0.00 0.00 0.00 -0.72 -2.14 0.00 0.00 176.83 173.97 2qjm s TYR 120 N -2.91 0.48 0.54 6.34 -0.85 -1.15 -4.08 117.35 115.71 2qjm s TYR 120 Ca 0.06 -0.41 0.05 0.00 -0.52 0.00 0.00 57.07 56.25 2qjm s TYR 120 Cb 0.00 -0.30 0.05 0.00 0.38 0.00 0.00 41.96 42.09 2qjm s TYR 120 CO 0.04 -0.09 0.74 0.20 -1.52 0.00 0.00 175.55 174.92 2qjm s GLY 121 N -1.21 1.84 -0.42 5.49 0.00 -0.63 -3.39 107.32 108.99 2qjm s GLY 121 Ca -0.09 -1.66 -0.01 0.00 0.00 0.00 0.00 44.72 42.96 2qjm s GLY 121 CO -0.00 -1.33 0.20 0.30 0.00 0.00 0.00 173.10 172.27 2qjm s HIS 122 N -2.66 3.59 -0.27 1.90 0.09 -1.26 -0.25 115.29 116.42 2qjm s HIS 122 Ca 0.59 -2.59 -0.15 0.00 -0.00 0.00 0.00 55.06 52.90 2qjm s HIS 122 Cb -0.09 -3.15 -0.03 0.00 -0.00 0.00 0.00 32.58 29.31 2qjm s HIS 122 CO 0.38 -0.95 0.38 0.00 -0.00 0.00 0.00 174.74 174.55 2qjm s ALA 123 N 0.90 3.56 0.22 -1.40 0.00 -0.07 -4.99 121.76 119.99 2qjm s ALA 123 Ca 0.10 -0.83 0.11 0.00 0.00 0.00 0.00 51.96 51.34 2qjm s ALA 123 Cb -0.22 -2.73 -0.05 0.00 0.00 0.00 0.00 23.12 20.12 2qjm s ALA 123 CO -0.05 -0.69 -0.17 -0.80 0.00 0.00 0.00 175.76 174.05 2qjm s ASN 124 N 1.64 3.77 -0.07 0.00 0.01 -1.26 -1.58 114.94 117.45 2qjm s ASN 124 Ca 0.15 -0.83 -0.30 0.00 -0.71 0.00 0.00 52.86 51.17 2qjm s ASN 124 Cb -0.16 -0.43 0.09 0.00 0.41 0.00 0.00 41.25 41.16 2qjm s ASN 124 CO 0.10 0.08 0.76 -0.83 -1.51 0.00 0.00 177.10 175.70 2qjm s GLY 125 N -3.06 -0.50 0.50 0.66 0.00 -0.97 -4.45 107.32 99.50 2qjm s GLY 125 Ca 0.25 1.46 0.29 0.00 0.00 0.00 0.00 44.72 46.72 2qjm s GLY 125 CO 0.14 0.93 1.82 1.48 0.00 0.00 0.00 173.10 177.46 2qjm h SER 126 N 2.83 0.00 -5.28 1.64 4.64 -1.89 0.23 113.55 115.72 2qjm h SER 126 Ca -0.25 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 60.95 2qjm h SER 126 Cb 1.15 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.18 2qjm h SER 126 CO 0.37 0.00 -0.06 1.51 -0.87 0.00 0.00 176.83 177.79 2qjm s ASP 127 N -5.93 0.25 0.13 4.97 1.47 -1.26 -3.29 116.67 113.02 2qjm s ASP 127 Ca 0.04 -1.14 -0.25 0.00 1.18 0.00 0.00 52.55 52.38 2qjm s ASP 127 Cb 0.07 0.67 -0.02 0.00 -0.34 0.00 0.00 42.92 43.30 2qjm s ASP 127 CO 0.60 -1.30 1.63 0.40 0.68 0.00 0.00 175.17 177.18 2qjm h ILE 128 N 2.15 0.39 -0.40 2.11 2.04 -1.89 0.16 117.51 122.07 2qjm h ILE 128 Ca -0.28 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.67 2qjm h ILE 128 Cb 1.25 0.39 -0.09 0.00 -0.74 0.00 0.00 36.82 37.63 2qjm h ILE 128 CO 0.37 0.00 -0.19 0.00 0.00 0.00 0.00 178.15 178.32 2qjm h ALA 129 N 0.55 0.10 -0.70 1.87 0.00 -1.99 0.48 119.26 119.58 2qjm h ALA 129 Ca 0.09 0.14 -0.06 0.00 0.00 0.00 0.00 54.91 55.09 2qjm h ALA 129 Cb 0.48 0.47 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 2qjm h ALA 129 CO -0.30 -0.56 0.21 1.49 0.00 0.00 0.00 179.25 180.09 2qjm h GLU 130 N -0.12 1.09 -0.31 0.00 4.81 -1.87 -2.07 114.58 116.12 2qjm h GLU 130 Ca 0.20 -0.24 -0.12 0.00 -0.13 0.00 0.00 59.36 59.07 2qjm h GLU 130 Cb 0.42 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 2qjm h GLU 130 CO -0.48 0.94 -0.30 1.15 -0.73 0.00 0.00 179.01 179.60 2qjm h THR 131 N 1.05 1.28 -0.60 0.32 2.02 0.57 -1.91 112.91 115.63 2qjm h THR 131 Ca 0.23 -1.41 -0.08 0.00 0.77 0.00 0.00 66.41 65.92 2qjm h THR 131 Cb 0.31 1.36 -0.02 0.00 -1.74 0.00 0.00 68.15 68.06 2qjm h THR 131 CO -0.01 0.46 0.05 0.58 0.37 0.00 0.00 175.52 176.97 2qjm h VAL 132 N 0.55 1.26 -0.51 3.16 2.07 0.20 -1.09 116.25 121.90 2qjm h VAL 132 Ca 0.07 -1.07 -0.05 0.00 0.82 0.00 0.00 66.70 66.46 2qjm h VAL 132 Cb 0.79 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 2qjm h VAL 132 CO 0.06 0.39 0.10 -0.33 0.02 0.00 0.00 177.57 177.82 2qjm h GLU 133 N 0.94 0.82 -0.84 1.57 4.39 -1.17 -2.24 114.58 118.05 2qjm h GLU 133 Ca 0.18 -0.21 -0.02 0.00 0.34 0.00 0.00 59.36 59.65 2qjm h GLU 133 Cb 0.48 -0.10 -0.04 0.00 -0.10 0.00 0.00 28.75 28.99 2qjm h GLU 133 CO 0.02 0.81 0.45 0.00 -1.16 0.00 0.00 179.01 179.13 2qjm h ALA 134 N 0.98 1.07 -0.65 3.43 0.00 -1.03 -0.83 119.26 122.24 2qjm h ALA 134 Ca 0.16 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 2qjm h ALA 134 Cb 0.37 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2qjm h ALA 134 CO 0.01 0.59 0.25 0.28 0.00 0.00 0.00 179.25 180.38 2qjm h VAL 135 N 1.17 1.23 -0.72 0.00 2.07 -1.01 -1.86 116.25 117.13 2qjm h VAL 135 Ca 0.29 -0.72 -0.01 0.00 0.82 0.00 0.00 66.70 67.08 2qjm h VAL 135 Cb 0.04 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 30.24 2qjm h VAL 135 CO -0.05 0.29 0.39 1.23 0.02 0.00 0.00 177.57 179.45 2qjm h GLY 136 N 1.03 1.07 0.91 2.17 0.00 -0.67 -1.30 103.07 106.28 2qjm h GLY 136 Ca 0.22 -0.49 0.02 0.00 0.00 0.00 0.00 47.33 47.08 2qjm h GLY 136 CO -0.02 0.47 0.30 0.45 0.00 0.00 0.00 176.54 177.74 2qjm h HIS 137 N 0.99 0.57 -0.37 5.60 3.86 -0.42 -0.81 115.15 124.56 2qjm h HIS 137 Ca 0.25 0.02 -0.08 0.00 -1.16 0.00 0.00 60.37 59.40 2qjm h HIS 137 Cb 0.04 -0.19 -0.02 0.00 1.06 0.00 0.00 27.41 28.30 2qjm h HIS 137 CO -0.00 0.34 -0.08 1.88 0.86 0.00 0.00 177.93 180.92 2qjm h TYR 138 N 0.61 0.67 -0.65 2.45 0.05 -1.01 -0.34 116.97 118.75 2qjm h TYR 138 Ca 0.19 -0.10 -0.07 0.00 0.05 0.00 0.00 58.73 58.81 2qjm h TYR 138 Cb -0.01 -0.18 -0.03 0.00 1.01 0.00 0.00 36.73 37.52 2qjm h TYR 138 CO -0.06 0.69 0.15 0.82 -1.05 0.00 0.00 178.16 178.71 2qjm h ILE 139 N 0.58 1.25 0.00 -2.88 2.04 -0.78 -1.57 117.51 116.15 2qjm h ILE 139 Ca 0.11 -0.94 0.00 0.00 1.00 0.00 0.00 64.86 65.03 2qjm h ILE 139 Cb 0.49 0.59 0.00 0.00 -0.74 0.00 0.00 36.82 37.16 2qjm h ILE 139 CO 0.03 0.36 0.00 0.44 0.00 0.00 0.00 178.15 178.97 2qjm h ASP 140 N 0.99 0.00 -0.17 1.72 3.32 -0.34 -2.45 116.42 119.49 2qjm h ASP 140 Ca 0.21 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.26 2qjm h ASP 140 Cb 0.36 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.91 2qjm h ASP 140 CO 0.00 0.00 0.00 0.23 -1.72 0.00 0.00 179.24 177.75 2qjm n MET 141 N -2.90 1.62 -0.37 3.56 2.81 -0.21 -4.91 117.12 116.71 2qjm n MET 141 Ca 0.02 -0.94 0.00 0.00 -1.81 0.00 0.00 57.70 54.96 2qjm n MET 141 Cb 0.33 -1.34 0.00 0.00 -0.71 0.00 0.00 33.22 31.50 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 1.05 0.75 3.72 3.03 0.00 -0.92 -4.63 105.19 108.19 2qjm n GLY 142 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.36 3.61 -0.26 1.61 1.51 -0.86 -2.12 117.35 118.46 2qjm s TYR 143 Ca 0.00 1.58 0.21 0.00 -1.01 0.00 0.00 57.07 57.85 2qjm s TYR 143 Cb 0.00 -3.24 0.07 0.00 -0.11 0.00 0.00 41.96 38.68 2qjm s TYR 143 CO 0.00 -0.51 1.19 0.87 -1.11 0.00 0.00 175.55 175.99 2qjm h LYS 144 N 6.01 0.00 -4.91 -0.62 1.57 -1.82 -3.41 116.57 113.38 2qjm h LYS 144 Ca -0.43 0.00 -0.45 0.00 -1.87 0.00 0.00 60.65 57.90 2qjm h LYS 144 Cb 1.21 0.00 -0.30 0.00 0.08 0.00 0.00 32.23 33.22 2qjm h LYS 144 CO 0.75 0.09 -0.80 0.00 -0.57 0.00 0.00 179.45 178.92 2qjm s ALA 145 N -3.22 1.01 -0.02 3.86 0.00 -1.26 -1.70 121.76 120.42 2qjm s ALA 145 Ca 0.01 -0.47 0.00 0.00 0.00 0.00 0.00 51.96 51.51 2qjm s ALA 145 Cb 0.08 -0.31 0.02 0.00 0.00 0.00 0.00 23.12 22.91 2qjm s ALA 145 CO 0.76 0.21 -0.00 0.42 0.00 0.00 0.00 175.76 177.14 2qjm s ILE 146 N -0.06 0.17 -0.14 0.00 1.09 0.36 -1.61 121.20 121.00 2qjm s ILE 146 Ca 0.01 0.05 -0.18 0.00 -1.10 0.00 0.00 60.65 59.43 2qjm s ILE 146 Cb -0.07 -0.24 -0.04 0.00 -1.06 0.00 0.00 42.46 41.05 2qjm s ILE 146 CO 0.00 0.12 0.48 -0.60 -0.10 0.00 0.00 174.94 174.85 2qjm s ARG 147 N 0.80 4.30 -0.23 2.79 3.52 0.65 -1.10 118.95 129.68 2qjm s ARG 147 Ca -0.08 0.43 -0.03 0.00 -0.13 0.00 0.00 55.73 55.92 2qjm s ARG 147 Cb -0.11 -3.47 0.00 0.00 -1.56 0.00 0.00 34.95 29.82 2qjm s ARG 147 CO -0.01 0.09 -0.06 0.00 -0.81 0.00 0.00 175.30 174.50 2qjm s ALA 148 N 0.86 2.75 -0.07 6.12 0.00 0.06 -0.89 121.76 130.60 2qjm s ALA 148 Ca 0.25 -1.25 0.05 0.00 0.00 0.00 0.00 51.96 51.01 2qjm s ALA 148 Cb -0.15 -1.67 -0.00 0.00 0.00 0.00 0.00 23.12 21.30 2qjm s ALA 148 CO 0.10 -0.53 -0.22 -0.65 0.00 0.00 0.00 175.76 174.46 2qjm s GLN 149 N 1.43 2.46 0.10 0.00 -1.52 -0.61 -4.68 119.66 116.84 2qjm s GLN 149 Ca 0.04 -0.79 0.08 0.00 -1.95 0.00 0.00 55.36 52.74 2qjm s GLN 149 Cb -0.15 -2.00 -0.03 0.00 -0.22 0.00 0.00 33.01 30.60 2qjm s GLN 149 CO -0.04 0.26 -0.20 -0.08 -0.25 0.00 0.00 175.29 174.97 2qjm s THR 150 N 0.11 1.65 0.54 -0.19 -1.32 -1.26 -2.29 115.64 112.89 2qjm s THR 150 Ca -0.09 -1.55 -0.16 0.00 -1.21 0.00 0.00 61.69 58.67 2qjm s THR 150 Cb -0.15 -1.53 -0.06 0.00 -1.51 0.00 0.00 72.50 69.25 2qjm s THR 150 CO 0.05 -0.10 1.01 -0.83 -2.21 0.00 0.00 174.62 172.54 2qjm s GLY 151 N -1.95 2.10 -0.30 6.08 0.00 0.81 -4.95 107.32 109.11 2qjm s GLY 151 Ca 0.06 0.26 -0.04 0.00 0.00 0.00 0.00 44.72 45.00 2qjm s GLY 151 CO 0.04 0.55 0.04 0.14 0.00 0.00 0.00 173.10 173.87 2qjm s VAL 152 N -2.55 3.47 0.12 1.40 1.01 -1.26 -4.27 120.40 118.32 2qjm s VAL 152 Ca 0.61 -1.02 -0.31 0.00 0.00 0.00 0.00 61.98 61.26 2qjm s VAL 152 Cb -0.12 -2.87 -0.10 0.00 0.00 0.00 0.00 36.38 33.29 2qjm s VAL 152 CO 0.33 0.01 1.73 -2.16 0.00 0.00 0.00 175.10 175.00 2qjm s PRO 153 N 1.39 4.16 0.00 2.72 0.04 -1.26 -1.58 135.00 140.47 2qjm s PRO 153 Ca -0.01 2.48 0.00 0.00 0.04 0.00 0.00 61.00 63.52 2qjm s PRO 153 Cb -0.18 -3.48 0.00 0.00 0.04 0.00 0.00 34.50 30.88 2qjm s PRO 153 CO 0.00 -0.77 0.00 0.41 0.04 0.00 0.00 177.00 176.68 2qjm n GLY 154 N 4.07 1.22 0.00 0.56 0.00 -1.26 -5.06 105.19 104.72 2qjm n GLY 154 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 -0.07 0.00 -3.97 -0.61 5.41 -0.61 -5.06 119.36 114.45 2qjm n ILE 155 Ca 0.00 0.00 -0.37 0.00 1.00 0.00 0.00 62.75 63.38 2qjm n ILE 155 Cb 0.00 0.00 -0.07 0.00 -0.71 0.00 0.00 39.64 38.86 2qjm n ILE 155 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 2qjm s SER 174 N -1.00 6.16 0.13 4.38 0.15 -1.26 -4.93 113.70 117.33 2qjm s SER 174 Ca 0.00 0.40 0.00 0.00 0.70 0.00 0.00 55.95 57.05 2qjm s SER 174 Cb 0.00 -1.96 -0.04 0.00 -1.71 0.00 0.00 66.02 62.31 2qjm s SER 174 CO 0.00 0.39 0.01 -0.76 1.20 0.00 0.00 173.24 174.08 2qjm s LEU 175 N -0.95 2.09 0.18 3.45 1.43 -1.26 -4.74 118.68 118.89 2qjm s LEU 175 Ca 0.14 -1.14 -0.32 0.00 -1.03 0.00 0.00 54.13 51.79 2qjm s LEU 175 Cb -0.12 0.12 -0.11 0.00 0.03 0.00 0.00 46.19 46.12 2qjm s LEU 175 CO 0.03 -0.62 1.65 -2.16 0.23 0.00 0.00 176.35 175.48 2qjm s PRO 176 N -3.96 4.17 0.40 1.29 0.04 -1.26 -4.74 135.00 130.93 2qjm s PRO 176 Ca 0.20 2.49 -0.23 0.00 0.04 0.00 0.00 61.00 63.50 2qjm s PRO 176 Cb 0.07 -3.13 -0.10 0.00 0.04 0.00 0.00 34.50 31.38 2qjm s PRO 176 CO -0.00 -0.69 0.97 -1.12 0.04 0.00 0.00 177.00 176.20 2qjm s SER 177 N 1.21 6.98 -0.29 6.66 0.01 -1.26 -4.81 113.70 122.20 2qjm s SER 177 Ca 0.73 1.82 -0.10 0.00 1.31 0.00 0.00 55.95 59.70 2qjm s SER 177 Cb -0.47 -2.56 -0.02 0.00 0.21 0.00 0.00 66.02 63.18 2qjm s SER 177 CO 0.32 -0.33 0.16 -0.69 0.41 0.00 0.00 173.24 173.11 2qjm s VAL 178 N -1.89 4.85 -0.02 3.43 1.01 -1.26 -0.98 120.40 125.54 2qjm s VAL 178 Ca 0.58 -0.17 -0.00 0.00 0.00 0.00 0.00 61.98 62.38 2qjm s VAL 178 Cb -0.15 -3.39 -0.04 0.00 0.00 0.00 0.00 36.38 32.80 2qjm s VAL 178 CO 0.19 0.16 0.04 0.42 0.00 0.00 0.00 175.10 175.92 2qjm s THR 179 N 1.67 4.48 0.45 3.92 -4.23 -0.25 -4.99 115.64 116.69 2qjm s THR 179 Ca 0.06 -0.44 -0.03 0.00 -1.18 0.00 0.00 61.69 60.10 2qjm s THR 179 Cb -0.16 -3.01 -0.03 0.00 1.34 0.00 0.00 72.50 70.64 2qjm s THR 179 CO 0.08 0.40 0.71 -0.83 -0.54 0.00 0.00 174.62 174.44 2qjm s GLY 180 N -1.54 1.47 -0.11 3.99 0.00 -1.26 -1.81 107.32 108.06 2qjm s GLY 180 Ca 0.20 -0.73 -0.17 0.00 0.00 0.00 0.00 44.72 44.02 2qjm s GLY 180 CO 0.11 -0.59 0.43 0.86 0.00 0.00 0.00 173.10 173.91 2qjm s TRP 181 N -2.61 -0.42 -0.21 1.90 -0.11 -0.91 -4.86 118.94 111.72 2qjm s TRP 181 Ca 0.46 0.93 -0.04 0.00 1.22 0.00 0.00 56.10 58.67 2qjm s TRP 181 Cb -0.10 0.17 0.11 0.00 -1.50 0.00 0.00 33.47 32.15 2qjm s TRP 181 CO 0.41 -0.32 0.32 0.34 -4.62 0.00 0.00 176.95 173.08 2qjm s ASP 182 N -0.35 0.55 0.10 5.86 2.15 -1.26 -3.34 116.67 120.37 2qjm s ASP 182 Ca -0.05 0.22 -0.20 0.00 0.43 0.00 0.00 52.55 52.96 2qjm s ASP 182 Cb -0.03 0.86 -0.08 0.00 -0.30 0.00 0.00 42.92 43.36 2qjm s ASP 182 CO 0.03 -0.29 1.64 0.74 -0.17 0.00 0.00 175.17 177.12 2qjm h THR 183 N 6.24 1.16 -0.59 1.71 2.02 -1.99 -2.70 112.91 118.75 2qjm h THR 183 Ca -0.18 -0.46 0.06 0.00 0.77 0.00 0.00 66.41 66.60 2qjm h THR 183 Cb 1.14 1.08 -0.06 0.00 -1.74 0.00 0.00 68.15 68.58 2qjm h THR 183 CO 0.24 0.15 0.29 -0.09 0.37 0.00 0.00 175.52 176.48 2qjm h ARG 184 N 0.19 0.52 -0.80 6.66 9.65 -1.98 0.18 114.38 128.80 2qjm h ARG 184 Ca 0.07 -0.03 0.01 0.00 -1.10 0.00 0.00 59.98 58.93 2qjm h ARG 184 Cb 0.16 -0.12 -0.04 0.00 -1.39 0.00 0.00 29.97 28.58 2qjm h ARG 184 CO -0.01 0.34 0.53 0.87 2.80 0.00 0.00 179.97 184.50 2qjm h LYS 185 N 0.54 1.05 -0.44 0.20 1.57 -1.97 -1.30 116.57 116.22 2qjm h LYS 185 Ca 0.27 -0.06 -0.13 0.00 -1.87 0.00 0.00 60.65 58.86 2qjm h LYS 185 Cb 0.22 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 2qjm h LYS 185 CO -0.21 0.69 -0.25 0.00 -0.57 0.00 0.00 179.45 179.12 2qjm h ALA 186 N 1.29 0.73 -0.24 3.86 0.00 -1.01 -1.71 119.26 122.18 2qjm h ALA 186 Ca 0.29 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 2qjm h ALA 186 Cb -0.12 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 2qjm h ALA 186 CO -0.06 0.66 0.04 -0.07 0.00 0.00 0.00 179.25 179.82 2qjm h LEU 187 N 0.78 0.32 0.00 0.00 3.38 -0.18 0.80 115.31 120.41 2qjm h LEU 187 Ca 0.10 -0.04 -0.15 0.00 0.09 0.00 0.00 57.88 57.88 2qjm h LEU 187 Cb 0.81 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.46 2qjm h LEU 187 CO 0.07 0.35 -0.76 0.78 0.09 0.00 0.00 178.44 178.96 2qjm h ASN 188 N 0.35 0.00 0.00 -0.43 2.35 -1.01 -3.40 115.58 113.45 2qjm h ASN 188 Ca 0.08 0.00 -0.24 0.00 -0.55 0.00 0.00 56.30 55.60 2qjm h ASN 188 Cb 0.18 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.51 2qjm h ASN 188 CO -0.00 0.71 -1.40 0.00 -1.65 0.00 0.00 177.43 175.10 2qjm n TYR 189 N -3.26 0.77 -0.25 1.19 9.36 -0.66 -4.45 117.16 119.86 2qjm n TYR 189 Ca 0.00 0.33 0.05 0.00 3.32 0.00 0.00 57.90 61.60 2qjm n TYR 189 Cb 0.83 -1.01 0.16 0.00 -0.63 0.00 0.00 39.34 38.69 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 0.42 -0.43 2.97 2.07 -1.08 -0.31 116.25 118.89 2qjm h VAL 190 Ca -0.36 -0.06 0.02 0.00 0.82 0.00 0.00 66.70 67.12 2qjm h VAL 190 Cb 1.24 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 31.23 2qjm h VAL 190 CO -0.22 0.03 0.29 -0.65 0.02 0.00 0.00 177.57 177.04 2qjm h PRO 191 N 0.16 0.52 -0.12 1.57 0.11 -1.79 -1.02 132.00 131.43 2qjm h PRO 191 Ca 0.40 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 66.40 2qjm h PRO 191 Cb 0.71 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.69 2qjm h PRO 191 CO -0.59 0.34 -0.28 0.87 -0.21 0.00 0.00 178.00 178.13 2qjm h LYS 192 N 0.53 0.22 0.17 1.05 1.57 -1.28 -2.20 116.57 116.64 2qjm h LYS 192 Ca 0.17 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.86 2qjm h LYS 192 Cb 0.01 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2qjm h LYS 192 CO -0.04 0.50 -0.08 1.25 -0.57 0.00 0.00 179.45 180.50 2qjm h LEU 193 N 0.20 -0.20 -1.13 2.94 5.85 -0.83 -2.02 115.31 120.11 2qjm h LEU 193 Ca 0.03 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.71 2qjm h LEU 193 Cb 0.61 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.69 2qjm h LEU 193 CO 0.04 -0.14 -0.19 -0.26 -0.34 0.00 0.00 178.44 177.56 2qjm h PHE 194 N -0.24 0.00 -0.13 1.25 0.04 -1.41 -1.08 116.94 115.37 2qjm h PHE 194 Ca -0.02 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.69 2qjm h PHE 194 Cb 0.18 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.33 2qjm h PHE 194 CO -0.07 0.19 -0.13 1.49 -0.60 0.00 0.00 178.31 179.19 2qjm h GLU 195 N 0.00 0.32 -0.73 1.51 4.81 -1.23 -1.92 114.58 117.34 2qjm h GLU 195 Ca -0.00 -0.17 -0.06 0.00 -0.13 0.00 0.00 59.36 59.00 2qjm h GLU 195 Cb 0.72 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.07 2qjm h GLU 195 CO 0.02 0.71 0.23 0.93 -0.73 0.00 0.00 179.01 180.17 2qjm h GLU 196 N -0.06 1.13 -0.77 1.92 4.39 -1.11 -0.20 114.58 119.89 2qjm h GLU 196 Ca 0.02 -0.24 -0.00 0.00 0.34 0.00 0.00 59.36 59.48 2qjm h GLU 196 Cb 0.65 -0.16 -0.04 0.00 -0.10 0.00 0.00 28.75 29.10 2qjm h GLU 196 CO 0.03 0.96 0.47 -0.07 -1.16 0.00 0.00 179.01 179.24 2qjm h LEU 197 N 1.08 0.92 -0.42 1.33 3.38 -1.14 0.10 115.31 120.57 2qjm h LEU 197 Ca 0.24 -0.06 -0.18 0.00 0.09 0.00 0.00 57.88 57.97 2qjm h LEU 197 Cb 0.30 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 2qjm h LEU 197 CO -0.01 0.71 -0.68 0.03 0.09 0.00 0.00 178.44 178.58 2qjm h ARG 198 N 1.05 0.49 -0.65 1.13 2.47 -1.02 0.99 114.38 118.84 2qjm h ARG 198 Ca 0.28 -0.37 -0.04 0.00 -1.26 0.00 0.00 59.98 58.59 2qjm h ARG 198 Cb -0.05 0.07 -0.03 0.00 -1.65 0.00 0.00 29.97 28.31 2qjm h ARG 198 CO -0.05 1.00 0.26 0.87 0.56 0.00 0.00 179.97 182.60 2qjm h LYS 199 N 0.35 0.95 0.12 0.04 1.57 -0.63 -0.67 116.57 118.31 2qjm h LYS 199 Ca -0.02 -0.16 -0.21 0.00 -1.87 0.00 0.00 60.65 58.40 2qjm h LYS 199 Cb 1.25 -0.16 0.01 0.00 0.08 0.00 0.00 32.23 33.40 2qjm h LYS 199 CO 0.12 0.78 -0.98 1.15 -0.57 0.00 0.00 179.45 179.95 2qjm h THR 200 N 0.94 1.35 -0.01 -0.16 2.02 -0.81 -3.40 112.91 112.84 2qjm h THR 200 Ca 0.22 -2.47 0.00 0.00 0.77 0.00 0.00 66.41 64.93 2qjm h THR 200 Cb 0.18 3.02 0.00 0.00 -1.74 0.00 0.00 68.15 69.61 2qjm h THR 200 CO -0.02 0.69 -0.23 -1.22 0.37 0.00 0.00 175.52 175.11 2qjm n TYR 201 N -4.10 0.00 -4.05 3.16 4.01 0.33 -5.10 117.16 111.42 2qjm n TYR 201 Ca -0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.56 2qjm n TYR 201 Cb 0.82 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.85 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 0.95 -1.90 1.26 2.72 0.00 -0.26 -4.48 105.19 103.50 2qjm n GLY 202 Ca 0.05 -1.38 0.09 0.00 0.00 0.00 0.00 46.02 44.78 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 -0.08 1.12 0.10 1.61 3.72 -1.26 -4.58 117.46 118.08 2qjm n PHE 203 Ca 0.00 -0.60 -0.05 0.00 -0.05 0.00 0.00 57.45 56.75 2qjm n PHE 203 Cb 0.00 -0.16 0.11 0.00 -0.94 0.00 0.00 39.48 38.49 2qjm n PHE 203 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 2qjm h ASP 204 N 3.41 0.18 -3.15 4.37 3.32 -2.00 -3.45 116.42 119.10 2qjm h ASP 204 Ca 0.00 -0.11 -0.58 0.00 0.02 0.00 0.00 57.03 56.35 2qjm h ASP 204 Cb 1.22 -0.05 -0.04 0.00 0.22 0.00 0.00 39.33 40.68 2qjm h ASP 204 CO 0.14 0.79 -0.31 -1.00 -1.72 0.00 0.00 179.24 177.14 2qjm s HIS 205 N -3.61 3.49 -0.17 4.55 3.76 -1.26 -5.06 115.29 116.99 2qjm s HIS 205 Ca -0.03 0.58 -0.29 0.00 -0.15 0.00 0.00 55.06 55.17 2qjm s HIS 205 Cb 0.12 -2.02 -0.00 0.00 1.11 0.00 0.00 32.58 31.78 2qjm s HIS 205 CO 0.79 0.45 1.07 -1.01 -0.85 0.00 0.00 174.74 175.19 2qjm s HIS 206 N -1.62 3.32 -0.12 1.40 3.76 -0.69 -4.98 115.29 116.35 2qjm s HIS 206 Ca 0.40 1.43 -0.02 0.00 -0.15 0.00 0.00 55.06 56.72 2qjm s HIS 206 Cb -0.12 -3.29 -0.03 0.00 1.11 0.00 0.00 32.58 30.25 2qjm s HIS 206 CO 0.23 -0.63 -0.06 -0.51 -0.85 0.00 0.00 174.74 172.92 2qjm s LEU 207 N 2.79 3.12 0.13 0.89 1.43 -1.26 -0.49 118.68 125.30 2qjm s LEU 207 Ca 0.48 -0.14 0.09 0.00 -1.03 0.00 0.00 54.13 53.53 2qjm s LEU 207 Cb -0.18 -1.72 -0.04 0.00 0.03 0.00 0.00 46.19 44.28 2qjm s LEU 207 CO 0.12 0.22 -0.21 -0.76 0.23 0.00 0.00 176.35 175.96 2qjm s LEU 208 N 0.02 2.36 -0.00 1.79 1.02 -0.26 0.79 118.68 124.40 2qjm s LEU 208 Ca -0.01 -0.77 0.01 0.00 0.02 0.00 0.00 54.13 53.38 2qjm s LEU 208 Cb -0.14 -0.91 -0.00 0.00 0.02 0.00 0.00 46.19 45.16 2qjm s LEU 208 CO 0.03 0.04 -0.02 -2.28 0.02 0.00 0.00 176.35 174.14 2qjm s HIS 209 N -1.50 0.16 -0.34 0.29 2.46 -1.00 -0.76 115.29 114.60 2qjm s HIS 209 Ca 0.11 -0.03 -0.07 0.00 0.47 0.00 0.00 55.06 55.54 2qjm s HIS 209 Cb -0.08 -0.10 0.04 0.00 -0.13 0.00 0.00 32.58 32.30 2qjm s HIS 209 CO 0.06 -0.00 0.12 0.34 -2.47 0.00 0.00 174.74 172.78 2qjm s ASP 210 N -0.05 5.37 0.47 9.88 -1.08 -1.26 -0.44 116.67 129.55 2qjm s ASP 210 Ca 0.01 -1.11 0.30 0.00 -0.52 0.00 0.00 52.55 51.23 2qjm s ASP 210 Cb -0.01 -1.89 1.15 0.00 -1.46 0.00 0.00 42.92 40.71 2qjm s ASP 210 CO -0.00 -0.33 1.88 1.23 0.52 0.00 0.00 175.17 178.47 2qjm h GLY 211 N 8.25 0.00 -6.45 2.66 0.00 -0.72 -3.47 103.07 103.34 2qjm h GLY 211 Ca -0.24 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 46.60 2qjm h GLY 211 CO 0.61 0.00 -0.88 1.57 0.00 0.00 0.00 176.54 177.84 2qjm n HIS 212 N -2.90 -1.67 -0.94 5.60 -0.00 -1.16 -2.30 115.22 111.84 2qjm n HIS 212 Ca 0.01 0.75 -0.01 0.00 0.46 0.00 0.00 57.72 58.93 2qjm n HIS 212 Cb 0.32 -3.81 -0.01 0.00 -0.12 0.00 0.00 29.99 26.38 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 -4.38 -0.01 0.34 1.57 8.25 0.11 -4.66 115.22 116.44 2qjm n HIS 213 Ca -0.31 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.29 2qjm n HIS 213 Cb 0.69 -1.94 0.46 0.00 1.12 0.00 0.00 29.99 30.32 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 -6.27 -0.41 2.47 -1.59 -3.39 114.38 105.18 2qjm h ARG 214 Ca -0.03 0.00 -0.57 0.00 -1.26 0.00 0.00 59.98 58.12 2qjm h ARG 214 Cb 0.91 0.00 -0.10 0.00 -1.65 0.00 0.00 29.97 29.13 2qjm h ARG 214 CO 0.04 0.00 -0.63 0.71 0.56 0.00 0.00 179.97 180.65 2qjm s TYR 215 N -3.38 2.84 0.65 3.04 2.02 -1.01 -4.94 117.35 116.57 2qjm s TYR 215 Ca 0.05 -0.16 -0.06 0.00 -0.37 0.00 0.00 57.07 56.53 2qjm s TYR 215 Cb 0.08 -1.32 0.04 0.00 -0.40 0.00 0.00 41.96 40.36 2qjm s TYR 215 CO 0.56 0.55 0.96 0.95 -1.57 0.00 0.00 175.55 177.00 2qjm s THR 216 N -1.98 2.93 0.21 -0.71 -4.23 -1.26 -4.10 115.64 106.49 2qjm s THR 216 Ca 0.30 -0.13 -0.10 0.00 -1.18 0.00 0.00 61.69 60.58 2qjm s THR 216 Cb -0.08 -3.22 0.14 0.00 1.34 0.00 0.00 72.50 70.68 2qjm s THR 216 CO 0.20 -0.23 1.78 -0.65 -0.54 0.00 0.00 174.62 175.18 2qjm h PRO 217 N -0.40 0.54 -0.54 3.99 0.11 -1.93 0.52 132.00 134.28 2qjm h PRO 217 Ca -0.45 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.60 2qjm h PRO 217 Cb 1.29 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 2qjm h PRO 217 CO 0.60 0.36 0.22 0.37 -0.21 0.00 0.00 178.00 179.34 2qjm h GLN 218 N 0.56 0.81 -0.60 1.05 -0.00 -1.94 -0.61 115.11 114.38 2qjm h GLN 218 Ca 0.30 -0.15 -0.06 0.00 -0.00 0.00 0.00 58.65 58.74 2qjm h GLN 218 Cb 0.26 -0.13 -0.03 0.00 0.00 0.00 0.00 27.48 27.58 2qjm h GLN 218 CO -0.23 0.70 0.14 0.93 0.00 0.00 0.00 178.83 180.38 2qjm h GLU 219 N 0.73 0.93 -0.61 1.69 5.08 -1.81 -0.85 114.58 119.74 2qjm h GLU 219 Ca 0.18 -0.20 -0.10 0.00 -1.00 0.00 0.00 59.36 58.24 2qjm h GLU 219 Cb 0.20 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 2qjm h GLU 219 CO -0.02 0.83 -0.00 0.00 -1.00 0.00 0.00 179.01 178.82 2qjm h ALA 220 N 1.27 0.83 -0.55 3.43 0.00 -0.48 0.13 119.26 123.88 2qjm h ALA 220 Ca 0.19 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 2qjm h ALA 220 Cb 0.32 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2qjm h ALA 220 CO -0.00 0.67 0.17 0.00 0.00 0.00 0.00 179.25 180.09 2qjm h ALA 221 N 0.99 0.72 -0.00 0.00 0.00 -0.79 0.35 119.26 120.53 2qjm h ALA 221 Ca 0.17 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2qjm h ALA 221 Cb 0.57 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 2qjm h ALA 221 CO 0.03 0.39 0.00 -0.97 0.00 0.00 0.00 179.25 178.70 2qjm h ASN 222 N 0.77 0.00 0.03 0.00 -1.24 -0.85 -0.96 115.58 113.33 2qjm h ASN 222 Ca 0.18 -0.10 -0.00 0.00 0.71 0.00 0.00 56.30 57.09 2qjm h ASN 222 Cb 0.29 -0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.34 2qjm h ASN 222 CO -0.00 0.10 -0.01 0.25 -1.29 0.00 0.00 177.43 176.47 2qjm h LEU 223 N -0.09 -0.03 -0.71 0.34 5.85 -0.47 -1.32 115.31 118.87 2qjm h LEU 223 Ca 0.00 -0.05 0.10 0.00 0.84 0.00 0.00 57.88 58.76 2qjm h LEU 223 Cb 0.10 0.01 -0.07 0.00 0.37 0.00 0.00 40.66 41.06 2qjm h LEU 223 CO -0.00 0.03 0.35 1.23 -0.34 0.00 0.00 178.44 179.71 2qjm h GLY 224 N -0.09 1.07 1.00 3.75 0.00 -0.22 -0.85 103.07 107.72 2qjm h GLY 224 Ca -0.00 -0.21 -0.02 0.00 0.00 0.00 0.00 47.33 47.09 2qjm h GLY 224 CO 0.01 0.04 0.31 1.70 0.00 0.00 0.00 176.54 178.59 2qjm h LYS 225 N 0.58 0.93 0.00 4.80 3.64 -0.91 -1.85 116.57 123.76 2qjm h LYS 225 Ca 0.35 -0.14 -0.00 0.00 -1.27 0.00 0.00 60.65 59.59 2qjm h LYS 225 Cb 0.39 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 32.05 2qjm h LYS 225 CO -0.28 0.75 -0.02 0.52 -2.27 0.00 0.00 179.45 178.15 2qjm h MET 226 N 0.89 0.00 0.00 1.90 2.86 -0.14 -2.58 114.93 117.86 2qjm h MET 226 Ca 0.22 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.86 2qjm h MET 226 Cb 0.13 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.79 2qjm h MET 226 CO -0.03 0.02 -0.78 1.28 1.06 0.00 0.00 176.91 178.46 2qjm n LEU 227 N -3.14 0.63 -0.34 1.22 4.77 -0.43 -4.42 117.00 115.29 2qjm n LEU 227 Ca -0.00 0.01 0.17 0.00 -0.03 0.00 0.00 56.01 56.15 2qjm n LEU 227 Cb 0.26 -0.15 0.37 0.00 -2.33 0.00 0.00 43.42 41.57 2qjm n LEU 227 CO 0.26 0.06 1.15 -0.33 -1.33 0.00 0.00 177.39 177.20 2qjm h GLU 228 N 0.00 0.55 0.00 3.23 5.08 -0.94 0.10 114.58 122.61 2qjm h GLU 228 Ca 0.00 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2qjm h GLU 228 Cb 0.65 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.77 2qjm h GLU 228 CO 0.00 0.36 0.00 -1.35 -1.00 0.00 0.00 179.01 177.02 2qjm h PRO 229 N 0.57 0.00 -0.59 2.33 0.11 -1.79 -2.83 132.00 129.80 2qjm h PRO 229 Ca 0.63 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.74 2qjm h PRO 229 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2qjm h PRO 229 CO -0.48 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 177.97 2qjm n TYR 230 N -2.84 0.77 -3.79 0.65 4.01 0.02 -5.01 117.16 110.98 2qjm n TYR 230 Ca -0.01 -0.39 -0.28 0.00 -0.16 0.00 0.00 57.90 57.07 2qjm n TYR 230 Cb 0.17 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.21 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 1.56 -1.25 -2.16 -0.72 1.13 -1.07 -4.92 117.38 109.95 2qjm n GLN 231 Ca 0.22 0.66 -0.33 0.00 -1.94 0.00 0.00 57.00 55.61 2qjm n GLN 231 Cb 0.61 -2.66 -0.00 0.00 0.11 0.00 0.00 30.24 28.29 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 -5.47 3.56 0.17 1.08 1.02 -1.26 -4.64 118.68 113.14 2qjm s LEU 232 Ca 0.12 1.79 -0.08 0.00 0.02 0.00 0.00 54.13 55.98 2qjm s LEU 232 Cb -0.06 -4.53 0.04 0.00 0.02 0.00 0.00 46.19 41.66 2qjm s LEU 232 CO 0.90 -1.03 1.53 0.15 0.02 0.00 0.00 176.35 177.92 2qjm h PHE 233 N 0.66 1.03 -1.74 0.29 3.57 0.03 -3.41 116.94 117.37 2qjm h PHE 233 Ca -0.47 -0.28 0.19 0.00 3.53 0.00 0.00 57.97 60.93 2qjm h PHE 233 Cb 1.21 -0.23 -0.18 0.00 2.79 0.00 0.00 35.95 39.54 2qjm h PHE 233 CO 0.59 1.08 0.68 1.67 -2.23 0.00 0.00 178.31 180.10 2qjm s TRP 234 N -4.46 -0.22 -0.24 0.41 -2.14 -1.25 -4.58 118.94 106.45 2qjm s TRP 234 Ca -0.10 0.18 -0.02 0.00 2.66 0.00 0.00 56.10 58.82 2qjm s TRP 234 Cb 0.12 0.51 0.02 0.00 -3.10 0.00 0.00 33.47 31.02 2qjm s TRP 234 CO 0.86 -0.32 -0.07 -1.17 -2.66 0.00 0.00 176.95 173.59 2qjm s LEU 235 N -2.11 3.03 0.03 -4.66 2.96 0.15 -2.38 118.68 115.69 2qjm s LEU 235 Ca 0.07 -0.74 -0.06 0.00 -0.22 0.00 0.00 54.13 53.18 2qjm s LEU 235 Cb -0.01 -1.67 -0.05 0.00 0.50 0.00 0.00 46.19 44.97 2qjm s LEU 235 CO -0.06 -0.09 0.28 -0.70 -1.32 0.00 0.00 176.35 174.46 2qjm s GLU 236 N 1.36 3.58 -1.06 1.98 2.12 0.41 -1.58 118.70 125.51 2qjm s GLU 236 Ca 0.02 -0.10 -0.05 0.00 0.36 0.00 0.00 54.97 55.20 2qjm s GLU 236 Cb -0.16 -3.05 0.01 0.00 0.26 0.00 0.00 34.13 31.19 2qjm s GLU 236 CO -0.05 0.63 0.10 -0.25 -0.54 0.00 0.00 175.26 175.14 2qjm n ASP 237 N 0.95 -0.04 -0.30 -1.70 8.00 0.06 -0.13 116.55 123.39 2qjm n ASP 237 Ca -0.10 -0.92 -0.02 0.00 0.71 0.00 0.00 54.79 54.46 2qjm n ASP 237 Cb 0.53 -1.14 0.11 0.00 -0.02 0.00 0.00 41.12 40.59 2qjm n ASP 237 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2qjm s THR 239 N -6.10 0.11 0.23 0.00 -1.32 -1.26 -2.40 115.64 104.90 2qjm s THR 239 Ca -0.13 -0.95 -0.31 0.00 -1.21 0.00 0.00 61.69 59.09 2qjm s THR 239 Cb 0.17 -0.38 -0.14 0.00 -1.51 0.00 0.00 72.50 70.64 2qjm s THR 239 CO 0.79 -0.52 1.24 -2.65 -2.21 0.00 0.00 174.62 171.27 2qjm n PRO 240 N 1.46 1.60 -0.67 7.08 -0.02 -1.26 -4.86 135.00 138.33 2qjm n PRO 240 Ca -0.23 0.57 -0.00 0.00 -2.02 0.00 0.00 63.50 61.82 2qjm n PRO 240 Cb 0.56 -2.11 0.21 0.00 -0.02 0.00 0.00 33.50 32.14 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 1.37 3.85 -0.37 3.55 0.00 -1.26 -4.61 120.51 123.04 2qjm n ALA 241 Ca 0.12 -2.87 -0.00 0.00 0.00 0.00 0.00 53.44 50.68 2qjm n ALA 241 Cb 0.29 -0.73 0.14 0.00 0.00 0.00 0.00 19.45 19.16 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 1.18 1.25 -4.57 0.00 3.07 -1.95 -3.19 114.58 110.37 2qjm h GLU 242 Ca 0.15 -0.08 -0.72 0.00 -0.50 0.00 0.00 59.36 58.22 2qjm h GLU 242 Cb 1.58 -0.28 -0.21 0.00 -0.84 0.00 0.00 28.75 29.01 2qjm h GLU 242 CO 0.33 0.83 -0.09 1.21 -1.40 0.00 0.00 179.01 179.89 2qjm s ASN 243 N -6.05 6.19 0.63 1.42 3.84 -1.26 -4.92 114.94 114.79 2qjm s ASN 243 Ca -0.13 -1.29 0.40 0.00 0.21 0.00 0.00 52.86 52.05 2qjm s ASN 243 Cb 0.19 -2.25 2.13 0.00 -0.55 0.00 0.00 41.25 40.77 2qjm s ASN 243 CO 0.82 -0.86 2.29 1.56 -2.79 0.00 0.00 177.10 178.11 2qjm h GLN 244 N 8.95 0.00 0.00 0.43 4.20 -1.91 -0.83 115.11 125.94 2qjm h GLN 244 Ca -0.29 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.42 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 0.98 0.01 0.00 0.93 -0.67 0.00 0.00 178.83 180.08 2qjm h GLU 245 N 0.00 0.00 -0.45 1.46 5.08 -1.91 -3.04 114.58 115.73 2qjm h GLU 245 Ca -0.00 0.00 0.13 0.00 -1.00 0.00 0.00 59.36 58.49 2qjm h GLU 245 Cb 0.09 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 2qjm h GLU 245 CO 0.00 0.00 0.33 0.00 -1.00 0.00 0.00 179.01 178.34 2qjm h ALA 246 N 2.10 2.39 -0.00 3.43 0.00 -1.49 -0.23 119.26 125.46 2qjm h ALA 246 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2qjm h ALA 246 Cb 0.36 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2qjm h ALA 246 CO 0.00 -0.56 -0.01 1.19 0.00 0.00 0.00 179.25 179.86 2qjm n PHE 247 N -4.33 0.00 -0.14 0.00 3.01 -1.15 -3.99 117.46 110.86 2qjm n PHE 247 Ca 0.08 0.00 -0.10 0.00 1.01 0.00 0.00 57.45 58.44 2qjm n PHE 247 Cb 0.53 -0.29 -0.01 0.00 -0.01 0.00 0.00 39.48 39.71 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 0.04 0.73 -0.68 -1.08 2.43 -1.25 -1.42 114.38 113.15 2qjm h ARG 248 Ca 0.00 -0.23 -0.05 0.00 -0.81 0.00 0.00 59.98 58.89 2qjm h ARG 248 Cb 0.30 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.75 2qjm h ARG 248 CO 0.00 0.81 0.22 -0.07 -1.51 0.00 0.00 179.97 179.41 2qjm h LEU 249 N 0.57 0.99 0.70 3.80 3.38 -1.76 -1.39 115.31 121.60 2qjm h LEU 249 Ca 0.12 -0.21 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 2qjm h LEU 249 Cb 0.47 -0.26 0.01 0.00 0.09 0.00 0.00 40.66 40.97 2qjm h LEU 249 CO 0.02 0.94 -0.33 0.58 0.09 0.00 0.00 178.44 179.73 2qjm h VAL 250 N 1.00 0.28 -0.70 1.22 2.07 -1.73 -2.39 116.25 116.00 2qjm h VAL 250 Ca 0.22 -0.09 0.16 0.00 0.82 0.00 0.00 66.70 67.81 2qjm h VAL 250 Cb 0.30 0.31 -0.04 0.00 -1.52 0.00 0.00 31.29 30.34 2qjm h VAL 250 CO -0.01 0.01 0.48 -0.09 0.02 0.00 0.00 177.57 177.98 2qjm h ARG 251 N -1.00 0.25 0.00 1.57 9.65 -1.21 -0.85 114.38 122.78 2qjm h ARG 251 Ca -0.10 -0.01 -0.11 0.00 -1.10 0.00 0.00 59.98 58.65 2qjm h ARG 251 Cb 0.74 -0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 29.24 2qjm h ARG 251 CO 0.16 0.16 -0.55 0.37 2.80 0.00 0.00 179.97 182.91 2qjm h GLN 252 N 0.26 0.00 -0.02 0.20 4.15 -0.93 -3.34 115.11 115.43 2qjm h GLN 252 Ca 0.34 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.76 2qjm h GLN 252 Cb 0.97 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.66 2qjm h GLN 252 CO -0.08 0.55 -0.10 0.72 -1.93 0.00 0.00 178.83 177.99 2qjm n HIS 253 N -3.76 0.00 -3.81 3.99 8.25 -0.36 -5.02 115.22 114.51 2qjm n HIS 253 Ca -0.01 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.34 2qjm n HIS 253 Cb 0.58 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.60 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 -1.53 0.09 -2.41 1.59 -1.32 -0.97 -4.69 115.64 106.40 2qjm s THR 254 Ca 0.17 -0.72 0.22 0.00 -1.21 0.00 0.00 61.69 60.16 2qjm s THR 254 Cb 0.13 -0.78 0.38 0.00 -1.51 0.00 0.00 72.50 70.73 2qjm s THR 254 CO 0.27 -0.40 1.36 1.33 -2.21 0.00 0.00 174.62 174.97 2qjm n VAL 255 N 0.91 0.46 -1.97 5.08 0.24 -1.26 -4.71 118.33 117.07 2qjm n VAL 255 Ca -0.20 -0.73 -0.41 0.00 -2.04 0.00 0.00 64.34 60.96 2qjm n VAL 255 Cb 0.58 1.03 -0.02 0.00 -1.47 0.00 0.00 33.84 33.95 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 -1.48 2.58 0.33 3.34 2.01 -1.26 -4.93 115.64 116.23 2qjm s THR 256 Ca 0.36 0.48 -0.29 0.00 0.31 0.00 0.00 61.69 62.55 2qjm s THR 256 Cb 0.22 -3.30 -0.11 0.00 0.01 0.00 0.00 72.50 69.31 2qjm s THR 256 CO 0.30 0.07 1.45 -2.84 -0.69 0.00 0.00 174.62 172.91 2qjm s PRO 257 N -0.16 4.20 -0.02 4.92 0.02 -1.26 -4.86 135.00 137.84 2qjm s PRO 257 Ca 0.61 2.43 0.04 0.00 0.02 0.00 0.00 61.00 64.11 2qjm s PRO 257 Cb -0.43 -3.03 -0.03 0.00 0.02 0.00 0.00 34.50 31.04 2qjm s PRO 257 CO 0.42 -0.44 -0.12 -0.51 -0.33 0.00 0.00 177.00 176.02 2qjm s LEU 258 N -1.51 2.86 0.04 -5.54 1.43 -1.26 0.31 118.68 115.01 2qjm s LEU 258 Ca 0.54 -0.22 0.03 0.00 -1.03 0.00 0.00 54.13 53.45 2qjm s LEU 258 Cb -0.44 -1.63 -0.02 0.00 0.03 0.00 0.00 46.19 44.13 2qjm s LEU 258 CO 0.55 0.31 -0.09 0.00 0.23 0.00 0.00 176.35 177.35 2qjm s ALA 259 N -0.85 0.64 0.07 4.21 0.00 -0.61 -0.63 121.76 124.59 2qjm s ALA 259 Ca 0.14 -0.79 -0.27 0.00 0.00 0.00 0.00 51.96 51.04 2qjm s ALA 259 Cb -0.11 0.02 0.08 0.00 0.00 0.00 0.00 23.12 23.12 2qjm s ALA 259 CO 0.04 0.01 0.96 0.54 0.00 0.00 0.00 175.76 177.30 2qjm s VAL 260 N -1.34 0.00 0.00 0.00 0.11 -1.11 -0.76 120.40 117.29 2qjm s VAL 260 Ca -0.09 -0.34 0.00 0.00 -2.93 0.00 0.00 61.98 58.62 2qjm s VAL 260 Cb -0.10 -1.55 0.00 0.00 -1.53 0.00 0.00 36.38 33.20 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 -0.37 1.68 0.41 6.54 0.00 -1.26 -0.02 105.19 112.17 2qjm n GLY 261 Ca -0.07 0.00 0.23 0.00 0.00 0.00 0.00 46.02 46.18 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 0.00 -0.02 1.61 4.11 -1.94 0.32 114.58 118.66 2qjm h GLU 262 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2qjm h GLU 262 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2qjm h GLU 262 CO 0.00 0.00 -0.01 0.44 0.07 0.00 0.00 179.01 179.51 2qjm n ILE 263 N -4.33 0.00 -2.34 -1.06 -5.35 -1.26 -4.75 119.36 100.28 2qjm n ILE 263 Ca 0.13 -0.32 -0.37 0.00 -0.27 0.00 0.00 62.75 61.93 2qjm n ILE 263 Cb 0.74 0.78 -0.02 0.00 -1.74 0.00 0.00 39.64 39.41 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 -2.01 2.95 0.00 4.28 0.08 0.11 -4.96 117.98 118.43 2qjm s PHE 264 Ca 0.35 1.56 0.00 0.00 0.12 0.00 0.00 56.93 58.96 2qjm s PHE 264 Cb 0.21 -3.30 0.00 0.00 -0.57 0.00 0.00 43.02 39.36 2qjm s PHE 264 CO 0.33 -1.28 0.02 0.27 -0.10 0.00 0.00 175.22 174.46 2qjm n ASN 265 N -0.51 0.04 -3.96 1.36 0.23 -1.26 -4.01 115.26 107.15 2qjm n ASN 265 Ca 0.07 -0.51 -0.10 0.00 -0.53 0.00 0.00 54.58 53.52 2qjm n ASN 265 Cb 0.49 0.95 -0.07 0.00 -2.08 0.00 0.00 39.78 39.07 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 -0.95 0.05 0.44 5.53 -4.23 -1.26 -4.02 115.64 111.20 2qjm s THR 266 Ca 0.00 -1.38 0.30 0.00 -1.18 0.00 0.00 61.69 59.44 2qjm s THR 266 Cb 0.00 -1.88 0.33 0.00 1.34 0.00 0.00 72.50 72.28 2qjm s THR 266 CO 0.00 -0.25 2.12 -0.29 -0.54 0.00 0.00 174.62 175.67 2qjm h ILE 267 N 2.50 0.44 0.00 2.99 2.10 -1.92 -2.22 117.51 121.40 2qjm h ILE 267 Ca -0.31 -0.40 0.00 0.00 1.08 0.00 0.00 64.86 65.23 2qjm h ILE 267 Cb 1.23 1.28 0.00 0.00 -1.09 0.00 0.00 36.82 38.24 2qjm h ILE 267 CO 0.47 0.08 0.00 0.79 -1.08 0.00 0.00 178.15 178.40 2qjm n TRP 268 N -3.54 0.00 0.86 2.19 7.02 -1.26 -1.25 117.44 121.46 2qjm n TRP 268 Ca -0.02 0.00 0.12 0.00 -1.02 0.00 0.00 57.50 56.58 2qjm n TRP 268 Cb 0.20 -0.48 0.27 0.00 -2.42 0.00 0.00 31.31 28.88 2qjm n TRP 268 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 2qjm n ASP 269 N -1.48 0.51 0.00 -0.99 8.00 -0.83 -4.34 116.55 117.41 2qjm n ASP 269 Ca 0.04 -0.05 0.00 0.00 0.71 0.00 0.00 54.79 55.49 2qjm n ASP 269 Cb 0.16 0.13 0.00 0.00 -0.02 0.00 0.00 41.12 41.39 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 -1.60 0.86 -0.16 2.24 0.00 -0.67 -4.83 120.51 116.34 2qjm n ALA 270 Ca 0.05 -0.16 -0.02 0.00 0.00 0.00 0.00 53.44 53.30 2qjm n ALA 270 Cb 0.37 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.87 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 0.07 -0.13 0.00 4.11 -1.37 -0.34 114.58 116.93 2qjm h GLU 271 Ca 0.00 -0.00 -0.19 0.00 0.07 0.00 0.00 59.36 59.23 2qjm h GLU 271 Cb 0.31 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.54 2qjm h GLU 271 CO 0.00 0.05 -0.71 -0.44 0.07 0.00 0.00 179.01 177.98 2qjm h ASP 272 N 0.08 0.67 -0.81 3.06 3.32 -1.88 -0.29 116.42 120.57 2qjm h ASP 272 Ca 0.25 -0.42 -0.00 0.00 0.02 0.00 0.00 57.03 56.88 2qjm h ASP 272 Cb 0.39 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.70 2qjm h ASP 272 CO -0.45 1.18 0.49 -0.07 -1.72 0.00 0.00 179.24 178.66 2qjm h LEU 273 N 0.40 0.97 0.10 1.55 3.38 -1.71 -1.10 115.31 118.89 2qjm h LEU 273 Ca -0.03 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 2qjm h LEU 273 Cb 1.30 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.80 2qjm h LEU 273 CO 0.13 0.75 -0.05 0.40 0.09 0.00 0.00 178.44 179.76 2qjm h ILE 274 N 1.12 0.41 -0.05 1.22 2.04 -0.98 0.20 117.51 121.47 2qjm h ILE 274 Ca 0.29 -1.15 0.01 0.00 1.00 0.00 0.00 64.86 65.01 2qjm h ILE 274 Cb -0.05 0.74 -0.00 0.00 -0.74 0.00 0.00 36.82 36.77 2qjm h ILE 274 CO -0.05 0.13 0.06 1.56 0.00 0.00 0.00 178.15 179.84 2qjm h GLN 275 N -1.01 0.00 -0.22 2.37 4.20 -1.06 0.22 115.11 119.62 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 0.31 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.09 2qjm h GLN 275 CO 0.02 0.00 0.00 0.09 -0.67 0.00 0.00 178.83 178.27 2qjm n ASN 276 N -3.83 2.48 -3.65 1.46 3.02 -0.42 -4.95 115.26 109.37 2qjm n ASN 276 Ca -0.02 -1.83 -0.21 0.00 -0.03 0.00 0.00 54.58 52.49 2qjm n ASN 276 Cb 0.15 -0.13 0.05 0.00 -0.61 0.00 0.00 39.78 39.23 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 0.87 -5.50 0.02 3.52 6.02 0.78 -4.91 117.38 118.19 2qjm n GLN 277 Ca 0.17 0.68 0.11 0.00 -0.01 0.00 0.00 57.00 57.96 2qjm n GLN 277 Cb 0.47 -5.40 0.07 0.00 1.02 0.00 0.00 30.24 26.40 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 -4.30 0.63 -4.17 1.08 4.77 0.70 -4.95 117.00 110.77 2qjm n LEU 278 Ca -0.26 -0.02 -0.12 0.00 -0.03 0.00 0.00 56.01 55.59 2qjm n LEU 278 Cb 0.66 -0.13 -0.10 0.00 -2.33 0.00 0.00 43.42 41.52 2qjm n LEU 278 CO 0.67 0.06 -0.39 0.27 -1.33 0.00 0.00 177.39 176.67 2qjm s ILE 279 N -3.14 0.76 -0.08 -0.08 -4.36 -1.20 -4.79 121.20 108.30 2qjm s ILE 279 Ca 0.06 -1.82 0.15 0.00 -0.26 0.00 0.00 60.65 58.78 2qjm s ILE 279 Cb 0.15 -1.54 -0.22 0.00 1.25 0.00 0.00 42.46 42.10 2qjm s ILE 279 CO 0.78 -0.77 0.21 0.47 0.24 0.00 0.00 174.94 175.87 2qjm n ASP 280 N 0.18 1.29 -3.90 4.36 8.00 0.20 -4.81 116.55 121.87 2qjm n ASP 280 Ca -0.14 0.00 -0.16 0.00 0.71 0.00 0.00 54.79 55.20 2qjm n ASP 280 Cb 0.60 1.31 -0.15 0.00 -0.02 0.00 0.00 41.12 42.86 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 -2.75 0.42 -0.20 1.24 2.02 -1.04 -1.07 117.35 115.97 2qjm s TYR 281 Ca -0.07 -0.07 -0.08 0.00 -0.37 0.00 0.00 57.07 56.49 2qjm s TYR 281 Cb 0.07 -0.36 -0.04 0.00 -0.40 0.00 0.00 41.96 41.23 2qjm s TYR 281 CO 0.65 -0.07 0.07 -1.50 -1.57 0.00 0.00 175.55 173.13 2qjm s ILE 282 N 0.38 4.72 -2.46 2.71 1.10 -0.16 -2.74 121.20 124.75 2qjm s ILE 282 Ca -0.04 -0.05 0.23 0.00 -0.51 0.00 0.00 60.65 60.27 2qjm s ILE 282 Cb -0.07 -3.15 0.42 0.00 0.15 0.00 0.00 42.46 39.81 2qjm s ILE 282 CO -0.01 0.42 1.44 0.54 -2.11 0.00 0.00 174.94 175.23 2qjm n ARG 283 N 3.89 2.23 -1.63 3.50 5.12 0.97 -1.33 116.66 129.41 2qjm n ARG 283 Ca -0.16 -1.85 -0.40 0.00 -1.93 0.00 0.00 57.85 53.51 2qjm n ARG 283 Cb 0.52 -1.47 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 1.08 0.39 -2.51 7.54 0.00 -1.23 -2.06 120.51 123.72 2qjm n ALA 284 Ca 0.18 0.15 -0.26 0.00 0.00 0.00 0.00 53.44 53.50 2qjm n ALA 284 Cb 0.51 -2.13 -0.08 0.00 0.00 0.00 0.00 19.45 17.76 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 -1.36 2.10 0.33 0.00 -4.23 -1.26 -4.48 115.64 106.74 2qjm s THR 285 Ca 0.67 -1.79 0.05 0.00 -1.18 0.00 0.00 61.69 59.44 2qjm s THR 285 Cb -0.49 -2.89 0.12 0.00 1.34 0.00 0.00 72.50 70.58 2qjm s THR 285 CO 0.53 0.00 1.82 0.58 -0.54 0.00 0.00 174.62 177.02 2qjm h VAL 286 N 1.48 1.22 0.05 2.29 2.07 -1.91 -0.80 116.25 120.66 2qjm h VAL 286 Ca -0.43 -0.99 -0.28 0.00 0.82 0.00 0.00 66.70 65.82 2qjm h VAL 286 Cb 1.26 1.18 -0.03 0.00 -1.52 0.00 0.00 31.29 32.18 2qjm h VAL 286 CO 0.73 0.32 -1.50 1.62 0.02 0.00 0.00 177.57 178.76 2qjm h VAL 287 N 0.39 1.15 0.09 2.57 3.04 -1.91 0.21 116.25 121.80 2qjm h VAL 287 Ca 0.07 -2.88 -0.27 0.00 -1.01 0.00 0.00 66.70 62.62 2qjm h VAL 287 Cb 0.48 2.65 -0.01 0.00 -2.01 0.00 0.00 31.29 32.40 2qjm h VAL 287 CO 0.03 0.75 -1.26 1.23 -1.01 0.00 0.00 177.57 177.31 2qjm h GLY 288 N 2.54 0.23 -3.58 3.17 0.00 -1.84 -3.38 103.07 100.21 2qjm h GLY 288 Ca -0.21 -0.58 -0.52 0.00 0.00 0.00 0.00 47.33 46.01 2qjm h GLY 288 CO 0.12 0.51 0.37 0.00 0.00 0.00 0.00 176.54 177.54 2qjm n ALA 289 N -2.52 5.57 -1.98 3.60 0.00 -0.31 -4.02 120.51 120.84 2qjm n ALA 289 Ca -0.08 -3.32 -0.01 0.00 0.00 0.00 0.00 53.44 50.02 2qjm n ALA 289 Cb 1.01 -1.27 -0.00 0.00 0.00 0.00 0.00 19.45 19.19 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 -0.99 0.33 1.98 0.00 0.00 -1.25 -3.98 105.19 101.29 2qjm n GLY 290 Ca 0.54 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.70 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 -1.07 -2.46 0.31 -0.02 0.00 0.74 -3.86 105.19 98.83 2qjm n GLY 291 Ca -0.01 -1.62 -0.07 0.00 0.00 0.00 0.00 46.02 44.31 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 0.99 -0.52 0.99 -0.00 -1.88 -1.40 115.31 113.49 2qjm h LEU 292 Ca 0.00 -0.26 0.10 0.00 -0.00 0.00 0.00 57.88 57.73 2qjm h LEU 292 Cb 0.00 -0.26 -0.08 0.00 -0.00 0.00 0.00 40.66 40.31 2qjm h LEU 292 CO 0.00 1.02 0.02 0.74 -0.00 0.00 0.00 178.44 180.22 2qjm h THR 293 N 0.95 0.60 0.18 0.22 2.02 -1.93 -1.23 112.91 113.72 2qjm h THR 293 Ca 0.18 -0.05 -0.34 0.00 0.77 0.00 0.00 66.41 66.97 2qjm h THR 293 Cb 0.49 0.46 0.01 0.00 -1.74 0.00 0.00 68.15 67.37 2qjm h THR 293 CO 0.02 0.02 -1.67 -0.74 0.37 0.00 0.00 175.52 173.53 2qjm h HIS 294 N 0.14 0.69 -0.42 3.16 -0.00 -1.65 -3.31 115.15 113.76 2qjm h HIS 294 Ca 0.27 -0.51 0.07 0.00 -0.00 0.00 0.00 60.37 60.20 2qjm h HIS 294 Cb 0.40 -0.03 -0.02 0.00 -0.00 0.00 0.00 27.41 27.76 2qjm h HIS 294 CO -0.31 1.65 0.28 1.25 -0.00 0.00 0.00 177.93 180.81 2qjm h LEU 295 N 0.04 0.24 -0.72 0.26 5.85 -1.18 0.09 115.31 119.89 2qjm h LEU 295 Ca -0.33 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.36 2qjm h LEU 295 Cb 2.05 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 42.99 2qjm h LEU 295 CO 0.17 0.16 0.32 -0.09 -0.34 0.00 0.00 178.44 178.65 2qjm h ARG 296 N 0.28 1.06 -0.44 1.25 2.43 -1.33 -0.15 114.38 117.47 2qjm h ARG 296 Ca 0.19 -0.17 -0.09 0.00 -0.81 0.00 0.00 59.98 59.09 2qjm h ARG 296 Cb 0.39 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.74 2qjm h ARG 296 CO -0.04 0.85 -0.10 0.00 -1.51 0.00 0.00 179.97 179.17 2qjm h ARG 297 N 1.02 0.79 -0.36 0.20 3.08 -1.09 -1.15 114.38 116.87 2qjm h ARG 297 Ca 0.24 -0.26 -0.06 0.00 0.07 0.00 0.00 59.98 59.97 2qjm h ARG 297 Cb 0.16 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 2qjm h ARG 297 CO -0.03 0.86 -0.02 0.82 -1.07 0.00 0.00 179.97 180.54 2qjm h ILE 298 N 0.72 1.26 -0.45 2.04 2.04 -0.80 -1.77 117.51 120.55 2qjm h ILE 298 Ca 0.12 -1.03 -0.08 0.00 1.00 0.00 0.00 64.86 64.88 2qjm h ILE 298 Cb 0.58 1.20 -0.02 0.00 -0.74 0.00 0.00 36.82 37.85 2qjm h ILE 298 CO 0.04 0.34 -0.04 0.00 0.00 0.00 0.00 178.15 178.49 2qjm h ALA 299 N 0.86 1.09 -0.12 1.87 0.00 -0.86 -1.40 119.26 120.70 2qjm h ALA 299 Ca 0.10 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 2qjm h ALA 299 Cb 0.49 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2qjm h ALA 299 CO 0.02 0.57 0.05 -0.44 0.00 0.00 0.00 179.25 179.45 2qjm h ASP 300 N 0.71 0.16 -0.20 0.00 5.19 -1.04 0.13 116.42 121.37 2qjm h ASP 300 Ca 0.13 -0.16 0.00 0.00 -0.62 0.00 0.00 57.03 56.39 2qjm h ASP 300 Cb 0.49 -0.04 -0.01 0.00 0.18 0.00 0.00 39.33 39.95 2qjm h ASP 300 CO 0.02 0.28 0.12 0.25 -3.12 0.00 0.00 179.24 176.80 2qjm h LEU 301 N 0.03 0.21 -1.43 1.55 5.85 -1.15 -1.75 115.31 118.63 2qjm h LEU 301 Ca 0.04 -0.00 0.08 0.00 0.84 0.00 0.00 57.88 58.84 2qjm h LEU 301 Cb 0.17 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 41.10 2qjm h LEU 301 CO -0.00 0.16 0.47 0.00 -0.34 0.00 0.00 178.44 178.72 2qjm h ALA 302 N 1.08 1.79 -0.78 1.25 0.00 -1.08 -1.97 119.26 119.54 2qjm h ALA 302 Ca 0.07 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.99 2qjm h ALA 302 Cb -0.02 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 2qjm h ALA 302 CO -0.02 0.08 0.51 1.03 0.00 0.00 0.00 179.25 180.85 2qjm h SER 303 N 0.67 0.85 0.18 0.00 0.87 0.18 0.13 113.55 116.43 2qjm h SER 303 Ca 0.32 -0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.85 2qjm h SER 303 Cb 0.38 -0.20 -0.00 0.00 -0.44 0.00 0.00 62.40 62.13 2qjm h SER 303 CO -0.11 0.60 -0.05 -0.07 -0.53 0.00 0.00 176.83 176.67 2qjm h LEU 304 N 1.00 0.00 -3.21 2.23 3.38 -1.13 -2.10 115.31 115.48 2qjm h LEU 304 Ca 0.30 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.26 2qjm h LEU 304 Cb -0.03 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 2qjm h LEU 304 CO -0.08 0.05 -0.00 -1.22 0.09 0.00 0.00 178.44 177.28 2qjm n TYR 305 N -3.67 0.76 -2.05 1.13 4.01 -0.84 -4.95 117.16 111.55 2qjm n TYR 305 Ca -0.02 -0.92 -0.21 0.00 -0.16 0.00 0.00 57.90 56.59 2qjm n TYR 305 Cb 0.15 -0.29 -0.04 0.00 -0.31 0.00 0.00 39.34 38.85 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 -0.71 -1.59 -2.94 -0.72 6.02 -0.79 -4.96 117.38 111.69 2qjm n GLN 306 Ca 0.21 1.10 -0.40 0.00 -0.01 0.00 0.00 57.00 57.90 2qjm n GLN 306 Cb 0.85 -5.65 -0.06 0.00 1.02 0.00 0.00 30.24 26.40 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 -2.92 4.49 0.28 5.09 1.01 0.39 -4.99 120.40 123.76 2qjm s VAL 307 Ca 0.00 1.74 0.08 0.00 0.00 0.00 0.00 61.98 63.79 2qjm s VAL 307 Cb 0.00 -4.16 -0.04 0.00 0.00 0.00 0.00 36.38 32.18 2qjm s VAL 307 CO 0.00 0.45 0.17 -0.13 0.00 0.00 0.00 175.10 175.59 2qjm s ARG 308 N -0.66 2.71 0.22 2.72 0.52 -0.24 -3.90 118.95 120.32 2qjm s ARG 308 Ca 0.38 -1.23 -0.25 0.00 -0.52 0.00 0.00 55.73 54.11 2qjm s ARG 308 Cb -0.22 -2.43 -0.09 0.00 0.52 0.00 0.00 34.95 32.73 2qjm s ARG 308 CO 0.26 0.30 0.83 0.95 0.02 0.00 0.00 175.30 177.66 2qjm s THR 309 N -2.24 4.31 -0.36 0.02 -4.23 -0.54 -0.98 115.64 111.62 2qjm s THR 309 Ca 0.35 1.73 0.14 0.00 -1.18 0.00 0.00 61.69 62.72 2qjm s THR 309 Cb -0.07 -4.10 0.40 0.00 1.34 0.00 0.00 72.50 70.08 2qjm s THR 309 CO 0.24 0.39 0.98 0.61 -0.54 0.00 0.00 174.62 176.29 2qjm n GLY 310 N 1.21 1.96 3.70 3.99 0.00 -0.45 -0.38 105.19 115.22 2qjm n GLY 310 Ca -0.03 -1.07 -0.65 0.00 0.00 0.00 0.00 46.02 44.26 2qjm n GLY 310 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qjm n HIS 312 N 3.59 0.03 -2.68 0.00 -0.00 -0.87 -1.90 115.22 113.38 2qjm n HIS 312 Ca 0.28 0.35 -0.05 0.00 0.46 0.00 0.00 57.72 58.76 2qjm n HIS 312 Cb -0.02 -1.97 0.07 0.00 -0.12 0.00 0.00 29.99 27.94 2qjm n HIS 312 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2qjm n GLY 313 N 1.08 -0.07 3.90 1.57 0.00 -1.26 -4.66 105.19 105.75 2qjm n GLY 313 Ca 0.11 0.13 -0.29 0.00 0.00 0.00 0.00 46.02 45.97 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 0.12 2.75 0.15 4.61 0.00 -1.26 -3.08 121.76 125.05 2qjm s ALA 314 Ca 0.15 -0.62 0.32 0.00 0.00 0.00 0.00 51.96 51.81 2qjm s ALA 314 Cb 0.24 -2.93 1.69 0.00 0.00 0.00 0.00 23.12 22.12 2qjm s ALA 314 CO -0.08 -1.53 1.98 1.79 0.00 0.00 0.00 175.76 177.93 2qjm h THR 315 N -0.93 0.00 0.00 0.00 1.35 -1.91 -2.22 112.91 109.21 2qjm h THR 315 Ca -0.46 -0.06 0.00 0.00 -0.55 0.00 0.00 66.41 65.34 2qjm h THR 315 Cb 1.31 0.82 0.00 0.00 -1.73 0.00 0.00 68.15 68.55 2qjm h THR 315 CO 0.65 0.00 0.00 -0.90 -0.25 0.00 0.00 175.52 175.02 2qjm n ASP 316 N -2.66 0.00 -4.21 5.36 5.75 -1.26 -4.31 116.55 115.21 2qjm n ASP 316 Ca -0.02 -1.12 -0.36 0.00 -0.01 0.00 0.00 54.79 53.29 2qjm n ASP 316 Cb 0.09 0.00 -0.13 0.00 -1.03 0.00 0.00 41.12 40.04 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 -1.38 3.83 1.04 -2.12 1.02 -0.84 -4.64 118.68 115.59 2qjm s LEU 317 Ca 0.13 -1.12 -0.11 0.00 0.02 0.00 0.00 54.13 53.04 2qjm s LEU 317 Cb 0.06 -1.74 0.22 0.00 0.02 0.00 0.00 46.19 44.74 2qjm s LEU 317 CO 0.10 -0.24 1.09 -0.94 0.02 0.00 0.00 176.35 176.38 2qjm s SER 318 N 1.31 1.89 0.62 2.29 1.04 -1.26 -4.72 113.70 114.88 2qjm s SER 318 Ca -0.03 1.89 0.31 0.00 0.48 0.00 0.00 55.95 58.59 2qjm s SER 318 Cb -0.19 -2.46 1.70 0.00 0.10 0.00 0.00 66.02 65.17 2qjm s SER 318 CO -0.01 -3.69 2.05 -0.65 0.98 0.00 0.00 173.24 171.92 2qjm h PRO 319 N -2.27 0.00 -0.23 4.02 0.11 -1.93 0.23 132.00 131.93 2qjm h PRO 319 Ca -0.52 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.55 2qjm h PRO 319 Cb 1.30 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.40 2qjm h PRO 319 CO 0.45 0.00 -0.00 0.28 -0.21 0.00 0.00 178.00 178.52 2qjm h VAL 320 N 0.00 1.26 -0.53 3.15 2.07 -1.93 0.39 116.25 120.67 2qjm h VAL 320 Ca 0.08 -0.90 -0.03 0.00 0.82 0.00 0.00 66.70 66.67 2qjm h VAL 320 Cb 0.61 1.39 -0.02 0.00 -1.52 0.00 0.00 31.29 31.75 2qjm h VAL 320 CO -0.00 0.28 0.23 0.74 0.02 0.00 0.00 177.57 178.84 2qjm h THR 321 N 0.18 1.21 -0.95 2.57 2.02 -1.28 -0.99 112.91 115.67 2qjm h THR 321 Ca 0.07 -0.63 0.00 0.00 0.77 0.00 0.00 66.41 66.61 2qjm h THR 321 Cb 0.41 0.65 -0.05 0.00 -1.74 0.00 0.00 68.15 67.43 2qjm h THR 321 CO 0.01 0.24 0.60 -0.03 0.37 0.00 0.00 175.52 176.72 2qjm h MET 322 N 0.71 1.27 0.10 6.66 -1.53 -1.28 0.80 114.93 121.67 2qjm h MET 322 Ca 0.18 -0.10 -0.01 0.00 -3.44 0.00 0.00 59.70 56.34 2qjm h MET 322 Cb 0.17 -0.28 0.00 0.00 -0.55 0.00 0.00 31.60 30.94 2qjm h MET 322 CO -0.02 0.87 -0.05 0.78 0.14 0.00 0.00 176.91 178.63 2qjm h GLY 323 N 1.30 -0.15 1.01 1.39 0.00 -0.47 0.13 103.07 106.28 2qjm h GLY 323 Ca 0.34 0.05 -0.04 0.00 0.00 0.00 0.00 47.33 47.69 2qjm h GLY 323 CO -0.07 -0.05 0.26 0.00 0.00 0.00 0.00 176.54 176.67 2qjm h ALA 325 N 1.10 1.21 -0.24 0.00 0.00 0.85 -0.35 119.26 121.84 2qjm h ALA 325 Ca 0.21 -0.07 -0.15 0.00 0.00 0.00 0.00 54.91 54.91 2qjm h ALA 325 Cb 0.21 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2qjm h ALA 325 CO -0.02 0.60 -0.47 -0.07 0.00 0.00 0.00 179.25 179.29 2qjm h LEU 326 N 1.29 0.70 -0.82 0.00 3.38 -0.43 0.32 115.31 119.75 2qjm h LEU 326 Ca 0.35 -0.34 -0.07 0.00 0.09 0.00 0.00 57.88 57.91 2qjm h LEU 326 Cb -0.14 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.38 2qjm h LEU 326 CO -0.08 1.06 0.10 0.45 0.09 0.00 0.00 178.44 180.07 2qjm h HIS 327 N 0.51 1.04 0.11 1.13 3.86 -1.00 0.89 115.15 121.69 2qjm h HIS 327 Ca 0.03 -0.13 -0.01 0.00 -1.16 0.00 0.00 60.37 59.10 2qjm h HIS 327 Cb 1.01 -0.29 0.00 0.00 1.06 0.00 0.00 27.41 29.19 2qjm h HIS 327 CO 0.05 0.88 -0.05 0.35 0.86 0.00 0.00 177.93 180.01 2qjm h PHE 328 N 0.93 -0.13 -0.05 2.45 3.57 -0.61 -2.86 116.94 120.23 2qjm h PHE 328 Ca 0.19 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.68 2qjm h PHE 328 Cb 0.40 0.04 -0.00 0.00 2.79 0.00 0.00 35.95 39.18 2qjm h PHE 328 CO 0.03 0.05 -0.02 -0.44 -2.23 0.00 0.00 178.31 175.70 2qjm h ASP 329 N -0.30 0.06 0.74 0.41 3.32 -0.10 -0.19 116.42 120.36 2qjm h ASP 329 Ca -0.01 -0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.95 2qjm h ASP 329 Cb 0.24 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 2qjm h ASP 329 CO 0.02 0.09 -0.41 0.74 -1.72 0.00 0.00 179.24 177.97 2qjm h THR 330 N 0.07 1.00 0.00 0.35 2.02 -0.61 -3.36 112.91 112.39 2qjm h THR 330 Ca 0.02 -1.56 -0.35 0.00 0.77 0.00 0.00 66.41 65.29 2qjm h THR 330 Cb 0.08 1.92 -0.05 0.00 -1.74 0.00 0.00 68.15 68.36 2qjm h THR 330 CO 0.00 0.40 -2.01 1.87 0.37 0.00 0.00 175.52 176.16 2qjm n TRP 331 N -3.64 0.28 -1.72 3.16 -0.00 -0.81 -0.28 117.44 114.43 2qjm n TRP 331 Ca -0.01 0.12 -0.61 0.00 -0.00 0.00 0.00 57.50 57.01 2qjm n TRP 331 Cb 0.51 -0.96 -0.08 0.00 -0.00 0.00 0.00 31.31 30.77 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 -4.33 0.20 -0.19 5.87 3.14 -0.15 -4.39 118.33 118.49 2qjm n VAL 332 Ca -0.43 -0.04 -0.09 0.00 -2.96 0.00 0.00 64.34 60.82 2qjm n VAL 332 Cb 0.78 -0.98 0.01 0.00 -1.06 0.00 0.00 33.84 32.59 2qjm n VAL 332 CO 0.00 0.00 0.00 1.55 -6.46 0.00 0.00 176.83 171.92 2qjm h PRO 333 N 6.46 0.87 -1.88 1.45 0.13 -1.91 -3.16 132.00 133.96 2qjm h PRO 333 Ca -0.46 -0.23 -0.34 0.00 -0.87 0.00 0.00 66.00 64.11 2qjm h PRO 333 Cb 1.34 -0.10 -0.13 0.00 0.13 0.00 0.00 31.00 32.24 2qjm h PRO 333 CO 0.96 0.85 0.18 0.27 -0.23 0.00 0.00 178.00 180.04 2qjm n ASN 334 N -4.38 6.08 -4.77 1.44 6.94 -1.26 -4.95 115.26 114.36 2qjm n ASN 334 Ca 0.02 -2.93 -0.38 0.00 -0.02 0.00 0.00 54.58 51.27 2qjm n ASN 334 Cb 0.26 -1.22 -0.02 0.00 -2.36 0.00 0.00 39.78 36.43 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 -0.96 3.07 0.03 -2.53 5.36 -1.20 -1.47 117.98 120.29 2qjm s PHE 335 Ca 0.48 1.55 -0.02 0.00 -0.96 0.00 0.00 56.93 57.99 2qjm s PHE 335 Cb 0.30 -3.39 -0.01 0.00 -0.34 0.00 0.00 43.02 39.58 2qjm s PHE 335 CO -0.10 -1.30 -0.03 0.41 -1.46 0.00 0.00 175.22 172.74 2qjm n GLY 336 N 0.63 -0.07 3.62 13.12 0.00 0.49 -4.65 105.19 118.33 2qjm n GLY 336 Ca 0.04 -0.03 -0.07 0.00 0.00 0.00 0.00 46.02 45.96 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 -1.69 0.00 -0.09 -0.61 2.07 -0.49 -4.93 121.20 115.46 2qjm s ILE 337 Ca -0.03 -0.35 0.00 0.00 -1.41 0.00 0.00 60.65 58.86 2qjm s ILE 337 Cb 0.00 -1.47 0.02 0.00 0.13 0.00 0.00 42.46 41.15 2qjm s ILE 337 CO 0.04 0.00 -0.08 -1.58 -1.91 0.00 0.00 174.94 171.41 2qjm s GLN 338 N -3.38 1.47 0.33 3.50 2.00 -0.46 -3.18 119.66 119.94 2qjm s GLN 338 Ca 0.08 -0.26 -0.29 0.00 -2.00 0.00 0.00 55.36 52.89 2qjm s GLN 338 Cb -0.02 -1.44 -0.10 0.00 0.80 0.00 0.00 33.01 32.25 2qjm s GLN 338 CO -0.04 -0.18 1.25 -2.00 -0.50 0.00 0.00 175.29 173.82 2qjm s GLU 339 N 1.38 4.39 -0.10 1.67 2.12 -0.80 -2.94 118.70 124.42 2qjm s GLU 339 Ca -0.02 2.09 -0.03 0.00 0.36 0.00 0.00 54.97 57.37 2qjm s GLU 339 Cb -0.14 -3.06 0.04 0.00 0.26 0.00 0.00 34.13 31.24 2qjm s GLU 339 CO -0.04 -0.11 0.07 -0.47 -0.54 0.00 0.00 175.26 174.17 2qjm s TYR 340 N -1.17 0.11 -0.14 5.30 5.04 -1.22 -4.26 117.35 121.02 2qjm s TYR 340 Ca 0.49 0.02 0.01 0.00 -2.44 0.00 0.00 57.07 55.14 2qjm s TYR 340 Cb -0.37 -0.57 0.02 0.00 0.35 0.00 0.00 41.96 41.39 2qjm s TYR 340 CO 0.49 -0.33 -0.15 -1.64 -1.34 0.00 0.00 175.55 172.58 2qjm s MET 341 N 2.16 2.33 0.39 4.97 -1.94 -1.18 -4.71 119.30 121.32 2qjm s MET 341 Ca 0.04 -0.58 -0.27 0.00 -1.71 0.00 0.00 55.69 53.16 2qjm s MET 341 Cb -0.14 -2.08 -0.10 0.00 2.01 0.00 0.00 34.83 34.52 2qjm s MET 341 CO -0.06 -0.18 1.41 1.03 -0.01 0.00 0.00 175.02 177.21 2qjm s ARG 342 N 1.33 4.06 0.55 2.03 0.52 -1.26 -4.51 118.95 121.66 2qjm s ARG 342 Ca 0.02 2.40 -0.04 0.00 -0.52 0.00 0.00 55.73 57.59 2qjm s ARG 342 Cb -0.13 -2.89 0.01 0.00 0.52 0.00 0.00 34.95 32.45 2qjm s ARG 342 CO -0.08 -0.51 0.83 -1.01 0.02 0.00 0.00 175.30 174.54 2qjm s HIS 343 N -1.16 3.20 0.75 -0.53 3.76 -1.26 -4.90 115.29 115.15 2qjm s HIS 343 Ca 0.54 0.46 -0.11 0.00 -0.15 0.00 0.00 55.06 55.81 2qjm s HIS 343 Cb -0.43 -2.63 0.04 0.00 1.11 0.00 0.00 32.58 30.67 2qjm s HIS 343 CO 0.57 -0.71 1.08 0.95 -0.85 0.00 0.00 174.74 175.78 2qjm s THR 344 N -2.85 3.60 0.24 1.30 -4.23 -1.26 -4.83 115.64 107.60 2qjm s THR 344 Ca 0.53 0.52 -0.07 0.00 -1.18 0.00 0.00 61.69 61.48 2qjm s THR 344 Cb -0.10 -3.19 0.22 0.00 1.34 0.00 0.00 72.50 70.76 2qjm s THR 344 CO 0.42 -0.68 1.90 -0.33 -0.54 0.00 0.00 174.62 175.39 2qjm h GLU 345 N -0.94 1.13 -0.53 3.99 5.08 -1.98 -0.47 114.58 120.88 2qjm h GLU 345 Ca -0.45 -0.07 0.02 0.00 -1.00 0.00 0.00 59.36 57.87 2qjm h GLU 345 Cb 1.23 -0.26 -0.04 0.00 0.50 0.00 0.00 28.75 30.19 2qjm h GLU 345 CO 0.56 0.75 0.32 0.93 -1.00 0.00 0.00 179.01 180.56 2qjm h GLU 346 N 1.17 0.61 -0.02 2.33 3.07 -1.93 -0.30 114.58 119.52 2qjm h GLU 346 Ca 0.34 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 59.17 2qjm h GLU 346 Cb -0.06 -0.14 -0.00 0.00 -0.84 0.00 0.00 28.75 27.71 2qjm h GLU 346 CO -0.10 0.40 0.01 1.15 -1.40 0.00 0.00 179.01 179.08 2qjm h THR 347 N 0.63 1.03 -0.03 1.13 2.02 -1.15 -1.03 112.91 115.51 2qjm h THR 347 Ca 0.21 -0.07 0.01 0.00 0.77 0.00 0.00 66.41 67.33 2qjm h THR 347 Cb 0.02 1.04 -0.00 0.00 -1.74 0.00 0.00 68.15 67.48 2qjm h THR 347 CO -0.10 0.02 0.02 0.44 0.37 0.00 0.00 175.52 176.28 2qjm h ASP 348 N -0.00 0.00 -0.12 4.18 3.32 -0.74 -0.53 116.42 122.52 2qjm h ASP 348 Ca 0.01 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.91 2qjm h ASP 348 Cb 0.02 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.58 2qjm h ASP 348 CO -0.00 0.00 -0.52 0.00 -1.72 0.00 0.00 179.24 177.00 2qjm h ALA 349 N 1.98 0.22 -0.03 3.45 0.00 -0.20 -3.19 119.26 121.49 2qjm h ALA 349 Ca 0.01 -0.51 -0.11 0.00 0.00 0.00 0.00 54.91 54.31 2qjm h ALA 349 Cb 0.06 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2qjm h ALA 349 CO -0.00 0.41 -0.49 0.28 0.00 0.00 0.00 179.25 179.45 2qjm h VAL 350 N 0.17 1.35 -2.75 0.00 2.07 -0.36 -3.37 116.25 113.38 2qjm h VAL 350 Ca -0.03 -1.70 -0.64 0.00 0.82 0.00 0.00 66.70 65.16 2qjm h VAL 350 Cb 1.15 1.88 -0.40 0.00 -1.52 0.00 0.00 31.29 32.41 2qjm h VAL 350 CO 0.11 0.49 -0.42 0.49 0.02 0.00 0.00 177.57 178.26 2qjm n PHE 351 N -3.96 3.52 -1.67 1.57 3.72 -0.29 -0.53 117.46 119.82 2qjm n PHE 351 Ca -0.02 -4.12 -0.46 0.00 -0.05 0.00 0.00 57.45 52.81 2qjm n PHE 351 Cb 0.52 -0.72 -0.03 0.00 -0.94 0.00 0.00 39.48 38.30 2qjm n PHE 351 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 2qjm n PRO 352 N 1.51 2.04 -3.95 -1.08 -0.02 -1.15 -4.76 135.00 127.59 2qjm n PRO 352 Ca 0.25 0.73 -0.09 0.00 -2.02 0.00 0.00 63.50 62.36 2qjm n PRO 352 Cb 0.38 -2.43 -0.10 0.00 -0.02 0.00 0.00 33.50 31.33 2qjm n PRO 352 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 2qjm s HIS 353 N 0.34 0.22 -0.99 6.00 -3.43 -1.26 -1.40 115.29 114.76 2qjm s HIS 353 Ca 0.73 -0.48 -0.02 0.00 -0.80 0.00 0.00 55.06 54.48 2qjm s HIS 353 Cb -0.67 -0.16 0.29 0.00 -1.43 0.00 0.00 32.58 30.61 2qjm s HIS 353 CO 0.45 -0.28 1.31 -3.47 -2.00 0.00 0.00 174.74 170.75 2qjm n ASP 354 N 1.16 5.84 -3.59 7.38 2.03 -0.16 -4.95 116.55 124.27 2qjm n ASP 354 Ca -0.21 -3.40 -0.17 0.00 0.52 0.00 0.00 54.79 51.53 2qjm n ASP 354 Cb 0.57 -1.15 -0.07 0.00 -0.72 0.00 0.00 41.12 39.75 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 -2.65 -0.56 0.13 -0.67 -0.85 -1.26 0.11 117.35 111.60 2qjm s TYR 355 Ca 0.33 0.99 -0.05 0.00 -0.52 0.00 0.00 57.07 57.81 2qjm s TYR 355 Cb 0.06 0.33 -0.02 0.00 0.38 0.00 0.00 41.96 42.70 2qjm s TYR 355 CO 0.07 -0.54 0.15 1.67 -1.52 0.00 0.00 175.55 175.39 2qjm s TRP 356 N -1.09 0.59 -0.02 -3.49 -2.14 -0.28 -4.95 118.94 107.56 2qjm s TRP 356 Ca -0.11 -0.98 -0.01 0.00 2.66 0.00 0.00 56.10 57.67 2qjm s TRP 356 Cb -0.02 -0.27 -0.04 0.00 -3.10 0.00 0.00 33.47 30.05 2qjm s TRP 356 CO 0.08 -0.59 0.08 0.12 -2.66 0.00 0.00 176.95 173.97 2qjm s PHE 357 N -3.99 3.29 -0.30 1.66 5.36 -1.26 -0.26 117.98 122.48 2qjm s PHE 357 Ca 0.18 0.22 -0.12 0.00 -0.96 0.00 0.00 56.93 56.26 2qjm s PHE 357 Cb 0.06 -1.75 0.14 0.00 -0.34 0.00 0.00 43.02 41.12 2qjm s PHE 357 CO -0.01 0.55 0.75 -1.21 -1.46 0.00 0.00 175.22 173.85 2qjm s GLU 358 N -1.63 0.50 -1.10 10.12 0.41 0.15 -4.97 118.70 122.17 2qjm s GLU 358 Ca 0.22 1.23 -0.24 0.00 -0.41 0.00 0.00 54.97 55.77 2qjm s GLU 358 Cb -0.12 0.71 0.02 0.00 -1.78 0.00 0.00 34.13 32.96 2qjm s GLU 358 CO 0.12 -0.17 0.70 1.17 -0.49 0.00 0.00 175.26 176.60 2qjm n LYS 359 N 5.23 -0.78 -1.32 1.61 4.81 -1.26 -1.06 118.16 125.39 2qjm n LYS 359 Ca -0.12 0.36 -0.11 0.00 -0.87 0.00 0.00 58.31 57.57 2qjm n LYS 359 Cb 0.51 -3.02 -0.05 0.00 0.02 0.00 0.00 35.03 32.48 2qjm n LYS 359 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2qjm n GLY 360 N -1.89 1.18 3.15 3.14 0.00 -0.90 -4.85 105.19 105.02 2qjm n GLY 360 Ca -0.14 -0.27 -0.14 0.00 0.00 0.00 0.00 46.02 45.47 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 -2.79 0.78 0.06 1.61 2.02 -0.23 -2.72 118.70 117.43 2qjm s GLU 361 Ca 0.00 -1.08 0.06 0.00 0.02 0.00 0.00 54.97 53.97 2qjm s GLU 361 Cb 0.00 -0.46 -0.04 0.00 0.10 0.00 0.00 34.13 33.73 2qjm s GLU 361 CO 0.00 0.07 -0.14 -0.51 0.02 0.00 0.00 175.26 174.70 2qjm s LEU 362 N -2.29 2.85 0.03 1.80 1.43 0.04 0.34 118.68 122.88 2qjm s LEU 362 Ca 0.02 -0.37 0.03 0.00 -1.03 0.00 0.00 54.13 52.79 2qjm s LEU 362 Cb -0.04 -1.67 -0.02 0.00 0.03 0.00 0.00 46.19 44.50 2qjm s LEU 362 CO -0.00 0.23 -0.11 -0.36 0.23 0.00 0.00 176.35 176.34 2qjm s PHE 363 N -1.04 0.93 -0.07 0.29 0.08 0.65 -0.30 117.98 118.53 2qjm s PHE 363 Ca 0.17 -0.32 -0.00 0.00 0.12 0.00 0.00 56.93 56.90 2qjm s PHE 363 Cb -0.11 -0.57 -0.03 0.00 -0.57 0.00 0.00 43.02 41.75 2qjm s PHE 363 CO 0.08 -0.00 -0.03 0.54 -0.10 0.00 0.00 175.22 175.71 2qjm s VAL 364 N -0.77 4.02 0.98 -0.44 0.11 -1.26 -1.13 120.40 121.91 2qjm s VAL 364 Ca -0.01 -0.40 -0.16 0.00 -2.93 0.00 0.00 61.98 58.48 2qjm s VAL 364 Cb -0.07 -2.69 0.21 0.00 -1.53 0.00 0.00 36.38 32.30 2qjm s VAL 364 CO 0.01 0.57 1.33 -0.83 -3.33 0.00 0.00 175.10 172.85 2qjm s GLY 365 N -0.95 1.79 0.00 6.54 0.00 0.30 -4.95 107.32 110.06 2qjm s GLY 365 Ca 0.14 -1.24 0.26 0.00 0.00 0.00 0.00 44.72 43.88 2qjm s GLY 365 CO 0.03 -0.45 1.67 1.18 0.00 0.00 0.00 173.10 175.53 2qjm n GLU 366 N -3.81 1.74 -1.67 2.90 -0.58 -1.26 -4.88 120.64 113.08 2qjm n GLU 366 Ca 0.16 -1.08 -0.47 0.00 -0.42 0.00 0.00 57.16 55.35 2qjm n GLU 366 Cb 0.59 -1.46 -0.04 0.00 -0.57 0.00 0.00 31.44 29.96 2qjm n GLU 366 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 2qjm n THR 367 N 0.31 0.13 -1.66 2.62 -1.04 -1.26 -3.87 114.28 109.51 2qjm n THR 367 Ca 0.18 -0.02 -0.38 0.00 -2.04 0.00 0.00 64.05 61.79 2qjm n THR 367 Cb 0.37 -1.58 0.05 0.00 -1.82 0.00 0.00 70.33 67.35 2qjm n THR 367 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 2qjm n PRO 368 N 4.08 1.16 0.00 -2.82 -0.02 -1.26 -3.92 135.00 132.22 2qjm n PRO 368 Ca 0.18 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 2qjm n PRO 368 Cb 0.28 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 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 1.11 -1.53 0.61 -1.23 0.00 -0.90 -3.83 105.19 99.43 2qjm n GLY 369 Ca 0.13 -1.59 0.05 0.00 0.00 0.00 0.00 46.02 44.61 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 0.45 -1.03 1.61 1.44 -1.26 -0.53 115.22 115.90 2qjm n HIS 370 Ca 0.00 -0.22 -0.01 0.00 -2.01 0.00 0.00 57.72 55.48 2qjm n HIS 370 Cb 0.00 -0.01 -0.00 0.00 0.12 0.00 0.00 29.99 30.10 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 1.00 0.36 3.38 -1.39 0.00 -1.25 -4.50 105.19 102.78 2qjm n GLY 371 Ca 0.11 -0.06 -0.28 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.63 2.19 0.27 1.61 1.01 -1.26 -0.98 120.40 121.59 2qjm s VAL 372 Ca 0.00 -1.77 -0.04 0.00 0.00 0.00 0.00 61.98 60.17 2qjm s VAL 372 Cb 0.00 -1.95 -0.02 0.00 0.00 0.00 0.00 36.38 34.41 2qjm s VAL 372 CO 0.00 0.03 0.34 -0.62 0.00 0.00 0.00 175.10 174.85 2qjm s ASP 373 N -2.14 0.45 -0.04 3.32 3.68 -0.50 -4.88 116.67 116.57 2qjm s ASP 373 Ca 0.14 -1.32 0.04 0.00 2.13 0.00 0.00 52.55 53.53 2qjm s ASP 373 Cb -0.10 0.53 -0.00 0.00 -1.45 0.00 0.00 42.92 41.90 2qjm s ASP 373 CO 0.06 -1.07 -0.15 -0.51 0.13 0.00 0.00 175.17 173.63 2qjm s ILE 374 N -3.75 1.28 -0.81 4.11 2.07 -1.26 -2.95 121.20 119.90 2qjm s ILE 374 Ca 0.32 -0.64 -0.19 0.00 -1.41 0.00 0.00 60.65 58.74 2qjm s ILE 374 Cb 0.02 -1.11 0.13 0.00 0.13 0.00 0.00 42.46 41.64 2qjm s ILE 374 CO 0.15 0.37 0.96 -0.62 -1.91 0.00 0.00 174.94 173.89 2qjm s ASP 375 N 0.04 6.50 0.22 4.50 -1.08 0.31 -4.90 116.67 122.25 2qjm s ASP 375 Ca -0.03 -1.88 -0.09 0.00 -0.52 0.00 0.00 52.55 50.04 2qjm s ASP 375 Cb -0.10 -2.35 0.24 0.00 -1.46 0.00 0.00 42.92 39.25 2qjm s ASP 375 CO 0.02 -1.05 1.84 -0.33 0.52 0.00 0.00 175.17 176.16 2qjm h GLU 376 N 8.84 0.80 -0.65 4.34 5.08 -1.98 0.16 114.58 131.17 2qjm h GLU 376 Ca -0.01 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 2qjm h GLU 376 Cb 1.05 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 30.08 2qjm h GLU 376 CO 1.06 0.53 0.38 1.49 -1.00 0.00 0.00 179.01 181.47 2qjm h GLU 377 N 0.83 0.90 -0.17 2.33 4.81 -1.99 -1.63 114.58 119.65 2qjm h GLU 377 Ca 0.31 -0.09 -0.17 0.00 -0.13 0.00 0.00 59.36 59.28 2qjm h GLU 377 Cb 0.11 -0.18 -0.00 0.00 0.63 0.00 0.00 28.75 29.30 2qjm h GLU 377 CO -0.15 0.66 -0.61 1.25 -0.73 0.00 0.00 179.01 179.43 2qjm h LEU 378 N 0.89 0.64 -1.41 1.64 5.85 -1.85 -3.10 115.31 117.96 2qjm h LEU 378 Ca 0.23 -0.36 -0.03 0.00 0.84 0.00 0.00 57.88 58.56 2qjm h LEU 378 Cb 0.00 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 40.83 2qjm h LEU 378 CO -0.04 1.09 0.08 0.00 -0.34 0.00 0.00 178.44 179.23 2qjm h ALA 379 N 0.91 1.53 0.00 1.25 0.00 -0.32 -1.63 119.26 121.01 2qjm h ALA 379 Ca -0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2qjm h ALA 379 Cb 1.17 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.82 2qjm h ALA 379 CO 0.11 0.35 0.00 0.00 0.00 0.00 0.00 179.25 179.72 2qjm h ALA 380 N 1.62 1.00 0.00 0.00 0.00 -1.23 -1.69 119.26 118.97 2qjm h ALA 380 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2qjm h ALA 380 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2qjm h ALA 380 CO -0.00 0.00 0.00 1.63 0.00 0.00 0.00 179.25 180.88 2qjm n LYS 381 N -2.89 0.02 -3.90 0.00 4.01 -0.61 -4.37 118.16 110.43 2qjm n LYS 381 Ca -0.02 0.04 -0.29 0.00 -0.51 0.00 0.00 58.31 57.54 2qjm n LYS 381 Cb 0.13 -1.53 -0.13 0.00 -0.51 0.00 0.00 35.03 32.99 2qjm n LYS 381 CO 0.00 0.00 0.00 0.71 -1.11 0.00 0.00 177.40 177.00 2qjm s TYR 382 N -3.01 3.33 0.50 2.13 2.02 -0.64 -5.05 117.35 116.64 2qjm s TYR 382 Ca 0.13 -3.23 -0.22 0.00 -0.37 0.00 0.00 57.07 53.37 2qjm s TYR 382 Cb 0.18 -2.67 -0.06 0.00 -0.40 0.00 0.00 41.96 39.00 2qjm s TYR 382 CO 0.51 -0.62 1.28 -1.25 -1.57 0.00 0.00 175.55 173.90 2qjm s PRO 383 N -0.98 3.43 0.22 -1.71 0.04 -1.26 0.28 135.00 135.01 2qjm s PRO 383 Ca 0.22 2.05 -0.30 0.00 0.04 0.00 0.00 61.00 63.01 2qjm s PRO 383 Cb -0.12 -2.35 -0.15 0.00 0.04 0.00 0.00 34.50 31.92 2qjm s PRO 383 CO -0.11 -0.90 1.01 0.98 0.04 0.00 0.00 177.00 178.02 2qjm n TYR 384 N -0.75 1.04 -3.61 0.56 9.36 -1.26 -4.35 117.16 118.15 2qjm n TYR 384 Ca 0.09 0.74 -0.29 0.00 3.32 0.00 0.00 57.90 61.76 2qjm n TYR 384 Cb 0.46 -2.22 -0.15 0.00 -0.63 0.00 0.00 39.34 36.80 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 -0.96 0.31 -0.13 2.98 2.20 -1.26 -5.02 119.74 117.86 2qjm s LYS 385 Ca 0.66 -0.54 -0.38 0.00 -0.36 0.00 0.00 55.97 55.35 2qjm s LYS 385 Cb -0.81 -1.52 -0.15 0.00 -1.51 0.00 0.00 37.83 33.85 2qjm s LYS 385 CO 0.56 -0.92 1.64 -0.35 -0.36 0.00 0.00 175.35 175.93 2qjm n PRO 386 N 5.16 1.35 -3.90 4.03 -0.04 -1.26 -4.73 135.00 135.62 2qjm n PRO 386 Ca -0.06 0.49 -0.17 0.00 -0.04 0.00 0.00 63.50 63.73 2qjm n PRO 386 Cb 0.44 -2.19 -0.16 0.00 -0.04 0.00 0.00 33.50 31.54 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 2.63 0.28 0.09 0.55 0.00 -1.26 -4.51 121.76 119.55 2qjm s ALA 387 Ca 0.93 0.19 0.02 0.00 0.00 0.00 0.00 51.96 53.09 2qjm s ALA 387 Cb -0.96 -0.32 -0.04 0.00 0.00 0.00 0.00 23.12 21.80 2qjm s ALA 387 CO 0.57 -0.09 0.19 0.71 0.00 0.00 0.00 175.76 177.14 2qjm s TYR 388 N 1.05 3.40 0.39 0.00 2.02 -1.26 -4.02 117.35 118.94 2qjm s TYR 388 Ca -0.09 0.16 -0.14 0.00 -0.37 0.00 0.00 57.07 56.63 2qjm s TYR 388 Cb -0.13 -1.69 -0.08 0.00 -0.40 0.00 0.00 41.96 39.66 2qjm s TYR 388 CO -0.02 0.55 0.80 -1.17 -1.57 0.00 0.00 175.55 174.15 2qjm s LEU 389 N -2.68 3.89 0.97 -1.29 2.96 -1.26 -4.74 118.68 116.53 2qjm s LEU 389 Ca 0.33 1.29 -0.12 0.00 -0.22 0.00 0.00 54.13 55.41 2qjm s LEU 389 Cb -0.12 -4.15 0.17 0.00 0.50 0.00 0.00 46.19 42.59 2qjm s LEU 389 CO 0.26 -0.36 1.09 -2.84 -1.32 0.00 0.00 176.35 173.18 2qjm s PRO 390 N -3.53 0.62 0.14 0.98 0.02 -1.26 -4.47 135.00 127.50 2qjm s PRO 390 Ca 0.54 0.75 0.06 0.00 0.02 0.00 0.00 61.00 62.37 2qjm s PRO 390 Cb -0.10 -1.74 -0.04 0.00 0.02 0.00 0.00 34.50 32.64 2qjm s PRO 390 CO 0.25 -2.66 -0.15 0.14 -0.33 0.00 0.00 177.00 174.26 2qjm s VAL 391 N -2.86 1.43 0.09 3.83 -7.23 -0.15 -4.82 120.40 110.68 2qjm s VAL 391 Ca 0.65 -1.80 0.10 0.00 -1.81 0.00 0.00 61.98 59.12 2qjm s VAL 391 Cb -0.19 -1.63 -0.04 0.00 0.56 0.00 0.00 36.38 35.08 2qjm s VAL 391 CO 0.58 -0.42 -0.25 0.00 -0.31 0.00 0.00 175.10 174.70 2qjm s ALA 392 N -2.22 2.39 0.01 1.32 0.00 -1.26 -1.10 121.76 120.90 2qjm s ALA 392 Ca 0.11 -1.36 0.00 0.00 0.00 0.00 0.00 51.96 50.72 2qjm s ALA 392 Cb -0.04 -0.48 -0.01 0.00 0.00 0.00 0.00 23.12 22.59 2qjm s ALA 392 CO 0.04 0.55 -0.02 1.03 0.00 0.00 0.00 175.76 177.35 2qjm s ARG 393 N -1.70 0.17 0.86 0.00 0.52 -0.75 -0.47 118.95 117.59 2qjm s ARG 393 Ca 0.14 -0.22 -0.12 0.00 -0.52 0.00 0.00 55.73 55.01 2qjm s ARG 393 Cb -0.10 -0.06 0.11 0.00 0.52 0.00 0.00 34.95 35.42 2qjm s ARG 393 CO 0.05 0.01 1.12 -0.51 0.02 0.00 0.00 175.30 175.99 2qjm s LEU 394 N -0.46 2.28 0.61 2.53 1.43 1.00 -2.15 118.68 123.91 2qjm s LEU 394 Ca -0.04 1.12 0.30 0.00 -1.03 0.00 0.00 54.13 54.48 2qjm s LEU 394 Cb -0.03 -3.58 1.62 0.00 0.03 0.00 0.00 46.19 44.22 2qjm s LEU 394 CO -0.00 -2.30 2.00 -0.33 0.23 0.00 0.00 176.35 175.96 2qjm h GLU 395 N -1.32 0.00 -0.09 1.70 5.08 -1.89 0.12 114.58 118.18 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 1.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.55 2qjm h GLU 395 CO 0.61 0.00 0.00 -0.40 -1.00 0.00 0.00 179.01 178.22 2qjm n ASP 396 N -3.58 1.94 0.00 1.42 5.68 -1.26 -4.91 116.55 115.84 2qjm n ASP 396 Ca 0.03 -1.68 0.00 0.00 -0.50 0.00 0.00 54.79 52.65 2qjm n ASP 396 Cb 0.45 -0.05 0.00 0.00 -1.14 0.00 0.00 41.12 40.38 2qjm n ASP 396 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2qjm n GLY 397 N 1.22 0.26 3.69 6.12 0.00 0.40 -5.06 105.19 111.82 2qjm n GLY 397 Ca 0.17 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.75 2qjm n GLY 397 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2qjm n THR 398 N -1.73 0.05 -1.98 2.61 -1.04 -1.25 -4.61 114.28 106.33 2qjm n THR 398 Ca 0.00 -0.01 -0.42 0.00 -2.04 0.00 0.00 64.05 61.58 2qjm n THR 398 Cb 0.00 -1.78 -0.03 0.00 -1.82 0.00 0.00 70.33 66.70 2qjm n THR 398 CO 0.00 0.00 0.00 -0.32 -0.64 0.00 0.00 175.07 174.11 2qjm s MET 399 N 1.26 4.23 0.00 -2.82 1.75 -1.26 -0.00 119.30 122.46 2qjm s MET 399 Ca 0.78 2.29 0.00 0.00 -1.25 0.00 0.00 55.69 57.51 2qjm s MET 399 Cb -0.59 -3.34 0.00 0.00 2.84 0.00 0.00 34.83 33.74 2qjm s MET 399 CO 0.36 -0.62 0.00 1.87 -0.65 0.00 0.00 175.02 175.98 2qjm n TRP 400 N 4.58 0.00 -3.65 4.11 -0.00 0.38 -4.86 117.44 118.01 2qjm n TRP 400 Ca 0.14 0.00 -0.37 0.00 -0.00 0.00 0.00 57.50 57.27 2qjm n TRP 400 Cb 0.40 0.00 -0.11 0.00 -0.00 0.00 0.00 31.31 31.60 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 -0.21 5.94 0.00 5.87 0.01 -1.26 -4.34 114.94 120.95 2qjm s ASN 401 Ca 0.00 0.01 0.30 0.00 -0.71 0.00 0.00 52.86 52.46 2qjm s ASN 401 Cb 0.00 -2.09 1.77 0.00 0.41 0.00 0.00 41.25 41.35 2qjm s ASN 401 CO 0.00 0.00 2.11 1.87 -1.51 0.00 0.00 177.10 179.57