#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bi9 n ALA 3 N 0.00 -2.87 -3.32 3.17 0.00 -1.26 -4.93 120.51 111.30 1bi9 n ALA 3 Ca 0.00 0.90 -0.40 0.00 0.00 0.00 0.00 53.44 53.94 1bi9 n ALA 3 Cb 0.00 -3.26 -0.02 0.00 0.00 0.00 0.00 19.45 16.17 1bi9 n ALA 3 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1bi9 n SER 4 N -0.57 5.31 -2.77 0.00 7.64 -1.26 -4.93 113.62 117.04 1bi9 n SER 4 Ca 0.07 -3.23 -0.15 0.00 1.01 0.00 0.00 58.87 56.58 1bi9 n SER 4 Cb 0.49 -1.19 -0.05 0.00 -1.01 0.00 0.00 64.21 62.46 1bi9 n SER 4 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1bi9 n LEU 5 N 1.94 3.93 -4.23 -3.43 7.99 -1.26 -4.69 117.00 117.25 1bi9 n LEU 5 Ca 0.25 -2.45 -0.42 0.00 -0.01 0.00 0.00 56.01 53.38 1bi9 n LEU 5 Cb 0.37 -0.94 -0.04 0.00 -0.11 0.00 0.00 43.42 42.69 1bi9 n LEU 5 CO 0.52 0.61 0.39 -1.10 -1.51 0.00 0.00 177.39 176.29 1bi9 s GLN 6 N 2.82 3.42 0.25 3.23 -0.21 -1.26 -5.04 119.66 122.87 1bi9 s GLN 6 Ca 0.37 -2.79 0.10 0.00 0.02 0.00 0.00 55.36 53.06 1bi9 s GLN 6 Cb 0.13 -4.20 -0.04 0.00 1.00 0.00 0.00 33.01 29.90 1bi9 s GLN 6 CO -0.02 -1.25 -0.04 -0.51 -2.12 0.00 0.00 175.29 171.36 1bi9 s LEU 7 N -0.47 3.10 0.00 2.90 1.43 -1.26 -5.08 118.68 119.30 1bi9 s LEU 7 Ca 0.22 -0.67 0.00 0.00 -1.03 0.00 0.00 54.13 52.65 1bi9 s LEU 7 Cb -0.12 -1.65 0.00 0.00 0.03 0.00 0.00 46.19 44.45 1bi9 s LEU 7 CO -0.08 0.02 0.44 0.00 0.23 0.00 0.00 176.35 176.96 1bi9 n LEU 8 N -0.72 -0.14 -3.98 1.79 -0.00 -1.26 -5.10 117.00 107.58 1bi9 n LEU 8 Ca -0.07 -0.88 -0.30 0.00 -0.00 0.00 0.00 56.01 54.76 1bi9 n LEU 8 Cb 0.59 0.00 -0.14 0.00 -0.00 0.00 0.00 43.42 43.86 1bi9 n LEU 8 CO 0.39 0.94 -0.26 -2.16 -0.00 0.00 0.00 177.39 176.31 1bi9 s PRO 9 N 0.00 1.72 0.04 1.47 0.04 -1.26 -5.10 135.00 131.91 1bi9 s PRO 9 Ca 0.00 -2.25 0.00 0.00 0.04 0.00 0.00 61.00 58.80 1bi9 s PRO 9 Cb 0.00 -3.25 -0.03 0.00 0.04 0.00 0.00 34.50 31.26 1bi9 s PRO 9 CO 0.00 -1.03 -0.04 -1.54 0.04 0.00 0.00 177.00 174.43 1bi9 s SER 10 N 0.31 0.55 0.00 6.66 1.04 -1.26 -4.98 113.70 116.02 1bi9 s SER 10 Ca 0.14 -0.73 0.00 0.00 0.48 0.00 0.00 55.95 55.84 1bi9 s SER 10 Cb -0.23 0.12 0.00 0.00 0.10 0.00 0.00 66.02 66.01 1bi9 s SER 10 CO -0.04 -0.40 0.00 -0.81 0.98 0.00 0.00 173.24 172.97 1bi9 n PRO 11 N 0.91 2.92 -3.77 4.02 -0.04 -1.26 -4.97 135.00 132.81 1bi9 n PRO 11 Ca -0.19 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.13 1bi9 n PRO 11 Cb 0.58 0.00 -0.14 0.00 -0.04 0.00 0.00 33.50 33.89 1bi9 n PRO 11 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1bi9 s THR 12 N 0.00 -0.04 -0.11 0.52 -4.23 -1.26 -4.93 115.64 105.58 1bi9 s THR 12 Ca 0.00 0.15 -0.33 0.00 -1.18 0.00 0.00 61.69 60.33 1bi9 s THR 12 Cb 0.00 -0.19 -0.11 0.00 1.34 0.00 0.00 72.50 73.54 1bi9 s THR 12 CO 0.00 0.06 1.96 -0.81 -0.54 0.00 0.00 174.62 175.29 1bi9 n PRO 13 N 3.98 2.14 -2.83 3.99 -0.04 -1.26 -3.55 135.00 137.43 1bi9 n PRO 13 Ca -0.24 0.76 -0.20 0.00 -0.04 0.00 0.00 63.50 63.78 1bi9 n PRO 13 Cb 0.53 -2.73 0.01 0.00 -0.04 0.00 0.00 33.50 31.27 1bi9 n PRO 13 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1bi9 n ASN 14 N 7.54 -3.10 -4.76 3.54 5.03 -1.26 -4.77 115.26 117.48 1bi9 n ASN 14 Ca 0.25 -0.30 -0.41 0.00 0.87 0.00 0.00 54.58 54.98 1bi9 n ASN 14 Cb 0.32 -0.95 -0.01 0.00 -1.02 0.00 0.00 39.78 38.12 1bi9 n ASN 14 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 1bi9 s LEU 15 N -2.42 4.33 -0.38 3.41 2.96 -1.23 -4.96 118.68 120.39 1bi9 s LEU 15 Ca 0.14 3.02 -0.17 0.00 -0.22 0.00 0.00 54.13 56.90 1bi9 s LEU 15 Cb -0.01 -3.65 0.00 0.00 0.50 0.00 0.00 46.19 43.03 1bi9 s LEU 15 CO 0.53 -0.92 0.46 -1.61 -1.32 0.00 0.00 176.35 173.49 1bi9 s GLU 16 N -1.19 3.40 -0.57 1.98 2.02 -1.26 -5.00 118.70 118.09 1bi9 s GLU 16 Ca 0.59 -0.44 -0.26 0.00 0.02 0.00 0.00 54.97 54.88 1bi9 s GLU 16 Cb -0.48 -3.87 -0.05 0.00 0.10 0.00 0.00 34.13 29.83 1bi9 s GLU 16 CO 0.55 -0.72 2.14 0.42 0.02 0.00 0.00 175.26 177.67 1bi9 s ILE 17 N 2.26 3.18 0.15 -1.63 -1.09 -1.26 -4.81 121.20 118.00 1bi9 s ILE 17 Ca 0.15 0.08 -0.01 0.00 -2.23 0.00 0.00 60.65 58.64 1bi9 s ILE 17 Cb -0.16 -3.48 -0.16 0.00 -1.58 0.00 0.00 42.46 37.08 1bi9 s ILE 17 CO 0.14 -0.47 1.36 0.50 -1.23 0.00 0.00 174.94 175.23 1bi9 h LYS 18 N 16.95 0.33 -4.65 2.79 3.64 -2.01 -3.43 116.57 130.19 1bi9 h LYS 18 Ca -0.23 -0.34 -0.70 0.00 -1.27 0.00 0.00 60.65 58.11 1bi9 h LYS 18 Cb 1.20 0.09 -0.27 0.00 -0.41 0.00 0.00 32.23 32.84 1bi9 h LYS 18 CO 1.18 1.02 -0.58 0.71 -2.27 0.00 0.00 179.45 179.52 1bi9 s TYR 19 N -3.31 3.25 -0.00 1.91 2.02 -1.26 -4.88 117.35 115.07 1bi9 s TYR 19 Ca -0.05 -1.28 0.00 0.00 -0.37 0.00 0.00 57.07 55.38 1bi9 s TYR 19 Cb 0.10 -2.33 0.00 0.00 -0.40 0.00 0.00 41.96 39.33 1bi9 s TYR 19 CO 0.85 -0.70 0.61 0.25 -1.57 0.00 0.00 175.55 174.99 1bi9 n THR 20 N 4.87 0.22 -3.95 -0.71 -2.24 -1.26 -4.74 114.28 106.46 1bi9 n THR 20 Ca -0.12 -0.22 -0.22 0.00 -2.27 0.00 0.00 64.05 61.22 1bi9 n THR 20 Cb 0.45 0.89 -0.05 0.00 -2.10 0.00 0.00 70.33 69.52 1bi9 n THR 20 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1bi9 s LYS 21 N -0.22 2.57 0.53 -0.78 1.02 -1.26 -1.25 119.74 120.35 1bi9 s LYS 21 Ca 0.00 -1.40 -0.21 0.00 0.02 0.00 0.00 55.97 54.38 1bi9 s LYS 21 Cb 0.00 -2.34 -0.05 0.00 -0.52 0.00 0.00 37.83 34.92 1bi9 s LYS 21 CO 0.00 0.12 1.27 0.42 -0.92 0.00 0.00 175.35 176.23 1bi9 s ILE 22 N -2.35 2.51 -0.40 2.17 1.01 -0.96 -4.81 121.20 118.37 1bi9 s ILE 22 Ca 0.39 0.37 0.02 0.00 0.00 0.00 0.00 60.65 61.43 1bi9 s ILE 22 Cb -0.04 -3.18 0.11 0.00 0.01 0.00 0.00 42.46 39.36 1bi9 s ILE 22 CO 0.25 -0.02 0.15 0.12 0.00 0.00 0.00 174.94 175.44 1bi9 s PHE 23 N -1.44 3.62 -0.03 3.97 5.36 -0.66 -0.94 117.98 127.86 1bi9 s PHE 23 Ca 0.70 -2.84 0.06 0.00 -0.96 0.00 0.00 56.93 53.89 1bi9 s PHE 23 Cb -0.35 -3.02 -0.01 0.00 -0.34 0.00 0.00 43.02 39.30 1bi9 s PHE 23 CO 0.40 -0.92 -0.21 0.42 -1.46 0.00 0.00 175.22 173.45 1bi9 s ILE 24 N 0.74 1.73 -1.49 3.12 1.01 -0.25 -1.08 121.20 124.99 1bi9 s ILE 24 Ca 0.11 -0.91 -0.06 0.00 0.00 0.00 0.00 60.65 59.79 1bi9 s ILE 24 Cb -0.21 -1.46 0.05 0.00 0.01 0.00 0.00 42.46 40.85 1bi9 s ILE 24 CO -0.06 0.49 0.57 -3.20 0.00 0.00 0.00 174.94 172.75 1bi9 n ASN 25 N 2.80 -1.49 -1.69 3.58 5.15 -1.26 0.36 115.26 122.71 1bi9 n ASN 25 Ca -0.17 -0.98 -0.17 0.00 -0.60 0.00 0.00 54.58 52.67 1bi9 n ASN 25 Cb 0.52 -3.10 -0.06 0.00 -0.53 0.00 0.00 39.78 36.62 1bi9 n ASN 25 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1bi9 n ASN 26 N -2.89 -4.54 -4.19 1.20 3.02 -1.26 -4.55 115.26 102.04 1bi9 n ASN 26 Ca -0.18 0.34 -0.26 0.00 -0.03 0.00 0.00 54.58 54.45 1bi9 n ASN 26 Cb 0.62 -4.04 -0.16 0.00 -0.61 0.00 0.00 39.78 35.60 1bi9 n ASN 26 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1bi9 s GLU 27 N -3.77 1.62 -0.42 3.52 0.41 0.16 -5.02 118.70 115.21 1bi9 s GLU 27 Ca 0.00 -0.68 -0.23 0.00 -0.41 0.00 0.00 54.97 53.65 1bi9 s GLU 27 Cb 0.00 -1.53 0.02 0.00 -1.78 0.00 0.00 34.13 30.84 1bi9 s GLU 27 CO 0.00 0.39 0.79 -1.58 -0.49 0.00 0.00 175.26 174.36 1bi9 s TRP 28 N -0.37 3.04 0.48 1.61 0.52 -1.26 -1.09 118.94 121.87 1bi9 s TRP 28 Ca 0.05 0.33 0.08 0.00 0.02 0.00 0.00 56.10 56.58 1bi9 s TRP 28 Cb -0.08 -3.57 0.03 0.00 -1.15 0.00 0.00 33.47 28.70 1bi9 s TRP 28 CO -0.00 -0.89 0.58 -0.65 0.02 0.00 0.00 176.95 176.01 1bi9 s GLN 29 N 3.23 2.52 0.13 4.98 -1.52 -0.11 -4.93 119.66 123.95 1bi9 s GLN 29 Ca 0.31 -1.53 0.09 0.00 -1.95 0.00 0.00 55.36 52.27 1bi9 s GLN 29 Cb -0.12 -2.56 -0.04 0.00 -0.22 0.00 0.00 33.01 30.07 1bi9 s GLN 29 CO 0.20 -0.49 -0.15 -0.80 -0.25 0.00 0.00 175.29 173.80 1bi9 s ASN 30 N -4.39 4.02 0.27 5.90 0.02 -1.26 -2.27 114.94 117.23 1bi9 s ASN 30 Ca 0.53 -0.54 -0.30 0.00 -1.02 0.00 0.00 52.86 51.53 1bi9 s ASN 30 Cb -0.06 -0.62 -0.13 0.00 0.02 0.00 0.00 41.25 40.46 1bi9 s ASN 30 CO 0.32 0.16 1.42 -1.54 0.02 0.00 0.00 177.10 177.49 1bi9 n SER 31 N 0.65 2.97 -0.33 -1.22 3.41 -1.26 -4.83 113.62 113.00 1bi9 n SER 31 Ca -0.14 1.16 0.22 0.00 -0.26 0.00 0.00 58.87 59.84 1bi9 n SER 31 Cb 0.53 -1.47 0.49 0.00 -0.26 0.00 0.00 64.21 63.50 1bi9 n SER 31 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1bi9 h GLU 32 N 4.02 0.41 0.01 4.33 4.39 -1.95 -0.64 114.58 125.14 1bi9 h GLU 32 Ca -0.46 -0.02 -0.24 0.00 0.34 0.00 0.00 59.36 58.98 1bi9 h GLU 32 Cb 1.27 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 29.79 1bi9 h GLU 32 CO 0.74 0.27 -1.21 0.66 -1.16 0.00 0.00 179.01 178.31 1bi9 h SER 33 N 0.42 0.04 0.00 1.42 4.64 -1.89 -3.48 113.55 114.70 1bi9 h SER 33 Ca 0.62 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.89 1bi9 h SER 33 Cb 1.50 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.57 1bi9 h SER 33 CO -0.34 1.04 0.00 0.61 -0.87 0.00 0.00 176.83 177.27 1bi9 n GLY 34 N 1.42 0.58 3.77 -0.77 0.00 -0.25 -5.07 105.19 104.88 1bi9 n GLY 34 Ca -0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.66 1bi9 n GLY 34 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bi9 s ARG 35 N -0.90 2.37 -0.06 1.61 0.52 -1.26 -4.95 118.95 116.26 1bi9 s ARG 35 Ca 0.00 1.15 -0.19 0.00 -0.52 0.00 0.00 55.73 56.18 1bi9 s ARG 35 Cb 0.00 -1.91 0.04 0.00 0.52 0.00 0.00 34.95 33.60 1bi9 s ARG 35 CO 0.00 -1.56 0.43 0.08 0.02 0.00 0.00 175.30 174.27 1bi9 s VAL 36 N -2.89 0.03 0.09 3.52 1.01 -1.26 -2.41 120.40 118.48 1bi9 s VAL 36 Ca 0.61 -0.25 0.07 0.00 0.00 0.00 0.00 61.98 62.42 1bi9 s VAL 36 Cb -0.17 -0.71 -0.03 0.00 0.00 0.00 0.00 36.38 35.47 1bi9 s VAL 36 CO 0.55 -0.14 -0.19 0.72 0.00 0.00 0.00 175.10 176.04 1bi9 s PHE 37 N -0.90 1.65 0.39 5.22 -0.71 -0.81 -4.87 117.98 117.95 1bi9 s PHE 37 Ca -0.10 -0.42 -0.14 0.00 -1.04 0.00 0.00 56.93 55.23 1bi9 s PHE 37 Cb -0.04 -0.92 -0.08 0.00 -1.21 0.00 0.00 43.02 40.78 1bi9 s PHE 37 CO 0.05 0.16 0.80 -1.25 -1.34 0.00 0.00 175.22 173.64 1bi9 s PRO 38 N -1.76 3.94 -0.10 1.99 0.04 -1.26 -1.38 135.00 136.46 1bi9 s PRO 38 Ca 0.05 0.68 0.03 0.00 0.04 0.00 0.00 61.00 61.80 1bi9 s PRO 38 Cb -0.10 -2.35 -0.00 0.00 0.04 0.00 0.00 34.50 32.09 1bi9 s PRO 38 CO 0.03 0.01 -0.22 0.08 0.04 0.00 0.00 177.00 176.95 1bi9 s VAL 39 N -2.23 2.27 0.16 -0.36 1.01 -0.37 -4.93 120.40 115.95 1bi9 s VAL 39 Ca 0.54 -0.95 0.11 0.00 0.00 0.00 0.00 61.98 61.69 1bi9 s VAL 39 Cb -0.10 -1.88 -0.04 0.00 0.00 0.00 0.00 36.38 34.36 1bi9 s VAL 39 CO 0.24 0.55 -0.25 0.00 0.00 0.00 0.00 175.10 175.64 1bi9 s ASN 41 N -2.35 6.61 0.22 0.00 3.84 0.85 -4.84 114.94 119.27 1bi9 s ASN 41 Ca 0.17 0.81 0.17 0.00 0.21 0.00 0.00 52.86 54.22 1bi9 s ASN 41 Cb -0.09 -2.54 0.86 0.00 -0.55 0.00 0.00 41.25 38.92 1bi9 s ASN 41 CO 0.08 -1.21 1.51 -0.81 -2.79 0.00 0.00 177.10 173.88 1bi9 n PRO 42 N 7.65 0.11 -0.01 0.43 -0.04 -1.26 -0.29 135.00 141.58 1bi9 n PRO 42 Ca 0.14 0.56 -0.16 0.00 -0.04 0.00 0.00 63.50 64.00 1bi9 n PRO 42 Cb 0.48 -1.82 -0.14 0.00 -0.04 0.00 0.00 33.50 31.98 1bi9 n PRO 42 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1bi9 n ALA 43 N -1.70 1.16 -0.07 0.55 0.00 -1.26 -2.40 120.51 116.78 1bi9 n ALA 43 Ca -0.00 -0.69 -0.06 0.00 0.00 0.00 0.00 53.44 52.69 1bi9 n ALA 43 Cb 0.06 -0.72 -0.12 0.00 0.00 0.00 0.00 19.45 18.67 1bi9 n ALA 43 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1bi9 n THR 44 N -3.28 0.95 0.00 0.00 -2.24 -1.08 -2.24 114.28 106.38 1bi9 n THR 44 Ca -0.26 -0.63 0.00 0.00 -2.27 0.00 0.00 64.05 60.89 1bi9 n THR 44 Cb 1.05 -0.51 0.00 0.00 -2.10 0.00 0.00 70.33 68.77 1bi9 n THR 44 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bi9 n GLY 45 N 1.99 2.39 3.77 3.38 0.00 0.60 -3.22 105.19 114.10 1bi9 n GLY 45 Ca -0.23 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.45 1bi9 n GLY 45 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1bi9 s GLU 46 N -0.71 2.97 0.24 1.61 2.12 -1.25 -4.66 118.70 119.02 1bi9 s GLU 46 Ca 0.00 1.53 -0.30 0.00 0.36 0.00 0.00 54.97 56.56 1bi9 s GLU 46 Cb 0.00 -1.96 -0.09 0.00 0.26 0.00 0.00 34.13 32.34 1bi9 s GLU 46 CO 0.00 -1.14 0.99 -1.14 -0.54 0.00 0.00 175.26 173.43 1bi9 s GLN 47 N -3.73 4.78 -0.21 4.30 0.74 -1.26 -0.10 119.66 124.18 1bi9 s GLN 47 Ca 0.70 1.58 -0.06 0.00 0.05 0.00 0.00 55.36 57.63 1bi9 s GLN 47 Cb -0.23 -3.26 -0.20 0.00 1.10 0.00 0.00 33.01 30.42 1bi9 s GLN 47 CO 0.36 0.40 0.02 0.28 -0.55 0.00 0.00 175.29 175.80 1bi9 n VAL 48 N 1.52 1.61 -3.99 1.34 0.31 0.74 -4.82 118.33 115.03 1bi9 n VAL 48 Ca -0.01 -0.51 0.02 0.00 -0.01 0.00 0.00 64.34 63.83 1bi9 n VAL 48 Cb 0.46 -1.67 0.00 0.00 -0.91 0.00 0.00 33.84 31.72 1bi9 n VAL 48 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1bi9 s GLU 50 N -2.00 2.07 0.06 0.00 2.02 -1.26 -1.24 118.70 118.35 1bi9 s GLU 50 Ca 0.12 -0.96 0.09 0.00 0.02 0.00 0.00 54.97 54.24 1bi9 s GLU 50 Cb -0.00 -2.04 -0.03 0.00 0.10 0.00 0.00 34.13 32.16 1bi9 s GLU 50 CO -0.01 0.55 -0.23 0.08 0.02 0.00 0.00 175.26 175.68 1bi9 s VAL 51 N -0.64 2.45 0.27 2.63 1.01 -0.48 -4.83 120.40 120.81 1bi9 s VAL 51 Ca 0.10 -1.38 -0.30 0.00 0.00 0.00 0.00 61.98 60.40 1bi9 s VAL 51 Cb -0.10 -2.02 -0.10 0.00 0.00 0.00 0.00 36.38 34.16 1bi9 s VAL 51 CO -0.00 0.29 1.47 -1.10 0.00 0.00 0.00 175.10 175.76 1bi9 s GLN 52 N -1.51 4.23 -0.38 2.72 -1.52 -0.38 -1.92 119.66 120.91 1bi9 s GLN 52 Ca 0.14 2.37 -0.14 0.00 -1.95 0.00 0.00 55.36 55.78 1bi9 s GLN 52 Cb -0.10 -3.08 0.01 0.00 -0.22 0.00 0.00 33.01 29.61 1bi9 s GLN 52 CO 0.04 -0.47 0.26 -2.00 -0.25 0.00 0.00 175.29 172.88 1bi9 s GLU 53 N -0.51 3.15 0.65 2.91 2.12 -1.01 -4.62 118.70 121.39 1bi9 s GLU 53 Ca 0.60 -0.88 -0.12 0.00 0.36 0.00 0.00 54.97 54.93 1bi9 s GLU 53 Cb -0.43 -3.87 -0.02 0.00 0.26 0.00 0.00 34.13 30.06 1bi9 s GLU 53 CO 0.45 -0.62 1.04 0.00 -0.54 0.00 0.00 175.26 175.59 1bi9 s ALA 54 N 1.68 2.87 0.09 6.30 0.00 -0.11 -4.72 121.76 127.87 1bi9 s ALA 54 Ca 0.05 0.05 -0.02 0.00 0.00 0.00 0.00 51.96 52.05 1bi9 s ALA 54 Cb -0.18 -3.14 0.01 0.00 0.00 0.00 0.00 23.12 19.80 1bi9 s ALA 54 CO 0.10 -0.92 0.15 -3.47 0.00 0.00 0.00 175.76 171.62 1bi9 n ASP 55 N -2.78 -0.43 -0.10 0.00 -0.08 -1.26 -4.34 116.55 107.55 1bi9 n ASP 55 Ca 0.07 -1.46 -0.03 0.00 -1.51 0.00 0.00 54.79 51.87 1bi9 n ASP 55 Cb 0.54 0.76 -0.02 0.00 2.34 0.00 0.00 41.12 44.73 1bi9 n ASP 55 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1bi9 n LYS 56 N -0.14 -0.11 -0.22 -0.67 4.76 -1.26 -0.50 118.16 120.01 1bi9 n LYS 56 Ca -0.01 0.73 0.03 0.00 -2.87 0.00 0.00 58.31 56.19 1bi9 n LYS 56 Cb 0.15 -1.08 0.14 0.00 -1.84 0.00 0.00 35.03 32.40 1bi9 n LYS 56 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 1bi9 h VAL 57 N 0.00 0.53 -0.61 -0.18 2.07 -1.99 -1.09 116.25 114.97 1bi9 h VAL 57 Ca 0.04 -0.07 -0.02 0.00 0.82 0.00 0.00 66.70 67.47 1bi9 h VAL 57 Cb 0.10 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 30.14 1bi9 h VAL 57 CO -0.23 0.04 0.32 0.44 0.02 0.00 0.00 177.57 178.16 1bi9 h ASP 58 N 0.21 0.78 -0.82 0.57 3.32 -1.18 -2.48 116.42 116.81 1bi9 h ASP 58 Ca 0.36 -0.11 0.05 0.00 0.02 0.00 0.00 57.03 57.35 1bi9 h ASP 58 Cb 0.59 -0.20 -0.05 0.00 0.22 0.00 0.00 39.33 39.89 1bi9 h ASP 58 CO -0.50 0.66 0.52 0.40 -1.72 0.00 0.00 179.24 178.60 1bi9 h ILE 59 N 0.83 1.08 -0.49 0.35 1.08 0.03 -2.56 117.51 117.83 1bi9 h ILE 59 Ca 0.21 -0.34 0.06 0.00 -0.39 0.00 0.00 64.86 64.41 1bi9 h ILE 59 Cb 0.07 0.02 -0.05 0.00 -3.07 0.00 0.00 36.82 33.79 1bi9 h ILE 59 CO -0.03 0.18 0.18 0.44 -0.69 0.00 0.00 178.15 178.23 1bi9 h ASP 60 N 0.98 0.19 -0.44 1.72 5.19 -0.86 0.86 116.42 124.06 1bi9 h ASP 60 Ca 0.34 0.06 -0.06 0.00 -0.62 0.00 0.00 57.03 56.75 1bi9 h ASP 60 Cb 0.09 0.03 -0.02 0.00 0.18 0.00 0.00 39.33 39.61 1bi9 h ASP 60 CO -0.14 0.14 0.05 0.11 -3.12 0.00 0.00 179.24 176.28 1bi9 h LYS 61 N 0.36 0.73 -0.97 3.56 1.57 -1.36 0.11 116.57 120.58 1bi9 h LYS 61 Ca 0.23 -0.21 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1bi9 h LYS 61 Cb 0.24 -0.08 -0.05 0.00 0.08 0.00 0.00 32.23 32.42 1bi9 h LYS 61 CO -0.23 0.77 0.60 0.00 -0.57 0.00 0.00 179.45 180.02 1bi9 h ALA 62 N 0.93 1.23 -0.32 3.86 0.00 -1.06 0.44 119.26 124.34 1bi9 h ALA 62 Ca 0.13 -0.10 -0.12 0.00 0.00 0.00 0.00 54.91 54.82 1bi9 h ALA 62 Cb 0.41 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1bi9 h ALA 62 CO 0.01 0.67 -0.31 0.28 0.00 0.00 0.00 179.25 179.90 1bi9 h VAL 63 N 1.33 1.28 -0.16 0.00 2.07 -0.54 -0.79 116.25 119.44 1bi9 h VAL 63 Ca 0.35 -1.44 -0.01 0.00 0.82 0.00 0.00 66.70 66.42 1bi9 h VAL 63 Cb -0.08 1.37 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 1bi9 h VAL 63 CO -0.07 0.47 0.05 1.56 0.02 0.00 0.00 177.57 179.59 1bi9 h GLN 64 N 0.58 0.25 -0.70 1.57 4.20 0.13 0.13 115.11 121.27 1bi9 h GLN 64 Ca 0.07 -0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.69 1bi9 h GLN 64 Cb 0.81 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.53 1bi9 h GLN 64 CO 0.07 0.38 0.34 0.00 -0.67 0.00 0.00 178.83 178.95 1bi9 h ALA 65 N 0.86 0.90 -0.56 3.87 0.00 -0.08 -0.43 119.26 123.80 1bi9 h ALA 65 Ca 0.05 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 1bi9 h ALA 65 Cb 0.24 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1bi9 h ALA 65 CO -0.00 0.46 0.18 0.00 0.00 0.00 0.00 179.25 179.89 1bi9 h ALA 66 N 1.16 0.74 0.17 0.00 0.00 -1.02 -0.89 119.26 119.43 1bi9 h ALA 66 Ca 0.24 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.97 1bi9 h ALA 66 Cb 0.12 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 1bi9 h ALA 66 CO -0.03 0.40 -0.28 -0.09 0.00 0.00 0.00 179.25 179.25 1bi9 h ARG 67 N 0.79 -0.51 -0.98 0.00 9.65 -0.42 -1.63 114.38 121.28 1bi9 h ARG 67 Ca 0.18 0.03 0.09 0.00 -1.10 0.00 0.00 59.98 59.18 1bi9 h ARG 67 Cb 0.28 0.12 -0.07 0.00 -1.39 0.00 0.00 29.97 28.90 1bi9 h ARG 67 CO -0.01 -0.34 0.62 1.25 2.80 0.00 0.00 179.97 184.29 1bi9 h LEU 68 N -0.53 0.96 0.00 3.80 5.85 -0.95 -0.78 115.31 123.66 1bi9 h LEU 68 Ca 0.02 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1bi9 h LEU 68 Cb 0.53 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.39 1bi9 h LEU 68 CO -0.13 0.58 0.00 0.00 -0.34 0.00 0.00 178.44 178.55 1bi9 n ALA 69 N -2.36 1.58 0.24 1.25 0.00 -0.35 -2.66 120.51 118.21 1bi9 n ALA 69 Ca 0.16 -0.04 0.03 0.00 0.00 0.00 0.00 53.44 53.58 1bi9 n ALA 69 Cb 0.25 -1.18 -0.00 0.00 0.00 0.00 0.00 19.45 18.52 1bi9 n ALA 69 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1bi9 n PHE 70 N -1.39 0.00 -1.90 0.00 7.35 -0.33 -4.48 117.46 116.71 1bi9 n PHE 70 Ca 0.04 0.00 -0.35 0.00 -0.76 0.00 0.00 57.45 56.38 1bi9 n PHE 70 Cb 0.11 0.00 0.04 0.00 0.35 0.00 0.00 39.48 39.98 1bi9 n PHE 70 CO 0.00 0.00 0.00 -1.54 -0.76 0.00 0.00 176.76 174.46 1bi9 s SER 71 N -1.02 5.05 0.00 -2.13 1.04 -1.05 -4.88 113.70 110.71 1bi9 s SER 71 Ca 0.04 2.31 0.00 0.00 0.48 0.00 0.00 55.95 58.78 1bi9 s SER 71 Cb 0.04 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.57 1bi9 s SER 71 CO 0.15 -1.68 0.00 0.18 0.98 0.00 0.00 173.24 172.86 1bi9 n LEU 72 N -1.88 0.00 -0.13 2.42 4.77 -1.26 -0.58 117.00 120.35 1bi9 n LEU 72 Ca 0.13 0.00 0.22 0.00 -0.03 0.00 0.00 56.01 56.32 1bi9 n LEU 72 Cb 0.50 0.00 0.33 0.00 -2.33 0.00 0.00 43.42 41.92 1bi9 n LEU 72 CO 0.45 0.00 1.09 0.61 -1.33 0.00 0.00 177.39 178.21 1bi9 n GLY 73 N 0.00 -0.65 0.57 -0.72 0.00 -1.26 -4.61 105.19 98.52 1bi9 n GLY 73 Ca 0.00 0.28 -0.08 0.00 0.00 0.00 0.00 46.02 46.22 1bi9 n GLY 73 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1bi9 n SER 74 N -2.93 -0.36 -0.13 1.61 2.88 0.26 -4.64 113.62 110.31 1bi9 n SER 74 Ca 0.18 0.16 -0.12 0.00 -1.33 0.00 0.00 58.87 57.76 1bi9 n SER 74 Cb 1.31 -0.15 -0.02 0.00 -0.75 0.00 0.00 64.21 64.59 1bi9 n SER 74 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 1bi9 h VAL 75 N 0.11 1.28 0.00 2.46 2.07 -1.86 -2.23 116.25 118.08 1bi9 h VAL 75 Ca -0.06 -1.42 -0.00 0.00 0.82 0.00 0.00 66.70 66.04 1bi9 h VAL 75 Cb 0.24 1.34 -0.00 0.00 -1.52 0.00 0.00 31.29 31.36 1bi9 h VAL 75 CO 0.09 0.47 -0.00 -0.25 0.02 0.00 0.00 177.57 177.90 1bi9 h TRP 76 N 0.67 0.00 0.00 1.57 2.91 -1.90 -2.43 115.95 116.77 1bi9 h TRP 76 Ca 0.08 0.00 -0.19 0.00 1.13 0.00 0.00 58.89 59.90 1bi9 h TRP 76 Cb 0.84 0.00 -0.03 0.00 -0.51 0.00 0.00 29.16 29.45 1bi9 h TRP 76 CO 0.06 0.00 -1.35 0.00 -1.03 0.00 0.00 178.44 176.12 1bi9 h ARG 77 N 0.00 0.00 0.00 2.65 2.47 -1.74 -3.35 114.38 114.41 1bi9 h ARG 77 Ca -0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1bi9 h ARG 77 Cb 0.53 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.85 1bi9 h ARG 77 CO 0.00 0.41 -1.02 0.54 0.56 0.00 0.00 179.97 180.46 1bi9 n ARG 78 N -3.00 0.29 -1.63 0.04 1.74 -0.86 -4.96 116.66 108.29 1bi9 n ARG 78 Ca -0.09 -0.00 -0.41 0.00 -0.77 0.00 0.00 57.85 56.58 1bi9 n ARG 78 Cb 0.88 -1.59 0.02 0.00 -1.02 0.00 0.00 32.46 30.75 1bi9 n ARG 78 CO 0.00 0.00 0.00 -0.12 -1.52 0.00 0.00 177.63 175.99 1bi9 n MET 79 N -1.96 1.38 -2.01 5.56 1.56 -0.92 -4.92 117.12 115.80 1bi9 n MET 79 Ca 0.02 0.50 -0.35 0.00 -0.27 0.00 0.00 57.70 57.60 1bi9 n MET 79 Cb 0.44 -2.12 0.03 0.00 2.15 0.00 0.00 33.22 33.72 1bi9 n MET 79 CO 0.00 0.00 0.00 -0.51 -0.73 0.00 0.00 175.97 174.73 1bi9 s ASP 80 N -0.78 5.31 0.13 6.12 1.01 -1.26 -4.89 116.67 122.32 1bi9 s ASP 80 Ca 0.65 2.21 -0.17 0.00 0.71 0.00 0.00 52.55 55.94 1bi9 s ASP 80 Cb -0.53 -2.58 -0.02 0.00 1.01 0.00 0.00 42.92 40.80 1bi9 s ASP 80 CO 0.56 -1.50 1.76 0.00 0.21 0.00 0.00 175.17 176.19 1bi9 h ALA 81 N 0.72 0.43 -0.11 5.23 0.00 -1.91 -0.55 119.26 123.08 1bi9 h ALA 81 Ca -0.49 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.39 1bi9 h ALA 81 Cb 1.27 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.92 1bi9 h ALA 81 CO 0.55 -0.06 0.15 0.66 0.00 0.00 0.00 179.25 180.54 1bi9 h SER 82 N 0.43 0.00 0.17 0.00 4.64 -1.90 0.83 113.55 117.72 1bi9 h SER 82 Ca 0.12 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.16 1bi9 h SER 82 Cb 0.02 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.14 1bi9 h SER 82 CO -0.02 0.00 -1.15 -0.08 -0.87 0.00 0.00 176.83 174.71 1bi9 h GLU 83 N 0.00 0.59 -0.93 4.77 4.81 -1.47 -2.39 114.58 119.95 1bi9 h GLU 83 Ca 0.05 -0.73 0.07 0.00 -0.13 0.00 0.00 59.36 58.63 1bi9 h GLU 83 Cb 0.34 0.23 -0.06 0.00 0.63 0.00 0.00 28.75 29.89 1bi9 h GLU 83 CO -0.00 1.31 0.60 0.00 -0.73 0.00 0.00 179.01 180.20 1bi9 h ARG 84 N 0.28 1.00 -0.37 1.92 3.08 -0.17 -1.76 114.38 118.37 1bi9 h ARG 84 Ca -0.15 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 59.81 1bi9 h ARG 84 Cb 1.82 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 31.63 1bi9 h ARG 84 CO 0.22 0.66 0.13 0.78 -1.07 0.00 0.00 179.97 180.69 1bi9 h GLY 85 N 1.04 0.61 0.98 0.04 0.00 -1.26 -2.52 103.07 101.95 1bi9 h GLY 85 Ca 0.41 -0.35 0.01 0.00 0.00 0.00 0.00 47.33 47.40 1bi9 h GLY 85 CO -0.17 0.33 0.48 3.21 0.00 0.00 0.00 176.54 180.39 1bi9 h ARG 86 N 0.45 0.95 -0.92 4.80 2.47 -0.86 -1.06 114.38 120.21 1bi9 h ARG 86 Ca 0.12 -0.06 0.10 0.00 -1.26 0.00 0.00 59.98 58.88 1bi9 h ARG 86 Cb 0.23 -0.21 -0.07 0.00 -1.65 0.00 0.00 29.97 28.27 1bi9 h ARG 86 CO -0.01 0.63 0.59 -0.07 0.56 0.00 0.00 179.97 181.67 1bi9 h LEU 87 N 0.98 0.84 -0.74 3.04 3.38 -1.10 0.63 115.31 122.34 1bi9 h LEU 87 Ca 0.27 0.02 -0.13 0.00 0.09 0.00 0.00 57.88 58.13 1bi9 h LEU 87 Cb -0.09 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 1bi9 h LEU 87 CO -0.07 0.50 -0.62 -0.07 0.09 0.00 0.00 178.44 178.27 1bi9 h LEU 88 N 0.93 0.03 -0.23 1.67 3.38 -0.91 -1.24 115.31 118.95 1bi9 h LEU 88 Ca 0.42 -0.02 -0.22 0.00 0.09 0.00 0.00 57.88 58.16 1bi9 h LEU 88 Cb 0.39 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1bi9 h LEU 88 CO -0.18 0.65 -0.87 -0.78 0.09 0.00 0.00 178.44 177.34 1bi9 h ASP 89 N 0.02 0.57 -0.55 -0.43 3.58 0.33 -1.65 116.42 118.31 1bi9 h ASP 89 Ca -0.01 -0.43 -0.07 0.00 0.42 0.00 0.00 57.03 56.94 1bi9 h ASP 89 Cb 1.10 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 41.96 1bi9 h ASP 89 CO 0.08 1.21 0.05 0.50 -2.88 0.00 0.00 179.24 178.20 1bi9 h LYS 90 N 0.28 0.93 -0.58 0.28 1.63 0.33 -0.96 116.57 118.48 1bi9 h LYS 90 Ca -0.07 -0.27 -0.01 0.00 -0.85 0.00 0.00 60.65 59.46 1bi9 h LYS 90 Cb 1.49 -0.10 -0.03 0.00 -0.60 0.00 0.00 32.23 33.00 1bi9 h LYS 90 CO 0.15 0.92 0.33 1.25 -3.45 0.00 0.00 179.45 178.65 1bi9 h LEU 91 N 0.81 0.70 -0.76 5.20 5.85 -1.14 -0.42 115.31 125.55 1bi9 h LEU 91 Ca 0.16 -0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.80 1bi9 h LEU 91 Cb 0.47 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.29 1bi9 h LEU 91 CO 0.02 0.55 0.31 0.00 -0.34 0.00 0.00 178.44 178.98 1bi9 h ALA 92 N 1.57 0.99 -0.19 1.25 0.00 -0.49 -0.64 119.26 121.75 1bi9 h ALA 92 Ca 0.21 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1bi9 h ALA 92 Cb -0.00 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1bi9 h ALA 92 CO -0.04 0.60 0.08 -0.44 0.00 0.00 0.00 179.25 179.45 1bi9 h ASP 93 N 1.10 0.27 -0.62 0.00 3.32 0.18 -1.42 116.42 119.25 1bi9 h ASP 93 Ca 0.25 -0.17 -0.02 0.00 0.02 0.00 0.00 57.03 57.12 1bi9 h ASP 93 Cb 0.20 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.65 1bi9 h ASP 93 CO -0.02 0.36 0.32 -0.07 -1.72 0.00 0.00 179.24 178.11 1bi9 h LEU 94 N 0.16 0.81 -1.29 1.55 3.38 -1.00 -0.07 115.31 118.85 1bi9 h LEU 94 Ca 0.06 -0.08 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 1bi9 h LEU 94 Cb 0.18 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1bi9 h LEU 94 CO -0.01 0.67 -0.25 0.58 0.09 0.00 0.00 178.44 179.53 1bi9 h VAL 95 N 0.90 1.22 -0.12 1.22 2.07 -0.74 -2.07 116.25 118.73 1bi9 h VAL 95 Ca 0.22 -1.04 -0.04 0.00 0.82 0.00 0.00 66.70 66.67 1bi9 h VAL 95 Cb 0.07 1.42 -0.00 0.00 -1.52 0.00 0.00 31.29 31.26 1bi9 h VAL 95 CO -0.03 0.31 -0.08 -0.08 0.02 0.00 0.00 177.57 177.71 1bi9 h GLU 96 N 0.16 0.26 0.08 1.57 4.57 0.02 -1.39 114.58 119.84 1bi9 h GLU 96 Ca 0.03 -0.12 0.02 0.00 -1.18 0.00 0.00 59.36 58.11 1bi9 h GLU 96 Cb 0.53 -0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 29.07 1bi9 h GLU 96 CO 0.04 0.63 -0.28 -0.09 -1.18 0.00 0.00 179.01 178.13 1bi9 h ARG 97 N -0.10 -0.45 -0.80 1.92 2.43 -0.78 -2.63 114.38 113.98 1bi9 h ARG 97 Ca 0.02 0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.19 1bi9 h ARG 97 Cb 0.56 0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 30.19 1bi9 h ARG 97 CO 0.02 -0.30 0.04 -0.25 -1.51 0.00 0.00 179.97 177.98 1bi9 n ASP 98 N -5.39 3.56 -0.27 -3.80 9.92 -0.81 -4.54 116.55 115.22 1bi9 n ASP 98 Ca -0.06 -2.55 0.17 0.00 -0.53 0.00 0.00 54.79 51.82 1bi9 n ASP 98 Cb 0.30 -0.61 0.45 0.00 -0.64 0.00 0.00 41.12 40.62 1bi9 n ASP 98 CO 0.00 0.00 0.00 -0.09 0.13 0.00 0.00 177.20 177.24 1bi9 h ARG 99 N 1.98 0.51 -0.22 -1.24 2.43 -0.85 -0.86 114.38 116.12 1bi9 h ARG 99 Ca 0.04 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.14 1bi9 h ARG 99 Cb 1.39 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.82 1bi9 h ARG 99 CO 0.31 0.33 -0.02 0.00 -1.51 0.00 0.00 179.97 179.09 1bi9 h ALA 100 N 1.61 0.30 -0.31 2.80 0.00 -1.84 -1.20 119.26 120.62 1bi9 h ALA 100 Ca 0.49 -0.23 -0.17 0.00 0.00 0.00 0.00 54.91 55.01 1bi9 h ALA 100 Cb 1.06 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 1bi9 h ALA 100 CO -0.22 0.05 -0.47 1.79 0.00 0.00 0.00 179.25 180.40 1bi9 h THR 101 N 0.16 1.28 -0.61 0.00 1.35 -1.76 -1.96 112.91 111.37 1bi9 h THR 101 Ca 0.06 -1.65 -0.03 0.00 -0.55 0.00 0.00 66.41 64.24 1bi9 h THR 101 Cb 0.44 1.53 -0.03 0.00 -1.73 0.00 0.00 68.15 68.36 1bi9 h THR 101 CO 0.01 0.54 0.28 -0.07 -0.25 0.00 0.00 175.52 176.03 1bi9 h LEU 102 N 0.66 0.81 -1.08 3.87 3.38 -1.12 -1.80 115.31 120.04 1bi9 h LEU 102 Ca 0.04 -0.15 -0.05 0.00 0.09 0.00 0.00 57.88 57.81 1bi9 h LEU 102 Cb 1.05 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 1bi9 h LEU 102 CO 0.10 0.73 -0.24 0.00 0.09 0.00 0.00 178.44 179.13 1bi9 h ALA 103 N 1.11 1.02 0.07 1.53 0.00 -1.20 -1.91 119.26 119.88 1bi9 h ALA 103 Ca 0.21 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1bi9 h ALA 103 Cb 0.15 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1bi9 h ALA 103 CO -0.02 0.30 -0.03 1.15 0.00 0.00 0.00 179.25 180.65 1bi9 h THR 104 N 0.00 1.11 -0.46 0.00 2.02 -0.54 -0.74 112.91 114.30 1bi9 h THR 104 Ca -0.00 -0.62 0.00 0.00 0.77 0.00 0.00 66.41 66.56 1bi9 h THR 104 Cb 0.77 1.51 -0.02 0.00 -1.74 0.00 0.00 68.15 68.67 1bi9 h THR 104 CO 0.03 0.15 0.30 0.24 0.37 0.00 0.00 175.52 176.61 1bi9 h MET 105 N -0.37 0.61 -0.99 6.66 2.07 -1.26 1.34 114.93 122.99 1bi9 h MET 105 Ca -0.01 -0.04 0.11 0.00 -2.07 0.00 0.00 59.70 57.69 1bi9 h MET 105 Cb 0.32 -0.14 -0.08 0.00 -1.87 0.00 0.00 31.60 29.84 1bi9 h MET 105 CO 0.02 0.42 0.63 1.49 1.07 0.00 0.00 176.91 180.54 1bi9 h GLU 106 N 0.62 0.97 0.02 1.72 4.57 -1.24 0.49 114.58 121.73 1bi9 h GLU 106 Ca 0.17 -0.06 -0.00 0.00 -1.18 0.00 0.00 59.36 58.29 1bi9 h GLU 106 Cb -0.05 -0.22 0.00 0.00 -0.16 0.00 0.00 28.75 28.32 1bi9 h GLU 106 CO -0.03 0.64 -0.01 1.03 -1.18 0.00 0.00 179.01 179.46 1bi9 h SER 107 N 1.00 -0.02 -0.64 1.04 0.87 -0.22 -2.39 113.55 113.20 1bi9 h SER 107 Ca 0.48 -0.75 0.03 0.00 -1.23 0.00 0.00 61.79 60.32 1bi9 h SER 107 Cb 0.45 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.38 1bi9 h SER 107 CO -0.24 0.82 0.42 0.25 -0.53 0.00 0.00 176.83 177.55 1bi9 h LEU 108 N -0.93 0.67 0.01 2.23 7.12 0.20 0.52 115.31 125.13 1bi9 h LEU 108 Ca -0.00 -0.01 -0.24 0.00 0.13 0.00 0.00 57.88 57.76 1bi9 h LEU 108 Cb 0.77 -0.16 -0.03 0.00 -0.53 0.00 0.00 40.66 40.71 1bi9 h LEU 108 CO 0.00 0.47 -1.32 -1.13 -0.13 0.00 0.00 178.44 176.34 1bi9 h ASN 109 N 0.78 0.05 0.43 1.25 -0.73 -0.15 -3.40 115.58 113.81 1bi9 h ASN 109 Ca 0.25 -0.57 0.00 0.00 1.87 0.00 0.00 56.30 57.85 1bi9 h ASN 109 Cb 0.03 -0.02 0.00 0.00 0.27 0.00 0.00 38.32 38.61 1bi9 h ASN 109 CO -0.07 1.52 -0.67 0.61 -0.37 0.00 0.00 177.43 178.45 1bi9 n GLY 110 N 1.50 -1.21 2.15 1.57 0.00 -0.90 -4.25 105.19 104.05 1bi9 n GLY 110 Ca -0.32 -0.40 -0.07 0.00 0.00 0.00 0.00 46.02 45.24 1bi9 n GLY 110 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bi9 n GLY 111 N 1.47 0.40 3.60 -0.02 0.00 0.18 -4.70 105.19 106.12 1bi9 n GLY 111 Ca 0.05 -0.44 -0.34 0.00 0.00 0.00 0.00 46.02 45.29 1bi9 n GLY 111 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1bi9 s LYS 112 N -5.17 3.71 -0.47 1.61 2.20 -1.18 -3.54 119.74 116.90 1bi9 s LYS 112 Ca 0.14 -0.41 -0.44 0.00 -0.36 0.00 0.00 55.97 54.90 1bi9 s LYS 112 Cb -0.06 -3.04 -0.19 0.00 -1.51 0.00 0.00 37.83 33.03 1bi9 s LYS 112 CO 0.18 0.34 1.86 -0.35 -0.36 0.00 0.00 175.35 177.02 1bi9 n PRO 113 N 3.28 0.20 -0.30 4.03 -0.04 -1.26 -4.27 135.00 136.64 1bi9 n PRO 113 Ca -0.17 0.07 0.02 0.00 -0.04 0.00 0.00 63.50 63.37 1bi9 n PRO 113 Cb 0.53 -1.63 0.07 0.00 -0.04 0.00 0.00 33.50 32.42 1bi9 n PRO 113 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1bi9 n PHE 114 N 5.89 0.14 -0.32 0.54 7.35 -0.05 -0.17 117.46 130.84 1bi9 n PHE 114 Ca 0.40 0.98 0.05 0.00 -0.76 0.00 0.00 57.45 58.13 1bi9 n PHE 114 Cb -0.01 -0.87 0.25 0.00 0.35 0.00 0.00 39.48 39.19 1bi9 n PHE 114 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 1bi9 h LEU 115 N 0.00 0.90 -0.27 -2.13 3.38 -1.87 0.13 115.31 115.45 1bi9 h LEU 115 Ca 0.33 0.02 -0.10 0.00 0.09 0.00 0.00 57.88 58.22 1bi9 h LEU 115 Cb 0.53 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 1bi9 h LEU 115 CO -0.81 0.55 -0.21 1.56 0.09 0.00 0.00 178.44 179.62 1bi9 h GLN 116 N 1.01 0.62 -0.55 1.13 4.20 -0.90 -1.40 115.11 119.22 1bi9 h GLN 116 Ca 0.43 -0.30 0.01 0.00 0.06 0.00 0.00 58.65 58.85 1bi9 h GLN 116 Cb 0.32 -0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.07 1bi9 h GLN 116 CO -0.18 0.89 0.36 0.00 -0.67 0.00 0.00 178.83 179.23 1bi9 h ALA 117 N 0.71 1.63 -0.02 3.87 0.00 -0.58 0.14 119.26 125.02 1bi9 h ALA 117 Ca 0.05 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 1bi9 h ALA 117 Cb 0.75 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.34 1bi9 h ALA 117 CO 0.05 0.33 -0.30 0.35 0.00 0.00 0.00 179.25 179.69 1bi9 h PHE 118 N 0.72 0.34 0.00 0.00 3.57 -0.55 -1.82 116.94 119.19 1bi9 h PHE 118 Ca 0.21 -0.17 0.00 0.00 3.53 0.00 0.00 57.97 61.54 1bi9 h PHE 118 Cb -0.05 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 38.65 1bi9 h PHE 118 CO -0.00 0.94 -0.71 1.88 -2.23 0.00 0.00 178.31 178.19 1bi9 h TYR 119 N -0.37 0.00 0.00 0.41 0.05 -1.17 -3.38 116.97 112.52 1bi9 h TYR 119 Ca -0.03 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.75 1bi9 h TYR 119 Cb 1.01 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.75 1bi9 h TYR 119 CO 0.16 0.00 0.00 -0.89 -1.05 0.00 0.00 178.16 176.38 1bi9 n ILE 120 N -2.28 0.00 -0.21 -2.88 5.41 0.49 -4.41 119.36 115.48 1bi9 n ILE 120 Ca 0.02 0.13 0.01 0.00 1.00 0.00 0.00 62.75 63.91 1bi9 n ILE 120 Cb 0.47 -1.01 0.09 0.00 -0.71 0.00 0.00 39.64 38.49 1bi9 n ILE 120 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 176.55 176.99 1bi9 h ASP 121 N 0.00 -0.41 1.08 4.38 5.19 -1.53 0.29 116.42 125.43 1bi9 h ASP 121 Ca 0.00 0.17 0.00 0.00 -0.62 0.00 0.00 57.03 56.58 1bi9 h ASP 121 Cb 0.00 0.33 0.00 0.00 0.18 0.00 0.00 39.33 39.84 1bi9 h ASP 121 CO 0.00 -0.16 0.00 0.18 -3.12 0.00 0.00 179.24 176.14 1bi9 n LEU 122 N -5.35 0.19 -0.01 1.55 4.32 -0.69 -1.61 117.00 115.41 1bi9 n LEU 122 Ca 0.09 0.52 -0.17 0.00 -0.02 0.00 0.00 56.01 56.43 1bi9 n LEU 122 Cb 0.36 -0.46 -0.10 0.00 -1.62 0.00 0.00 43.42 41.60 1bi9 n LEU 122 CO 0.08 -0.06 0.31 -0.61 -1.22 0.00 0.00 177.39 175.89 1bi9 h GLN 123 N 0.00 0.48 -0.53 3.23 4.15 -1.17 -2.21 115.11 119.07 1bi9 h GLN 123 Ca 0.00 -0.44 -0.00 0.00 0.77 0.00 0.00 58.65 58.98 1bi9 h GLN 123 Cb 0.54 0.11 -0.03 0.00 0.21 0.00 0.00 27.48 28.31 1bi9 h GLN 123 CO 0.00 1.08 0.32 0.78 -1.93 0.00 0.00 178.83 179.08 1bi9 h GLY 124 N 0.04 0.76 0.84 2.39 0.00 -0.85 0.67 103.07 106.92 1bi9 h GLY 124 Ca -0.05 -0.31 0.01 0.00 0.00 0.00 0.00 47.33 46.98 1bi9 h GLY 124 CO 0.11 0.30 -0.07 -2.08 0.00 0.00 0.00 176.54 174.81 1bi9 h VAL 125 N 0.71 0.83 -0.37 4.60 2.07 -1.32 0.20 116.25 122.97 1bi9 h VAL 125 Ca 0.19 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.63 1bi9 h VAL 125 Cb -0.02 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 1bi9 h VAL 125 CO -0.04 0.00 -0.09 0.40 0.02 0.00 0.00 177.57 177.86 1bi9 h ILE 126 N -0.13 1.28 -0.33 4.57 2.04 -1.08 -1.29 117.51 122.57 1bi9 h ILE 126 Ca 0.02 -1.17 0.00 0.00 1.00 0.00 0.00 64.86 64.72 1bi9 h ILE 126 Cb 0.15 1.27 -0.02 0.00 -0.74 0.00 0.00 36.82 37.49 1bi9 h ILE 126 CO -0.06 0.39 0.21 0.11 0.00 0.00 0.00 178.15 178.80 1bi9 h LYS 127 N 0.51 0.44 -0.37 2.37 1.79 0.56 -0.94 116.57 120.93 1bi9 h LYS 127 Ca 0.09 -0.03 -0.09 0.00 -2.18 0.00 0.00 60.65 58.45 1bi9 h LYS 127 Cb 0.61 -0.10 -0.01 0.00 -1.58 0.00 0.00 32.23 31.15 1bi9 h LYS 127 CO 0.04 0.30 -0.10 1.79 -1.08 0.00 0.00 179.45 180.39 1bi9 h THR 128 N 0.44 1.28 0.07 -0.16 1.35 -0.57 -0.17 112.91 115.15 1bi9 h THR 128 Ca 0.12 -1.19 0.01 0.00 -0.55 0.00 0.00 66.41 64.80 1bi9 h THR 128 Cb -0.04 1.28 -0.02 0.00 -1.73 0.00 0.00 68.15 67.64 1bi9 h THR 128 CO -0.03 0.39 -0.13 -0.07 -0.25 0.00 0.00 175.52 175.44 1bi9 h LEU 129 N 0.53 -0.36 -0.19 3.87 3.38 -1.09 -0.79 115.31 120.66 1bi9 h LEU 129 Ca 0.09 0.04 0.04 0.00 0.09 0.00 0.00 57.88 58.14 1bi9 h LEU 129 Cb 0.62 0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.48 1bi9 h LEU 129 CO 0.04 -0.19 -0.04 0.03 0.09 0.00 0.00 178.44 178.37 1bi9 h ARG 130 N -0.25 0.01 -0.39 1.13 2.47 -1.10 -1.71 114.38 114.53 1bi9 h ARG 130 Ca 0.02 -0.00 0.08 0.00 -1.26 0.00 0.00 59.98 58.82 1bi9 h ARG 130 Cb 0.28 -0.00 -0.08 0.00 -1.65 0.00 0.00 29.97 28.52 1bi9 h ARG 130 CO -0.08 0.00 -0.12 -0.92 0.56 0.00 0.00 179.97 179.41 1bi9 h TYR 131 N 0.01 -0.27 0.00 3.04 3.20 -0.62 -1.66 116.97 120.67 1bi9 h TYR 131 Ca 0.09 0.04 -0.06 0.00 3.14 0.00 0.00 58.73 61.93 1bi9 h TYR 131 Cb 0.13 0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.58 1bi9 h TYR 131 CO -0.21 -0.20 -0.31 1.88 -1.64 0.00 0.00 178.16 177.69 1bi9 h TYR 132 N -0.03 0.00 0.00 -3.82 0.05 -1.04 -2.28 116.97 109.85 1bi9 h TYR 132 Ca 0.19 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.96 1bi9 h TYR 132 Cb 0.32 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.06 1bi9 h TYR 132 CO -0.37 0.31 -0.02 0.00 -1.05 0.00 0.00 178.16 177.04 1bi9 h ALA 133 N 1.69 1.53 0.10 3.88 0.00 -0.35 -1.56 119.26 124.56 1bi9 h ALA 133 Ca -0.00 -0.02 -0.27 0.00 0.00 0.00 0.00 54.91 54.62 1bi9 h ALA 133 Cb 0.93 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 1bi9 h ALA 133 CO 0.04 0.02 -1.30 0.78 0.00 0.00 0.00 179.25 178.80 1bi9 h GLY 134 N 0.11 0.25 2.00 0.00 0.00 -1.16 -3.33 103.07 100.95 1bi9 h GLY 134 Ca -0.00 -0.65 -0.04 0.00 0.00 0.00 0.00 47.33 46.65 1bi9 h GLY 134 CO 0.00 0.57 -0.17 1.49 0.00 0.00 0.00 176.54 178.43 1bi9 h TRP 135 N 0.06 0.00 -0.90 5.60 -0.00 -1.25 -3.36 115.95 116.10 1bi9 h TRP 135 Ca -0.15 0.00 0.23 0.00 -0.00 0.00 0.00 58.89 58.98 1bi9 h TRP 135 Cb 1.96 0.00 -0.16 0.00 -0.00 0.00 0.00 29.16 30.96 1bi9 h TRP 135 CO 0.05 0.17 0.07 0.00 -0.00 0.00 0.00 178.44 178.73 1bi9 h ALA 136 N 1.83 1.08 -0.56 1.49 0.00 -1.61 -0.07 119.26 121.42 1bi9 h ALA 136 Ca -0.00 0.29 -0.23 0.00 0.00 0.00 0.00 54.91 54.97 1bi9 h ALA 136 Cb 0.55 0.48 -0.13 0.00 0.00 0.00 0.00 17.79 18.69 1bi9 h ALA 136 CO 0.02 -0.51 0.17 -0.40 0.00 0.00 0.00 179.25 178.54 1bi9 n ASP 137 N -5.39 3.58 -0.23 0.00 5.68 -1.26 -4.39 116.55 114.53 1bi9 n ASP 137 Ca 0.20 -3.47 0.05 0.00 -0.50 0.00 0.00 54.79 51.08 1bi9 n ASP 137 Cb 0.66 -0.69 0.07 0.00 -1.14 0.00 0.00 41.12 40.03 1bi9 n ASP 137 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1bi9 n LYS 138 N -0.78 0.82 -3.00 0.11 5.02 -0.05 -4.96 118.16 115.32 1bi9 n LYS 138 Ca 0.38 -1.85 -0.44 0.00 -2.02 0.00 0.00 58.31 54.39 1bi9 n LYS 138 Cb 1.23 -1.05 -0.04 0.00 -0.02 0.00 0.00 35.03 35.14 1bi9 n LYS 138 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1bi9 s ILE 139 N -1.58 4.61 0.05 -0.18 1.01 -1.20 -5.03 121.20 118.89 1bi9 s ILE 139 Ca 0.17 -0.75 -0.00 0.00 0.00 0.00 0.00 60.65 60.07 1bi9 s ILE 139 Cb 0.15 -4.58 -0.04 0.00 0.01 0.00 0.00 42.46 37.99 1bi9 s ILE 139 CO 0.02 -1.28 0.19 -1.00 0.00 0.00 0.00 174.94 172.87 1bi9 s HIS 140 N 3.27 3.49 0.00 3.97 3.76 -1.26 -4.84 115.29 123.67 1bi9 s HIS 140 Ca 0.17 0.25 0.00 0.00 -0.15 0.00 0.00 55.06 55.32 1bi9 s HIS 140 Cb -0.20 -1.76 0.00 0.00 1.11 0.00 0.00 32.58 31.73 1bi9 s HIS 140 CO 0.07 0.59 0.00 0.41 -0.85 0.00 0.00 174.74 174.96 1bi9 n GLY 141 N 0.40 2.61 3.18 -2.22 0.00 -1.26 -4.84 105.19 103.06 1bi9 n GLY 141 Ca -0.06 -2.11 -0.10 0.00 0.00 0.00 0.00 46.02 43.75 1bi9 n GLY 141 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1bi9 s MET 142 N -0.40 1.03 -0.19 1.61 0.23 -1.19 -4.92 119.30 115.46 1bi9 s MET 142 Ca 0.00 -1.48 -0.04 0.00 -1.03 0.00 0.00 55.69 53.13 1bi9 s MET 142 Cb 0.00 0.26 -0.02 0.00 -1.53 0.00 0.00 34.83 33.54 1bi9 s MET 142 CO 0.00 -0.31 -0.02 0.95 -2.03 0.00 0.00 175.02 173.61 1bi9 s THR 143 N -4.08 3.83 -0.21 3.16 -4.23 -1.26 0.28 115.64 113.13 1bi9 s THR 143 Ca 0.28 -0.36 -0.05 0.00 -1.18 0.00 0.00 61.69 60.38 1bi9 s THR 143 Cb 0.07 -2.72 -0.02 0.00 1.34 0.00 0.00 72.50 71.17 1bi9 s THR 143 CO 0.05 0.45 0.00 -0.63 -0.54 0.00 0.00 174.62 173.95 1bi9 s ILE 144 N 0.88 3.92 -0.39 2.99 -1.09 -0.98 -5.03 121.20 121.50 1bi9 s ILE 144 Ca 0.00 -0.32 -0.28 0.00 -2.23 0.00 0.00 60.65 57.82 1bi9 s ILE 144 Cb -0.14 -2.78 -0.02 0.00 -1.58 0.00 0.00 42.46 37.94 1bi9 s ILE 144 CO 0.02 0.42 1.77 -2.16 -1.23 0.00 0.00 174.94 173.76 1bi9 s PRO 145 N 1.14 3.23 0.22 2.79 0.04 -1.26 -4.32 135.00 136.84 1bi9 s PRO 145 Ca 0.03 1.24 0.08 0.00 0.04 0.00 0.00 61.00 62.39 1bi9 s PRO 145 Cb -0.14 -4.21 -0.04 0.00 0.04 0.00 0.00 34.50 30.14 1bi9 s PRO 145 CO 0.01 -1.99 0.02 0.08 0.04 0.00 0.00 177.00 175.17 1bi9 s VAL 146 N 7.16 3.69 0.33 -0.36 1.01 -1.26 -5.11 120.40 125.85 1bi9 s VAL 146 Ca 0.76 -1.62 -0.28 0.00 0.00 0.00 0.00 61.98 60.84 1bi9 s VAL 146 Cb -0.20 -2.92 -0.09 0.00 0.00 0.00 0.00 36.38 33.17 1bi9 s VAL 146 CO 0.31 -0.24 1.17 -1.81 0.00 0.00 0.00 175.10 174.53 1bi9 s ASP 147 N -3.34 6.92 0.00 3.32 1.01 -1.26 -4.78 116.67 118.54 1bi9 s ASP 147 Ca 0.30 2.40 0.00 0.00 0.71 0.00 0.00 52.55 55.95 1bi9 s ASP 147 Cb -0.08 -2.63 0.00 0.00 1.01 0.00 0.00 42.92 41.22 1bi9 s ASP 147 CO 0.20 -0.40 0.00 0.61 0.21 0.00 0.00 175.17 175.78 1bi9 n GLY 148 N 0.90 0.00 2.87 0.21 0.00 -1.26 -4.63 105.19 103.28 1bi9 n GLY 148 Ca 0.01 -1.91 -0.42 0.00 0.00 0.00 0.00 46.02 43.69 1bi9 n GLY 148 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1bi9 n ASP 149 N -0.44 4.54 -2.76 1.61 8.00 -1.26 -4.84 116.55 121.40 1bi9 n ASP 149 Ca 0.00 -2.97 -0.14 0.00 0.71 0.00 0.00 54.79 52.38 1bi9 n ASP 149 Cb 0.00 -1.58 -0.05 0.00 -0.02 0.00 0.00 41.12 39.48 1bi9 n ASP 149 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1bi9 n TYR 150 N 5.16 -0.11 -3.17 1.24 4.01 -1.26 -1.84 117.16 121.20 1bi9 n TYR 150 Ca 0.46 -1.65 0.03 0.00 -0.16 0.00 0.00 57.90 56.57 1bi9 n TYR 150 Cb 0.38 0.06 -0.01 0.00 -0.31 0.00 0.00 39.34 39.46 1bi9 n TYR 150 CO 0.00 0.00 0.00 0.12 -0.46 0.00 0.00 176.86 176.52 1bi9 s PHE 151 N -2.61 -1.60 0.01 -0.72 5.36 -0.35 -4.83 117.98 113.25 1bi9 s PHE 151 Ca 0.17 1.50 0.04 0.00 -0.96 0.00 0.00 56.93 57.67 1bi9 s PHE 151 Cb 0.01 0.46 -0.03 0.00 -0.34 0.00 0.00 43.02 43.12 1bi9 s PHE 151 CO 0.12 -0.92 -0.09 0.95 -1.46 0.00 0.00 175.22 173.82 1bi9 s THR 152 N 2.83 3.47 0.09 0.12 -4.23 -1.26 0.01 115.64 116.66 1bi9 s THR 152 Ca 0.18 -0.86 -0.04 0.00 -1.18 0.00 0.00 61.69 59.79 1bi9 s THR 152 Cb -0.14 -2.50 -0.03 0.00 1.34 0.00 0.00 72.50 71.17 1bi9 s THR 152 CO -0.22 0.38 0.08 0.72 -0.54 0.00 0.00 174.62 175.04 1bi9 s PHE 153 N -0.98 0.47 0.13 3.99 -0.12 0.23 -2.33 117.98 119.37 1bi9 s PHE 153 Ca 0.17 -0.93 0.09 0.00 -0.05 0.00 0.00 56.93 56.20 1bi9 s PHE 153 Cb -0.11 -0.28 -0.04 0.00 -0.63 0.00 0.00 43.02 41.96 1bi9 s PHE 153 CO 0.07 -0.49 -0.21 0.95 -0.05 0.00 0.00 175.22 175.49 1bi9 s THR 154 N -3.93 1.90 -0.07 -4.49 -4.23 0.14 0.20 115.64 105.17 1bi9 s THR 154 Ca 0.11 -1.74 0.03 0.00 -1.18 0.00 0.00 61.69 58.90 1bi9 s THR 154 Cb 0.07 -1.77 0.01 0.00 1.34 0.00 0.00 72.50 72.14 1bi9 s THR 154 CO -0.07 -0.12 -0.14 -0.13 -0.54 0.00 0.00 174.62 173.62 1bi9 s ARG 155 N -2.27 1.88 -0.67 3.99 0.52 0.24 -3.18 118.95 119.46 1bi9 s ARG 155 Ca 0.12 -0.50 -0.20 0.00 -0.52 0.00 0.00 55.73 54.64 1bi9 s ARG 155 Cb -0.09 -1.53 0.10 0.00 0.52 0.00 0.00 34.95 33.96 1bi9 s ARG 155 CO 0.06 0.08 0.84 -1.01 0.02 0.00 0.00 175.30 175.28 1bi9 s HIS 156 N 0.53 2.95 0.39 -0.53 3.76 -1.26 -0.60 115.29 120.53 1bi9 s HIS 156 Ca -0.14 -0.95 0.05 0.00 -0.15 0.00 0.00 55.06 53.87 1bi9 s HIS 156 Cb -0.15 -4.13 -0.00 0.00 1.11 0.00 0.00 32.58 29.41 1bi9 s HIS 156 CO 0.04 -1.41 0.55 -1.21 -0.85 0.00 0.00 174.74 171.86 1bi9 s GLU 157 N 2.97 3.04 0.63 1.40 2.02 -0.62 -4.87 118.70 123.28 1bi9 s GLU 157 Ca 0.18 -0.87 -0.13 0.00 0.02 0.00 0.00 54.97 54.17 1bi9 s GLU 157 Cb -0.19 -2.72 -0.02 0.00 0.10 0.00 0.00 34.13 31.30 1bi9 s GLU 157 CO 0.05 -0.11 1.05 -1.25 0.02 0.00 0.00 175.26 175.02 1bi9 s PRO 158 N -4.33 3.22 0.03 0.39 0.04 -1.25 -1.01 135.00 132.09 1bi9 s PRO 158 Ca 0.47 1.05 -0.18 0.00 0.04 0.00 0.00 61.00 62.39 1bi9 s PRO 158 Cb -0.10 -2.03 -0.23 0.00 0.04 0.00 0.00 34.50 32.19 1bi9 s PRO 158 CO 0.34 -0.88 1.14 0.82 0.04 0.00 0.00 177.00 178.46 1bi9 h ILE 159 N -0.05 1.38 0.00 0.56 2.04 -1.89 -3.43 117.51 116.13 1bi9 h ILE 159 Ca -0.45 -2.09 0.00 0.00 1.00 0.00 0.00 64.86 63.32 1bi9 h ILE 159 Cb 1.21 2.49 0.00 0.00 -0.74 0.00 0.00 36.82 39.78 1bi9 h ILE 159 CO 0.58 0.62 0.00 0.61 0.00 0.00 0.00 178.15 179.96 1bi9 n GLY 160 N 1.02 0.58 3.66 5.37 0.00 -1.26 -4.96 105.19 109.60 1bi9 n GLY 160 Ca -0.10 -0.99 -0.42 0.00 0.00 0.00 0.00 46.02 44.50 1bi9 n GLY 160 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bi9 s VAL 161 N 0.00 4.76 -0.24 1.61 1.01 -1.26 -2.00 120.40 124.28 1bi9 s VAL 161 Ca 0.00 1.87 -0.02 0.00 0.00 0.00 0.00 61.98 63.84 1bi9 s VAL 161 Cb 0.00 -4.24 0.02 0.00 0.00 0.00 0.00 36.38 32.16 1bi9 s VAL 161 CO 0.00 -0.09 -0.06 0.00 0.00 0.00 0.00 175.10 174.94 1bi9 s GLY 163 N 1.35 2.40 -0.07 0.00 0.00 0.10 -1.26 107.32 109.84 1bi9 s GLY 163 Ca 0.01 0.11 -0.04 0.00 0.00 0.00 0.00 44.72 44.80 1bi9 s GLY 163 CO -0.05 0.36 0.16 1.20 0.00 0.00 0.00 173.10 174.77 1bi9 s GLN 164 N -2.78 0.14 -0.10 2.90 -0.21 -0.43 -1.19 119.66 117.99 1bi9 s GLN 164 Ca 0.53 0.33 -0.00 0.00 0.02 0.00 0.00 55.36 56.23 1bi9 s GLN 164 Cb -0.12 -0.07 0.02 0.00 1.00 0.00 0.00 33.01 33.85 1bi9 s GLN 164 CO 0.18 -0.11 -0.07 0.42 -2.12 0.00 0.00 175.29 173.59 1bi9 s ILE 165 N 0.76 0.96 0.15 1.08 1.01 -0.47 -0.34 121.20 124.35 1bi9 s ILE 165 Ca -0.06 -0.26 0.05 0.00 0.00 0.00 0.00 60.65 60.38 1bi9 s ILE 165 Cb -0.07 -0.98 -0.04 0.00 0.01 0.00 0.00 42.46 41.37 1bi9 s ILE 165 CO -0.04 0.35 -0.11 0.27 0.00 0.00 0.00 174.94 175.41 1bi9 s ILE 166 N 1.60 1.28 0.26 2.92 -0.00 -1.14 -2.30 121.20 123.81 1bi9 s ILE 166 Ca 0.03 -2.01 -0.04 0.00 -0.00 0.00 0.00 60.65 58.62 1bi9 s ILE 166 Cb -0.13 -1.80 0.06 0.00 -0.00 0.00 0.00 42.46 40.59 1bi9 s ILE 166 CO -0.07 -0.66 0.32 -0.81 -0.00 0.00 0.00 174.94 173.72 1bi9 n PRO 167 N -0.07 -0.59 0.00 0.37 -0.04 -1.24 -2.47 135.00 130.96 1bi9 n PRO 167 Ca -0.11 -0.49 0.11 0.00 -0.04 0.00 0.00 63.50 62.96 1bi9 n PRO 167 Cb 0.60 -0.35 0.01 0.00 -0.04 0.00 0.00 33.50 33.71 1bi9 n PRO 167 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1bi9 n TRP 168 N -2.59 0.03 -0.20 0.54 4.27 -1.26 -4.34 117.44 113.87 1bi9 n TRP 168 Ca 0.04 0.01 0.01 0.00 -3.89 0.00 0.00 57.50 53.67 1bi9 n TRP 168 Cb 0.14 -0.14 0.11 0.00 -1.36 0.00 0.00 31.31 30.06 1bi9 n TRP 168 CO 0.00 0.00 0.00 -0.91 -2.29 0.00 0.00 177.69 174.49 1bi9 h ASN 169 N 0.00 -0.21 -1.45 -0.67 2.35 -1.96 -3.30 115.58 110.35 1bi9 h ASN 169 Ca 0.00 0.15 -0.44 0.00 -0.55 0.00 0.00 56.30 55.45 1bi9 h ASN 169 Cb 0.54 0.25 -0.33 0.00 0.05 0.00 0.00 38.32 38.83 1bi9 h ASN 169 CO 0.00 -0.09 -0.96 0.49 -1.65 0.00 0.00 177.43 175.22 1bi9 n PHE 170 N -5.25 -0.94 -0.05 1.19 3.72 -1.26 -5.02 117.46 109.85 1bi9 n PHE 170 Ca 0.09 -3.20 -0.01 0.00 -0.05 0.00 0.00 57.45 54.28 1bi9 n PHE 170 Cb 0.36 0.17 -0.01 0.00 -0.94 0.00 0.00 39.48 39.05 1bi9 n PHE 170 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 1bi9 n PRO 171 N 0.91 -0.06 -0.09 -1.08 -0.02 -1.24 0.22 135.00 133.64 1bi9 n PRO 171 Ca 0.19 0.56 -0.11 0.00 -2.02 0.00 0.00 63.50 62.12 1bi9 n PRO 171 Cb 0.61 -0.83 -0.04 0.00 -0.02 0.00 0.00 33.50 33.22 1bi9 n PRO 171 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1bi9 h LEU 172 N 0.00 0.47 0.03 2.45 5.85 -1.95 -1.46 115.31 120.70 1bi9 h LEU 172 Ca 0.02 -0.30 0.02 0.00 0.84 0.00 0.00 57.88 58.46 1bi9 h LEU 172 Cb 0.05 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 40.93 1bi9 h LEU 172 CO -0.12 0.66 -0.17 -0.07 -0.34 0.00 0.00 178.44 178.40 1bi9 h LEU 173 N 0.27 -0.48 -0.21 2.25 3.38 -1.55 -0.02 115.31 118.95 1bi9 h LEU 173 Ca 0.08 0.07 0.05 0.00 0.09 0.00 0.00 57.88 58.16 1bi9 h LEU 173 Cb 0.41 0.20 -0.05 0.00 0.09 0.00 0.00 40.66 41.31 1bi9 h LEU 173 CO 0.01 -0.23 -0.10 0.24 0.09 0.00 0.00 178.44 178.45 1bi9 h MET 174 N -0.29 -0.08 -0.19 1.13 2.86 -0.20 0.14 114.93 118.30 1bi9 h MET 174 Ca 0.04 0.01 0.05 0.00 -2.06 0.00 0.00 59.70 57.74 1bi9 h MET 174 Cb 0.34 0.02 -0.05 0.00 0.06 0.00 0.00 31.60 31.97 1bi9 h MET 174 CO -0.14 -0.05 -0.12 0.35 1.06 0.00 0.00 176.91 178.01 1bi9 h PHE 175 N -0.08 -0.30 0.14 -0.22 3.04 -0.98 -2.17 116.94 116.38 1bi9 h PHE 175 Ca 0.11 0.02 -0.01 0.00 3.98 0.00 0.00 57.97 62.08 1bi9 h PHE 175 Cb 0.25 0.16 0.00 0.00 2.56 0.00 0.00 35.95 38.92 1bi9 h PHE 175 CO -0.27 -0.18 -0.07 1.15 -2.02 0.00 0.00 178.31 176.92 1bi9 h THR 176 N -0.11 0.86 -0.34 4.41 2.02 -0.56 -0.37 112.91 118.82 1bi9 h THR 176 Ca 0.11 -0.01 0.10 0.00 0.77 0.00 0.00 66.41 67.38 1bi9 h THR 176 Cb 0.28 0.87 -0.01 0.00 -1.74 0.00 0.00 68.15 67.55 1bi9 h THR 176 CO -0.26 0.00 0.45 -0.50 0.37 0.00 0.00 175.52 175.58 1bi9 h TRP 177 N -0.20 0.00 0.03 3.16 6.55 -0.36 -0.92 115.95 124.22 1bi9 h TRP 177 Ca -0.02 0.00 -0.35 0.00 0.95 0.00 0.00 58.89 59.47 1bi9 h TRP 177 Cb 0.15 0.00 -0.04 0.00 -0.86 0.00 0.00 29.16 28.41 1bi9 h TRP 177 CO -0.07 0.00 -1.94 1.63 -1.05 0.00 0.00 178.44 177.01 1bi9 n LYS 178 N -3.51 0.64 0.31 0.49 5.02 -0.80 -4.34 118.16 115.97 1bi9 n LYS 178 Ca 0.06 0.36 -0.17 0.00 -2.02 0.00 0.00 58.31 56.53 1bi9 n LYS 178 Cb 0.61 -1.64 -0.08 0.00 -0.02 0.00 0.00 35.03 33.89 1bi9 n LYS 178 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1bi9 h ILE 179 N -0.56 0.29 -0.14 -0.18 1.08 -0.44 -3.07 117.51 114.48 1bi9 h ILE 179 Ca -0.49 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.01 1bi9 h ILE 179 Cb 1.66 0.29 -0.06 0.00 -3.07 0.00 0.00 36.82 35.64 1bi9 h ILE 179 CO -0.16 0.00 -0.48 0.00 -0.69 0.00 0.00 178.15 176.82 1bi9 h ALA 180 N -0.48 -0.83 -0.69 1.87 0.00 -1.43 0.91 119.26 118.61 1bi9 h ALA 180 Ca -0.06 -0.05 0.12 0.00 0.00 0.00 0.00 54.91 54.92 1bi9 h ALA 180 Cb 0.70 0.97 -0.08 0.00 0.00 0.00 0.00 17.79 19.38 1bi9 h ALA 180 CO 0.06 -1.00 0.26 -1.35 0.00 0.00 0.00 179.25 177.21 1bi9 h PRO 181 N -0.49 0.41 0.44 0.00 0.11 -1.76 0.17 132.00 130.88 1bi9 h PRO 181 Ca 0.03 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.09 1bi9 h PRO 181 Cb 0.59 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.61 1bi9 h PRO 181 CO -0.39 0.27 -0.21 0.00 -0.21 0.00 0.00 178.00 177.46 1bi9 h ALA 182 N 1.49 -0.59 -0.52 -0.75 0.00 -1.33 -2.94 119.26 114.61 1bi9 h ALA 182 Ca 0.36 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1bi9 h ALA 182 Cb 0.50 0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.50 1bi9 h ALA 182 CO -0.36 -0.72 0.28 -0.07 0.00 0.00 0.00 179.25 178.38 1bi9 h LEU 183 N -0.83 0.64 -2.19 0.00 3.38 -0.68 -1.05 115.31 114.59 1bi9 h LEU 183 Ca -0.06 -0.05 0.04 0.00 0.09 0.00 0.00 57.88 57.90 1bi9 h LEU 183 Cb 0.56 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 1bi9 h LEU 183 CO 0.10 0.53 0.12 0.00 0.09 0.00 0.00 178.44 179.28 1bi9 n GLY 186 N 1.36 0.78 3.84 0.00 0.00 -0.51 -3.86 105.19 106.80 1bi9 n GLY 186 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 1bi9 n GLY 186 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1bi9 s ASN 187 N -2.39 2.53 0.09 1.61 0.01 -1.10 -4.85 114.94 110.84 1bi9 s ASN 187 Ca 0.00 0.38 0.09 0.00 -0.71 0.00 0.00 52.86 52.62 1bi9 s ASN 187 Cb 0.00 -0.49 -0.03 0.00 0.41 0.00 0.00 41.25 41.14 1bi9 s ASN 187 CO 0.00 -3.11 -0.24 0.42 -1.51 0.00 0.00 177.10 172.67 1bi9 s THR 188 N -3.64 1.95 0.13 1.60 -4.23 -0.85 -4.63 115.64 105.98 1bi9 s THR 188 Ca 0.73 -1.52 0.11 0.00 -1.18 0.00 0.00 61.69 59.83 1bi9 s THR 188 Cb -0.06 -1.72 -0.04 0.00 1.34 0.00 0.00 72.50 72.02 1bi9 s THR 188 CO 0.54 0.11 -0.27 -0.69 -0.54 0.00 0.00 174.62 173.77 1bi9 s VAL 189 N -1.00 2.28 -0.31 2.29 1.01 0.93 -0.29 120.40 125.31 1bi9 s VAL 189 Ca 0.10 -1.76 -0.00 0.00 0.00 0.00 0.00 61.98 60.31 1bi9 s VAL 189 Cb -0.10 -2.02 0.10 0.00 0.00 0.00 0.00 36.38 34.37 1bi9 s VAL 189 CO 0.04 0.08 0.10 -0.69 0.00 0.00 0.00 175.10 174.63 1bi9 s VAL 190 N -1.09 0.96 -0.10 2.92 1.01 -0.39 -1.81 120.40 121.89 1bi9 s VAL 190 Ca 0.14 -1.47 -0.01 0.00 0.00 0.00 0.00 61.98 60.64 1bi9 s VAL 190 Cb -0.10 -1.73 -0.03 0.00 0.00 0.00 0.00 36.38 34.53 1bi9 s VAL 190 CO 0.06 -0.68 -0.05 -0.51 0.00 0.00 0.00 175.10 173.93 1bi9 s ILE 191 N 1.56 3.86 -0.34 2.22 2.07 0.41 -1.31 121.20 129.67 1bi9 s ILE 191 Ca 0.10 -0.40 0.03 0.00 -1.41 0.00 0.00 60.65 58.97 1bi9 s ILE 191 Cb -0.17 -2.63 0.10 0.00 0.13 0.00 0.00 42.46 39.89 1bi9 s ILE 191 CO -0.24 0.56 0.06 -0.75 -1.91 0.00 0.00 174.94 172.66 1bi9 s LYS 192 N -0.41 1.60 1.03 3.50 2.36 0.54 -0.07 119.74 128.30 1bi9 s LYS 192 Ca 0.06 -1.83 -0.14 0.00 -2.55 0.00 0.00 55.97 51.51 1bi9 s LYS 192 Cb -0.12 -3.24 0.21 0.00 -1.05 0.00 0.00 37.83 33.63 1bi9 s LYS 192 CO 0.02 -0.93 1.11 -1.25 1.55 0.00 0.00 175.35 175.85 1bi9 s PRO 193 N 0.95 0.14 0.61 4.03 0.04 -1.26 -2.90 135.00 136.61 1bi9 s PRO 193 Ca 0.09 0.30 -0.17 0.00 0.04 0.00 0.00 61.00 61.27 1bi9 s PRO 193 Cb -0.20 -1.72 -0.02 0.00 0.04 0.00 0.00 34.50 32.60 1bi9 s PRO 193 CO -0.07 -2.88 1.13 0.00 0.04 0.00 0.00 177.00 175.22 1bi9 s ALA 194 N -3.06 2.53 0.34 8.56 0.00 -1.03 -4.57 121.76 124.53 1bi9 s ALA 194 Ca 0.67 0.72 0.08 0.00 0.00 0.00 0.00 51.96 53.42 1bi9 s ALA 194 Cb -0.16 -3.36 0.61 0.00 0.00 0.00 0.00 23.12 20.22 1bi9 s ALA 194 CO 0.56 -1.12 1.80 1.05 0.00 0.00 0.00 175.76 178.05 1bi9 h GLU 195 N 0.52 0.22 -0.00 0.00 9.09 -1.90 -2.84 114.58 119.67 1bi9 h GLU 195 Ca -0.48 -0.08 0.00 0.00 0.05 0.00 0.00 59.36 58.85 1bi9 h GLU 195 Cb 1.26 -0.02 0.00 0.00 -1.65 0.00 0.00 28.75 28.35 1bi9 h GLU 195 CO 0.55 0.50 -0.05 0.00 0.05 0.00 0.00 179.01 180.05 1bi9 n GLN 196 N -4.13 0.44 -2.93 1.06 0.00 -1.26 -4.52 117.38 106.04 1bi9 n GLN 196 Ca -0.01 -0.07 -0.14 0.00 0.00 0.00 0.00 57.00 56.78 1bi9 n GLN 196 Cb 0.39 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 29.13 1bi9 n GLN 196 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31 1bi9 n THR 197 N -1.22 -0.27 0.81 -0.39 -2.24 -1.07 -4.78 114.28 105.12 1bi9 n THR 197 Ca 0.13 -2.53 0.09 0.00 -2.27 0.00 0.00 64.05 59.46 1bi9 n THR 197 Cb 0.27 0.13 -0.05 0.00 -2.10 0.00 0.00 70.33 68.57 1bi9 n THR 197 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1bi9 n PRO 198 N 1.49 1.41 0.39 -0.78 -0.04 -1.24 -4.47 135.00 131.77 1bi9 n PRO 198 Ca 0.14 -0.45 -0.18 0.00 -0.04 0.00 0.00 63.50 62.97 1bi9 n PRO 198 Cb 0.59 -1.33 -0.09 0.00 -0.04 0.00 0.00 33.50 32.63 1bi9 n PRO 198 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1bi9 h LEU 199 N 1.04 -1.17 -0.94 1.53 3.38 -1.93 -1.50 115.31 115.73 1bi9 h LEU 199 Ca 0.00 0.07 0.21 0.00 0.09 0.00 0.00 57.88 58.25 1bi9 h LEU 199 Cb 0.52 0.34 -0.12 0.00 0.09 0.00 0.00 40.66 41.49 1bi9 h LEU 199 CO 0.00 -0.70 0.50 0.77 0.09 0.00 0.00 178.44 179.10 1bi9 h SER 200 N -1.11 0.54 0.17 -0.43 4.64 -1.88 -1.67 113.55 113.80 1bi9 h SER 200 Ca -0.10 0.13 0.01 0.00 -0.47 0.00 0.00 61.79 61.37 1bi9 h SER 200 Cb 0.89 0.06 -0.04 0.00 -0.31 0.00 0.00 62.40 63.00 1bi9 h SER 200 CO 0.09 0.11 -0.41 0.00 -0.87 0.00 0.00 176.83 175.75 1bi9 h ALA 201 N 1.68 -0.76 -0.88 5.18 0.00 -1.71 -2.19 119.26 120.58 1bi9 h ALA 201 Ca 0.57 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.42 1bi9 h ALA 201 Cb 1.02 0.67 -0.05 0.00 0.00 0.00 0.00 17.79 19.43 1bi9 h ALA 201 CO -0.46 -0.99 0.58 -0.07 0.00 0.00 0.00 179.25 178.31 1bi9 h LEU 202 N -0.68 0.98 -1.04 0.00 3.38 -0.39 -1.60 115.31 115.97 1bi9 h LEU 202 Ca 0.01 -0.02 0.04 0.00 0.09 0.00 0.00 57.88 58.00 1bi9 h LEU 202 Cb 0.68 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 41.14 1bi9 h LEU 202 CO -0.21 0.69 0.65 0.22 0.09 0.00 0.00 178.44 179.87 1bi9 h TYR 203 N 1.14 1.21 0.00 1.13 5.03 -1.06 0.20 116.97 124.62 1bi9 h TYR 203 Ca 0.34 0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.67 1bi9 h TYR 203 Cb -0.04 -0.40 -0.00 0.00 1.55 0.00 0.00 36.73 37.84 1bi9 h TYR 203 CO -0.00 0.69 -0.04 0.52 -1.32 0.00 0.00 178.16 178.01 1bi9 h MET 204 N 1.24 0.00 -0.60 1.82 2.86 -0.67 0.21 114.93 119.79 1bi9 h MET 204 Ca 0.39 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 58.00 1bi9 h MET 204 Cb 0.02 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.65 1bi9 h MET 204 CO -0.13 0.04 0.25 0.78 1.06 0.00 0.00 176.91 178.91 1bi9 h GLY 205 N 0.14 0.95 0.86 8.32 0.00 -0.37 0.36 103.07 113.32 1bi9 h GLY 205 Ca -0.00 -0.51 0.01 0.00 0.00 0.00 0.00 47.33 46.83 1bi9 h GLY 205 CO 0.01 0.48 -0.06 0.00 0.00 0.00 0.00 176.54 176.96 1bi9 h ALA 206 N 1.09 -0.07 -0.71 3.60 0.00 -0.67 -1.57 119.26 120.94 1bi9 h ALA 206 Ca 0.20 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1bi9 h ALA 206 Cb 0.19 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1bi9 h ALA 206 CO -0.02 -0.56 0.40 -0.07 0.00 0.00 0.00 179.25 179.00 1bi9 h LEU 207 N -0.11 0.86 -0.10 0.00 3.38 -1.11 -1.63 115.31 116.60 1bi9 h LEU 207 Ca 0.02 -0.06 0.01 0.00 0.09 0.00 0.00 57.88 57.94 1bi9 h LEU 207 Cb 0.14 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1bi9 h LEU 207 CO -0.06 0.69 0.04 0.40 0.09 0.00 0.00 178.44 179.60 1bi9 h ILE 208 N 0.98 0.99 -0.55 1.22 2.04 0.33 0.22 117.51 122.74 1bi9 h ILE 208 Ca 0.25 -0.03 0.01 0.00 1.00 0.00 0.00 64.86 66.09 1bi9 h ILE 208 Cb 0.00 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 36.94 1bi9 h ILE 208 CO -0.04 0.02 0.36 0.50 0.00 0.00 0.00 178.15 178.99 1bi9 h LYS 209 N 0.10 0.72 -0.40 2.37 3.64 -0.94 -2.55 116.57 119.50 1bi9 h LYS 209 Ca 0.04 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.34 1bi9 h LYS 209 Cb 0.01 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.65 1bi9 h LYS 209 CO -0.04 0.47 0.10 1.49 -2.27 0.00 0.00 179.45 179.20 1bi9 h GLU 210 N 0.74 0.58 0.00 1.90 4.81 -0.87 -2.77 114.58 118.98 1bi9 h GLU 210 Ca 0.20 -0.10 -0.06 0.00 -0.13 0.00 0.00 59.36 59.27 1bi9 h GLU 210 Cb -0.08 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.20 1bi9 h GLU 210 CO -0.05 0.54 -0.30 0.00 -0.73 0.00 0.00 179.01 178.47 1bi9 h ALA 211 N 1.54 1.44 0.00 2.92 0.00 -0.14 -3.47 119.26 121.55 1bi9 h ALA 211 Ca 0.13 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1bi9 h ALA 211 Cb 0.22 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1bi9 h ALA 211 CO -0.00 0.37 0.00 0.41 0.00 0.00 0.00 179.25 180.03 1bi9 n GLY 212 N -0.60 0.61 3.73 0.00 0.00 -1.04 -4.92 105.19 102.98 1bi9 n GLY 212 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 1bi9 n GLY 212 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bi9 s PHE 213 N -1.56 2.86 0.36 1.61 0.08 -1.20 -4.93 117.98 115.20 1bi9 s PHE 213 Ca 0.00 0.59 -0.28 0.00 0.12 0.00 0.00 56.93 57.36 1bi9 s PHE 213 Cb 0.00 -4.07 -0.12 0.00 -0.57 0.00 0.00 43.02 38.26 1bi9 s PHE 213 CO 0.00 -3.83 1.41 -2.30 -0.10 0.00 0.00 175.22 170.39 1bi9 n PRO 214 N 3.13 2.44 -1.73 0.24 -0.02 -1.26 -4.80 135.00 133.01 1bi9 n PRO 214 Ca 0.12 0.86 -0.42 0.00 -2.02 0.00 0.00 63.50 62.03 1bi9 n PRO 214 Cb 0.37 -2.53 -0.01 0.00 -0.02 0.00 0.00 33.50 31.31 1bi9 n PRO 214 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1bi9 n PRO 215 N 0.52 2.48 0.00 0.52 -0.04 -1.26 -2.08 135.00 135.14 1bi9 n PRO 215 Ca 0.03 0.88 0.00 0.00 -0.04 0.00 0.00 63.50 64.37 1bi9 n PRO 215 Cb 0.38 -2.60 0.00 0.00 -0.04 0.00 0.00 33.50 31.23 1bi9 n PRO 215 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1bi9 n GLY 216 N 1.76 3.13 0.20 0.55 0.00 -1.26 -4.67 105.19 104.90 1bi9 n GLY 216 Ca 0.08 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.01 1bi9 n GLY 216 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1bi9 h VAL 217 N 0.00 1.21 -3.33 1.61 2.07 -1.71 -3.28 116.25 112.82 1bi9 h VAL 217 Ca 0.00 -0.69 -0.59 0.00 0.82 0.00 0.00 66.70 66.25 1bi9 h VAL 217 Cb 0.00 0.89 -0.34 0.00 -1.52 0.00 0.00 31.29 30.33 1bi9 h VAL 217 CO 0.00 0.24 -0.84 -0.69 0.02 0.00 0.00 177.57 176.31 1bi9 s VAL 218 N -5.44 1.52 -0.07 2.57 1.01 -1.26 -0.05 120.40 118.68 1bi9 s VAL 218 Ca -0.13 -0.68 0.02 0.00 0.00 0.00 0.00 61.98 61.18 1bi9 s VAL 218 Cb 0.10 -1.37 0.01 0.00 0.00 0.00 0.00 36.38 35.13 1bi9 s VAL 218 CO 0.76 0.44 -0.11 0.20 0.00 0.00 0.00 175.10 176.39 1bi9 s ASN 219 N 0.73 1.74 -0.15 3.32 0.01 -0.75 -4.50 114.94 115.33 1bi9 s ASN 219 Ca -0.12 -0.29 0.02 0.00 -0.71 0.00 0.00 52.86 51.76 1bi9 s ASN 219 Cb -0.16 -0.80 0.01 0.00 0.41 0.00 0.00 41.25 40.71 1bi9 s ASN 219 CO 0.03 0.02 -0.20 -0.63 -1.51 0.00 0.00 177.10 174.80 1bi9 s ILE 220 N 0.75 2.16 -0.31 0.60 1.01 -0.24 -0.44 121.20 124.73 1bi9 s ILE 220 Ca -0.13 -0.93 0.01 0.00 0.00 0.00 0.00 60.65 59.59 1bi9 s ILE 220 Cb -0.15 -1.88 0.10 0.00 0.01 0.00 0.00 42.46 40.53 1bi9 s ILE 220 CO 0.03 0.54 0.07 -0.76 0.00 0.00 0.00 174.94 174.82 1bi9 s LEU 221 N 0.95 3.02 0.35 2.97 1.02 0.91 -1.65 118.68 126.24 1bi9 s LEU 221 Ca -0.04 -1.74 -0.28 0.00 0.02 0.00 0.00 54.13 52.09 1bi9 s LEU 221 Cb -0.15 -1.12 -0.09 0.00 0.02 0.00 0.00 46.19 44.85 1bi9 s LEU 221 CO -0.05 -0.39 1.22 -2.16 0.02 0.00 0.00 176.35 175.00 1bi9 s PRO 222 N 1.39 4.29 0.00 1.29 0.04 -1.26 -4.30 135.00 136.44 1bi9 s PRO 222 Ca 0.09 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.15 1bi9 s PRO 222 Cb -0.18 -2.95 0.00 0.00 0.04 0.00 0.00 34.50 31.41 1bi9 s PRO 222 CO -0.18 -0.18 0.00 0.41 0.04 0.00 0.00 177.00 177.09 1bi9 n GLY 223 N 0.82 -2.25 3.90 0.56 0.00 -1.26 -0.94 105.19 106.02 1bi9 n GLY 223 Ca 0.01 -1.21 -0.28 0.00 0.00 0.00 0.00 46.02 44.55 1bi9 n GLY 223 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1bi9 s TYR 224 N -2.05 3.56 0.06 1.61 1.51 -1.26 -4.21 117.35 116.57 1bi9 s TYR 224 Ca 0.00 0.83 -0.31 0.00 -1.01 0.00 0.00 57.07 56.58 1bi9 s TYR 224 Cb 0.00 -2.31 -0.18 0.00 -0.11 0.00 0.00 41.96 39.35 1bi9 s TYR 224 CO 0.00 -0.28 1.52 0.78 -1.11 0.00 0.00 175.55 176.46 1bi9 h GLY 225 N 0.25 -0.89 1.64 0.71 0.00 -1.95 -1.46 103.07 101.36 1bi9 h GLY 225 Ca -0.47 0.33 0.04 0.00 0.00 0.00 0.00 47.33 47.23 1bi9 h GLY 225 CO 0.62 -0.33 0.14 -2.55 0.00 0.00 0.00 176.54 174.43 1bi9 h PRO 226 N -0.94 0.00 0.00 4.80 0.11 -1.96 -0.85 132.00 133.17 1bi9 h PRO 226 Ca -0.09 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.02 1bi9 h PRO 226 Cb 0.68 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.79 1bi9 h PRO 226 CO 0.14 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.18 1bi9 n THR 227 N -3.78 0.00 0.10 -1.15 -2.24 -1.21 -4.31 114.28 101.69 1bi9 n THR 227 Ca 0.00 0.05 -0.13 0.00 -2.27 0.00 0.00 64.05 61.70 1bi9 n THR 227 Cb 0.25 -1.01 -0.07 0.00 -2.10 0.00 0.00 70.33 67.40 1bi9 n THR 227 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bi9 h ALA 228 N -1.83 -0.17 -0.76 6.98 0.00 -1.45 -0.72 119.26 121.31 1bi9 h ALA 228 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1bi9 h ALA 228 Cb 0.00 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1bi9 h ALA 228 CO 0.00 -0.60 0.48 0.78 0.00 0.00 0.00 179.25 179.91 1bi9 h GLY 229 N -0.17 1.08 1.67 0.00 0.00 -1.15 -2.43 103.07 102.07 1bi9 h GLY 229 Ca -0.02 -0.42 -0.14 0.00 0.00 0.00 0.00 47.33 46.75 1bi9 h GLY 229 CO 0.03 0.41 -0.52 0.00 0.00 0.00 0.00 176.54 176.46 1bi9 h ALA 230 N 1.50 0.87 0.00 3.60 0.00 -0.82 -2.85 119.26 121.56 1bi9 h ALA 230 Ca 0.27 -0.49 -0.06 0.00 0.00 0.00 0.00 54.91 54.63 1bi9 h ALA 230 Cb -0.08 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1bi9 h ALA 230 CO -0.06 0.68 -0.31 0.00 0.00 0.00 0.00 179.25 179.56 1bi9 h ALA 231 N 1.17 1.04 -0.05 0.00 0.00 -0.68 -2.18 119.26 118.56 1bi9 h ALA 231 Ca 0.01 -0.28 -0.13 0.00 0.00 0.00 0.00 54.91 54.51 1bi9 h ALA 231 Cb 1.01 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.76 1bi9 h ALA 231 CO 0.09 0.38 -0.46 0.82 0.00 0.00 0.00 179.25 180.08 1bi9 h ILE 232 N 0.00 1.42 0.00 0.00 2.04 -1.33 -1.32 117.51 118.31 1bi9 h ILE 232 Ca -0.00 -1.88 -0.02 0.00 1.00 0.00 0.00 64.86 63.95 1bi9 h ILE 232 Cb 0.80 2.40 -0.00 0.00 -0.74 0.00 0.00 36.82 39.28 1bi9 h ILE 232 CO 0.04 0.55 -0.10 0.00 0.00 0.00 0.00 178.15 178.64 1bi9 h ALA 233 N 0.40 1.17 -0.00 1.87 0.00 -1.34 -2.79 119.26 118.57 1bi9 h ALA 233 Ca -0.04 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1bi9 h ALA 233 Cb 1.14 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1bi9 h ALA 233 CO 0.09 0.13 -0.60 0.43 0.00 0.00 0.00 179.25 179.30 1bi9 n SER 234 N -3.46 0.97 -4.68 0.00 7.64 -0.84 -3.84 113.62 109.41 1bi9 n SER 234 Ca -0.01 -0.99 -0.44 0.00 1.01 0.00 0.00 58.87 58.44 1bi9 n SER 234 Cb 0.26 0.85 -0.04 0.00 -1.01 0.00 0.00 64.21 64.27 1bi9 n SER 234 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 1bi9 n HIS 235 N -1.00 2.48 0.38 1.43 -0.00 -0.50 -4.76 115.22 113.25 1bi9 n HIS 235 Ca 0.04 -0.02 0.05 0.00 -0.00 0.00 0.00 57.72 57.79 1bi9 n HIS 235 Cb 0.26 -2.67 0.23 0.00 -0.00 0.00 0.00 29.99 27.82 1bi9 n HIS 235 CO 0.00 0.00 0.00 1.51 -0.00 0.00 0.00 176.34 177.85 1bi9 n ILE 236 N 4.48 1.24 -0.56 3.57 0.13 -1.26 -3.15 119.36 123.81 1bi9 n ILE 236 Ca 0.19 0.31 0.05 0.00 -1.10 0.00 0.00 62.75 62.20 1bi9 n ILE 236 Cb 0.34 -1.12 0.08 0.00 -0.84 0.00 0.00 39.64 38.09 1bi9 n ILE 236 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1bi9 n GLY 237 N -0.38 3.97 3.63 4.50 0.00 -1.26 -4.92 105.19 110.74 1bi9 n GLY 237 Ca 0.03 -0.60 -0.35 0.00 0.00 0.00 0.00 46.02 45.10 1bi9 n GLY 237 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bi9 s ILE 238 N -1.98 4.91 -0.61 -0.61 1.01 -1.19 -4.78 121.20 117.95 1bi9 s ILE 238 Ca 0.17 0.01 0.25 0.00 0.00 0.00 0.00 60.65 61.08 1bi9 s ILE 238 Cb 0.15 -3.23 0.23 0.00 0.01 0.00 0.00 42.46 39.61 1bi9 s ILE 238 CO 0.02 0.43 1.58 0.44 0.00 0.00 0.00 174.94 177.41 1bi9 h ASP 239 N 6.93 0.00 -4.02 3.58 3.32 -1.25 -3.44 116.42 121.53 1bi9 h ASP 239 Ca -0.38 -0.05 0.06 0.00 0.02 0.00 0.00 57.03 56.69 1bi9 h ASP 239 Cb 1.17 0.00 -0.23 0.00 0.22 0.00 0.00 39.33 40.48 1bi9 h ASP 239 CO 0.69 0.02 0.50 -0.75 -1.72 0.00 0.00 179.24 177.98 1bi9 s LYS 240 N -3.16 0.62 -0.01 3.56 2.36 -1.03 -2.11 119.74 119.96 1bi9 s LYS 240 Ca 0.08 0.24 0.04 0.00 -2.55 0.00 0.00 55.97 53.78 1bi9 s LYS 240 Cb 0.11 0.29 -0.01 0.00 -1.05 0.00 0.00 37.83 37.17 1bi9 s LYS 240 CO 0.66 -0.17 -0.13 -1.50 1.55 0.00 0.00 175.35 175.75 1bi9 s ILE 241 N -0.86 1.04 -0.25 5.43 2.07 -0.50 0.01 121.20 128.15 1bi9 s ILE 241 Ca -0.02 -0.55 0.01 0.00 -1.41 0.00 0.00 60.65 58.68 1bi9 s ILE 241 Cb -0.01 -0.87 0.04 0.00 0.13 0.00 0.00 42.46 41.74 1bi9 s ILE 241 CO 0.01 0.30 -0.10 0.00 -1.91 0.00 0.00 174.94 173.23 1bi9 s ALA 242 N -0.22 2.58 0.04 1.50 0.00 -0.33 -1.79 121.76 123.54 1bi9 s ALA 242 Ca 0.03 -1.58 0.08 0.00 0.00 0.00 0.00 51.96 50.49 1bi9 s ALA 242 Cb -0.06 -1.57 -0.03 0.00 0.00 0.00 0.00 23.12 21.46 1bi9 s ALA 242 CO -0.00 -0.93 -0.20 0.12 0.00 0.00 0.00 175.76 174.74 1bi9 s PHE 243 N 1.22 2.49 -0.06 0.00 5.36 0.04 -1.37 117.98 125.66 1bi9 s PHE 243 Ca -0.03 -0.30 -0.03 0.00 -0.96 0.00 0.00 56.93 55.61 1bi9 s PHE 243 Cb -0.18 -1.45 0.04 0.00 -0.34 0.00 0.00 43.02 41.10 1bi9 s PHE 243 CO -0.06 0.22 0.13 0.95 -1.46 0.00 0.00 175.22 175.00 1bi9 s THR 244 N -0.89 -0.08 -3.20 0.12 -4.23 -0.97 0.21 115.64 106.61 1bi9 s THR 244 Ca 0.14 0.21 0.00 0.00 -1.18 0.00 0.00 61.69 60.86 1bi9 s THR 244 Cb -0.10 -0.23 0.00 0.00 1.34 0.00 0.00 72.50 73.51 1bi9 s THR 244 CO 0.04 0.09 0.00 0.61 -0.54 0.00 0.00 174.62 174.82 1bi9 n GLY 245 N 4.35 -0.56 3.78 3.99 0.00 -0.82 -3.66 105.19 112.27 1bi9 n GLY 245 Ca -0.24 -0.61 -0.34 0.00 0.00 0.00 0.00 46.02 44.84 1bi9 n GLY 245 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1bi9 s SER 246 N -4.00 5.57 0.27 1.61 1.04 -1.26 -3.48 113.70 113.45 1bi9 s SER 246 Ca 0.00 2.00 0.07 0.00 0.48 0.00 0.00 55.95 58.50 1bi9 s SER 246 Cb 0.00 -2.56 0.37 0.00 0.10 0.00 0.00 66.02 63.93 1bi9 s SER 246 CO 0.00 -1.32 1.63 0.71 0.98 0.00 0.00 173.24 175.25 1bi9 h THR 247 N 0.61 1.37 -0.05 2.02 1.35 -1.96 0.34 112.91 116.58 1bi9 h THR 247 Ca -0.48 -1.82 0.01 0.00 -0.55 0.00 0.00 66.41 63.57 1bi9 h THR 247 Cb 1.24 1.92 -0.01 0.00 -1.73 0.00 0.00 68.15 69.57 1bi9 h THR 247 CO 0.56 0.53 -0.02 1.05 -0.25 0.00 0.00 175.52 177.40 1bi9 h GLU 248 N 0.13 -0.00 -0.08 4.72 9.09 -2.00 -0.05 114.58 126.38 1bi9 h GLU 248 Ca 0.00 0.00 -0.13 0.00 0.05 0.00 0.00 59.36 59.28 1bi9 h GLU 248 Cb 0.98 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.07 1bi9 h GLU 248 CO 0.08 -0.00 -0.53 0.28 0.05 0.00 0.00 179.01 178.89 1bi9 h VAL 249 N -0.00 1.36 -0.58 -1.06 2.07 -1.93 -2.84 116.25 113.27 1bi9 h VAL 249 Ca 0.03 -1.81 0.06 0.00 0.82 0.00 0.00 66.70 65.80 1bi9 h VAL 249 Cb 0.05 1.88 -0.05 0.00 -1.52 0.00 0.00 31.29 31.64 1bi9 h VAL 249 CO -0.06 0.54 0.28 1.23 0.02 0.00 0.00 177.57 179.58 1bi9 h GLY 250 N 1.38 0.82 0.42 2.17 0.00 -0.22 -1.02 103.07 106.61 1bi9 h GLY 250 Ca 0.00 -0.18 0.09 0.00 0.00 0.00 0.00 47.33 47.24 1bi9 h GLY 250 CO 0.08 0.09 0.22 0.50 0.00 0.00 0.00 176.54 177.43 1bi9 h LYS 251 N 0.52 0.40 -0.50 4.80 1.57 -0.78 -0.82 116.57 121.76 1bi9 h LYS 251 Ca 0.27 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.99 1bi9 h LYS 251 Cb 0.21 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 1bi9 h LYS 251 CO -0.20 0.26 0.18 -0.07 -0.57 0.00 0.00 179.45 179.05 1bi9 h LEU 252 N 0.41 0.66 -0.15 2.94 3.38 -1.25 -2.67 115.31 118.63 1bi9 h LEU 252 Ca 0.30 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.18 1bi9 h LEU 252 Cb 0.35 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1bi9 h LEU 252 CO -0.29 0.61 0.07 0.40 0.09 0.00 0.00 178.44 179.32 1bi9 h ILE 253 N 0.72 1.13 -0.47 1.22 1.08 0.08 -1.26 117.51 120.01 1bi9 h ILE 253 Ca 0.17 -0.39 -0.07 0.00 -0.39 0.00 0.00 64.86 64.18 1bi9 h ILE 253 Cb 0.17 1.12 -0.02 0.00 -3.07 0.00 0.00 36.82 35.02 1bi9 h ILE 253 CO -0.01 0.12 0.02 -0.61 -0.69 0.00 0.00 178.15 176.98 1bi9 h GLN 254 N 0.11 0.77 0.05 2.37 4.15 -1.38 0.12 115.11 121.30 1bi9 h GLN 254 Ca 0.05 -0.19 -0.00 0.00 0.77 0.00 0.00 58.65 59.27 1bi9 h GLN 254 Cb 0.14 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 27.73 1bi9 h GLN 254 CO -0.01 0.77 -0.02 1.49 -1.93 0.00 0.00 178.83 179.13 1bi9 h GLU 255 N 0.72 -0.06 -0.72 1.69 4.81 -1.32 0.68 114.58 120.38 1bi9 h GLU 255 Ca 0.15 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.39 1bi9 h GLU 255 Cb 0.41 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.77 1bi9 h GLU 255 CO 0.02 0.15 0.48 0.00 -0.73 0.00 0.00 179.01 178.92 1bi9 h ALA 256 N 0.67 1.51 0.55 2.92 0.00 -1.02 0.68 119.26 124.57 1bi9 h ALA 256 Ca -0.01 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1bi9 h ALA 256 Cb 0.24 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1bi9 h ALA 256 CO 0.01 0.45 -0.34 0.00 0.00 0.00 0.00 179.25 179.37 1bi9 h ALA 257 N 1.56 -0.85 -0.02 0.00 0.00 -0.33 -2.24 119.26 117.37 1bi9 h ALA 257 Ca 0.27 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1bi9 h ALA 257 Cb -0.08 0.42 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 1bi9 h ALA 257 CO -0.06 -0.99 -0.10 0.78 0.00 0.00 0.00 179.25 178.87 1bi9 h GLY 258 N -0.84 0.03 0.61 0.00 0.00 -0.10 -2.01 103.07 100.76 1bi9 h GLY 258 Ca -0.07 -0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.25 1bi9 h GLY 258 CO 0.07 0.01 -0.08 0.54 0.00 0.00 0.00 176.54 177.08 1bi9 n ARG 259 N -4.40 0.94 0.00 4.80 1.74 0.16 -4.53 116.66 115.37 1bi9 n ARG 259 Ca -0.02 -0.35 0.00 0.00 -0.77 0.00 0.00 57.85 56.70 1bi9 n ARG 259 Cb 0.18 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.13 1bi9 n ARG 259 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1bi9 n SER 260 N -0.72 0.00 -0.00 0.55 3.41 -0.86 -4.99 113.62 111.00 1bi9 n SER 260 Ca 0.17 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.78 1bi9 n SER 260 Cb 0.27 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.22 1bi9 n SER 260 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1bi9 n ASN 261 N -0.77 1.29 -2.40 4.04 6.94 -1.20 -5.01 115.26 118.16 1bi9 n ASN 261 Ca 0.00 -1.66 -0.19 0.00 -0.02 0.00 0.00 54.58 52.70 1bi9 n ASN 261 Cb 0.00 -0.01 0.01 0.00 -2.36 0.00 0.00 39.78 37.42 1bi9 n ASN 261 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 1bi9 n LEU 262 N -0.33 -2.19 -4.69 -4.53 4.77 -0.80 -4.96 117.00 104.27 1bi9 n LEU 262 Ca 0.00 -0.13 -0.32 0.00 -0.03 0.00 0.00 56.01 55.53 1bi9 n LEU 262 Cb 0.35 -2.69 0.14 0.00 -2.33 0.00 0.00 43.42 38.89 1bi9 n LEU 262 CO 0.00 -0.00 0.73 -1.59 -1.33 0.00 0.00 177.39 175.20 1bi9 s LYS 263 N -5.23 1.37 0.49 3.23 -2.85 -1.26 -4.92 119.74 110.57 1bi9 s LYS 263 Ca 0.13 1.66 -0.23 0.00 -1.00 0.00 0.00 55.97 56.53 1bi9 s LYS 263 Cb -0.06 -1.76 -0.06 0.00 -2.06 0.00 0.00 37.83 33.89 1bi9 s LYS 263 CO 0.16 -2.40 1.28 1.03 0.10 0.00 0.00 175.35 175.52 1bi9 s ARG 264 N -4.37 3.48 -0.03 1.78 0.52 -0.90 -4.87 118.95 114.57 1bi9 s ARG 264 Ca 0.70 2.05 0.02 0.00 -0.52 0.00 0.00 55.73 57.98 1bi9 s ARG 264 Cb -0.26 -2.38 0.01 0.00 0.52 0.00 0.00 34.95 32.84 1bi9 s ARG 264 CO 0.54 -0.86 -0.09 0.08 0.02 0.00 0.00 175.30 174.99 1bi9 s VAL 265 N -1.39 0.80 -0.06 3.52 1.01 -1.26 -1.41 120.40 121.60 1bi9 s VAL 265 Ca 0.67 -0.35 0.02 0.00 0.00 0.00 0.00 61.98 62.32 1bi9 s VAL 265 Cb -0.36 -0.72 0.01 0.00 0.00 0.00 0.00 36.38 35.31 1bi9 s VAL 265 CO 0.43 0.26 -0.12 -0.89 0.00 0.00 0.00 175.10 174.77 1bi9 s THR 266 N 0.30 1.13 -0.17 3.92 2.01 -0.74 -5.01 115.64 117.10 1bi9 s THR 266 Ca -0.05 -0.49 0.01 0.00 0.31 0.00 0.00 61.69 61.47 1bi9 s THR 266 Cb -0.10 -1.03 0.02 0.00 0.01 0.00 0.00 72.50 71.40 1bi9 s THR 266 CO 0.01 0.35 -0.18 -0.76 -0.69 0.00 0.00 174.62 173.35 1bi9 s LEU 267 N 0.59 1.97 -0.76 4.42 1.43 -1.26 -0.78 118.68 124.30 1bi9 s LEU 267 Ca -0.13 -0.59 -0.08 0.00 -1.03 0.00 0.00 54.13 52.30 1bi9 s LEU 267 Cb -0.15 -1.37 0.20 0.00 0.03 0.00 0.00 46.19 44.90 1bi9 s LEU 267 CO 0.03 -0.01 0.64 -0.70 0.23 0.00 0.00 176.35 176.55 1bi9 s GLU 268 N 1.32 3.17 0.50 1.70 2.12 0.13 -4.99 118.70 122.65 1bi9 s GLU 268 Ca 0.04 -2.59 -0.01 0.00 0.36 0.00 0.00 54.97 52.77 1bi9 s GLU 268 Cb -0.13 -4.10 0.00 0.00 0.26 0.00 0.00 34.13 30.16 1bi9 s GLU 268 CO -0.11 -1.24 0.74 -0.51 -0.54 0.00 0.00 175.26 173.60 1bi9 s LEU 269 N -0.11 3.50 0.00 2.70 1.43 -1.26 -1.94 118.68 123.00 1bi9 s LEU 269 Ca 0.19 0.37 0.00 0.00 -1.03 0.00 0.00 54.13 53.66 1bi9 s LEU 269 Cb -0.14 -3.23 0.00 0.00 0.03 0.00 0.00 46.19 42.84 1bi9 s LEU 269 CO -0.07 -0.84 0.00 0.61 0.23 0.00 0.00 176.35 176.28 1bi9 n GLY 270 N -2.24 -3.11 0.00 -3.19 0.00 -1.23 -4.94 105.19 90.49 1bi9 n GLY 270 Ca 0.03 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.27 1bi9 n GLY 270 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bi9 n GLY 271 N 0.46 3.68 3.82 -0.02 0.00 -1.26 -4.79 105.19 107.08 1bi9 n GLY 271 Ca 0.00 -1.68 -0.37 0.00 0.00 0.00 0.00 46.02 43.97 1bi9 n GLY 271 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1bi9 s LYS 272 N -2.50 4.15 -0.62 1.61 -2.85 -1.25 -4.95 119.74 113.33 1bi9 s LYS 272 Ca 0.00 0.70 0.06 0.00 -1.00 0.00 0.00 55.97 55.72 1bi9 s LYS 272 Cb 0.00 -3.04 0.20 0.00 -2.06 0.00 0.00 37.83 32.94 1bi9 s LYS 272 CO 0.00 0.52 0.57 0.45 0.10 0.00 0.00 175.35 176.99 1bi9 n SER 273 N 1.13 2.62 -4.80 0.03 2.88 -1.26 -2.20 113.62 112.02 1bi9 n SER 273 Ca -0.06 -3.15 -0.35 0.00 -1.33 0.00 0.00 58.87 53.98 1bi9 n SER 273 Cb 0.51 -0.69 -0.05 0.00 -0.75 0.00 0.00 64.21 63.23 1bi9 n SER 273 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1bi9 s PRO 274 N -1.62 4.10 0.15 -1.46 0.04 -1.06 -2.76 135.00 132.38 1bi9 s PRO 274 Ca 0.32 1.33 0.10 0.00 0.04 0.00 0.00 61.00 62.79 1bi9 s PRO 274 Cb 0.05 -2.31 -0.04 0.00 0.04 0.00 0.00 34.50 32.24 1bi9 s PRO 274 CO -0.11 -0.17 -0.19 -0.80 0.04 0.00 0.00 177.00 175.77 1bi9 s ASN 275 N -1.88 3.78 -0.07 6.66 -0.87 -1.09 -2.05 114.94 119.42 1bi9 s ASN 275 Ca 0.62 -0.67 0.02 0.00 -1.57 0.00 0.00 52.86 51.25 1bi9 s ASN 275 Cb -0.16 -0.47 0.02 0.00 -0.02 0.00 0.00 41.25 40.62 1bi9 s ASN 275 CO 0.20 0.15 -0.10 -0.63 -2.57 0.00 0.00 177.10 174.15 1bi9 s ILE 276 N -1.40 1.00 -0.23 0.60 1.01 0.93 -1.55 121.20 121.57 1bi9 s ILE 276 Ca 0.20 -0.38 0.02 0.00 0.00 0.00 0.00 60.65 60.49 1bi9 s ILE 276 Cb -0.09 -0.95 0.05 0.00 0.01 0.00 0.00 42.46 41.48 1bi9 s ILE 276 CO 0.11 0.33 -0.11 -0.63 0.00 0.00 0.00 174.94 174.64 1bi9 s ILE 277 N 0.88 1.90 0.21 2.92 1.01 0.89 -1.34 121.20 127.66 1bi9 s ILE 277 Ca -0.11 -1.29 -0.05 0.00 0.00 0.00 0.00 60.65 59.20 1bi9 s ILE 277 Cb -0.15 -1.98 -0.06 0.00 0.01 0.00 0.00 42.46 40.29 1bi9 s ILE 277 CO 0.01 0.10 0.46 -0.36 0.00 0.00 0.00 174.94 175.15 1bi9 s PHE 278 N 1.26 3.47 0.48 3.97 0.08 -1.09 -1.50 117.98 124.65 1bi9 s PHE 278 Ca -0.04 0.60 0.23 0.00 0.12 0.00 0.00 56.93 57.84 1bi9 s PHE 278 Cb -0.18 -2.05 1.26 0.00 -0.57 0.00 0.00 43.02 41.48 1bi9 s PHE 278 CO -0.07 0.33 1.91 0.00 -0.10 0.00 0.00 175.22 177.28 1bi9 h ALA 279 N 2.34 2.43 0.00 5.36 0.00 -1.89 -1.37 119.26 126.13 1bi9 h ALA 279 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1bi9 h ALA 279 Cb 1.18 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1bi9 h ALA 279 CO 0.70 -0.66 0.00 -0.40 0.00 0.00 0.00 179.25 178.89 1bi9 n ASP 280 N -4.41 0.00 -4.86 0.00 5.68 -1.26 -4.78 116.55 106.92 1bi9 n ASP 280 Ca 0.16 0.49 -0.31 0.00 -0.50 0.00 0.00 54.79 54.62 1bi9 n ASP 280 Cb 0.72 -0.49 -0.04 0.00 -1.14 0.00 0.00 41.12 40.16 1bi9 n ASP 280 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1bi9 s ALA 281 N -2.99 3.30 -0.49 2.12 0.00 -0.52 -4.42 121.76 118.76 1bi9 s ALA 281 Ca 0.07 -0.05 -0.27 0.00 0.00 0.00 0.00 51.96 51.71 1bi9 s ALA 281 Cb 0.09 -2.79 -0.03 0.00 0.00 0.00 0.00 23.12 20.39 1bi9 s ALA 281 CO 0.25 0.09 2.00 0.16 0.00 0.00 0.00 175.76 178.26 1bi9 s ASP 282 N -2.80 5.23 0.31 0.00 1.47 -1.26 -4.82 116.67 114.79 1bi9 s ASP 282 Ca 0.53 0.85 0.06 0.00 1.18 0.00 0.00 52.55 55.18 1bi9 s ASP 282 Cb -0.10 -2.52 0.86 0.00 -0.34 0.00 0.00 42.92 40.82 1bi9 s ASP 282 CO 0.26 -2.31 1.61 0.25 0.68 0.00 0.00 175.17 175.66 1bi9 h LEU 283 N 16.46 -0.05 0.81 2.11 5.85 -1.93 0.72 115.31 139.29 1bi9 h LEU 283 Ca -0.28 0.23 -0.04 0.00 0.84 0.00 0.00 57.88 58.63 1bi9 h LEU 283 Cb 1.19 0.32 0.00 0.00 0.37 0.00 0.00 40.66 42.55 1bi9 h LEU 283 CO 1.14 -0.26 -0.42 0.44 -0.34 0.00 0.00 178.44 179.00 1bi9 h ASP 284 N 0.12 -1.01 -0.29 1.25 3.32 -2.00 -1.05 116.42 116.76 1bi9 h ASP 284 Ca 0.63 0.04 0.06 0.00 0.02 0.00 0.00 57.03 57.79 1bi9 h ASP 284 Cb 1.39 0.27 -0.07 0.00 0.22 0.00 0.00 39.33 41.15 1bi9 h ASP 284 CO -0.75 -0.69 -0.14 0.22 -1.72 0.00 0.00 179.24 176.16 1bi9 h TYR 285 N -1.12 -0.35 -0.74 4.55 3.20 -1.71 -2.15 116.97 118.66 1bi9 h TYR 285 Ca -0.11 0.03 0.14 0.00 3.14 0.00 0.00 58.73 61.93 1bi9 h TYR 285 Cb 0.87 0.20 -0.09 0.00 1.54 0.00 0.00 36.73 39.25 1bi9 h TYR 285 CO 0.00 -0.21 0.30 0.00 -1.64 0.00 0.00 178.16 176.61 1bi9 h ALA 286 N 1.12 1.04 -0.68 1.82 0.00 -0.82 -1.13 119.26 120.61 1bi9 h ALA 286 Ca 0.15 0.11 -0.06 0.00 0.00 0.00 0.00 54.91 55.11 1bi9 h ALA 286 Cb 0.33 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1bi9 h ALA 286 CO -0.36 -0.20 0.20 0.28 0.00 0.00 0.00 179.25 179.18 1bi9 h VAL 287 N 0.45 1.25 -0.36 0.00 2.07 -0.56 0.11 116.25 119.21 1bi9 h VAL 287 Ca 0.40 -0.88 -0.08 0.00 0.82 0.00 0.00 66.70 66.96 1bi9 h VAL 287 Cb 0.59 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.86 1bi9 h VAL 287 CO -0.39 0.34 -0.10 -0.08 0.02 0.00 0.00 177.57 177.37 1bi9 h GLU 288 N 1.02 0.70 -0.09 1.57 4.57 -0.77 -1.72 114.58 119.86 1bi9 h GLU 288 Ca 0.22 -0.27 -0.12 0.00 -1.18 0.00 0.00 59.36 58.00 1bi9 h GLU 288 Cb 0.30 -0.04 0.01 0.00 -0.16 0.00 0.00 28.75 28.86 1bi9 h GLU 288 CO -0.01 0.86 -0.43 1.96 -1.18 0.00 0.00 179.01 180.22 1bi9 h GLN 289 N 0.50 0.45 0.00 1.92 1.08 -1.14 -2.47 115.11 115.44 1bi9 h GLN 289 Ca 0.09 -0.36 -0.01 0.00 -1.45 0.00 0.00 58.65 56.91 1bi9 h GLN 289 Cb 0.61 0.08 -0.00 0.00 -0.05 0.00 0.00 27.48 28.12 1bi9 h GLN 289 CO 0.04 1.00 -0.05 0.00 -0.95 0.00 0.00 178.83 178.86 1bi9 h ALA 290 N 0.45 1.17 0.00 3.87 0.00 -0.83 -1.73 119.26 122.19 1bi9 h ALA 290 Ca -0.03 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1bi9 h ALA 290 Cb 1.08 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 1bi9 h ALA 290 CO 0.09 0.07 -0.03 1.25 0.00 0.00 0.00 179.25 180.63 1bi9 h HIS 291 N 0.00 0.00 -0.54 0.00 -0.00 -1.23 -3.28 115.15 110.10 1bi9 h HIS 291 Ca -0.00 0.00 0.08 0.00 -0.00 0.00 0.00 60.37 60.45 1bi9 h HIS 291 Cb 0.25 0.00 -0.06 0.00 -0.00 0.00 0.00 27.41 27.60 1bi9 h HIS 291 CO 0.00 0.16 0.19 1.96 -0.00 0.00 0.00 177.93 180.24 1bi9 h GLN 292 N -1.00 0.35 0.00 5.26 1.08 -1.39 -0.27 115.11 119.14 1bi9 h GLN 292 Ca -0.00 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.18 1bi9 h GLN 292 Cb 0.18 -0.08 0.00 0.00 -0.05 0.00 0.00 27.48 27.53 1bi9 h GLN 292 CO -0.00 0.23 0.00 0.41 -0.95 0.00 0.00 178.83 178.52 1bi9 n GLY 293 N -1.28 -0.33 0.00 3.46 0.00 -0.66 0.63 105.19 107.02 1bi9 n GLY 293 Ca 0.07 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1bi9 n GLY 293 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1bi9 n VAL 294 N -0.79 0.00 0.39 1.61 0.31 -0.23 -4.25 118.33 115.37 1bi9 n VAL 294 Ca 0.05 0.00 0.04 0.00 -0.01 0.00 0.00 64.34 64.42 1bi9 n VAL 294 Cb 0.02 0.24 -0.04 0.00 -0.91 0.00 0.00 33.84 33.16 1bi9 n VAL 294 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1bi9 n PHE 295 N -1.28 0.00 -1.73 3.52 3.72 -0.53 -4.15 117.46 117.02 1bi9 n PHE 295 Ca 0.00 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.02 1bi9 n PHE 295 Cb 0.05 0.00 0.05 0.00 -0.94 0.00 0.00 39.48 38.64 1bi9 n PHE 295 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1bi9 n PHE 296 N -1.03 2.11 -3.78 1.38 7.35 0.21 -2.11 117.46 121.59 1bi9 n PHE 296 Ca 0.02 0.43 -0.29 0.00 -0.76 0.00 0.00 57.45 56.85 1bi9 n PHE 296 Cb 0.14 -2.33 -0.01 0.00 0.35 0.00 0.00 39.48 37.63 1bi9 n PHE 296 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 1bi9 n ASN 297 N -1.04 -3.72 -1.34 -2.13 5.15 -1.26 0.46 115.26 111.39 1bi9 n ASN 297 Ca 0.11 -0.68 -0.15 0.00 -0.60 0.00 0.00 54.58 53.26 1bi9 n ASN 297 Cb 0.45 -3.04 -0.04 0.00 -0.53 0.00 0.00 39.78 36.61 1bi9 n ASN 297 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1bi9 n GLN 298 N -4.11 -1.08 0.00 1.20 3.00 -0.90 -2.51 117.38 112.97 1bi9 n GLN 298 Ca 0.03 0.91 0.00 0.00 -0.01 0.00 0.00 57.00 57.93 1bi9 n GLN 298 Cb 0.52 -5.11 0.00 0.00 0.00 0.00 0.00 30.24 25.65 1bi9 n GLN 298 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1bi9 n GLY 299 N -1.11 2.23 2.14 1.08 0.00 0.17 -2.59 105.19 107.12 1bi9 n GLY 299 Ca -0.16 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.67 1bi9 n GLY 299 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bi9 n GLN 300 N -1.75 2.41 -3.83 1.61 10.64 -1.04 -3.70 117.38 121.71 1bi9 n GLN 300 Ca 0.00 -1.47 -0.29 0.00 -1.83 0.00 0.00 57.00 53.41 1bi9 n GLN 300 Cb 0.00 -2.17 -0.16 0.00 -0.86 0.00 0.00 30.24 27.06 1bi9 n GLN 300 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1bi9 n THR 303 N -4.29 0.14 -3.48 0.00 -2.24 -1.26 -4.56 114.28 98.59 1bi9 n THR 303 Ca 0.40 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.18 1bi9 n THR 303 Cb 1.72 -0.41 -0.05 0.00 -2.10 0.00 0.00 70.33 69.49 1bi9 n THR 303 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bi9 s ALA 304 N -0.67 -2.54 0.55 6.98 0.00 0.15 -3.65 121.76 122.58 1bi9 s ALA 304 Ca 0.00 2.11 0.01 0.00 0.00 0.00 0.00 51.96 54.08 1bi9 s ALA 304 Cb 0.00 -1.94 0.03 0.00 0.00 0.00 0.00 23.12 21.21 1bi9 s ALA 304 CO 0.00 -0.78 0.78 0.20 0.00 0.00 0.00 175.76 175.96 1bi9 s GLY 305 N 2.17 1.81 -0.00 0.00 0.00 -1.11 -4.63 107.32 105.56 1bi9 s GLY 305 Ca -0.05 -1.30 0.19 0.00 0.00 0.00 0.00 44.72 43.57 1bi9 s GLY 305 CO -0.17 -1.01 0.78 -1.14 0.00 0.00 0.00 173.10 171.56 1bi9 n SER 306 N -2.35 0.87 -4.76 1.64 3.41 -1.26 -4.51 113.62 106.66 1bi9 n SER 306 Ca 0.08 -0.89 -0.39 0.00 -0.26 0.00 0.00 58.87 57.40 1bi9 n SER 306 Cb 0.60 1.05 -0.05 0.00 -0.26 0.00 0.00 64.21 65.55 1bi9 n SER 306 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1bi9 s ARG 307 N -2.83 4.45 -0.12 4.33 1.70 -1.26 -0.96 118.95 124.26 1bi9 s ARG 307 Ca 0.06 1.00 -0.03 0.00 -0.47 0.00 0.00 55.73 56.29 1bi9 s ARG 307 Cb 0.14 -3.33 0.05 0.00 -0.57 0.00 0.00 34.95 31.25 1bi9 s ARG 307 CO 0.78 0.40 0.07 0.42 -1.08 0.00 0.00 175.30 175.89 1bi9 s ILE 308 N -0.42 0.01 -0.40 4.99 1.01 -0.64 -2.67 121.20 123.07 1bi9 s ILE 308 Ca 0.36 0.01 -0.20 0.00 0.00 0.00 0.00 60.65 60.82 1bi9 s ILE 308 Cb -0.21 -0.49 0.01 0.00 0.01 0.00 0.00 42.46 41.79 1bi9 s ILE 308 CO 0.22 -0.08 0.58 -0.36 0.00 0.00 0.00 174.94 175.30 1bi9 s PHE 309 N 2.10 3.12 0.02 3.97 0.40 -0.59 -0.41 117.98 126.59 1bi9 s PHE 309 Ca 0.03 0.00 0.01 0.00 -0.60 0.00 0.00 56.93 56.38 1bi9 s PHE 309 Cb -0.15 -3.16 -0.04 0.00 0.51 0.00 0.00 43.02 40.19 1bi9 s PHE 309 CO -0.07 -0.74 0.03 0.08 0.70 0.00 0.00 175.22 175.23 1bi9 s VAL 310 N 2.61 4.36 0.23 -0.44 1.01 0.70 -0.08 120.40 128.79 1bi9 s VAL 310 Ca 0.20 -0.60 -0.30 0.00 0.00 0.00 0.00 61.98 61.29 1bi9 s VAL 310 Cb -0.15 -2.99 -0.09 0.00 0.00 0.00 0.00 36.38 33.15 1bi9 s VAL 310 CO 0.16 0.31 1.06 -0.70 0.00 0.00 0.00 175.10 175.93 1bi9 s GLU 311 N -1.79 4.68 0.36 2.72 2.12 -0.56 -1.71 118.70 124.52 1bi9 s GLU 311 Ca 0.22 1.69 0.18 0.00 0.36 0.00 0.00 54.97 57.42 1bi9 s GLU 311 Cb -0.12 -3.25 1.24 0.00 0.26 0.00 0.00 34.13 32.27 1bi9 s GLU 311 CO 0.14 0.24 1.60 0.93 -0.54 0.00 0.00 175.26 177.63 1bi9 h GLU 312 N 4.40 0.09 -0.58 4.30 5.08 -1.68 -0.33 114.58 125.86 1bi9 h GLU 312 Ca -0.45 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 57.92 1bi9 h GLU 312 Cb 1.21 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.41 1bi9 h GLU 312 CO 0.69 0.06 0.38 0.77 -1.00 0.00 0.00 179.01 179.91 1bi9 h SER 313 N 0.09 0.61 -0.01 1.42 0.02 -1.92 -3.13 113.55 110.64 1bi9 h SER 313 Ca 0.80 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.74 1bi9 h SER 313 Cb 2.03 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 64.42 1bi9 h SER 313 CO -0.73 0.43 -0.01 2.30 -1.14 0.00 0.00 176.83 177.68 1bi9 n ILE 314 N -4.46 0.00 -0.22 3.27 -5.35 -0.36 -4.67 119.36 107.57 1bi9 n ILE 314 Ca 0.06 -0.49 0.02 0.00 -0.27 0.00 0.00 62.75 62.07 1bi9 n ILE 314 Cb 0.10 1.14 0.13 0.00 -1.74 0.00 0.00 39.64 39.28 1bi9 n ILE 314 CO 0.00 0.00 0.00 0.22 -1.76 0.00 0.00 176.55 175.01 1bi9 h TYR 315 N 1.37 0.14 0.00 4.28 3.20 -1.06 0.67 116.97 125.57 1bi9 h TYR 315 Ca 0.00 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.91 1bi9 h TYR 315 Cb 0.30 0.04 0.00 0.00 1.54 0.00 0.00 36.73 38.60 1bi9 h TYR 315 CO 0.00 -0.10 0.00 -1.91 -1.64 0.00 0.00 178.16 174.51 1bi9 n GLU 316 N -5.19 0.00 -0.35 1.82 4.07 -1.26 -0.99 120.64 118.74 1bi9 n GLU 316 Ca 0.11 0.64 0.07 0.00 -0.06 0.00 0.00 57.16 57.92 1bi9 n GLU 316 Cb 0.38 -1.41 0.24 0.00 -0.06 0.00 0.00 31.44 30.59 1bi9 n GLU 316 CO 0.00 0.00 0.00 0.93 -0.06 0.00 0.00 177.13 178.00 1bi9 h GLU 317 N 0.00 0.88 -0.17 5.31 4.39 -1.85 -2.37 114.58 120.78 1bi9 h GLU 317 Ca 0.00 -0.05 0.02 0.00 0.34 0.00 0.00 59.36 59.67 1bi9 h GLU 317 Cb 0.00 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 28.43 1bi9 h GLU 317 CO 0.00 0.59 0.04 0.35 -1.16 0.00 0.00 179.01 178.83 1bi9 h PHE 318 N 0.91 0.08 -0.86 4.33 3.04 -0.65 0.24 116.94 124.04 1bi9 h PHE 318 Ca 0.49 0.01 0.10 0.00 3.98 0.00 0.00 57.97 62.56 1bi9 h PHE 318 Cb 0.54 -0.01 -0.08 0.00 2.56 0.00 0.00 35.95 38.97 1bi9 h PHE 318 CO -0.02 0.04 0.50 0.28 -2.02 0.00 0.00 178.31 177.08 1bi9 h VAL 319 N 0.12 0.90 -0.14 1.41 2.07 -0.53 0.17 116.25 120.26 1bi9 h VAL 319 Ca 0.07 -0.28 -0.13 0.00 0.82 0.00 0.00 66.70 67.19 1bi9 h VAL 319 Cb 0.06 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 29.84 1bi9 h VAL 319 CO -0.09 0.15 -0.41 0.11 0.02 0.00 0.00 177.57 177.35 1bi9 h LYS 320 N 0.82 0.52 -1.00 1.57 1.57 -1.28 -1.89 116.57 116.88 1bi9 h LYS 320 Ca 0.42 -0.38 0.06 0.00 -1.87 0.00 0.00 60.65 58.88 1bi9 h LYS 320 Cb 0.40 0.06 -0.06 0.00 0.08 0.00 0.00 32.23 32.71 1bi9 h LYS 320 CO -0.26 1.00 0.65 0.00 -0.57 0.00 0.00 179.45 180.27 1bi9 h ARG 321 N 0.14 1.16 -0.02 3.15 2.47 0.12 -1.51 114.38 119.89 1bi9 h ARG 321 Ca -0.01 -0.07 -0.01 0.00 -1.26 0.00 0.00 59.98 58.63 1bi9 h ARG 321 Cb 1.03 -0.26 -0.00 0.00 -1.65 0.00 0.00 29.97 29.09 1bi9 h ARG 321 CO 0.09 0.77 -0.01 0.77 0.56 0.00 0.00 179.97 182.14 1bi9 h SER 322 N 1.19 0.04 -0.98 7.04 0.02 -0.66 -2.97 113.55 117.24 1bi9 h SER 322 Ca 0.42 -0.45 0.04 0.00 -0.84 0.00 0.00 61.79 60.96 1bi9 h SER 322 Cb 0.12 -0.01 -0.06 0.00 0.14 0.00 0.00 62.40 62.59 1bi9 h SER 322 CO -0.16 0.48 0.64 -0.37 -1.14 0.00 0.00 176.83 176.28 1bi9 h VAL 323 N -0.40 1.16 -0.41 2.27 -1.51 -1.08 -1.04 116.25 115.24 1bi9 h VAL 323 Ca 0.00 -0.42 -0.02 0.00 -1.23 0.00 0.00 66.70 65.03 1bi9 h VAL 323 Cb 0.47 -0.18 -0.02 0.00 -2.13 0.00 0.00 31.29 29.43 1bi9 h VAL 323 CO 0.00 0.22 0.16 -0.33 -1.23 0.00 0.00 177.57 176.40 1bi9 h GLU 324 N 1.23 0.58 0.15 5.19 5.08 -1.30 -0.45 114.58 125.06 1bi9 h GLU 324 Ca 0.40 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.67 1bi9 h GLU 324 Cb 0.03 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.17 1bi9 h GLU 324 CO -0.13 0.49 -0.07 0.00 -1.00 0.00 0.00 179.01 178.29 1bi9 h ARG 325 N 0.58 -0.20 -0.18 2.33 2.47 -1.05 -2.67 114.38 115.66 1bi9 h ARG 325 Ca 0.14 0.01 0.04 0.00 -1.26 0.00 0.00 59.98 58.91 1bi9 h ARG 325 Cb 0.13 0.05 -0.04 0.00 -1.65 0.00 0.00 29.97 28.46 1bi9 h ARG 325 CO -0.01 0.12 -0.05 0.00 0.56 0.00 0.00 179.97 180.58 1bi9 h ALA 326 N 0.25 0.11 -0.68 0.04 0.00 -1.12 -0.81 119.26 117.05 1bi9 h ALA 326 Ca -0.02 0.07 0.20 0.00 0.00 0.00 0.00 54.91 55.16 1bi9 h ALA 326 Cb 0.41 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 1bi9 h ALA 326 CO 0.03 -0.49 0.56 0.87 0.00 0.00 0.00 179.25 180.23 1bi9 h LYS 327 N -0.01 0.00 -0.53 0.00 1.57 -1.05 0.14 116.57 116.68 1bi9 h LYS 327 Ca 0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1bi9 h LYS 327 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.46 1bi9 h LYS 327 CO -0.20 0.00 0.00 0.54 -0.57 0.00 0.00 179.45 179.22 1bi9 n ARG 328 N -4.01 4.32 -3.10 3.15 1.74 -0.33 -4.96 116.66 113.46 1bi9 n ARG 328 Ca 0.13 -3.05 -0.40 0.00 -0.77 0.00 0.00 57.85 53.77 1bi9 n ARG 328 Cb 0.82 -2.11 -0.05 0.00 -1.02 0.00 0.00 32.46 30.09 1bi9 n ARG 328 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1bi9 s ARG 329 N -2.59 4.30 -0.56 5.56 3.52 0.48 -5.02 118.95 124.64 1bi9 s ARG 329 Ca 0.51 0.70 -0.23 0.00 -0.13 0.00 0.00 55.73 56.58 1bi9 s ARG 329 Cb 0.38 -3.52 0.05 0.00 -1.56 0.00 0.00 34.95 30.30 1bi9 s ARG 329 CO 0.16 -0.11 0.91 0.42 -0.81 0.00 0.00 175.30 175.87 1bi9 s ILE 330 N 1.46 4.43 -0.22 4.11 1.09 -1.26 -4.98 121.20 125.83 1bi9 s ILE 330 Ca 0.32 0.14 -0.10 0.00 -1.10 0.00 0.00 60.65 59.91 1bi9 s ILE 330 Cb -0.16 -4.53 -0.05 0.00 -1.06 0.00 0.00 42.46 36.66 1bi9 s ILE 330 CO 0.13 -1.11 0.13 -0.69 -0.10 0.00 0.00 174.94 173.30 1bi9 s VAL 331 N 3.82 5.22 -0.75 2.92 1.01 -1.26 -0.04 120.40 131.32 1bi9 s VAL 331 Ca 0.28 0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.39 1bi9 s VAL 331 Cb -0.14 -3.41 0.00 0.00 0.00 0.00 0.00 36.38 32.83 1bi9 s VAL 331 CO 0.18 0.38 0.00 0.61 0.00 0.00 0.00 175.10 176.27 1bi9 n GLY 332 N 4.06 -1.33 3.72 4.51 0.00 -1.10 -4.99 105.19 110.06 1bi9 n GLY 332 Ca -0.16 -0.99 -0.65 0.00 0.00 0.00 0.00 46.02 44.22 1bi9 n GLY 332 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1bi9 n SER 333 N 0.45 1.38 0.18 1.61 2.88 -1.26 -4.66 113.62 114.19 1bi9 n SER 333 Ca 0.00 1.16 0.11 0.00 -1.33 0.00 0.00 58.87 58.81 1bi9 n SER 333 Cb 0.00 -0.94 0.58 0.00 -0.75 0.00 0.00 64.21 63.10 1bi9 n SER 333 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1bi9 h PRO 334 N 5.31 0.00 0.00 -1.46 0.13 -1.90 -0.82 132.00 133.26 1bi9 h PRO 334 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1bi9 h PRO 334 Cb 1.36 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.49 1bi9 h PRO 334 CO 0.95 0.00 -0.26 1.19 -0.23 0.00 0.00 178.00 179.65 1bi9 n PHE 335 N -2.27 0.05 -3.01 1.56 3.72 -1.26 -0.87 117.46 115.38 1bi9 n PHE 335 Ca -0.01 0.01 -0.42 0.00 -0.05 0.00 0.00 57.45 56.98 1bi9 n PHE 335 Cb 0.10 -0.40 -0.06 0.00 -0.94 0.00 0.00 39.48 38.18 1bi9 n PHE 335 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1bi9 s ASP 336 N -3.09 6.58 0.35 4.37 -1.08 -0.31 -4.95 116.67 118.53 1bi9 s ASP 336 Ca 0.12 0.51 0.20 0.00 -0.52 0.00 0.00 52.55 52.87 1bi9 s ASP 336 Cb 0.18 -2.38 1.09 0.00 -1.46 0.00 0.00 42.92 40.35 1bi9 s ASP 336 CO 0.62 -0.59 1.58 1.55 0.52 0.00 0.00 175.17 178.85 1bi9 h PRO 337 N 8.21 0.00 0.00 4.34 0.13 -1.86 -1.68 132.00 141.14 1bi9 h PRO 337 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 1bi9 h PRO 337 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1bi9 h PRO 337 CO 0.86 0.00 -0.33 1.79 -0.23 0.00 0.00 178.00 180.09 1bi9 h THR 338 N 0.00 0.00 -3.32 1.56 1.35 -1.92 -3.46 112.91 107.12 1bi9 h THR 338 Ca 0.00 -0.99 -0.52 0.00 -0.55 0.00 0.00 66.41 64.34 1bi9 h THR 338 Cb 0.21 1.83 0.03 0.00 -1.73 0.00 0.00 68.15 68.49 1bi9 h THR 338 CO 0.00 0.00 0.64 0.42 -0.25 0.00 0.00 175.52 176.33 1bi9 s THR 339 N -3.26 3.34 -0.21 6.82 -4.23 -0.64 -4.79 115.64 112.67 1bi9 s THR 339 Ca 0.05 1.07 0.01 0.00 -1.18 0.00 0.00 61.69 61.63 1bi9 s THR 339 Cb 0.07 -3.68 -0.14 0.00 1.34 0.00 0.00 72.50 70.09 1bi9 s THR 339 CO 0.71 0.14 -0.20 -0.62 -0.54 0.00 0.00 174.62 174.11 1bi9 n GLU 340 N 2.95 0.53 -4.42 3.99 1.02 0.94 -4.86 120.64 120.79 1bi9 n GLU 340 Ca 0.07 0.13 -0.34 0.00 -0.02 0.00 0.00 57.16 57.00 1bi9 n GLU 340 Cb 0.43 -1.42 -0.12 0.00 -0.02 0.00 0.00 31.44 30.32 1bi9 n GLU 340 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 1bi9 s GLN 341 N -2.42 3.46 0.23 3.49 0.74 -0.96 -4.75 119.66 119.45 1bi9 s GLN 341 Ca -0.29 -0.50 0.04 0.00 0.05 0.00 0.00 55.36 54.66 1bi9 s GLN 341 Cb 0.08 -2.86 0.04 0.00 1.10 0.00 0.00 33.01 31.37 1bi9 s GLN 341 CO 0.48 0.37 0.31 0.41 -0.55 0.00 0.00 175.29 176.31 1bi9 n GLY 342 N 3.15 2.00 3.86 2.59 0.00 -1.26 -2.70 105.19 112.84 1bi9 n GLY 342 Ca -0.18 -2.17 -0.31 0.00 0.00 0.00 0.00 46.02 43.36 1bi9 n GLY 342 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1bi9 s PRO 343 N -3.05 3.28 0.84 1.61 0.04 -1.23 -4.81 135.00 131.68 1bi9 s PRO 343 Ca 0.24 0.72 -0.11 0.00 0.04 0.00 0.00 61.00 61.88 1bi9 s PRO 343 Cb -0.02 -2.05 0.10 0.00 0.04 0.00 0.00 34.50 32.57 1bi9 s PRO 343 CO 0.15 -0.80 1.09 -0.65 0.04 0.00 0.00 177.00 176.84 1bi9 s GLN 344 N -5.19 1.72 0.15 4.56 -1.52 0.11 -4.84 119.66 114.65 1bi9 s GLN 344 Ca 0.56 0.73 -0.05 0.00 -1.95 0.00 0.00 55.36 54.65 1bi9 s GLN 344 Cb -0.12 -1.87 -0.01 0.00 -0.22 0.00 0.00 33.01 30.80 1bi9 s GLN 344 CO 0.54 -1.90 1.40 0.97 -0.25 0.00 0.00 175.29 176.05 1bi9 h ILE 345 N -1.30 1.34 -3.43 1.08 6.09 -1.87 -3.41 117.51 116.01 1bi9 h ILE 345 Ca -0.48 -2.04 -0.37 0.00 -1.37 0.00 0.00 64.86 60.60 1bi9 h ILE 345 Cb 1.27 2.02 -0.14 0.00 0.47 0.00 0.00 36.82 40.44 1bi9 h ILE 345 CO 0.57 0.63 -0.64 -1.81 -3.07 0.00 0.00 178.15 173.83 1bi9 s ASP 346 N -7.01 1.65 0.07 2.19 1.01 -1.26 -4.71 116.67 108.60 1bi9 s ASP 346 Ca -0.07 -1.28 -0.17 0.00 0.71 0.00 0.00 52.55 51.74 1bi9 s ASP 346 Cb 0.10 0.05 -0.13 0.00 1.01 0.00 0.00 42.92 43.95 1bi9 s ASP 346 CO 0.86 -0.60 1.33 0.50 0.21 0.00 0.00 175.17 177.48 1bi9 h LYS 347 N 2.42 0.60 0.15 8.23 1.63 -1.97 0.15 116.57 127.78 1bi9 h LYS 347 Ca -0.38 -0.38 -0.01 0.00 -0.85 0.00 0.00 60.65 59.02 1bi9 h LYS 347 Cb 1.23 0.05 0.00 0.00 -0.60 0.00 0.00 32.23 32.91 1bi9 h LYS 347 CO 0.64 1.00 -0.07 -0.22 -3.45 0.00 0.00 179.45 177.34 1bi9 h LYS 348 N 0.27 -0.20 -0.50 1.90 3.64 -2.00 -0.83 116.57 118.85 1bi9 h LYS 348 Ca 0.01 0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.33 1bi9 h LYS 348 Cb 0.98 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.82 1bi9 h LYS 348 CO 0.08 -0.13 0.00 0.37 -2.27 0.00 0.00 179.45 177.51 1bi9 h GLN 349 N -0.21 0.83 0.08 1.90 5.75 -1.94 -2.70 115.11 118.81 1bi9 h GLN 349 Ca -0.02 -0.23 0.01 0.00 -0.15 0.00 0.00 58.65 58.27 1bi9 h GLN 349 Cb 0.16 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.60 1bi9 h GLN 349 CO 0.03 0.83 -0.16 -0.92 -2.65 0.00 0.00 178.83 175.97 1bi9 h TYR 350 N 0.77 -0.42 -0.67 3.99 3.20 -0.61 -2.26 116.97 120.98 1bi9 h TYR 350 Ca 0.15 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.99 1bi9 h TYR 350 Cb 0.46 0.18 -0.03 0.00 1.54 0.00 0.00 36.73 38.88 1bi9 h TYR 350 CO 0.03 -0.24 0.28 -0.91 -1.64 0.00 0.00 178.16 175.67 1bi9 h ASN 351 N -0.31 0.91 -0.36 -2.11 2.35 -1.14 -2.22 115.58 112.71 1bi9 h ASN 351 Ca 0.03 -0.16 0.06 0.00 -0.55 0.00 0.00 56.30 55.68 1bi9 h ASN 351 Cb 0.33 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.45 1bi9 h ASN 351 CO -0.10 0.83 0.25 0.50 -1.65 0.00 0.00 177.43 177.25 1bi9 h LYS 352 N 0.94 0.20 0.02 0.81 3.64 -1.28 0.21 116.57 121.11 1bi9 h LYS 352 Ca 0.22 -0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 59.48 1bi9 h LYS 352 Cb 0.19 -0.04 0.01 0.00 -0.41 0.00 0.00 32.23 31.98 1bi9 h LYS 352 CO -0.02 0.13 -0.43 0.82 -2.27 0.00 0.00 179.45 177.68 1bi9 h ILE 353 N 0.20 1.53 -0.28 2.00 2.04 -0.88 -2.92 117.51 119.21 1bi9 h ILE 353 Ca 0.16 -2.13 -0.03 0.00 1.00 0.00 0.00 64.86 63.86 1bi9 h ILE 353 Cb 0.38 2.86 -0.01 0.00 -0.74 0.00 0.00 36.82 39.31 1bi9 h ILE 353 CO -0.03 0.59 0.04 -0.07 0.00 0.00 0.00 178.15 178.68 1bi9 h LEU 354 N -0.41 0.45 -1.26 1.44 3.38 -0.84 -0.11 115.31 117.96 1bi9 h LEU 354 Ca -0.06 -0.27 0.08 0.00 0.09 0.00 0.00 57.88 57.71 1bi9 h LEU 354 Cb 1.21 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 41.79 1bi9 h LEU 354 CO 0.08 0.60 0.54 -0.33 0.09 0.00 0.00 178.44 179.43 1bi9 h GLU 355 N 0.27 0.85 -0.16 1.13 3.07 -0.73 -0.54 114.58 118.47 1bi9 h GLU 355 Ca 0.08 -0.05 -0.17 0.00 -0.50 0.00 0.00 59.36 58.72 1bi9 h GLU 355 Cb 0.35 -0.19 -0.00 0.00 -0.84 0.00 0.00 28.75 28.07 1bi9 h GLU 355 CO 0.01 0.56 -0.61 1.25 -1.40 0.00 0.00 179.01 178.81 1bi9 h LEU 356 N 0.87 0.62 0.17 1.33 5.85 -1.26 -2.31 115.31 120.58 1bi9 h LEU 356 Ca 0.37 -0.36 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 1bi9 h LEU 356 Cb 0.29 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.14 1bi9 h LEU 356 CO -0.14 1.09 -0.08 0.40 -0.34 0.00 0.00 178.44 179.37 1bi9 h ILE 357 N 0.41 0.91 -0.39 4.05 2.04 0.24 -2.72 117.51 122.05 1bi9 h ILE 357 Ca -0.01 -0.32 0.08 0.00 1.00 0.00 0.00 64.86 65.62 1bi9 h ILE 357 Cb 1.17 1.11 -0.09 0.00 -0.74 0.00 0.00 36.82 38.27 1bi9 h ILE 357 CO 0.11 0.08 -0.24 1.56 0.00 0.00 0.00 178.15 179.66 1bi9 h GLN 358 N -0.37 -0.17 -0.89 2.37 4.20 -1.15 -1.05 115.11 118.04 1bi9 h GLN 358 Ca -0.02 0.01 0.14 0.00 0.06 0.00 0.00 58.65 58.84 1bi9 h GLN 358 Cb 0.29 0.04 -0.15 0.00 0.30 0.00 0.00 27.48 27.96 1bi9 h GLN 358 CO 0.04 -0.11 -0.37 1.03 -0.67 0.00 0.00 178.83 178.74 1bi9 h SER 359 N -0.17 -1.36 -1.00 1.46 0.87 -1.22 0.53 113.55 112.66 1bi9 h SER 359 Ca 0.19 0.29 0.09 0.00 -1.23 0.00 0.00 61.79 61.12 1bi9 h SER 359 Cb 0.47 0.71 -0.07 0.00 -0.44 0.00 0.00 62.40 63.06 1bi9 h SER 359 CO -0.49 -0.29 0.64 1.23 -0.53 0.00 0.00 176.83 177.38 1bi9 h GLY 360 N -0.04 1.55 0.85 5.77 0.00 -0.89 -1.85 103.07 108.45 1bi9 h GLY 360 Ca 0.32 -0.45 -0.02 0.00 0.00 0.00 0.00 47.33 47.18 1bi9 h GLY 360 CO -0.91 0.27 0.04 -2.08 0.00 0.00 0.00 176.54 173.86 1bi9 h VAL 361 N 1.09 1.21 -0.14 4.60 2.07 0.31 -1.75 116.25 123.64 1bi9 h VAL 361 Ca 0.45 -0.68 -0.08 0.00 0.82 0.00 0.00 66.70 67.21 1bi9 h VAL 361 Cb 0.30 1.28 -0.04 0.00 -1.52 0.00 0.00 31.29 31.30 1bi9 h VAL 361 CO -0.21 0.21 0.10 0.00 0.02 0.00 0.00 177.57 177.70 1bi9 n ALA 362 N -2.28 3.19 -1.42 1.67 0.00 0.35 -3.22 120.51 118.81 1bi9 n ALA 362 Ca -0.04 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 52.97 1bi9 n ALA 362 Cb 0.18 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.55 1bi9 n ALA 362 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1bi9 n GLU 363 N 0.42 0.00 0.00 0.00 2.13 -0.99 -4.98 120.64 117.22 1bi9 n GLU 363 Ca 0.09 -0.15 0.00 0.00 0.66 0.00 0.00 57.16 57.75 1bi9 n GLU 363 Cb 0.64 -0.29 0.00 0.00 0.27 0.00 0.00 31.44 32.06 1bi9 n GLU 363 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1bi9 n GLY 364 N 0.00 1.40 3.63 8.31 0.00 -1.15 -5.04 105.19 112.33 1bi9 n GLY 364 Ca 0.00 -0.07 -0.43 0.00 0.00 0.00 0.00 46.02 45.52 1bi9 n GLY 364 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bi9 n ALA 365 N 0.00 0.39 -2.91 4.61 0.00 -0.68 -4.89 120.51 117.03 1bi9 n ALA 365 Ca 0.00 0.33 -0.44 0.00 0.00 0.00 0.00 53.44 53.33 1bi9 n ALA 365 Cb 0.00 -2.11 -0.05 0.00 0.00 0.00 0.00 19.45 17.29 1bi9 n ALA 365 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1bi9 s LYS 366 N -1.82 3.11 -0.53 0.00 2.20 -0.70 -4.47 119.74 117.54 1bi9 s LYS 366 Ca 0.59 -0.98 -0.26 0.00 -0.36 0.00 0.00 55.97 54.96 1bi9 s LYS 366 Cb -0.61 -4.19 -0.05 0.00 -1.51 0.00 0.00 37.83 31.47 1bi9 s LYS 366 CO 0.60 -1.52 2.18 -1.17 -0.36 0.00 0.00 175.35 175.08 1bi9 s LEU 367 N 3.13 3.37 0.43 5.43 2.96 -1.26 -1.88 118.68 130.85 1bi9 s LEU 367 Ca 0.17 0.82 0.24 0.00 -0.22 0.00 0.00 54.13 55.14 1bi9 s LEU 367 Cb -0.20 -2.57 0.60 0.00 0.50 0.00 0.00 46.19 44.53 1bi9 s LEU 367 CO 0.10 -2.64 1.69 -0.33 -1.32 0.00 0.00 176.35 173.86 1bi9 h GLU 368 N 17.52 0.00 -1.07 1.98 4.39 -1.80 -3.48 114.58 132.12 1bi9 h GLU 368 Ca -0.26 0.00 0.26 0.00 0.34 0.00 0.00 59.36 59.71 1bi9 h GLU 368 Cb 1.22 0.00 -0.26 0.00 -0.10 0.00 0.00 28.75 29.62 1bi9 h GLU 368 CO 1.17 0.15 0.96 0.00 -1.16 0.00 0.00 179.01 180.13 1bi9 n GLY 370 N 0.37 -1.34 0.00 0.00 0.00 -1.24 -2.46 105.19 100.52 1bi9 n GLY 370 Ca 0.01 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 44.92 1bi9 n GLY 370 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bi9 n GLY 371 N -0.72 -0.99 3.44 -0.02 0.00 -1.26 -4.87 105.19 100.77 1bi9 n GLY 371 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.93 1bi9 n GLY 371 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1bi9 s LYS 372 N 0.00 1.35 1.27 1.61 -2.85 -1.26 -4.76 119.74 115.10 1bi9 s LYS 372 Ca 0.00 -1.24 -0.18 0.00 -1.00 0.00 0.00 55.97 53.54 1bi9 s LYS 372 Cb 0.00 0.41 0.31 0.00 -2.06 0.00 0.00 37.83 36.50 1bi9 s LYS 372 CO 0.00 -0.52 1.01 0.20 0.10 0.00 0.00 175.35 176.13 1bi9 s GLY 373 N -3.01 1.49 0.00 0.59 0.00 -1.26 -2.14 107.32 102.99 1bi9 s GLY 373 Ca 0.22 -0.61 0.00 0.00 0.00 0.00 0.00 44.72 44.33 1bi9 s GLY 373 CO 0.05 0.26 0.00 1.04 0.00 0.00 0.00 173.10 174.46 1bi9 n LEU 374 N -5.14 0.00 0.00 0.66 4.77 -0.82 -4.61 117.00 111.86 1bi9 n LEU 374 Ca 0.09 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 56.06 1bi9 n LEU 374 Cb 0.58 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.67 1bi9 n LEU 374 CO 0.49 0.00 -0.00 0.61 -1.33 0.00 0.00 177.39 177.16 1bi9 n GLY 375 N 3.26 3.67 3.85 -0.72 0.00 -1.26 -5.10 105.19 108.90 1bi9 n GLY 375 Ca 0.00 -2.20 -0.32 0.00 0.00 0.00 0.00 46.02 43.51 1bi9 n GLY 375 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1bi9 s ARG 376 N -2.08 3.89 0.02 1.61 3.52 -1.26 -4.81 118.95 119.84 1bi9 s ARG 376 Ca 0.01 0.84 0.00 0.00 -0.13 0.00 0.00 55.73 56.44 1bi9 s ARG 376 Cb -0.00 -2.19 0.00 0.00 -1.56 0.00 0.00 34.95 31.20 1bi9 s ARG 376 CO 0.00 -0.24 0.00 1.63 -0.81 0.00 0.00 175.30 175.88 1bi9 n LYS 377 N -1.59 -0.51 0.00 5.12 5.02 -1.26 -5.04 118.16 119.90 1bi9 n LYS 377 Ca 0.06 0.77 0.00 0.00 -2.02 0.00 0.00 58.31 57.11 1bi9 n LYS 377 Cb 0.54 -0.39 0.00 0.00 -0.02 0.00 0.00 35.03 35.16 1bi9 n LYS 377 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1bi9 n GLY 378 N 0.11 -2.62 2.56 0.72 0.00 -0.95 -4.73 105.19 100.27 1bi9 n GLY 378 Ca 0.00 -1.73 -0.20 0.00 0.00 0.00 0.00 46.02 44.09 1bi9 n GLY 378 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1bi9 n PHE 379 N -0.35 2.10 -3.02 1.61 3.72 -1.01 -4.91 117.46 115.60 1bi9 n PHE 379 Ca 0.00 -3.43 -0.32 0.00 -0.05 0.00 0.00 57.45 53.65 1bi9 n PHE 379 Cb 0.00 -0.35 -0.06 0.00 -0.94 0.00 0.00 39.48 38.13 1bi9 n PHE 379 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 1bi9 s PHE 380 N -3.11 3.38 -0.02 1.38 0.40 -1.26 0.07 117.98 118.82 1bi9 s PHE 380 Ca 0.41 1.26 -0.01 0.00 -0.60 0.00 0.00 56.93 57.99 1bi9 s PHE 380 Cb 0.37 -2.58 0.01 0.00 0.51 0.00 0.00 43.02 41.34 1bi9 s PHE 380 CO -0.09 0.01 0.04 0.42 0.70 0.00 0.00 175.22 176.30 1bi9 s ILE 381 N -2.10 -0.02 0.33 0.64 1.01 -1.26 -1.94 121.20 117.85 1bi9 s ILE 381 Ca 0.55 0.09 -0.27 0.00 0.00 0.00 0.00 60.65 61.02 1bi9 s ILE 381 Cb -0.10 -0.07 -0.09 0.00 0.01 0.00 0.00 42.46 42.21 1bi9 s ILE 381 CO 0.19 0.04 1.06 -1.83 0.00 0.00 0.00 174.94 174.40 1bi9 s GLU 382 N 0.46 4.46 -0.41 2.79 -1.05 -0.91 -4.88 118.70 119.15 1bi9 s GLU 382 Ca -0.04 1.63 -0.41 0.00 -0.15 0.00 0.00 54.97 56.01 1bi9 s GLU 382 Cb -0.05 -2.91 -0.16 0.00 -0.44 0.00 0.00 34.13 30.57 1bi9 s GLU 382 CO -0.01 0.09 2.06 -2.30 0.95 0.00 0.00 175.26 176.05 1bi9 n PRO 383 N 0.66 0.55 -3.91 -4.83 -0.02 -1.26 -4.18 135.00 121.99 1bi9 n PRO 383 Ca 0.02 0.16 -0.35 0.00 -2.02 0.00 0.00 63.50 61.31 1bi9 n PRO 383 Cb 0.47 -1.93 -0.14 0.00 -0.02 0.00 0.00 33.50 31.89 1bi9 n PRO 383 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1bi9 s THR 384 N 5.87 3.11 0.07 3.45 2.01 -0.75 -3.74 115.64 125.66 1bi9 s THR 384 Ca 1.12 -1.02 0.02 0.00 0.31 0.00 0.00 61.69 62.12 1bi9 s THR 384 Cb -1.21 -2.62 -0.04 0.00 0.01 0.00 0.00 72.50 68.64 1bi9 s THR 384 CO 0.61 0.12 0.11 -0.69 -0.69 0.00 0.00 174.62 174.08 1bi9 s VAL 385 N 1.35 4.76 -0.01 3.82 1.01 -1.03 -1.62 120.40 128.67 1bi9 s VAL 385 Ca -0.00 -0.66 0.04 0.00 0.00 0.00 0.00 61.98 61.36 1bi9 s VAL 385 Cb -0.17 -3.30 -0.01 0.00 0.00 0.00 0.00 36.38 32.90 1bi9 s VAL 385 CO -0.02 0.14 -0.13 -0.36 0.00 0.00 0.00 175.10 174.72 1bi9 s PHE 386 N -1.41 1.16 0.39 5.22 0.08 0.51 -2.17 117.98 121.76 1bi9 s PHE 386 Ca 0.30 -0.22 0.08 0.00 0.12 0.00 0.00 56.93 57.21 1bi9 s PHE 386 Cb -0.12 -0.75 -0.08 0.00 -0.57 0.00 0.00 43.02 41.50 1bi9 s PHE 386 CO 0.23 -0.02 -0.02 0.45 -0.10 0.00 0.00 175.22 175.76 1bi9 s SER 387 N -0.31 3.79 -1.12 1.36 0.15 -0.79 -1.02 113.70 115.76 1bi9 s SER 387 Ca 0.05 -1.32 -0.25 0.00 0.70 0.00 0.00 55.95 55.13 1bi9 s SER 387 Cb -0.05 -0.38 0.02 0.00 -1.71 0.00 0.00 66.02 63.91 1bi9 s SER 387 CO -0.00 -0.39 0.70 0.59 1.20 0.00 0.00 173.24 175.34 1bi9 n ASN 388 N -0.91 -4.69 -4.64 5.45 4.13 -1.25 -1.72 115.26 111.64 1bi9 n ASN 388 Ca -0.05 -1.14 -0.33 0.00 1.68 0.00 0.00 54.58 54.74 1bi9 n ASN 388 Cb 0.66 -2.23 -0.10 0.00 -1.54 0.00 0.00 39.78 36.58 1bi9 n ASN 388 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1bi9 s VAL 389 N -3.41 3.95 0.13 2.41 1.01 -1.24 -4.30 120.40 118.95 1bi9 s VAL 389 Ca 0.40 -0.58 0.07 0.00 0.00 0.00 0.00 61.98 61.86 1bi9 s VAL 389 Cb -0.20 -2.71 -0.04 0.00 0.00 0.00 0.00 36.38 33.43 1bi9 s VAL 389 CO 0.93 0.45 -0.16 0.42 0.00 0.00 0.00 175.10 176.74 1bi9 s THR 390 N -0.99 1.47 0.20 3.92 -4.23 -1.26 -4.41 115.64 110.34 1bi9 s THR 390 Ca 0.17 -1.72 -0.14 0.00 -1.18 0.00 0.00 61.69 58.82 1bi9 s THR 390 Cb -0.11 -1.57 0.21 0.00 1.34 0.00 0.00 72.50 72.37 1bi9 s THR 390 CO 0.07 -0.34 1.63 0.44 -0.54 0.00 0.00 174.62 175.88 1bi9 h ASP 391 N 3.57 -0.53 0.00 3.99 3.32 -2.00 -1.92 116.42 122.84 1bi9 h ASP 391 Ca -0.41 0.18 0.00 0.00 0.02 0.00 0.00 57.03 56.82 1bi9 h ASP 391 Cb 1.20 0.36 0.00 0.00 0.22 0.00 0.00 39.33 41.11 1bi9 h ASP 391 CO 0.49 -0.19 0.29 -2.24 -1.72 0.00 0.00 179.24 175.87 1bi9 h ASP 392 N 0.01 0.00 -3.39 6.45 2.03 -1.98 -3.34 116.42 116.20 1bi9 h ASP 392 Ca 0.29 0.00 -0.53 0.00 -0.73 0.00 0.00 57.03 56.06 1bi9 h ASP 392 Cb 0.45 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.95 1bi9 h ASP 392 CO -0.61 0.00 0.50 -0.04 -1.03 0.00 0.00 179.24 178.06 1bi9 s MET 393 N -3.38 4.52 0.23 4.15 -1.94 -0.72 -4.91 119.30 117.24 1bi9 s MET 393 Ca -0.02 1.71 -0.14 0.00 -1.71 0.00 0.00 55.69 55.53 1bi9 s MET 393 Cb 0.04 -3.32 0.28 0.00 2.01 0.00 0.00 34.83 33.84 1bi9 s MET 393 CO 0.13 -0.08 1.59 -0.09 -0.01 0.00 0.00 175.02 176.56 1bi9 h ARG 394 N 5.98 -0.04 -0.72 2.03 2.43 -1.89 0.51 114.38 122.68 1bi9 h ARG 394 Ca -0.43 0.00 0.14 0.00 -0.81 0.00 0.00 59.98 58.89 1bi9 h ARG 394 Cb 1.21 0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 30.73 1bi9 h ARG 394 CO 0.76 -0.02 0.49 -0.84 -1.51 0.00 0.00 179.97 178.84 1bi9 h ILE 395 N -0.04 0.80 -0.10 1.20 3.07 -1.87 0.35 117.51 120.92 1bi9 h ILE 395 Ca 0.35 -0.13 -0.14 0.00 1.55 0.00 0.00 64.86 66.49 1bi9 h ILE 395 Cb 0.58 0.38 0.01 0.00 -0.27 0.00 0.00 36.82 37.52 1bi9 h ILE 395 CO -0.82 0.07 -0.47 0.00 -1.05 0.00 0.00 178.15 175.88 1bi9 h ALA 396 N 1.66 0.19 -0.18 0.16 0.00 -0.29 -3.33 119.26 117.47 1bi9 h ALA 396 Ca 0.35 -0.49 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 1bi9 h ALA 396 Cb 0.83 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 1bi9 h ALA 396 CO -0.11 0.35 -0.09 0.87 0.00 0.00 0.00 179.25 180.27 1bi9 h LYS 397 N 0.07 0.38 -6.55 0.00 1.57 0.27 -3.44 116.57 108.87 1bi9 h LYS 397 Ca -0.03 -0.17 -0.52 0.00 -1.87 0.00 0.00 60.65 58.06 1bi9 h LYS 397 Cb 1.12 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 33.39 1bi9 h LYS 397 CO 0.10 0.69 0.05 -1.21 -0.57 0.00 0.00 179.45 178.51 1bi9 s GLU 398 N -4.55 4.11 0.37 3.15 2.02 0.11 -5.05 118.70 118.86 1bi9 s GLU 398 Ca -0.14 0.71 -0.25 0.00 0.02 0.00 0.00 54.97 55.31 1bi9 s GLU 398 Cb 0.06 -2.77 -0.09 0.00 0.10 0.00 0.00 34.13 31.42 1bi9 s GLU 398 CO 0.75 0.35 1.01 -2.00 0.02 0.00 0.00 175.26 175.40 1bi9 s GLU 399 N -2.25 4.34 -0.86 1.61 2.12 -1.26 -4.72 118.70 117.68 1bi9 s GLU 399 Ca 0.45 1.45 -0.04 0.00 0.36 0.00 0.00 54.97 57.19 1bi9 s GLU 399 Cb -0.15 -2.65 0.21 0.00 0.26 0.00 0.00 34.13 31.81 1bi9 s GLU 399 CO 0.20 0.02 0.74 0.42 -0.54 0.00 0.00 175.26 176.11 1bi9 s ILE 400 N -1.63 4.51 0.00 -3.70 1.09 -1.26 -4.93 121.20 115.27 1bi9 s ILE 400 Ca 0.55 -3.52 0.00 0.00 -1.10 0.00 0.00 60.65 56.58 1bi9 s ILE 400 Cb -0.21 -3.81 0.00 0.00 -1.06 0.00 0.00 42.46 37.38 1bi9 s ILE 400 CO 0.27 -1.05 0.62 2.22 -0.10 0.00 0.00 174.94 176.90 1bi9 n PHE 401 N 2.74 0.00 -4.01 3.97 1.16 -1.26 -4.69 117.46 115.38 1bi9 n PHE 401 Ca 0.18 -0.31 -0.12 0.00 -1.87 0.00 0.00 57.45 55.33 1bi9 n PHE 401 Cb 0.38 -0.32 -0.03 0.00 -1.61 0.00 0.00 39.48 37.90 1bi9 n PHE 401 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1bi9 n GLY 402 N 1.78 2.49 3.32 4.97 0.00 -1.24 -3.04 105.19 113.46 1bi9 n GLY 402 Ca 0.00 -1.62 -0.37 0.00 0.00 0.00 0.00 46.02 44.03 1bi9 n GLY 402 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1bi9 n PRO 403 N -0.47 1.61 -3.68 1.61 -0.04 -1.07 -4.43 135.00 128.54 1bi9 n PRO 403 Ca 0.02 -2.17 -0.11 0.00 -0.04 0.00 0.00 63.50 61.20 1bi9 n PRO 403 Cb 0.47 -3.29 -0.12 0.00 -0.04 0.00 0.00 33.50 30.52 1bi9 n PRO 403 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1bi9 s VAL 404 N 7.56 -0.34 -0.05 0.52 1.01 -1.26 -1.81 120.40 126.03 1bi9 s VAL 404 Ca 0.62 0.19 0.05 0.00 0.00 0.00 0.00 61.98 62.84 1bi9 s VAL 404 Cb 0.08 -0.53 -0.02 0.00 0.00 0.00 0.00 36.38 35.91 1bi9 s VAL 404 CO 0.12 0.08 -0.19 0.00 0.00 0.00 0.00 175.10 175.11 1bi9 s GLN 405 N 2.08 2.50 -0.11 2.72 -2.07 -0.64 -4.64 119.66 119.49 1bi9 s GLN 405 Ca -0.04 -0.80 0.00 0.00 -1.82 0.00 0.00 55.36 52.71 1bi9 s GLN 405 Cb -0.11 -2.27 -0.02 0.00 -1.09 0.00 0.00 33.01 29.52 1bi9 s GLN 405 CO -0.11 0.52 -0.13 -1.21 -1.32 0.00 0.00 175.29 173.04 1bi9 s GLU 406 N -0.47 3.22 -0.29 9.60 2.02 -0.14 -0.36 118.70 132.28 1bi9 s GLU 406 Ca 0.06 -0.68 -0.04 0.00 0.02 0.00 0.00 54.97 54.32 1bi9 s GLU 406 Cb -0.12 -2.59 0.02 0.00 0.10 0.00 0.00 34.13 31.55 1bi9 s GLU 406 CO 0.01 0.30 0.03 0.42 0.02 0.00 0.00 175.26 176.04 1bi9 s ILE 407 N 0.13 3.46 -0.03 -1.63 1.01 -0.19 -1.63 121.20 122.33 1bi9 s ILE 407 Ca -0.06 -0.95 -0.02 0.00 0.00 0.00 0.00 60.65 59.62 1bi9 s ILE 407 Cb -0.15 -2.83 -0.04 0.00 0.01 0.00 0.00 42.46 39.46 1bi9 s ILE 407 CO 0.05 0.06 0.09 -0.76 0.00 0.00 0.00 174.94 174.38 1bi9 s LEU 408 N 1.40 3.98 0.23 2.97 1.02 0.46 -3.58 118.68 125.15 1bi9 s LEU 408 Ca 0.00 0.21 -0.06 0.00 0.02 0.00 0.00 54.13 54.30 1bi9 s LEU 408 Cb -0.18 -2.24 -0.06 0.00 0.02 0.00 0.00 46.19 43.74 1bi9 s LEU 408 CO -0.00 0.30 0.50 -0.60 0.02 0.00 0.00 176.35 176.57 1bi9 s ARG 409 N -1.58 3.67 0.17 1.70 3.52 -1.26 -0.22 118.95 124.94 1bi9 s ARG 409 Ca 0.21 0.03 -0.21 0.00 -0.13 0.00 0.00 55.73 55.64 1bi9 s ARG 409 Cb -0.12 -2.70 0.05 0.00 -1.56 0.00 0.00 34.95 30.62 1bi9 s ARG 409 CO 0.12 0.31 0.55 -0.59 -0.81 0.00 0.00 175.30 174.88 1bi9 s PHE 410 N -1.90 -0.38 0.02 5.12 -0.71 -0.70 -4.85 117.98 114.59 1bi9 s PHE 410 Ca 0.44 0.11 0.00 0.00 -1.04 0.00 0.00 56.93 56.44 1bi9 s PHE 410 Cb -0.11 0.48 0.00 0.00 -1.21 0.00 0.00 43.02 42.18 1bi9 s PHE 410 CO 0.26 -0.86 0.00 1.17 -1.34 0.00 0.00 175.22 174.46 1bi9 n LYS 411 N -0.35 0.00 -2.65 1.99 4.81 -1.26 -1.68 118.16 119.02 1bi9 n LYS 411 Ca -0.15 0.00 -0.31 0.00 -0.87 0.00 0.00 58.31 56.98 1bi9 n LYS 411 Cb 0.64 -0.08 -0.04 0.00 0.02 0.00 0.00 35.03 35.58 1bi9 n LYS 411 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 1bi9 s THR 412 N -1.16 4.63 -0.01 3.15 -4.23 -1.26 -4.92 115.64 111.84 1bi9 s THR 412 Ca 0.00 0.98 -0.24 0.00 -1.18 0.00 0.00 61.69 61.24 1bi9 s THR 412 Cb 0.00 -3.71 -0.18 0.00 1.34 0.00 0.00 72.50 69.95 1bi9 s THR 412 CO 0.00 -0.57 1.19 -0.03 -0.54 0.00 0.00 174.62 174.67 1bi9 h MET 413 N 1.19 -0.20 0.00 3.99 4.05 -2.00 -2.55 114.93 119.42 1bi9 h MET 413 Ca -0.47 0.01 0.00 0.00 -0.28 0.00 0.00 59.70 58.96 1bi9 h MET 413 Cb 1.18 0.04 0.00 0.00 -0.80 0.00 0.00 31.60 32.03 1bi9 h MET 413 CO 0.63 0.20 0.41 -0.44 0.23 0.00 0.00 176.91 177.93 1bi9 h ASP 414 N -0.65 0.00 0.00 1.39 3.32 -1.99 -0.44 116.42 118.05 1bi9 h ASP 414 Ca -0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.03 1bi9 h ASP 414 Cb 0.48 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.03 1bi9 h ASP 414 CO 0.03 0.00 0.00 1.21 -1.72 0.00 0.00 179.24 178.76 1bi9 n GLU 415 N -2.74 0.00 -0.32 3.56 2.13 -0.99 -3.01 120.64 119.28 1bi9 n GLU 415 Ca -0.02 0.19 0.19 0.00 0.66 0.00 0.00 57.16 58.18 1bi9 n GLU 415 Cb 0.44 -0.78 0.38 0.00 0.27 0.00 0.00 31.44 31.75 1bi9 n GLU 415 CO 0.00 0.00 0.00 -0.39 -0.41 0.00 0.00 177.13 176.33 1bi9 h VAL 416 N 0.00 0.18 -0.79 6.31 -1.51 -1.14 0.91 116.25 120.21 1bi9 h VAL 416 Ca 0.00 -0.05 0.08 0.00 -1.23 0.00 0.00 66.70 65.50 1bi9 h VAL 416 Cb 0.00 0.03 -0.05 0.00 -2.13 0.00 0.00 31.29 29.14 1bi9 h VAL 416 CO 0.00 0.03 0.52 0.40 -1.23 0.00 0.00 177.57 177.28 1bi9 h ILE 417 N 0.14 1.00 0.20 7.19 2.04 -1.25 0.32 117.51 127.15 1bi9 h ILE 417 Ca 0.65 -0.28 -0.32 0.00 1.00 0.00 0.00 64.86 65.91 1bi9 h ILE 417 Cb 1.45 0.13 0.04 0.00 -0.74 0.00 0.00 36.82 37.69 1bi9 h ILE 417 CO -0.73 0.15 -1.37 -0.33 0.00 0.00 0.00 178.15 175.86 1bi9 h GLU 418 N 0.80 0.58 0.07 2.37 3.07 0.89 -3.06 114.58 119.32 1bi9 h GLU 418 Ca 0.35 -0.89 -0.00 0.00 -0.50 0.00 0.00 59.36 58.31 1bi9 h GLU 418 Cb 0.32 0.32 0.00 0.00 -0.84 0.00 0.00 28.75 28.54 1bi9 h GLU 418 CO -0.13 1.42 -0.04 0.00 -1.40 0.00 0.00 179.01 178.87 1bi9 h ARG 419 N 0.20 -0.09 -0.80 2.33 3.08 -0.75 -2.88 114.38 115.47 1bi9 h ARG 419 Ca -0.23 0.01 0.13 0.00 0.07 0.00 0.00 59.98 59.96 1bi9 h ARG 419 Cb 2.06 0.02 -0.09 0.00 0.08 0.00 0.00 29.97 32.04 1bi9 h ARG 419 CO 0.26 0.21 0.40 0.00 -1.07 0.00 0.00 179.97 179.76 1bi9 h ALA 420 N 0.50 1.16 0.49 0.04 0.00 -0.51 -3.02 119.26 117.92 1bi9 h ALA 420 Ca -0.01 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1bi9 h ALA 420 Cb 0.34 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1bi9 h ALA 420 CO 0.02 -0.08 -0.23 -0.91 0.00 0.00 0.00 179.25 178.04 1bi9 h ASN 421 N 0.60 -0.56 0.00 0.00 2.35 -1.51 -3.44 115.58 113.03 1bi9 h ASN 421 Ca 0.42 -0.02 -0.44 0.00 -0.55 0.00 0.00 56.30 55.71 1bi9 h ASN 421 Cb 0.55 0.14 -0.07 0.00 0.05 0.00 0.00 38.32 38.99 1bi9 h ASN 421 CO -0.34 -0.33 1.47 -3.20 -1.65 0.00 0.00 177.43 173.38 1bi9 n ASN 422 N -5.34 0.27 -3.57 5.81 2.85 -1.09 -4.83 115.26 109.37 1bi9 n ASN 422 Ca -0.12 0.18 -0.14 0.00 -0.11 0.00 0.00 54.58 54.40 1bi9 n ASN 422 Cb 0.29 -0.78 -0.06 0.00 1.24 0.00 0.00 39.78 40.47 1bi9 n ASN 422 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 1bi9 s SER 423 N 7.48 -0.56 -0.57 1.20 0.15 -1.26 -5.05 113.70 115.07 1bi9 s SER 423 Ca 1.15 0.75 -0.17 0.00 0.70 0.00 0.00 55.95 58.38 1bi9 s SER 423 Cb -1.09 0.65 0.12 0.00 -1.71 0.00 0.00 66.02 63.99 1bi9 s SER 423 CO 0.43 -0.42 0.60 -1.81 1.20 0.00 0.00 173.24 173.24 1bi9 s ASP 424 N -0.76 6.20 -0.03 5.45 1.01 -1.26 -4.82 116.67 122.46 1bi9 s ASP 424 Ca -0.05 -1.65 -0.02 0.00 0.71 0.00 0.00 52.55 51.53 1bi9 s ASP 424 Cb -0.01 -2.25 0.01 0.00 1.01 0.00 0.00 42.92 41.67 1bi9 s ASP 424 CO 0.04 -0.97 0.05 0.49 0.21 0.00 0.00 175.17 174.99 1bi9 n PHE 425 N 5.72 -3.28 0.00 4.23 3.01 -1.26 -5.02 117.46 120.85 1bi9 n PHE 425 Ca -0.11 1.94 0.00 0.00 1.01 0.00 0.00 57.45 60.29 1bi9 n PHE 425 Cb 0.41 -2.98 0.00 0.00 -0.01 0.00 0.00 39.48 36.91 1bi9 n PHE 425 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1bi9 n GLY 426 N 1.93 2.08 3.60 1.37 0.00 -1.26 -4.81 105.19 108.09 1bi9 n GLY 426 Ca -0.08 -1.10 -0.14 0.00 0.00 0.00 0.00 46.02 44.71 1bi9 n GLY 426 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1bi9 s LEU 427 N 0.00 -0.64 -0.02 0.99 2.96 -1.26 -3.87 118.68 116.84 1bi9 s LEU 427 Ca 0.00 1.39 -0.01 0.00 -0.22 0.00 0.00 54.13 55.28 1bi9 s LEU 427 Cb 0.00 2.35 0.01 0.00 0.50 0.00 0.00 46.19 49.06 1bi9 s LEU 427 CO 0.00 -0.24 0.05 -0.69 -1.32 0.00 0.00 176.35 174.15 1bi9 s VAL 428 N 0.42 -0.02 0.05 1.68 1.01 -0.94 -1.48 120.40 121.12 1bi9 s VAL 428 Ca -0.00 0.07 0.03 0.00 0.00 0.00 0.00 61.98 62.07 1bi9 s VAL 428 Cb -0.05 -0.09 -0.02 0.00 0.00 0.00 0.00 36.38 36.22 1bi9 s VAL 428 CO 0.00 0.03 -0.09 0.00 0.00 0.00 0.00 175.10 175.04 1bi9 s ALA 429 N 0.40 0.66 -0.12 5.51 0.00 -1.16 -2.58 121.76 124.47 1bi9 s ALA 429 Ca -0.03 -0.80 0.01 0.00 0.00 0.00 0.00 51.96 51.13 1bi9 s ALA 429 Cb -0.05 0.03 0.02 0.00 0.00 0.00 0.00 23.12 23.12 1bi9 s ALA 429 CO -0.01 0.00 -0.12 0.00 0.00 0.00 0.00 175.76 175.63 1bi9 s ALA 430 N -1.39 1.56 -0.10 0.00 0.00 -0.87 -0.61 121.76 120.34 1bi9 s ALA 430 Ca -0.09 -0.67 0.03 0.00 0.00 0.00 0.00 51.96 51.23 1bi9 s ALA 430 Cb -0.10 -0.89 -0.00 0.00 0.00 0.00 0.00 23.12 22.13 1bi9 s ALA 430 CO 0.01 -0.25 -0.22 0.08 0.00 0.00 0.00 175.76 175.38 1bi9 s VAL 431 N 1.33 2.28 -0.23 0.00 1.01 0.18 -0.04 120.40 124.93 1bi9 s VAL 431 Ca -0.01 -0.95 -0.05 0.00 0.00 0.00 0.00 61.98 60.98 1bi9 s VAL 431 Cb -0.14 -1.89 -0.01 0.00 0.00 0.00 0.00 36.38 34.35 1bi9 s VAL 431 CO -0.06 0.55 -0.01 -0.36 0.00 0.00 0.00 175.10 175.22 1bi9 s PHE 432 N 0.27 3.00 -0.02 5.22 0.40 -0.45 0.90 117.98 127.29 1bi9 s PHE 432 Ca -0.15 -0.89 -0.30 0.00 -0.60 0.00 0.00 56.93 54.99 1bi9 s PHE 432 Cb -0.17 -2.14 0.11 0.00 0.51 0.00 0.00 43.02 41.33 1bi9 s PHE 432 CO 0.08 -0.53 1.09 0.99 0.70 0.00 0.00 175.22 177.55 1bi9 s THR 433 N 1.50 0.00 -0.16 0.64 2.01 -1.26 -2.66 115.64 115.71 1bi9 s THR 433 Ca 0.05 -0.20 0.02 0.00 0.31 0.00 0.00 61.69 61.87 1bi9 s THR 433 Cb -0.15 -1.47 0.03 0.00 0.01 0.00 0.00 72.50 70.92 1bi9 s THR 433 CO -0.02 0.00 0.81 0.59 -0.69 0.00 0.00 174.62 175.31 1bi9 n ASN 434 N -0.31 1.66 -4.41 3.53 3.02 -1.26 -4.83 115.26 112.66 1bi9 n ASN 434 Ca -0.06 -1.56 -0.44 0.00 -0.03 0.00 0.00 54.58 52.49 1bi9 n ASN 434 Cb 0.61 -0.02 -0.05 0.00 -0.61 0.00 0.00 39.78 39.71 1bi9 n ASN 434 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1bi9 s ASP 435 N -0.59 6.20 0.40 6.41 -1.08 -1.26 -4.93 116.67 121.81 1bi9 s ASP 435 Ca 0.03 -1.18 0.21 0.00 -0.52 0.00 0.00 52.55 51.08 1bi9 s ASP 435 Cb 0.01 -2.30 1.18 0.00 -1.46 0.00 0.00 42.92 40.35 1bi9 s ASP 435 CO 0.02 -1.04 1.72 0.40 0.52 0.00 0.00 175.17 176.79 1bi9 h ILE 436 N 5.90 0.39 0.32 4.11 2.04 -1.98 -0.56 117.51 127.74 1bi9 h ILE 436 Ca -0.29 -0.11 -0.02 0.00 1.00 0.00 0.00 64.86 65.45 1bi9 h ILE 436 Cb 1.09 0.05 0.00 0.00 -0.74 0.00 0.00 36.82 37.23 1bi9 h ILE 436 CO 1.05 0.06 -0.16 0.78 0.00 0.00 0.00 178.15 179.88 1bi9 h ASN 437 N 0.31 -0.37 -0.38 1.72 2.35 -1.99 -0.62 115.58 116.61 1bi9 h ASN 437 Ca 0.67 -0.17 -0.00 0.00 -0.55 0.00 0.00 56.30 56.25 1bi9 h ASN 437 Cb 1.79 0.10 -0.02 0.00 0.05 0.00 0.00 38.32 40.24 1bi9 h ASN 437 CO -0.37 0.01 0.23 0.11 -1.65 0.00 0.00 177.43 175.77 1bi9 h LYS 438 N -0.81 0.51 -0.84 0.81 1.57 -1.80 -0.00 116.57 116.01 1bi9 h LYS 438 Ca -0.04 -0.04 0.11 0.00 -1.87 0.00 0.00 60.65 58.80 1bi9 h LYS 438 Cb 0.52 -0.11 -0.08 0.00 0.08 0.00 0.00 32.23 32.64 1bi9 h LYS 438 CO 0.07 0.37 0.48 0.00 -0.57 0.00 0.00 179.45 179.80 1bi9 h ALA 439 N 1.11 1.22 0.44 3.86 0.00 -1.15 -1.07 119.26 123.66 1bi9 h ALA 439 Ca 0.14 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 1bi9 h ALA 439 Cb -0.01 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1bi9 h ALA 439 CO -0.03 0.07 -0.21 -0.07 0.00 0.00 0.00 179.25 179.01 1bi9 h LEU 440 N 0.77 -0.50 -0.75 0.00 3.38 -0.49 -2.06 115.31 115.67 1bi9 h LEU 440 Ca 0.42 0.02 0.16 0.00 0.09 0.00 0.00 57.88 58.56 1bi9 h LEU 440 Cb 0.43 0.13 -0.14 0.00 0.09 0.00 0.00 40.66 41.17 1bi9 h LEU 440 CO -0.27 -0.17 -0.11 0.24 0.09 0.00 0.00 178.44 178.22 1bi9 h MET 441 N -0.97 0.03 0.87 1.13 2.86 -0.92 -1.54 114.93 116.40 1bi9 h MET 441 Ca -0.06 -0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.53 1bi9 h MET 441 Cb 0.45 -0.01 0.01 0.00 0.06 0.00 0.00 31.60 32.11 1bi9 h MET 441 CO 0.10 0.02 -0.42 0.28 1.06 0.00 0.00 176.91 177.95 1bi9 h VAL 442 N 0.04 0.00 -0.30 -2.22 2.07 -1.27 -1.09 116.25 113.47 1bi9 h VAL 442 Ca 0.38 -0.05 0.09 0.00 0.82 0.00 0.00 66.70 67.94 1bi9 h VAL 442 Cb 0.62 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1bi9 h VAL 442 CO -0.73 0.00 0.41 0.77 0.02 0.00 0.00 177.57 178.04 1bi9 h SER 443 N -1.22 0.00 0.43 0.57 4.64 -0.89 0.57 113.55 117.65 1bi9 h SER 443 Ca -0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.20 1bi9 h SER 443 Cb 0.90 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 1bi9 h SER 443 CO 0.20 0.00 -1.25 -1.54 -0.87 0.00 0.00 176.83 173.36 1bi9 n SER 444 N -3.53 0.53 -0.02 4.97 3.41 -0.62 -4.18 113.62 114.17 1bi9 n SER 444 Ca 0.05 -0.08 -0.11 0.00 -0.26 0.00 0.00 58.87 58.46 1bi9 n SER 444 Cb 0.55 1.02 -0.14 0.00 -0.26 0.00 0.00 64.21 65.38 1bi9 n SER 444 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1bi9 n ALA 445 N -1.99 1.37 -1.74 7.33 0.00 0.13 -4.86 120.51 120.74 1bi9 n ALA 445 Ca 0.00 -0.79 -0.42 0.00 0.00 0.00 0.00 53.44 52.23 1bi9 n ALA 445 Cb 0.49 -0.75 -0.03 0.00 0.00 0.00 0.00 19.45 19.16 1bi9 n ALA 445 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1bi9 s MET 446 N -2.58 3.75 -1.39 0.00 -1.94 0.15 -4.84 119.30 112.46 1bi9 s MET 446 Ca -0.09 2.24 -0.12 0.00 -1.71 0.00 0.00 55.69 56.01 1bi9 s MET 446 Cb 0.08 -4.20 -0.05 0.00 2.01 0.00 0.00 34.83 32.66 1bi9 s MET 446 CO 0.81 -1.38 2.53 1.04 -0.01 0.00 0.00 175.02 178.00 1bi9 n GLN 447 N 7.94 3.01 -4.31 2.03 6.02 -1.26 -4.86 117.38 125.95 1bi9 n GLN 447 Ca 0.23 -2.17 -0.27 0.00 -0.01 0.00 0.00 57.00 54.78 1bi9 n GLN 447 Cb 0.43 -2.90 -0.10 0.00 1.02 0.00 0.00 30.24 28.70 1bi9 n GLN 447 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1bi9 s ALA 448 N 2.91 2.87 -0.38 -1.58 0.00 -1.26 -4.44 121.76 119.88 1bi9 s ALA 448 Ca 0.57 -1.48 0.23 0.00 0.00 0.00 0.00 51.96 51.28 1bi9 s ALA 448 Cb 0.15 -0.68 0.41 0.00 0.00 0.00 0.00 23.12 23.01 1bi9 s ALA 448 CO -0.05 0.47 1.63 0.78 0.00 0.00 0.00 175.76 178.60 1bi9 h GLY 449 N 3.01 0.00 -4.70 0.00 0.00 -1.59 -3.45 103.07 96.34 1bi9 h GLY 449 Ca -0.47 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 46.75 1bi9 h GLY 449 CO 0.53 0.00 -0.19 -1.08 0.00 0.00 0.00 176.54 175.80 1bi9 s THR 450 N -3.24 0.03 -0.01 4.70 -1.32 -1.26 -5.11 115.64 109.43 1bi9 s THR 450 Ca 0.06 -0.24 0.00 0.00 -1.21 0.00 0.00 61.69 60.31 1bi9 s THR 450 Cb 0.05 -0.66 0.01 0.00 -1.51 0.00 0.00 72.50 70.40 1bi9 s THR 450 CO 0.66 -0.13 0.01 -0.69 -2.21 0.00 0.00 174.62 172.27 1bi9 s VAL 451 N -0.75 -0.00 -0.11 5.08 1.01 -1.26 -3.01 120.40 121.37 1bi9 s VAL 451 Ca -0.08 0.09 -0.01 0.00 0.00 0.00 0.00 61.98 61.98 1bi9 s VAL 451 Cb -0.04 -0.07 -0.03 0.00 0.00 0.00 0.00 36.38 36.25 1bi9 s VAL 451 CO 0.04 0.05 -0.07 0.26 0.00 0.00 0.00 175.10 175.38 1bi9 s TRP 452 N 0.51 2.95 -0.24 5.22 0.52 0.21 -5.01 118.94 123.12 1bi9 s TRP 452 Ca -0.04 -0.17 -0.02 0.00 0.02 0.00 0.00 56.10 55.88 1bi9 s TRP 452 Cb -0.06 -1.81 0.01 0.00 -1.15 0.00 0.00 33.47 30.46 1bi9 s TRP 452 CO -0.01 0.14 -0.06 0.42 0.02 0.00 0.00 176.95 177.45 1bi9 s ILE 453 N -0.26 3.00 -1.43 2.03 1.01 -1.26 0.52 121.20 124.80 1bi9 s ILE 453 Ca 0.04 -0.85 -0.04 0.00 0.00 0.00 0.00 60.65 59.80 1bi9 s ILE 453 Cb -0.13 -2.46 0.00 0.00 0.01 0.00 0.00 42.46 39.89 1bi9 s ILE 453 CO 0.03 0.29 0.52 0.59 0.00 0.00 0.00 174.94 176.37 1bi9 n ASN 454 N 4.71 -5.73 -1.95 3.58 3.02 0.26 -4.95 115.26 114.21 1bi9 n ASN 454 Ca -0.17 -0.25 -0.02 0.00 -0.03 0.00 0.00 54.58 54.11 1bi9 n ASN 454 Cb 0.48 -4.57 0.01 0.00 -0.61 0.00 0.00 39.78 35.10 1bi9 n ASN 454 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1bi9 n TYR 456 N -0.30 0.00 -2.70 0.00 9.36 -1.26 -4.70 117.16 117.56 1bi9 n TYR 456 Ca -0.01 0.00 -0.06 0.00 3.32 0.00 0.00 57.90 61.14 1bi9 n TYR 456 Cb 0.25 0.00 0.07 0.00 -0.63 0.00 0.00 39.34 39.03 1bi9 n TYR 456 CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 1bi9 n ASN 457 N 0.00 -2.01 -4.74 2.98 2.04 -1.26 -4.72 115.26 107.56 1bi9 n ASN 457 Ca 0.00 -2.54 -0.42 0.00 -0.44 0.00 0.00 54.58 51.18 1bi9 n ASN 457 Cb 0.00 1.29 -0.02 0.00 -2.53 0.00 0.00 39.78 38.52 1bi9 n ASN 457 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1bi9 n ALA 458 N 1.38 2.58 -2.00 -2.53 0.00 -1.24 -5.14 120.51 113.56 1bi9 n ALA 458 Ca 0.04 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.86 1bi9 n ALA 458 Cb 0.68 -2.47 0.00 0.00 0.00 0.00 0.00 19.45 17.66 1bi9 n ALA 458 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bi9 n GLY 478 N 2.49 2.48 0.58 0.00 0.00 -1.26 -4.92 105.19 104.57 1bi9 n GLY 478 Ca 0.10 -0.07 0.46 0.00 0.00 0.00 0.00 46.02 46.50 1bi9 n GLY 478 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1bi9 n GLU 479 N 0.00 -0.02 0.21 1.61 4.07 -1.26 0.18 120.64 125.43 1bi9 n GLU 479 Ca 0.00 1.14 0.12 0.00 -0.06 0.00 0.00 57.16 58.36 1bi9 n GLU 479 Cb 0.00 -2.42 0.23 0.00 -0.06 0.00 0.00 31.44 29.20 1bi9 n GLU 479 CO 0.00 0.00 0.00 0.74 -0.06 0.00 0.00 177.13 177.81 1bi9 h PHE 480 N 0.00 0.00 -0.18 4.31 0.04 -2.08 -3.31 116.94 115.72 1bi9 h PHE 480 Ca 0.89 0.00 -0.16 0.00 2.80 0.00 0.00 57.97 61.50 1bi9 h PHE 480 Cb 3.22 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 41.37 1bi9 h PHE 480 CO -0.00 0.00 -0.54 0.78 -0.60 0.00 0.00 178.31 177.95 1bi9 h GLY 481 N 3.96 0.59 -2.88 -1.45 0.00 0.14 -3.09 103.07 100.34 1bi9 h GLY 481 Ca 0.00 -0.68 -0.22 0.00 0.00 0.00 0.00 47.33 46.43 1bi9 h GLY 481 CO 0.00 0.61 0.28 1.47 0.00 0.00 0.00 176.54 178.90 1bi9 n LEU 482 N -3.96 4.63 -0.09 3.11 -0.00 -1.23 -3.78 117.00 115.68 1bi9 n LEU 482 Ca -0.03 -2.42 -0.10 0.00 -0.00 0.00 0.00 56.01 53.46 1bi9 n LEU 482 Cb 0.60 -0.66 -0.14 0.00 -0.00 0.00 0.00 43.42 43.22 1bi9 n LEU 482 CO 0.47 0.72 -1.11 0.54 -0.00 0.00 0.00 177.39 178.01 1bi9 n ARG 483 N -0.22 1.00 0.08 1.47 1.74 -1.17 -4.21 116.66 115.35 1bi9 n ARG 483 Ca 0.27 0.01 0.12 0.00 -0.77 0.00 0.00 57.85 57.48 1bi9 n ARG 483 Cb 1.03 -1.46 0.45 0.00 -1.02 0.00 0.00 32.46 31.46 1bi9 n ARG 483 CO 0.00 0.00 0.00 -0.85 -1.52 0.00 0.00 177.63 175.26 1bi9 n GLU 484 N -2.73 0.16 -0.52 5.56 0.28 -1.25 -3.01 120.64 119.13 1bi9 n GLU 484 Ca -0.31 0.27 0.09 0.00 -0.16 0.00 0.00 57.16 57.05 1bi9 n GLU 484 Cb 1.07 -1.74 0.33 0.00 1.43 0.00 0.00 31.44 32.52 1bi9 n GLU 484 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 1bi9 n TYR 485 N -2.04 1.27 -3.84 -1.84 4.01 -1.26 -4.94 117.16 108.53 1bi9 n TYR 485 Ca 0.04 -0.60 -0.12 0.00 -0.16 0.00 0.00 57.90 57.06 1bi9 n TYR 485 Cb 0.31 -0.19 -0.09 0.00 -0.31 0.00 0.00 39.34 39.05 1bi9 n TYR 485 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 1bi9 s SER 486 N -1.00 -0.04 0.34 7.72 1.04 -1.16 -3.84 113.70 116.75 1bi9 s SER 486 Ca 0.48 -0.12 0.09 0.00 0.48 0.00 0.00 55.95 56.88 1bi9 s SER 486 Cb 0.30 0.24 -0.06 0.00 0.10 0.00 0.00 66.02 66.60 1bi9 s SER 486 CO 0.24 -0.40 -0.06 -1.83 0.98 0.00 0.00 173.24 172.17 1bi9 s GLU 487 N -1.37 1.90 -0.13 4.02 -1.05 -0.18 -4.91 118.70 116.98 1bi9 s GLU 487 Ca -0.14 -1.86 -0.09 0.00 -0.15 0.00 0.00 54.97 52.72 1bi9 s GLU 487 Cb -0.07 -1.79 -0.04 0.00 -0.44 0.00 0.00 34.13 31.79 1bi9 s GLU 487 CO 0.02 0.15 0.18 0.08 0.95 0.00 0.00 175.26 176.64 1bi9 s VAL 488 N -2.57 5.42 -0.20 1.83 1.01 -1.26 -1.59 120.40 123.04 1bi9 s VAL 488 Ca 0.33 0.29 0.00 0.00 0.00 0.00 0.00 61.98 62.61 1bi9 s VAL 488 Cb 0.01 -3.46 0.05 0.00 0.00 0.00 0.00 36.38 32.97 1bi9 s VAL 488 CO 0.17 0.56 -0.08 -0.75 0.00 0.00 0.00 175.10 175.00 1bi9 s LYS 489 N -0.61 1.81 -0.15 2.72 2.20 0.23 -4.97 119.74 120.97 1bi9 s LYS 489 Ca 0.14 -0.78 -0.05 0.00 -0.36 0.00 0.00 55.97 54.92 1bi9 s LYS 489 Cb -0.12 -2.34 -0.03 0.00 -1.51 0.00 0.00 37.83 33.82 1bi9 s LYS 489 CO 0.04 -0.46 0.01 -0.08 -0.36 0.00 0.00 175.35 174.49 1bi9 s THR 490 N 1.46 4.29 -0.02 3.43 -1.32 -1.26 0.83 115.64 123.05 1bi9 s THR 490 Ca -0.02 -0.22 0.06 0.00 -1.21 0.00 0.00 61.69 60.30 1bi9 s THR 490 Cb -0.16 -2.89 -0.03 0.00 -1.51 0.00 0.00 72.50 67.91 1bi9 s THR 490 CO -0.08 0.50 -0.19 -0.69 -2.21 0.00 0.00 174.62 171.96 1bi9 s VAL 491 N 0.16 2.70 -0.03 5.08 1.01 0.13 -4.96 120.40 124.49 1bi9 s VAL 491 Ca 0.01 -0.95 -0.01 0.00 0.00 0.00 0.00 61.98 61.03 1bi9 s VAL 491 Cb -0.13 -2.04 0.03 0.00 0.00 0.00 0.00 36.38 34.24 1bi9 s VAL 491 CO 0.02 0.53 0.05 0.28 0.00 0.00 0.00 175.10 175.98 1bi9 s THR 492 N -0.74 -0.09 -0.09 3.92 -1.32 -1.26 0.74 115.64 116.80 1bi9 s THR 492 Ca 0.12 0.33 -0.00 0.00 -1.21 0.00 0.00 61.69 60.93 1bi9 s THR 492 Cb -0.10 -0.13 -0.03 0.00 -1.51 0.00 0.00 72.50 70.73 1bi9 s THR 492 CO 0.01 0.14 -0.06 -0.69 -2.21 0.00 0.00 174.62 171.81 1bi9 s VAL 493 N 1.69 3.76 0.18 5.08 1.01 0.10 -4.92 120.40 127.31 1bi9 s VAL 493 Ca -0.01 -0.44 -0.30 0.00 0.00 0.00 0.00 61.98 61.23 1bi9 s VAL 493 Cb -0.12 -2.57 -0.08 0.00 0.00 0.00 0.00 36.38 33.61 1bi9 s VAL 493 CO -0.03 0.57 1.03 -0.75 0.00 0.00 0.00 175.10 175.93 1bi9 s LYS 494 N -0.51 4.68 0.03 2.72 2.47 -1.26 -1.21 119.74 126.65 1bi9 s LYS 494 Ca 0.08 1.62 0.02 0.00 -1.56 0.00 0.00 55.97 56.13 1bi9 s LYS 494 Cb -0.12 -3.29 -0.02 0.00 -1.46 0.00 0.00 37.83 32.94 1bi9 s LYS 494 CO 0.02 0.21 -0.08 0.96 0.16 0.00 0.00 175.35 176.63 1bi9 s ILE 495 N -0.47 0.58 0.03 5.43 -4.36 -0.77 -4.96 121.20 116.69 1bi9 s ILE 495 Ca 0.47 -0.80 -0.07 0.00 -0.26 0.00 0.00 60.65 59.98 1bi9 s ILE 495 Cb -0.27 -0.58 -0.02 0.00 1.25 0.00 0.00 42.46 42.84 1bi9 s ILE 495 CO 0.34 -0.18 1.12 -0.65 0.24 0.00 0.00 174.94 175.81 1bi9 h PRO 496 N 5.02 -0.02 -3.30 0.37 0.11 -1.97 -3.42 132.00 128.79 1bi9 h PRO 496 Ca -0.34 0.00 -0.33 0.00 0.11 0.00 0.00 66.00 65.45 1bi9 h PRO 496 Cb 1.20 0.00 -0.37 0.00 0.11 0.00 0.00 31.00 31.94 1bi9 h PRO 496 CO 0.44 -0.01 -0.70 -1.14 -0.21 0.00 0.00 178.00 176.38 1bi9 s GLN 497 N -3.54 -0.03 0.05 1.05 0.74 -1.26 -4.97 119.66 111.69 1bi9 s GLN 497 Ca -0.03 0.38 -0.26 0.00 0.05 0.00 0.00 55.36 55.51 1bi9 s GLN 497 Cb 0.02 -0.38 -0.05 0.00 1.10 0.00 0.00 33.01 33.70 1bi9 s GLN 497 CO 0.13 -0.28 0.79 0.21 -0.55 0.00 0.00 175.29 175.60 1bi9 s LYS 498 N 1.89 4.52 0.02 1.67 2.20 -1.26 -5.07 119.74 123.70 1bi9 s LYS 498 Ca 0.00 1.12 0.02 0.00 -0.36 0.00 0.00 55.97 56.75 1bi9 s LYS 498 Cb -0.12 -3.37 -0.01 0.00 -1.51 0.00 0.00 37.83 32.81 1bi9 s LYS 498 CO -0.04 0.26 -0.07 -0.80 -0.36 0.00 0.00 175.35 174.34 1bi9 s ASN 499 N 0.01 0.74 0.00 1.43 0.01 -1.26 -5.05 114.94 110.82 1bi9 s ASN 499 Ca 0.40 -0.31 0.22 0.00 -0.71 0.00 0.00 52.86 52.46 1bi9 s ASN 499 Cb -0.21 -0.02 1.31 0.00 0.41 0.00 0.00 41.25 42.74 1bi9 s ASN 499 CO 0.24 -0.06 1.68 -1.54 -1.51 0.00 0.00 177.10 175.91