#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 2.82 -1.87 -5.12 0.00 -1.26 -5.11 120.51 109.97 1bi9 n ALA 3 Ca 0.00 -0.45 -0.39 0.00 0.00 0.00 0.00 53.44 52.60 1bi9 n ALA 3 Cb 0.00 -0.23 -0.03 0.00 0.00 0.00 0.00 19.45 19.19 1bi9 n ALA 3 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1bi9 s SER 4 N -0.65 5.19 0.16 0.00 0.01 -1.26 -4.98 113.70 112.17 1bi9 s SER 4 Ca 0.00 0.86 0.07 0.00 1.31 0.00 0.00 55.95 58.19 1bi9 s SER 4 Cb 0.00 -2.52 -0.04 0.00 0.21 0.00 0.00 66.02 63.67 1bi9 s SER 4 CO 0.00 -2.34 -0.02 -0.76 0.41 0.00 0.00 173.24 170.53 1bi9 s LEU 5 N 9.39 3.26 -1.10 2.44 1.43 -1.26 -5.06 118.68 127.79 1bi9 s LEU 5 Ca 0.80 -0.39 -0.15 0.00 -1.03 0.00 0.00 54.13 53.37 1bi9 s LEU 5 Cb -0.17 -1.95 0.16 0.00 0.03 0.00 0.00 46.19 44.26 1bi9 s LEU 5 CO 0.26 0.11 1.30 -1.10 0.23 0.00 0.00 176.35 177.15 1bi9 s GLN 6 N -2.76 3.91 0.35 1.70 1.11 -1.26 -4.62 119.66 118.08 1bi9 s GLN 6 Ca 0.26 -2.33 0.23 0.00 0.01 0.00 0.00 55.36 53.53 1bi9 s GLN 6 Cb -0.10 -4.97 0.24 0.00 -1.01 0.00 0.00 33.01 27.17 1bi9 s GLN 6 CO 0.18 -1.73 1.42 1.25 0.01 0.00 0.00 175.29 176.41 1bi9 h LEU 7 N 9.77 0.00 -9.24 2.90 5.85 -2.01 -3.47 115.31 119.10 1bi9 h LEU 7 Ca 0.25 -0.01 -0.62 0.00 0.84 0.00 0.00 57.88 58.34 1bi9 h LEU 7 Cb 0.93 0.00 0.13 0.00 0.37 0.00 0.00 40.66 42.09 1bi9 h LEU 7 CO 1.17 0.00 -0.41 -0.11 -0.34 0.00 0.00 178.44 178.76 1bi9 n LEU 8 N -2.90 -0.33 -4.76 2.25 7.94 -1.26 -4.90 117.00 113.04 1bi9 n LEU 8 Ca 0.03 0.99 -0.39 0.00 -1.11 0.00 0.00 56.01 55.53 1bi9 n LEU 8 Cb 0.53 -1.08 0.03 0.00 0.53 0.00 0.00 43.42 43.43 1bi9 n LEU 8 CO 0.36 -2.82 1.03 -2.16 -1.11 0.00 0.00 177.39 172.69 1bi9 s PRO 9 N -1.38 3.33 -0.08 1.96 0.04 -1.26 -5.00 135.00 132.61 1bi9 s PRO 9 Ca 0.62 2.34 0.02 0.00 0.04 0.00 0.00 61.00 64.02 1bi9 s PRO 9 Cb -0.69 -2.41 0.01 0.00 0.04 0.00 0.00 34.50 31.45 1bi9 s PRO 9 CO 0.59 -1.07 -0.15 -1.12 0.04 0.00 0.00 177.00 175.28 1bi9 s SER 10 N -0.74 2.19 -0.25 6.66 0.01 -1.26 -4.99 113.70 115.31 1bi9 s SER 10 Ca 0.68 -0.38 -0.28 0.00 1.31 0.00 0.00 55.95 57.28 1bi9 s SER 10 Cb -0.42 -1.00 -0.04 0.00 0.21 0.00 0.00 66.02 64.76 1bi9 s SER 10 CO 0.52 0.05 2.15 -2.16 0.41 0.00 0.00 173.24 174.22 1bi9 s PRO 11 N 0.69 3.11 -0.12 12.44 0.04 -1.26 -4.85 135.00 145.04 1bi9 s PRO 11 Ca -0.13 1.88 -0.37 0.00 0.04 0.00 0.00 61.00 62.42 1bi9 s PRO 11 Cb -0.16 -4.35 -0.17 0.00 0.04 0.00 0.00 34.50 29.85 1bi9 s PRO 11 CO 0.03 -2.13 1.06 -2.37 0.04 0.00 0.00 177.00 173.64 1bi9 n THR 12 N 7.72 0.00 -1.78 1.26 5.66 -1.26 -4.75 114.28 121.13 1bi9 n THR 12 Ca 0.29 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.87 1bi9 n THR 12 Cb 0.46 -0.12 -0.03 0.00 -1.55 0.00 0.00 70.33 69.09 1bi9 n THR 12 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 1bi9 s PRO 13 N 0.74 4.16 -0.56 1.09 0.04 -1.26 -3.77 135.00 135.43 1bi9 s PRO 13 Ca 0.83 2.50 -0.16 0.00 0.04 0.00 0.00 61.00 64.21 1bi9 s PRO 13 Cb -1.17 -3.79 0.02 0.00 0.04 0.00 0.00 34.50 29.61 1bi9 s PRO 13 CO 0.56 -0.85 0.54 0.09 0.04 0.00 0.00 177.00 177.38 1bi9 n ASN 14 N 6.30 -4.35 -4.62 6.66 5.03 -1.26 -4.82 115.26 118.20 1bi9 n ASN 14 Ca 0.18 -0.53 -0.36 0.00 0.87 0.00 0.00 54.58 54.74 1bi9 n ASN 14 Cb 0.40 -1.36 0.08 0.00 -1.02 0.00 0.00 39.78 37.88 1bi9 n ASN 14 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.26 175.32 1bi9 n LEU 15 N -1.34 3.76 -4.49 3.41 7.94 -1.25 -4.98 117.00 120.06 1bi9 n LEU 15 Ca -0.19 0.71 -0.39 0.00 -1.11 0.00 0.00 56.01 55.03 1bi9 n LEU 15 Cb 0.59 -1.41 -0.11 0.00 0.53 0.00 0.00 43.42 43.02 1bi9 n LEU 15 CO 0.52 -1.92 -0.18 -0.70 -1.11 0.00 0.00 177.39 173.99 1bi9 s GLU 16 N -3.19 3.48 -0.61 1.96 2.56 -1.26 -5.02 118.70 116.62 1bi9 s GLU 16 Ca 0.75 -0.63 -0.27 0.00 0.00 0.00 0.00 54.97 54.81 1bi9 s GLU 16 Cb -0.37 -3.65 0.01 0.00 2.00 0.00 0.00 34.13 32.12 1bi9 s GLU 16 CO 0.48 -0.39 1.54 0.42 -0.56 0.00 0.00 175.26 176.76 1bi9 s ILE 17 N 1.67 3.62 -0.08 -3.70 -1.09 -1.26 -4.81 121.20 115.54 1bi9 s ILE 17 Ca 0.05 0.45 0.13 0.00 -2.23 0.00 0.00 60.65 59.06 1bi9 s ILE 17 Cb -0.17 -4.36 -0.03 0.00 -1.58 0.00 0.00 42.46 36.32 1bi9 s ILE 17 CO 0.08 -1.22 1.34 0.50 -1.23 0.00 0.00 174.94 174.41 1bi9 h LYS 18 N 12.12 0.00 -4.96 2.79 3.64 -2.02 -3.44 116.57 124.70 1bi9 h LYS 18 Ca -0.27 0.00 -0.66 0.00 -1.27 0.00 0.00 60.65 58.45 1bi9 h LYS 18 Cb 1.11 0.00 -0.28 0.00 -0.41 0.00 0.00 32.23 32.65 1bi9 h LYS 18 CO 1.21 0.61 -0.71 0.71 -2.27 0.00 0.00 179.45 178.99 1bi9 s TYR 19 N -2.89 2.99 0.00 1.91 2.02 -1.26 -4.91 117.35 115.22 1bi9 s TYR 19 Ca 0.03 -1.01 0.00 0.00 -0.37 0.00 0.00 57.07 55.72 1bi9 s TYR 19 Cb 0.08 -2.12 0.00 0.00 -0.40 0.00 0.00 41.96 39.52 1bi9 s TYR 19 CO 0.77 -0.57 0.56 0.25 -1.57 0.00 0.00 175.55 174.99 1bi9 n THR 20 N 4.79 0.00 -4.10 -0.71 -2.24 -1.26 -4.79 114.28 105.97 1bi9 n THR 20 Ca -0.18 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.36 1bi9 n THR 20 Cb 0.50 0.61 -0.07 0.00 -2.10 0.00 0.00 70.33 69.27 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 0.00 2.24 0.39 -0.78 1.02 -1.26 -0.79 119.74 120.56 1bi9 s LYS 21 Ca 0.00 -1.84 -0.26 0.00 0.02 0.00 0.00 55.97 53.89 1bi9 s LYS 21 Cb 0.00 -2.00 -0.09 0.00 -0.52 0.00 0.00 37.83 35.23 1bi9 s LYS 21 CO 0.00 -0.14 1.21 0.42 -0.92 0.00 0.00 175.35 175.91 1bi9 s ILE 22 N -2.60 3.02 -0.36 2.17 1.01 -0.78 -4.84 121.20 118.81 1bi9 s ILE 22 Ca 0.41 0.89 -0.02 0.00 0.00 0.00 0.00 60.65 61.93 1bi9 s ILE 22 Cb 0.03 -3.51 0.09 0.00 0.01 0.00 0.00 42.46 39.08 1bi9 s ILE 22 CO 0.22 0.11 0.11 0.12 0.00 0.00 0.00 174.94 175.51 1bi9 s PHE 23 N -1.34 3.50 -0.04 3.97 5.36 -0.40 -0.83 117.98 128.20 1bi9 s PHE 23 Ca 0.56 -2.31 0.01 0.00 -0.96 0.00 0.00 56.93 54.23 1bi9 s PHE 23 Cb -0.33 -2.79 0.02 0.00 -0.34 0.00 0.00 43.02 39.57 1bi9 s PHE 23 CO 0.42 -0.91 -0.05 0.42 -1.46 0.00 0.00 175.22 173.64 1bi9 s ILE 24 N 1.15 0.53 -1.43 3.12 1.01 -0.50 -1.30 121.20 123.78 1bi9 s ILE 24 Ca 0.04 -0.14 -0.08 0.00 0.00 0.00 0.00 60.65 60.47 1bi9 s ILE 24 Cb -0.21 -0.54 0.04 0.00 0.01 0.00 0.00 42.46 41.76 1bi9 s ILE 24 CO -0.04 0.21 0.87 0.59 0.00 0.00 0.00 174.94 176.58 1bi9 n ASN 25 N 3.90 -3.32 -1.40 3.58 3.02 -1.26 -0.68 115.26 119.10 1bi9 n ASN 25 Ca -0.24 -0.78 -0.16 0.00 -0.03 0.00 0.00 54.58 53.36 1bi9 n ASN 25 Cb 0.51 -4.02 -0.07 0.00 -0.61 0.00 0.00 39.78 35.60 1bi9 n ASN 25 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1bi9 n ASN 26 N -2.94 -4.51 -4.31 6.41 3.02 -1.26 -4.65 115.26 107.03 1bi9 n ASN 26 Ca -0.11 0.39 -0.31 0.00 -0.03 0.00 0.00 54.58 54.52 1bi9 n ASN 26 Cb 0.59 -3.98 -0.16 0.00 -0.61 0.00 0.00 39.78 35.62 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 -3.33 2.33 -0.52 3.52 0.41 0.14 -5.04 118.70 116.22 1bi9 s GLU 27 Ca 0.00 -0.90 -0.22 0.00 -0.41 0.00 0.00 54.97 53.44 1bi9 s GLU 27 Cb 0.00 -2.12 0.05 0.00 -1.78 0.00 0.00 34.13 30.28 1bi9 s GLU 27 CO 0.00 0.49 0.77 -1.58 -0.49 0.00 0.00 175.26 174.45 1bi9 s TRP 28 N -0.43 2.93 0.31 1.61 0.52 -1.26 -1.41 118.94 121.22 1bi9 s TRP 28 Ca 0.04 -0.27 0.06 0.00 0.02 0.00 0.00 56.10 55.95 1bi9 s TRP 28 Cb -0.12 -3.78 -0.02 0.00 -1.15 0.00 0.00 33.47 28.41 1bi9 s TRP 28 CO 0.01 -1.17 0.41 -0.65 0.02 0.00 0.00 176.95 175.57 1bi9 s GLN 29 N 3.25 3.14 0.48 4.98 -1.52 -0.01 -4.90 119.66 125.09 1bi9 s GLN 29 Ca 0.22 -0.99 0.02 0.00 -1.95 0.00 0.00 55.36 52.67 1bi9 s GLN 29 Cb -0.16 -2.79 0.01 0.00 -0.22 0.00 0.00 33.01 29.86 1bi9 s GLN 29 CO 0.16 0.17 0.68 -0.80 -0.25 0.00 0.00 175.29 175.25 1bi9 s ASN 30 N -4.09 5.60 0.26 5.90 0.02 -1.26 -1.86 114.94 119.49 1bi9 s ASN 30 Ca 0.41 0.04 -0.30 0.00 -1.02 0.00 0.00 52.86 52.00 1bi9 s ASN 30 Cb -0.09 -1.14 -0.10 0.00 0.02 0.00 0.00 41.25 39.95 1bi9 s ASN 30 CO 0.30 -0.86 1.31 -0.94 0.02 0.00 0.00 177.10 176.92 1bi9 s SER 31 N -4.31 6.85 0.36 -1.22 1.04 -1.26 -4.87 113.70 110.28 1bi9 s SER 31 Ca 0.52 2.52 0.14 0.00 0.48 0.00 0.00 55.95 59.61 1bi9 s SER 31 Cb -0.10 -2.63 0.98 0.00 0.10 0.00 0.00 66.02 64.38 1bi9 s SER 31 CO 0.37 -0.52 1.75 -0.33 0.98 0.00 0.00 173.24 175.49 1bi9 h GLU 32 N 4.53 0.49 -0.00 4.02 4.39 -1.94 0.61 114.58 126.67 1bi9 h GLU 32 Ca -0.46 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.21 1bi9 h GLU 32 Cb 1.22 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.76 1bi9 h GLU 32 CO 0.72 0.32 -0.37 -1.13 -1.16 0.00 0.00 179.01 177.40 1bi9 n SER 33 N -4.76 0.79 0.00 1.42 3.41 -1.26 -4.93 113.62 108.30 1bi9 n SER 33 Ca 0.26 -0.61 0.00 0.00 -0.26 0.00 0.00 58.87 58.26 1bi9 n SER 33 Cb 0.80 0.19 0.00 0.00 -0.26 0.00 0.00 64.21 64.94 1bi9 n SER 33 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1bi9 n GLY 34 N 1.41 0.84 3.71 5.00 0.00 0.21 -4.99 105.19 111.37 1bi9 n GLY 34 Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.19 1.52 -0.05 1.61 0.52 -1.26 -4.87 118.95 116.23 1bi9 s ARG 35 Ca 0.00 1.32 -0.23 0.00 -0.52 0.00 0.00 55.73 56.31 1bi9 s ARG 35 Cb 0.00 -1.80 0.05 0.00 0.52 0.00 0.00 34.95 33.72 1bi9 s ARG 35 CO 0.00 -2.21 0.50 0.08 0.02 0.00 0.00 175.30 173.69 1bi9 s VAL 36 N -2.77 0.03 0.02 3.52 1.01 -1.26 -2.12 120.40 118.82 1bi9 s VAL 36 Ca 0.64 -0.21 0.04 0.00 0.00 0.00 0.00 61.98 62.45 1bi9 s VAL 36 Cb -0.20 -0.80 -0.02 0.00 0.00 0.00 0.00 36.38 35.36 1bi9 s VAL 36 CO 0.57 -0.11 -0.11 0.72 0.00 0.00 0.00 175.10 176.17 1bi9 s PHE 37 N -1.09 0.98 0.55 5.22 -0.71 -0.44 -4.89 117.98 117.60 1bi9 s PHE 37 Ca -0.11 -0.30 -0.18 0.00 -1.04 0.00 0.00 56.93 55.30 1bi9 s PHE 37 Cb -0.03 -0.60 -0.06 0.00 -1.21 0.00 0.00 43.02 41.13 1bi9 s PHE 37 CO 0.06 -0.00 1.06 -1.25 -1.34 0.00 0.00 175.22 173.75 1bi9 s PRO 38 N -0.87 3.50 -0.05 1.99 0.04 -1.26 -1.18 135.00 137.17 1bi9 s PRO 38 Ca 0.00 1.29 0.06 0.00 0.04 0.00 0.00 61.00 62.40 1bi9 s PRO 38 Cb -0.07 -2.05 -0.02 0.00 0.04 0.00 0.00 34.50 32.40 1bi9 s PRO 38 CO 0.01 -0.67 -0.23 0.08 0.04 0.00 0.00 177.00 176.23 1bi9 s VAL 39 N -2.22 2.27 0.21 -0.36 1.01 -0.31 -4.90 120.40 116.11 1bi9 s VAL 39 Ca 0.66 -1.00 0.10 0.00 0.00 0.00 0.00 61.98 61.73 1bi9 s VAL 39 Cb -0.17 -1.83 -0.05 0.00 0.00 0.00 0.00 36.38 34.33 1bi9 s VAL 39 CO 0.30 0.57 -0.19 0.00 0.00 0.00 0.00 175.10 175.78 1bi9 s ASN 41 N -3.07 6.28 0.00 0.00 3.84 0.54 -4.77 114.94 117.76 1bi9 s ASN 41 Ca 0.22 -0.62 0.07 0.00 0.21 0.00 0.00 52.86 52.75 1bi9 s ASN 41 Cb -0.05 -2.38 0.31 0.00 -0.55 0.00 0.00 41.25 38.58 1bi9 s ASN 41 CO 0.10 -1.13 1.21 -0.81 -2.79 0.00 0.00 177.10 173.67 1bi9 n PRO 42 N 7.03 0.02 0.04 0.43 -0.04 -1.26 0.16 135.00 141.37 1bi9 n PRO 42 Ca -0.02 0.35 -0.14 0.00 -0.04 0.00 0.00 63.50 63.66 1bi9 n PRO 42 Cb 0.46 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.29 1bi9 n PRO 42 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1bi9 h ALA 43 N 2.26 0.41 0.00 0.55 0.00 -1.89 -2.14 119.26 118.45 1bi9 h ALA 43 Ca 0.00 -1.19 -0.02 0.00 0.00 0.00 0.00 54.91 53.70 1bi9 h ALA 43 Cb 0.11 0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 1bi9 h ALA 43 CO 0.00 1.27 -1.31 0.25 0.00 0.00 0.00 179.25 179.46 1bi9 n THR 44 N -3.35 0.09 -0.97 0.00 -2.24 -0.88 -3.06 114.28 103.87 1bi9 n THR 44 Ca -0.16 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 1bi9 n THR 44 Cb 1.03 0.09 0.00 0.00 -2.10 0.00 0.00 70.33 69.35 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 2.26 0.49 3.92 3.38 0.00 0.43 -2.79 105.19 112.88 1bi9 n GLY 45 Ca -0.03 -0.21 -0.30 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.40 3.49 0.46 1.61 -6.30 -1.22 -4.84 118.70 111.51 1bi9 s GLU 46 Ca 0.00 -0.36 -0.22 0.00 -2.50 0.00 0.00 54.97 51.89 1bi9 s GLU 46 Cb 0.00 -2.97 -0.08 0.00 0.00 0.00 0.00 34.13 31.09 1bi9 s GLU 46 CO 0.00 0.55 1.13 -1.14 0.02 0.00 0.00 175.26 175.81 1bi9 s GLN 47 N -2.69 3.78 -0.19 4.30 0.74 -1.26 -0.34 119.66 124.00 1bi9 s GLN 47 Ca 0.37 1.67 -0.03 0.00 0.05 0.00 0.00 55.36 57.42 1bi9 s GLN 47 Cb -0.12 -2.35 -0.11 0.00 1.10 0.00 0.00 33.01 31.53 1bi9 s GLN 47 CO 0.27 -0.51 -0.20 0.28 -0.55 0.00 0.00 175.29 174.58 1bi9 n VAL 48 N -0.57 1.08 -3.74 1.34 0.31 0.23 -4.79 118.33 112.19 1bi9 n VAL 48 Ca 0.08 -0.36 -0.00 0.00 -0.01 0.00 0.00 64.34 64.05 1bi9 n VAL 48 Cb 0.49 -1.39 0.01 0.00 -0.91 0.00 0.00 33.84 32.04 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 -2.01 1.32 0.04 0.00 2.02 -1.26 -1.16 118.70 117.64 1bi9 s GLU 50 Ca 0.10 -1.22 0.06 0.00 0.02 0.00 0.00 54.97 53.92 1bi9 s GLU 50 Cb -0.01 -1.67 -0.02 0.00 0.10 0.00 0.00 34.13 32.53 1bi9 s GLU 50 CO 0.01 0.40 -0.16 0.08 0.02 0.00 0.00 175.26 175.61 1bi9 s VAL 51 N -1.06 1.28 0.64 2.63 1.01 -0.33 -4.81 120.40 119.76 1bi9 s VAL 51 Ca 0.10 -1.03 -0.18 0.00 0.00 0.00 0.00 61.98 60.87 1bi9 s VAL 51 Cb -0.10 -1.14 -0.03 0.00 0.00 0.00 0.00 36.38 35.12 1bi9 s VAL 51 CO 0.05 0.09 1.02 0.00 0.00 0.00 0.00 175.10 176.25 1bi9 n GLN 52 N 1.94 0.84 -3.86 2.72 1.13 0.03 -1.33 117.38 118.85 1bi9 n GLN 52 Ca -0.17 0.33 -0.36 0.00 -1.94 0.00 0.00 57.00 54.86 1bi9 n GLN 52 Cb 0.54 -2.24 -0.13 0.00 0.11 0.00 0.00 30.24 28.52 1bi9 n GLN 52 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 1bi9 s GLU 53 N -3.00 3.13 0.59 -1.09 2.12 -0.90 -4.65 118.70 114.89 1bi9 s GLU 53 Ca 0.77 -0.81 -0.13 0.00 0.36 0.00 0.00 54.97 55.16 1bi9 s GLU 53 Cb -0.39 -3.16 -0.05 0.00 0.26 0.00 0.00 34.13 30.79 1bi9 s GLU 53 CO 0.46 -0.35 1.02 0.00 -0.54 0.00 0.00 175.26 175.85 1bi9 s ALA 54 N 1.45 3.05 0.18 6.30 0.00 -0.82 -4.66 121.76 127.25 1bi9 s ALA 54 Ca 0.03 0.04 -0.04 0.00 0.00 0.00 0.00 51.96 51.99 1bi9 s ALA 54 Cb -0.16 -3.11 0.02 0.00 0.00 0.00 0.00 23.12 19.87 1bi9 s ALA 54 CO -0.01 -0.57 0.31 -3.47 0.00 0.00 0.00 175.76 172.02 1bi9 n ASP 55 N -2.32 -0.88 -0.30 0.00 -0.08 -1.26 -4.45 116.55 107.25 1bi9 n ASP 55 Ca 0.06 -1.84 -0.08 0.00 -1.51 0.00 0.00 54.79 51.43 1bi9 n ASP 55 Cb 0.54 1.54 -0.07 0.00 2.34 0.00 0.00 41.12 45.46 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 -0.27 -0.31 -0.36 -0.67 4.76 -1.26 -0.80 118.16 119.25 1bi9 n LYS 56 Ca -0.02 1.21 0.09 0.00 -2.87 0.00 0.00 58.31 56.72 1bi9 n LYS 56 Cb 0.28 -1.78 0.26 0.00 -1.84 0.00 0.00 35.03 31.95 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 0.86 -0.24 -0.18 2.07 -1.99 -0.71 116.25 116.06 1bi9 h VAL 57 Ca 0.11 -0.32 -0.13 0.00 0.82 0.00 0.00 66.70 67.19 1bi9 h VAL 57 Cb 0.29 -0.15 -0.00 0.00 -1.52 0.00 0.00 31.29 29.91 1bi9 h VAL 57 CO -0.67 0.17 -0.34 0.44 0.02 0.00 0.00 177.57 177.19 1bi9 h ASP 58 N 0.93 0.72 -1.00 0.57 3.32 -1.35 -2.50 116.42 117.10 1bi9 h ASP 58 Ca 0.52 -0.51 0.06 0.00 0.02 0.00 0.00 57.03 57.12 1bi9 h ASP 58 Cb 0.60 -0.20 -0.07 0.00 0.22 0.00 0.00 39.33 39.88 1bi9 h ASP 58 CO -0.30 1.09 0.65 0.40 -1.72 0.00 0.00 179.24 179.36 1bi9 h ILE 59 N 0.37 1.10 -0.47 0.35 1.08 -0.53 -0.51 117.51 118.89 1bi9 h ILE 59 Ca 0.03 -0.41 0.01 0.00 -0.39 0.00 0.00 64.86 64.10 1bi9 h ILE 59 Cb 0.93 -0.19 -0.02 0.00 -3.07 0.00 0.00 36.82 34.47 1bi9 h ILE 59 CO 0.08 0.22 0.31 0.44 -0.69 0.00 0.00 178.15 178.50 1bi9 h ASP 60 N 1.18 0.52 0.13 1.72 5.19 -0.97 0.16 116.42 124.35 1bi9 h ASP 60 Ca 0.43 -0.01 -0.10 0.00 -0.62 0.00 0.00 57.03 56.72 1bi9 h ASP 60 Cb 0.15 -0.13 -0.01 0.00 0.18 0.00 0.00 39.33 39.52 1bi9 h ASP 60 CO -0.16 0.38 -0.36 0.11 -3.12 0.00 0.00 179.24 176.09 1bi9 h LYS 61 N 0.62 0.32 -0.51 3.56 1.57 -0.93 -1.92 116.57 119.29 1bi9 h LYS 61 Ca 0.18 -0.14 -0.09 0.00 -1.87 0.00 0.00 60.65 58.72 1bi9 h LYS 61 Cb -0.06 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.23 1bi9 h LYS 61 CO -0.05 0.64 -0.05 0.00 -0.57 0.00 0.00 179.45 179.43 1bi9 h ALA 62 N 1.35 0.69 -0.18 3.86 0.00 -0.31 -1.67 119.26 122.99 1bi9 h ALA 62 Ca 0.03 -0.31 -0.11 0.00 0.00 0.00 0.00 54.91 54.52 1bi9 h ALA 62 Cb 0.76 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1bi9 h ALA 62 CO 0.06 0.54 -0.35 0.28 0.00 0.00 0.00 179.25 179.78 1bi9 h VAL 63 N 0.79 1.29 -0.70 0.00 2.07 -0.52 -0.85 116.25 118.33 1bi9 h VAL 63 Ca 0.14 -1.43 -0.07 0.00 0.82 0.00 0.00 66.70 66.15 1bi9 h VAL 63 Cb 0.59 1.54 -0.03 0.00 -1.52 0.00 0.00 31.29 31.87 1bi9 h VAL 63 CO 0.04 0.44 0.15 1.56 0.02 0.00 0.00 177.57 179.77 1bi9 h GLN 64 N 0.32 1.14 0.07 1.57 4.20 -1.03 -0.55 115.11 120.83 1bi9 h GLN 64 Ca 0.04 -0.29 -0.00 0.00 0.06 0.00 0.00 58.65 58.45 1bi9 h GLN 64 Cb 0.77 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.41 1bi9 h GLN 64 CO 0.06 1.02 -0.03 0.00 -0.67 0.00 0.00 178.83 179.21 1bi9 h ALA 65 N 1.07 -0.09 -0.84 3.87 0.00 -0.92 -1.37 119.26 120.99 1bi9 h ALA 65 Ca 0.22 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1bi9 h ALA 65 Cb 0.41 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 1bi9 h ALA 65 CO 0.01 -0.45 0.53 0.00 0.00 0.00 0.00 179.25 179.33 1bi9 h ALA 66 N 0.63 1.07 0.38 0.00 0.00 -1.02 -1.10 119.26 119.21 1bi9 h ALA 66 Ca -0.01 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1bi9 h ALA 66 Cb 0.25 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1bi9 h ALA 66 CO 0.02 0.50 -0.34 -0.09 0.00 0.00 0.00 179.25 179.34 1bi9 h ARG 67 N 1.14 -0.70 -0.74 0.00 9.65 -0.98 -2.01 114.38 120.74 1bi9 h ARG 67 Ca 0.30 0.05 0.01 0.00 -1.10 0.00 0.00 59.98 59.24 1bi9 h ARG 67 Cb -0.09 0.16 -0.04 0.00 -1.39 0.00 0.00 29.97 28.62 1bi9 h ARG 67 CO -0.06 -0.47 0.48 1.25 2.80 0.00 0.00 179.97 183.97 1bi9 h LEU 68 N -0.73 0.85 0.00 3.80 5.85 -1.04 -0.07 115.31 123.97 1bi9 h LEU 68 Ca -0.03 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.66 1bi9 h LEU 68 Cb 0.65 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.46 1bi9 h LEU 68 CO -0.04 0.62 0.00 0.00 -0.34 0.00 0.00 178.44 178.69 1bi9 n ALA 69 N -2.42 1.80 0.37 1.25 0.00 -0.44 -2.74 120.51 118.34 1bi9 n ALA 69 Ca 0.08 -0.06 0.04 0.00 0.00 0.00 0.00 53.44 53.50 1bi9 n ALA 69 Cb 0.04 -1.27 -0.01 0.00 0.00 0.00 0.00 19.45 18.21 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 -1.44 0.00 -1.17 0.00 7.35 -0.11 -4.48 117.46 117.60 1bi9 n PHE 70 Ca 0.05 0.00 -0.33 0.00 -0.76 0.00 0.00 57.45 56.41 1bi9 n PHE 70 Cb 0.18 0.00 0.12 0.00 0.35 0.00 0.00 39.48 40.12 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 -1.32 3.83 0.40 -2.13 1.04 -0.75 -4.86 113.70 109.90 1bi9 s SER 71 Ca 0.06 2.23 0.25 0.00 0.48 0.00 0.00 55.95 58.97 1bi9 s SER 71 Cb 0.07 -2.57 1.39 0.00 0.10 0.00 0.00 66.02 65.00 1bi9 s SER 71 CO 0.23 -2.50 1.59 -0.07 0.98 0.00 0.00 173.24 173.47 1bi9 h LEU 72 N -0.92 0.28 0.04 2.42 3.38 -1.93 -1.36 115.31 117.23 1bi9 h LEU 72 Ca -0.46 0.21 -0.26 0.00 0.09 0.00 0.00 57.88 57.46 1bi9 h LEU 72 Cb 1.28 0.21 -0.03 0.00 0.09 0.00 0.00 40.66 42.21 1bi9 h LEU 72 CO 0.47 -0.33 -1.34 1.23 0.09 0.00 0.00 178.44 178.56 1bi9 h GLY 73 N 0.03 0.10 -0.82 0.83 0.00 -1.94 -3.44 103.07 97.83 1bi9 h GLY 73 Ca 0.85 -0.26 -0.11 0.00 0.00 0.00 0.00 47.33 47.81 1bi9 h GLY 73 CO -0.62 0.23 -0.13 -1.26 0.00 0.00 0.00 176.54 174.76 1bi9 n SER 74 N -3.32 -0.36 -0.16 0.19 2.88 -0.52 -4.56 113.62 107.77 1bi9 n SER 74 Ca -0.09 0.17 -0.08 0.00 -1.33 0.00 0.00 58.87 57.54 1bi9 n SER 74 Cb 1.00 -0.16 0.01 0.00 -0.75 0.00 0.00 64.21 64.31 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 0.12 1.15 0.00 2.46 2.07 -1.89 -1.37 116.25 118.79 1bi9 h VAL 75 Ca -0.06 -0.35 -0.02 0.00 0.82 0.00 0.00 66.70 67.09 1bi9 h VAL 75 Cb 0.25 0.53 -0.00 0.00 -1.52 0.00 0.00 31.29 30.55 1bi9 h VAL 75 CO 0.09 0.15 -0.11 -0.25 0.02 0.00 0.00 177.57 177.47 1bi9 h TRP 76 N 0.63 0.00 0.00 1.57 2.91 -1.89 0.73 115.95 119.89 1bi9 h TRP 76 Ca 0.17 0.00 -0.26 0.00 1.13 0.00 0.00 58.89 59.92 1bi9 h TRP 76 Cb 0.00 0.00 -0.04 0.00 -0.51 0.00 0.00 29.16 28.61 1bi9 h TRP 76 CO -0.03 0.11 -1.50 0.00 -1.03 0.00 0.00 178.44 175.99 1bi9 h ARG 77 N 0.00 0.00 0.00 2.65 2.47 -1.63 -3.35 114.38 114.52 1bi9 h ARG 77 Ca -0.00 0.00 -0.13 0.00 -1.26 0.00 0.00 59.98 58.59 1bi9 h ARG 77 Cb 0.31 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.61 1bi9 h ARG 77 CO 0.01 0.62 -1.29 0.00 0.56 0.00 0.00 179.97 179.87 1bi9 h ARG 78 N 0.00 0.00 -6.19 0.04 3.08 -1.01 -3.48 114.38 106.82 1bi9 h ARG 78 Ca -0.21 0.00 -0.63 0.00 0.07 0.00 0.00 59.98 59.21 1bi9 h ARG 78 Cb 1.93 0.00 0.12 0.00 0.08 0.00 0.00 29.97 32.11 1bi9 h ARG 78 CO 0.09 0.24 -0.39 -0.12 -1.07 0.00 0.00 179.97 178.72 1bi9 n MET 79 N -2.86 0.46 -2.34 0.04 1.56 0.23 -4.91 117.12 109.30 1bi9 n MET 79 Ca -0.07 0.16 -0.36 0.00 -0.27 0.00 0.00 57.70 57.16 1bi9 n MET 79 Cb 0.78 -1.32 -0.01 0.00 2.15 0.00 0.00 33.22 34.82 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 -0.88 6.15 0.19 6.12 1.01 -1.26 -4.91 116.67 123.08 1bi9 s ASP 80 Ca 0.62 2.18 -0.13 0.00 0.71 0.00 0.00 52.55 55.93 1bi9 s ASP 80 Cb -0.76 -2.59 0.18 0.00 1.01 0.00 0.00 42.92 40.76 1bi9 s ASP 80 CO 0.58 -0.93 1.74 0.00 0.21 0.00 0.00 175.17 176.77 1bi9 h ALA 81 N 1.80 0.60 -0.23 5.23 0.00 -1.90 0.71 119.26 125.47 1bi9 h ALA 81 Ca -0.49 0.08 0.07 0.00 0.00 0.00 0.00 54.91 54.56 1bi9 h ALA 81 Cb 1.24 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 1bi9 h ALA 81 CO 0.59 -0.25 0.27 0.66 0.00 0.00 0.00 179.25 180.53 1bi9 h SER 82 N 0.32 0.00 0.28 0.00 4.64 -1.91 -0.26 113.55 116.62 1bi9 h SER 82 Ca 0.25 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.33 1bi9 h SER 82 Cb 0.29 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.38 1bi9 h SER 82 CO -0.27 0.00 -0.97 -0.08 -0.87 0.00 0.00 176.83 174.64 1bi9 h GLU 83 N 0.00 0.46 -0.74 4.77 4.81 -1.22 -1.78 114.58 120.88 1bi9 h GLU 83 Ca 0.11 -0.50 -0.02 0.00 -0.13 0.00 0.00 59.36 58.82 1bi9 h GLU 83 Cb 0.65 0.14 -0.04 0.00 0.63 0.00 0.00 28.75 30.14 1bi9 h GLU 83 CO -0.00 1.15 0.40 0.00 -0.73 0.00 0.00 179.01 179.83 1bi9 h ARG 84 N 0.26 1.03 -0.59 1.92 3.08 -0.79 -0.87 114.38 118.42 1bi9 h ARG 84 Ca -0.09 -0.12 -0.04 0.00 0.07 0.00 0.00 59.98 59.80 1bi9 h ARG 84 Cb 1.61 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 31.43 1bi9 h ARG 84 CO 0.17 0.77 0.21 0.78 -1.07 0.00 0.00 179.97 180.83 1bi9 h GLY 85 N 1.08 0.96 1.62 0.04 0.00 -1.25 -1.54 103.07 103.99 1bi9 h GLY 85 Ca 0.26 -0.54 -0.01 0.00 0.00 0.00 0.00 47.33 47.04 1bi9 h GLY 85 CO -0.04 0.51 0.16 3.21 0.00 0.00 0.00 176.54 180.38 1bi9 h ARG 86 N 0.82 0.49 -0.22 4.80 2.47 -0.54 -1.29 114.38 120.91 1bi9 h ARG 86 Ca 0.19 -0.05 -0.20 0.00 -1.26 0.00 0.00 59.98 58.67 1bi9 h ARG 86 Cb 0.24 -0.10 0.00 0.00 -1.65 0.00 0.00 29.97 28.46 1bi9 h ARG 86 CO -0.01 0.39 -0.62 -0.07 0.56 0.00 0.00 179.97 180.22 1bi9 h LEU 87 N 0.50 0.93 -0.92 3.04 3.38 -0.62 0.10 115.31 121.72 1bi9 h LEU 87 Ca 0.13 -0.58 -0.07 0.00 0.09 0.00 0.00 57.88 57.45 1bi9 h LEU 87 Cb 0.07 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 1bi9 h LEU 87 CO -0.02 1.34 0.06 -0.07 0.09 0.00 0.00 178.44 179.85 1bi9 h LEU 88 N 0.57 0.81 -0.40 1.67 3.38 -0.89 -0.55 115.31 119.89 1bi9 h LEU 88 Ca -0.02 -0.18 -0.16 0.00 0.09 0.00 0.00 57.88 57.61 1bi9 h LEU 88 Cb 1.24 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.78 1bi9 h LEU 88 CO 0.13 0.84 -0.43 -0.78 0.09 0.00 0.00 178.44 178.29 1bi9 h ASP 89 N 0.81 0.95 -0.86 -0.43 3.58 -1.15 -1.65 116.42 117.66 1bi9 h ASP 89 Ca 0.16 -0.46 -0.02 0.00 0.42 0.00 0.00 57.03 57.14 1bi9 h ASP 89 Cb 0.39 -0.27 -0.04 0.00 1.72 0.00 0.00 39.33 41.13 1bi9 h ASP 89 CO 0.01 1.24 0.46 0.50 -2.88 0.00 0.00 179.24 178.58 1bi9 h LYS 90 N 0.71 1.21 -0.13 0.28 3.64 -0.55 -0.96 116.57 120.76 1bi9 h LYS 90 Ca 0.05 -0.15 -0.03 0.00 -1.27 0.00 0.00 60.65 59.25 1bi9 h LYS 90 Cb 1.02 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 32.60 1bi9 h LYS 90 CO 0.10 0.89 -0.05 1.25 -2.27 0.00 0.00 179.45 179.38 1bi9 h LEU 91 N 1.21 0.18 -0.70 5.20 5.85 -0.88 -1.47 115.31 124.69 1bi9 h LEU 91 Ca 0.30 -0.02 -0.12 0.00 0.84 0.00 0.00 57.88 58.88 1bi9 h LEU 91 Cb 0.05 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 1bi9 h LEU 91 CO -0.05 0.26 -0.31 0.00 -0.34 0.00 0.00 178.44 178.00 1bi9 h ALA 92 N 1.76 0.87 0.11 1.25 0.00 -0.24 -2.01 119.26 121.02 1bi9 h ALA 92 Ca 0.04 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 1bi9 h ALA 92 Cb 0.22 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1bi9 h ALA 92 CO 0.01 0.63 -0.05 -0.44 0.00 0.00 0.00 179.25 179.40 1bi9 h ASP 93 N 0.56 -0.13 -0.80 0.00 3.32 -0.30 -1.71 116.42 117.36 1bi9 h ASP 93 Ca 0.06 -0.07 0.01 0.00 0.02 0.00 0.00 57.03 57.05 1bi9 h ASP 93 Cb 0.81 0.03 -0.04 0.00 0.22 0.00 0.00 39.33 40.36 1bi9 h ASP 93 CO 0.07 -0.01 0.53 -0.07 -1.72 0.00 0.00 179.24 178.04 1bi9 h LEU 94 N -0.23 0.92 -1.28 1.55 3.38 -1.38 -0.21 115.31 118.06 1bi9 h LEU 94 Ca -0.02 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 1bi9 h LEU 94 Cb 0.19 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 1bi9 h LEU 94 CO 0.03 0.67 0.39 0.58 0.09 0.00 0.00 178.44 180.20 1bi9 h VAL 95 N 1.09 1.18 -0.44 1.22 2.07 -1.18 0.82 116.25 121.01 1bi9 h VAL 95 Ca 0.29 -0.41 -0.12 0.00 0.82 0.00 0.00 66.70 67.29 1bi9 h VAL 95 Cb -0.12 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 29.90 1bi9 h VAL 95 CO -0.06 0.19 -0.21 -0.08 0.02 0.00 0.00 177.57 177.43 1bi9 h GLU 96 N 0.90 0.89 0.19 1.57 4.57 -0.33 0.73 114.58 123.09 1bi9 h GLU 96 Ca 0.24 -0.36 -0.01 0.00 -1.18 0.00 0.00 59.36 58.04 1bi9 h GLU 96 Cb -0.03 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 28.52 1bi9 h GLU 96 CO -0.04 1.01 -0.09 -0.09 -1.18 0.00 0.00 179.01 178.62 1bi9 h ARG 97 N 0.77 -0.24 -0.93 1.92 2.43 0.23 -2.96 114.38 115.61 1bi9 h ARG 97 Ca 0.11 0.02 -0.35 0.00 -0.81 0.00 0.00 59.98 58.94 1bi9 h ARG 97 Cb 0.75 0.06 -0.21 0.00 -0.42 0.00 0.00 29.97 30.15 1bi9 h ARG 97 CO 0.06 -0.02 0.44 -0.25 -1.51 0.00 0.00 179.97 178.69 1bi9 n ASP 98 N -5.12 3.93 -0.13 -3.80 8.00 0.16 -4.55 116.55 115.04 1bi9 n ASP 98 Ca -0.09 -3.24 0.11 0.00 0.71 0.00 0.00 54.79 52.28 1bi9 n ASP 98 Cb 0.19 -0.76 0.46 0.00 -0.02 0.00 0.00 41.12 40.98 1bi9 n ASP 98 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 1bi9 h ARG 99 N 1.38 0.50 -0.32 -1.24 2.43 -0.67 -2.22 114.38 114.23 1bi9 h ARG 99 Ca 0.43 -0.03 -0.12 0.00 -0.81 0.00 0.00 59.98 59.45 1bi9 h ARG 99 Cb 2.42 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 31.85 1bi9 h ARG 99 CO 0.83 0.33 -0.25 0.00 -1.51 0.00 0.00 179.97 179.37 1bi9 h ALA 100 N 1.66 0.47 0.00 2.80 0.00 -1.84 -2.34 119.26 120.01 1bi9 h ALA 100 Ca 0.31 -0.39 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 1bi9 h ALA 100 Cb 0.52 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1bi9 h ALA 100 CO -0.10 0.46 -0.50 1.79 0.00 0.00 0.00 179.25 180.90 1bi9 h THR 101 N 0.51 0.90 -0.11 0.00 1.35 -1.85 -1.92 112.91 111.79 1bi9 h THR 101 Ca 0.06 -2.15 -0.20 0.00 -0.55 0.00 0.00 66.41 63.57 1bi9 h THR 101 Cb 0.81 2.36 0.00 0.00 -1.73 0.00 0.00 68.15 69.59 1bi9 h THR 101 CO 0.07 0.49 -0.76 -0.07 -0.25 0.00 0.00 175.52 175.00 1bi9 h LEU 102 N 0.00 0.67 -0.89 3.87 3.38 -1.41 -1.38 115.31 119.55 1bi9 h LEU 102 Ca -0.01 -0.44 -0.04 0.00 0.09 0.00 0.00 57.88 57.49 1bi9 h LEU 102 Cb 1.32 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.86 1bi9 h LEU 102 CO 0.07 1.21 -0.17 0.00 0.09 0.00 0.00 178.44 179.64 1bi9 h ALA 103 N 0.78 0.97 -0.12 1.53 0.00 -1.41 -0.96 119.26 120.06 1bi9 h ALA 103 Ca -0.04 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.65 1bi9 h ALA 103 Cb 1.36 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.12 1bi9 h ALA 103 CO 0.14 0.21 -0.17 1.15 0.00 0.00 0.00 179.25 180.58 1bi9 h THR 104 N 0.00 1.37 -0.50 0.00 2.02 -0.85 -1.11 112.91 113.84 1bi9 h THR 104 Ca -0.00 -1.41 -0.04 0.00 0.77 0.00 0.00 66.41 65.73 1bi9 h THR 104 Cb 0.80 2.02 -0.02 0.00 -1.74 0.00 0.00 68.15 69.21 1bi9 h THR 104 CO 0.02 0.41 0.14 0.24 0.37 0.00 0.00 175.52 176.70 1bi9 h MET 105 N -0.09 0.79 -0.17 6.66 2.07 -1.15 0.73 114.93 123.78 1bi9 h MET 105 Ca 0.01 -0.18 0.05 0.00 -2.07 0.00 0.00 59.70 57.51 1bi9 h MET 105 Cb 0.74 -0.11 -0.06 0.00 -1.87 0.00 0.00 31.60 30.30 1bi9 h MET 105 CO 0.04 0.75 -0.19 1.49 1.07 0.00 0.00 176.91 180.08 1bi9 h GLU 106 N 0.69 -0.21 -0.25 1.72 4.57 -1.10 0.70 114.58 120.70 1bi9 h GLU 106 Ca 0.16 0.01 -0.14 0.00 -1.18 0.00 0.00 59.36 58.21 1bi9 h GLU 106 Cb 0.30 0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.93 1bi9 h GLU 106 CO -0.00 -0.14 -0.44 1.03 -1.18 0.00 0.00 179.01 178.28 1bi9 h SER 107 N -0.22 0.67 0.52 1.04 0.87 -0.97 -0.07 113.55 115.39 1bi9 h SER 107 Ca 0.11 -0.31 -0.14 0.00 -1.23 0.00 0.00 61.79 60.22 1bi9 h SER 107 Cb 0.38 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.14 1bi9 h SER 107 CO -0.30 1.01 -0.63 0.25 -0.53 0.00 0.00 176.83 176.64 1bi9 h LEU 108 N 0.50 0.12 0.00 2.23 7.12 0.11 -0.22 115.31 125.17 1bi9 h LEU 108 Ca 0.04 -0.07 -0.37 0.00 0.13 0.00 0.00 57.88 57.60 1bi9 h LEU 108 Cb 0.96 -0.03 -0.07 0.00 -0.53 0.00 0.00 40.66 40.99 1bi9 h LEU 108 CO 0.09 0.71 -2.40 -3.20 -0.13 0.00 0.00 178.44 173.51 1bi9 n ASN 109 N -3.82 0.68 -0.68 1.25 5.15 0.24 -4.47 115.26 113.61 1bi9 n ASN 109 Ca -0.02 -0.04 0.09 0.00 -0.60 0.00 0.00 54.58 54.02 1bi9 n ASN 109 Cb 0.63 0.50 0.06 0.00 -0.53 0.00 0.00 39.78 40.45 1bi9 n ASN 109 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1bi9 n GLY 110 N 1.91 0.35 2.90 8.20 0.00 -0.04 -4.46 105.19 114.06 1bi9 n GLY 110 Ca -0.37 -0.53 -0.22 0.00 0.00 0.00 0.00 46.02 44.90 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 1.07 -0.51 3.86 -0.02 0.00 -0.10 -4.79 105.19 104.70 1bi9 n GLY 111 Ca 0.10 0.10 -0.36 0.00 0.00 0.00 0.00 46.02 45.86 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 -5.58 3.69 -0.10 1.61 2.20 -1.18 -3.75 119.74 116.63 1bi9 s LYS 112 Ca 0.25 0.13 -0.40 0.00 -0.36 0.00 0.00 55.97 55.59 1bi9 s LYS 112 Cb -0.11 -3.14 -0.18 0.00 -1.51 0.00 0.00 37.83 32.89 1bi9 s LYS 112 CO 0.31 0.68 1.39 -2.30 -0.36 0.00 0.00 175.35 175.07 1bi9 n PRO 113 N 1.54 0.67 0.00 4.03 -0.02 -1.26 -4.32 135.00 135.65 1bi9 n PRO 113 Ca -0.14 0.24 -0.09 0.00 -2.02 0.00 0.00 63.50 61.49 1bi9 n PRO 113 Cb 0.53 -1.84 -0.03 0.00 -0.02 0.00 0.00 33.50 32.14 1bi9 n PRO 113 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1bi9 h PHE 114 N 4.77 -0.34 -0.34 6.00 3.57 -1.27 -1.22 116.94 128.11 1bi9 h PHE 114 Ca -0.48 0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.13 1bi9 h PHE 114 Cb 1.36 0.17 -0.01 0.00 2.79 0.00 0.00 35.95 40.26 1bi9 h PHE 114 CO 0.64 -0.20 0.24 -0.07 -2.23 0.00 0.00 178.31 176.69 1bi9 h LEU 115 N -0.17 0.03 -0.06 0.59 3.38 -1.88 0.95 115.31 118.15 1bi9 h LEU 115 Ca 0.09 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.93 1bi9 h LEU 115 Cb 0.30 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 41.05 1bi9 h LEU 115 CO -0.22 0.02 -0.46 1.56 0.09 0.00 0.00 178.44 179.42 1bi9 h GLN 116 N 0.04 0.42 0.00 1.13 4.20 -1.68 0.59 115.11 119.81 1bi9 h GLN 116 Ca 0.16 -0.37 -0.02 0.00 0.06 0.00 0.00 58.65 58.48 1bi9 h GLN 116 Cb 0.59 0.09 -0.00 0.00 0.30 0.00 0.00 27.48 28.46 1bi9 h GLN 116 CO -0.01 1.02 -0.11 0.00 -0.67 0.00 0.00 178.83 179.06 1bi9 h ALA 117 N 0.41 1.73 0.13 3.87 0.00 -0.43 0.38 119.26 125.35 1bi9 h ALA 117 Ca -0.04 -0.10 -0.22 0.00 0.00 0.00 0.00 54.91 54.56 1bi9 h ALA 117 Cb 1.13 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.92 1bi9 h ALA 117 CO 0.09 0.13 -1.01 0.35 0.00 0.00 0.00 179.25 178.81 1bi9 h PHE 118 N 0.00 0.50 0.00 0.00 3.57 -0.69 -1.02 116.94 119.31 1bi9 h PHE 118 Ca -0.00 -0.36 -0.10 0.00 3.53 0.00 0.00 57.97 61.03 1bi9 h PHE 118 Cb 0.20 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 38.90 1bi9 h PHE 118 CO 0.00 1.39 -1.49 0.66 -2.23 0.00 0.00 178.31 176.64 1bi9 n TYR 119 N -4.07 0.70 0.00 0.41 4.01 0.18 -4.16 117.16 114.24 1bi9 n TYR 119 Ca -0.18 0.22 0.00 0.00 -0.16 0.00 0.00 57.90 57.78 1bi9 n TYR 119 Cb 0.84 -0.93 0.00 0.00 -0.31 0.00 0.00 39.34 38.95 1bi9 n TYR 119 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 1bi9 n ILE 120 N -2.69 0.00 -0.26 -0.72 5.41 0.13 -4.30 119.36 116.94 1bi9 n ILE 120 Ca -0.08 0.05 -0.08 0.00 1.00 0.00 0.00 62.75 63.64 1bi9 n ILE 120 Cb 0.73 -0.97 -0.07 0.00 -0.71 0.00 0.00 39.64 38.62 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 -1.48 0.54 4.38 5.19 -1.62 0.21 116.42 123.64 1bi9 h ASP 121 Ca 0.00 0.22 0.00 0.00 -0.62 0.00 0.00 57.03 56.63 1bi9 h ASP 121 Cb 0.00 0.65 0.00 0.00 0.18 0.00 0.00 39.33 40.16 1bi9 h ASP 121 CO 0.00 -0.18 0.00 -0.07 -3.12 0.00 0.00 179.24 175.87 1bi9 h LEU 122 N -0.05 0.00 -0.12 1.55 4.07 -1.38 -0.61 115.31 118.77 1bi9 h LEU 122 Ca 0.10 0.00 -0.12 0.00 0.08 0.00 0.00 57.88 57.94 1bi9 h LEU 122 Cb 0.31 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.06 1bi9 h LEU 122 CO -0.61 0.00 -0.41 -0.61 -1.08 0.00 0.00 178.44 175.73 1bi9 h GLN 123 N 0.00 0.49 -0.68 1.13 4.15 -0.81 -2.58 115.11 116.80 1bi9 h GLN 123 Ca 0.00 -0.36 -0.04 0.00 0.77 0.00 0.00 58.65 59.01 1bi9 h GLN 123 Cb 0.27 0.07 -0.03 0.00 0.21 0.00 0.00 27.48 27.99 1bi9 h GLN 123 CO 0.00 0.99 0.25 0.78 -1.93 0.00 0.00 178.83 178.92 1bi9 h GLY 124 N 0.08 1.11 0.56 2.39 0.00 0.09 0.22 103.07 107.53 1bi9 h GLY 124 Ca -0.02 -0.62 0.05 0.00 0.00 0.00 0.00 47.33 46.74 1bi9 h GLY 124 CO 0.09 0.58 0.03 -2.08 0.00 0.00 0.00 176.54 175.16 1bi9 h VAL 125 N 0.98 0.80 -0.23 4.60 2.07 -1.14 0.25 116.25 123.59 1bi9 h VAL 125 Ca 0.23 -0.04 -0.05 0.00 0.82 0.00 0.00 66.70 67.65 1bi9 h VAL 125 Cb 0.24 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 1bi9 h VAL 125 CO -0.02 0.02 -0.06 0.40 0.02 0.00 0.00 177.57 177.93 1bi9 h ILE 126 N 0.12 1.29 0.13 4.57 2.04 -1.16 -2.25 117.51 122.25 1bi9 h ILE 126 Ca 0.15 -1.08 0.01 0.00 1.00 0.00 0.00 64.86 64.94 1bi9 h ILE 126 Cb 0.18 1.53 -0.02 0.00 -0.74 0.00 0.00 36.82 37.77 1bi9 h ILE 126 CO -0.23 0.33 -0.15 0.11 0.00 0.00 0.00 178.15 178.21 1bi9 h LYS 127 N 0.17 -0.31 -0.34 2.37 1.79 -0.15 -0.61 116.57 119.49 1bi9 h LYS 127 Ca 0.06 0.02 -0.07 0.00 -2.18 0.00 0.00 60.65 58.47 1bi9 h LYS 127 Cb 0.53 0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 31.23 1bi9 h LYS 127 CO 0.02 -0.20 -0.10 1.79 -1.08 0.00 0.00 179.45 179.88 1bi9 h THR 128 N -0.32 1.23 0.12 -0.16 1.35 -0.55 0.14 112.91 114.72 1bi9 h THR 128 Ca 0.01 -1.03 -0.01 0.00 -0.55 0.00 0.00 66.41 64.84 1bi9 h THR 128 Cb 0.31 1.09 0.00 0.00 -1.73 0.00 0.00 68.15 67.82 1bi9 h THR 128 CO -0.06 0.34 -0.06 -0.07 -0.25 0.00 0.00 175.52 175.43 1bi9 h LEU 129 N 0.53 -0.14 -0.77 3.87 3.38 -1.15 -1.32 115.31 119.72 1bi9 h LEU 129 Ca 0.10 -0.04 0.04 0.00 0.09 0.00 0.00 57.88 58.06 1bi9 h LEU 129 Cb 0.49 0.04 -0.05 0.00 0.09 0.00 0.00 40.66 41.23 1bi9 h LEU 129 CO 0.03 -0.05 0.49 0.03 0.09 0.00 0.00 178.44 179.02 1bi9 h ARG 130 N -0.22 0.91 -0.16 1.13 2.47 -0.74 -2.17 114.38 115.60 1bi9 h ARG 130 Ca -0.02 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.65 1bi9 h ARG 130 Cb 0.17 -0.21 -0.01 0.00 -1.65 0.00 0.00 29.97 28.28 1bi9 h ARG 130 CO 0.03 0.60 0.10 -0.92 0.56 0.00 0.00 179.97 180.34 1bi9 h TYR 131 N 0.94 0.19 0.00 3.04 3.20 -0.39 -2.56 116.97 121.38 1bi9 h TYR 131 Ca 0.31 0.01 -0.05 0.00 3.14 0.00 0.00 58.73 62.14 1bi9 h TYR 131 Cb 0.04 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.24 1bi9 h TYR 131 CO -0.04 0.12 -0.21 1.88 -1.64 0.00 0.00 178.16 178.27 1bi9 h TYR 132 N 0.20 0.00 -0.83 -3.82 0.05 -1.10 -2.91 116.97 108.56 1bi9 h TYR 132 Ca 0.06 0.00 0.04 0.00 0.05 0.00 0.00 58.73 58.88 1bi9 h TYR 132 Cb -0.02 0.00 -0.05 0.00 1.01 0.00 0.00 36.73 37.67 1bi9 h TYR 132 CO -0.07 0.21 0.53 0.00 -1.05 0.00 0.00 178.16 177.78 1bi9 h ALA 133 N 1.79 1.09 0.00 3.88 0.00 -0.98 0.86 119.26 125.90 1bi9 h ALA 133 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1bi9 h ALA 133 Cb 0.80 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1bi9 h ALA 133 CO 0.03 0.34 0.00 0.41 0.00 0.00 0.00 179.25 180.03 1bi9 n GLY 134 N -1.32 -1.30 0.08 0.00 0.00 -1.10 -3.20 105.19 98.34 1bi9 n GLY 134 Ca 0.10 -0.01 -0.09 0.00 0.00 0.00 0.00 46.02 46.02 1bi9 n GLY 134 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1bi9 h TRP 135 N 0.00 0.03 -0.91 1.61 -0.00 -0.83 -3.41 115.95 112.44 1bi9 h TRP 135 Ca 0.00 -0.02 0.17 0.00 -0.00 0.00 0.00 58.89 59.04 1bi9 h TRP 135 Cb 0.41 -0.00 -0.16 0.00 -0.00 0.00 0.00 29.16 29.41 1bi9 h TRP 135 CO 0.00 1.04 -0.27 0.00 -0.00 0.00 0.00 178.44 179.21 1bi9 n ALA 136 N -2.52 0.12 -0.85 1.49 0.00 -0.98 0.00 120.51 117.77 1bi9 n ALA 136 Ca -0.13 0.97 0.03 0.00 0.00 0.00 0.00 53.44 54.31 1bi9 n ALA 136 Cb 1.02 -0.54 0.36 0.00 0.00 0.00 0.00 19.45 20.30 1bi9 n ALA 136 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1bi9 n ASP 137 N -5.44 5.33 -0.43 0.00 5.68 -1.26 -4.28 116.55 116.15 1bi9 n ASP 137 Ca 0.13 -2.97 0.07 0.00 -0.50 0.00 0.00 54.79 51.52 1bi9 n ASP 137 Cb 0.43 -0.70 0.14 0.00 -1.14 0.00 0.00 41.12 39.84 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 0.39 1.11 -3.25 0.11 5.02 0.10 -4.96 118.16 116.68 1bi9 n LYS 138 Ca 0.30 -2.58 -0.43 0.00 -2.02 0.00 0.00 58.31 53.59 1bi9 n LYS 138 Cb 1.22 -1.28 -0.08 0.00 -0.02 0.00 0.00 35.03 34.87 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 -2.39 5.01 0.28 -0.18 1.01 -1.22 -5.05 121.20 118.66 1bi9 s ILE 139 Ca 0.30 -0.32 0.07 0.00 0.00 0.00 0.00 60.65 60.71 1bi9 s ILE 139 Cb 0.29 -4.12 -0.03 0.00 0.01 0.00 0.00 42.46 38.60 1bi9 s ILE 139 CO -0.03 -0.53 0.23 -1.00 0.00 0.00 0.00 174.94 173.62 1bi9 s HIS 140 N 2.33 3.06 0.00 3.97 3.76 -1.26 -4.86 115.29 122.28 1bi9 s HIS 140 Ca 0.14 -0.16 0.00 0.00 -0.15 0.00 0.00 55.06 54.89 1bi9 s HIS 140 Cb -0.17 -1.52 0.00 0.00 1.11 0.00 0.00 32.58 32.00 1bi9 s HIS 140 CO 0.14 0.42 0.00 0.41 -0.85 0.00 0.00 174.74 174.86 1bi9 n GLY 141 N -1.24 3.25 3.40 -2.22 0.00 -1.26 -4.79 105.19 102.34 1bi9 n GLY 141 Ca -0.06 -2.17 -0.20 0.00 0.00 0.00 0.00 46.02 43.59 1bi9 n GLY 141 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1bi9 s MET 142 N -1.87 1.63 -0.11 1.61 -1.94 -1.13 -4.93 119.30 112.56 1bi9 s MET 142 Ca 0.00 -1.93 0.02 0.00 -1.71 0.00 0.00 55.69 52.07 1bi9 s MET 142 Cb 0.00 -0.50 0.01 0.00 2.01 0.00 0.00 34.83 36.36 1bi9 s MET 142 CO 0.00 -0.33 -0.16 0.95 -0.01 0.00 0.00 175.02 175.47 1bi9 s THR 143 N -3.47 1.58 -0.06 2.05 -4.23 -1.26 0.01 115.64 110.26 1bi9 s THR 143 Ca 0.34 -0.69 0.03 0.00 -1.18 0.00 0.00 61.69 60.18 1bi9 s THR 143 Cb 0.06 -1.43 -0.03 0.00 1.34 0.00 0.00 72.50 72.45 1bi9 s THR 143 CO 0.15 0.46 -0.12 -0.63 -0.54 0.00 0.00 174.62 173.94 1bi9 s ILE 144 N 0.94 3.26 -0.60 2.99 -1.09 -0.78 -4.99 121.20 120.93 1bi9 s ILE 144 Ca -0.07 -0.65 -0.25 0.00 -2.23 0.00 0.00 60.65 57.45 1bi9 s ILE 144 Cb -0.15 -2.30 0.04 0.00 -1.58 0.00 0.00 42.46 38.47 1bi9 s ILE 144 CO -0.01 0.59 1.05 -2.16 -1.23 0.00 0.00 174.94 173.18 1bi9 s PRO 145 N -0.70 3.31 -0.06 2.79 0.04 -1.26 -4.06 135.00 135.06 1bi9 s PRO 145 Ca 0.11 -0.25 -0.04 0.00 0.04 0.00 0.00 61.00 60.86 1bi9 s PRO 145 Cb -0.11 -4.09 -0.04 0.00 0.04 0.00 0.00 34.50 30.30 1bi9 s PRO 145 CO 0.01 -1.68 0.13 0.08 0.04 0.00 0.00 177.00 175.58 1bi9 s VAL 146 N 4.45 5.23 0.65 -0.36 1.01 -1.26 -5.07 120.40 125.04 1bi9 s VAL 146 Ca 0.32 -0.08 -0.18 0.00 0.00 0.00 0.00 61.98 62.05 1bi9 s VAL 146 Cb -0.11 -3.35 -0.02 0.00 0.00 0.00 0.00 36.38 32.89 1bi9 s VAL 146 CO 0.18 0.46 1.11 0.47 0.00 0.00 0.00 175.10 177.33 1bi9 n ASP 147 N 1.47 1.30 0.00 3.32 8.00 -1.26 -4.64 116.55 124.74 1bi9 n ASP 147 Ca -0.15 0.79 0.00 0.00 0.71 0.00 0.00 54.79 56.14 1bi9 n ASP 147 Cb 0.54 -1.47 0.00 0.00 -0.02 0.00 0.00 41.12 40.17 1bi9 n ASP 147 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1bi9 n GLY 148 N 1.10 0.03 2.40 0.44 0.00 -1.26 -4.58 105.19 103.31 1bi9 n GLY 148 Ca 0.15 -1.79 -0.38 0.00 0.00 0.00 0.00 46.02 44.00 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 -0.99 7.73 -4.34 1.61 8.00 -1.26 -4.80 116.55 122.49 1bi9 n ASP 149 Ca 0.00 -2.60 -0.18 0.00 0.71 0.00 0.00 54.79 52.73 1bi9 n ASP 149 Cb 0.00 -1.54 -0.10 0.00 -0.02 0.00 0.00 41.12 39.46 1bi9 n ASP 149 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1bi9 s TYR 150 N 2.44 1.61 -0.15 1.24 2.02 -1.26 -1.52 117.35 121.73 1bi9 s TYR 150 Ca 0.64 -0.82 -0.04 0.00 -0.37 0.00 0.00 57.07 56.49 1bi9 s TYR 150 Cb 0.17 -0.90 0.05 0.00 -0.40 0.00 0.00 41.96 40.88 1bi9 s TYR 150 CO -0.06 0.08 0.07 0.12 -1.57 0.00 0.00 175.55 174.18 1bi9 s PHE 151 N -3.28 0.41 0.14 2.71 5.36 -0.15 -4.72 117.98 118.45 1bi9 s PHE 151 Ca 0.26 -0.35 0.09 0.00 -0.96 0.00 0.00 56.93 55.97 1bi9 s PHE 151 Cb 0.04 -0.75 -0.04 0.00 -0.34 0.00 0.00 43.02 41.93 1bi9 s PHE 151 CO 0.08 -0.48 -0.15 0.95 -1.46 0.00 0.00 175.22 174.16 1bi9 s THR 152 N 2.06 2.96 0.22 0.12 -4.23 -1.26 0.78 115.64 116.30 1bi9 s THR 152 Ca 0.02 -1.57 -0.12 0.00 -1.18 0.00 0.00 61.69 58.84 1bi9 s THR 152 Cb -0.15 -2.40 -0.00 0.00 1.34 0.00 0.00 72.50 71.28 1bi9 s THR 152 CO -0.08 0.02 0.42 0.72 -0.54 0.00 0.00 174.62 175.16 1bi9 s PHE 153 N -1.37 0.39 -0.01 3.99 -0.12 0.06 -1.86 117.98 119.06 1bi9 s PHE 153 Ca 0.21 -0.74 0.01 0.00 -0.05 0.00 0.00 56.93 56.36 1bi9 s PHE 153 Cb -0.10 0.11 0.00 0.00 -0.63 0.00 0.00 43.02 42.40 1bi9 s PHE 153 CO 0.12 -0.91 -0.04 0.95 -0.05 0.00 0.00 175.22 175.29 1bi9 s THR 154 N -4.01 0.32 0.09 -4.49 -4.23 0.10 -0.97 115.64 102.45 1bi9 s THR 154 Ca 0.22 -0.14 0.04 0.00 -1.18 0.00 0.00 61.69 60.62 1bi9 s THR 154 Cb 0.01 -0.29 -0.04 0.00 1.34 0.00 0.00 72.50 73.52 1bi9 s THR 154 CO 0.07 0.10 0.04 -0.13 -0.54 0.00 0.00 174.62 174.16 1bi9 s ARG 155 N 0.07 2.70 -0.40 3.99 0.52 0.67 -2.83 118.95 123.68 1bi9 s ARG 155 Ca -0.00 -0.79 -0.07 0.00 -0.52 0.00 0.00 55.73 54.35 1bi9 s ARG 155 Cb -0.03 -2.62 0.08 0.00 0.52 0.00 0.00 34.95 32.89 1bi9 s ARG 155 CO -0.00 0.54 0.21 -1.01 0.02 0.00 0.00 175.30 175.06 1bi9 s HIS 156 N -1.38 3.37 0.20 -0.53 3.76 -1.26 -1.41 115.29 118.03 1bi9 s HIS 156 Ca 0.28 -1.72 0.07 0.00 -0.15 0.00 0.00 55.06 53.53 1bi9 s HIS 156 Cb -0.12 -2.85 -0.04 0.00 1.11 0.00 0.00 32.58 30.69 1bi9 s HIS 156 CO 0.20 -0.85 0.11 -1.21 -0.85 0.00 0.00 174.74 172.13 1bi9 s GLU 157 N 1.35 2.73 0.88 1.40 2.02 -0.74 -4.93 118.70 121.41 1bi9 s GLU 157 Ca 0.03 -1.03 -0.10 0.00 0.02 0.00 0.00 54.97 53.88 1bi9 s GLU 157 Cb -0.22 -2.51 0.12 0.00 0.10 0.00 0.00 34.13 31.62 1bi9 s GLU 157 CO 0.01 0.44 1.12 -1.25 0.02 0.00 0.00 175.26 175.60 1bi9 s PRO 158 N -3.32 1.33 -0.01 0.39 0.04 -1.25 -0.81 135.00 131.37 1bi9 s PRO 158 Ca 0.31 1.38 -0.14 0.00 0.04 0.00 0.00 61.00 62.59 1bi9 s PRO 158 Cb -0.09 -1.78 -0.33 0.00 0.04 0.00 0.00 34.50 32.34 1bi9 s PRO 158 CO 0.22 -2.36 0.82 0.82 0.04 0.00 0.00 177.00 176.55 1bi9 h ILE 159 N -1.66 1.10 0.00 0.56 2.04 -1.89 -3.41 117.51 114.25 1bi9 h ILE 159 Ca -0.44 -2.60 0.00 0.00 1.00 0.00 0.00 64.86 62.82 1bi9 h ILE 159 Cb 1.26 2.90 0.00 0.00 -0.74 0.00 0.00 36.82 40.24 1bi9 h ILE 159 CO 0.45 0.84 0.00 0.61 0.00 0.00 0.00 178.15 180.05 1bi9 n GLY 160 N 1.80 0.51 3.65 5.37 0.00 -1.26 -4.95 105.19 110.30 1bi9 n GLY 160 Ca -0.21 -1.02 -0.41 0.00 0.00 0.00 0.00 46.02 44.38 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 4.90 -0.19 1.61 1.01 -1.26 -1.60 120.40 124.87 1bi9 s VAL 161 Ca 0.00 1.45 -0.04 0.00 0.00 0.00 0.00 61.98 63.39 1bi9 s VAL 161 Cb 0.00 -4.06 -0.02 0.00 0.00 0.00 0.00 36.38 32.30 1bi9 s VAL 161 CO 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 175.10 175.06 1bi9 s GLY 163 N 1.01 2.64 -0.02 0.00 0.00 0.24 -1.67 107.32 109.52 1bi9 s GLY 163 Ca 0.01 -0.00 0.01 0.00 0.00 0.00 0.00 44.72 44.73 1bi9 s GLY 163 CO 0.01 0.41 -0.03 1.20 0.00 0.00 0.00 173.10 174.69 1bi9 s GLN 164 N -1.16 0.38 -0.07 2.90 -0.21 -0.59 -0.21 119.66 120.68 1bi9 s GLN 164 Ca 0.29 -0.06 -0.01 0.00 0.02 0.00 0.00 55.36 55.60 1bi9 s GLN 164 Cb -0.19 -0.43 0.03 0.00 1.00 0.00 0.00 33.01 33.41 1bi9 s GLN 164 CO 0.18 -0.01 -0.03 0.42 -2.12 0.00 0.00 175.29 173.73 1bi9 s ILE 165 N 0.42 0.57 0.16 1.08 1.01 -0.39 0.22 121.20 124.27 1bi9 s ILE 165 Ca -0.04 -0.04 0.05 0.00 0.00 0.00 0.00 60.65 60.62 1bi9 s ILE 165 Cb -0.07 -0.66 -0.04 0.00 0.01 0.00 0.00 42.46 41.69 1bi9 s ILE 165 CO -0.01 0.28 -0.11 0.27 0.00 0.00 0.00 174.94 175.37 1bi9 s ILE 166 N 1.64 1.31 0.33 2.92 -0.00 -1.16 -2.39 121.20 123.85 1bi9 s ILE 166 Ca 0.01 -2.10 -0.05 0.00 -0.00 0.00 0.00 60.65 58.51 1bi9 s ILE 166 Cb -0.13 -1.90 0.07 0.00 -0.00 0.00 0.00 42.46 40.51 1bi9 s ILE 166 CO -0.04 -0.71 0.45 -0.81 -0.00 0.00 0.00 174.94 173.83 1bi9 n PRO 167 N -0.24 -0.28 0.00 0.37 -0.04 -1.23 -2.76 135.00 130.81 1bi9 n PRO 167 Ca -0.10 -0.80 0.12 0.00 -0.04 0.00 0.00 63.50 62.69 1bi9 n PRO 167 Cb 0.61 -0.44 0.30 0.00 -0.04 0.00 0.00 33.50 33.93 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 -2.49 0.00 -0.11 0.54 4.27 -1.26 -4.35 117.44 114.03 1bi9 n TRP 168 Ca 0.06 0.00 -0.06 0.00 -3.89 0.00 0.00 57.50 53.61 1bi9 n TRP 168 Cb 0.21 -0.16 0.02 0.00 -1.36 0.00 0.00 31.31 30.02 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 0.76 0.23 -1.68 -0.67 2.35 -1.96 -3.34 115.58 111.26 1bi9 h ASN 169 Ca 0.00 0.03 -0.47 0.00 -0.55 0.00 0.00 56.30 55.31 1bi9 h ASN 169 Cb 0.51 -0.01 -0.36 0.00 0.05 0.00 0.00 38.32 38.52 1bi9 h ASN 169 CO 0.00 0.17 -1.05 0.49 -1.65 0.00 0.00 177.43 175.39 1bi9 n PHE 170 N -4.96 -0.54 -0.23 1.19 3.01 -1.26 -5.02 117.46 109.65 1bi9 n PHE 170 Ca 0.01 -3.43 -0.06 0.00 1.01 0.00 0.00 57.45 54.98 1bi9 n PHE 170 Cb 0.11 -0.07 -0.06 0.00 -0.01 0.00 0.00 39.48 39.46 1bi9 n PHE 170 CO 0.00 0.00 0.00 -2.30 1.01 0.00 0.00 176.76 175.47 1bi9 n PRO 171 N 0.78 -0.24 -0.07 -1.08 -0.02 -1.26 0.05 135.00 133.17 1bi9 n PRO 171 Ca 0.21 0.90 -0.15 0.00 -2.02 0.00 0.00 63.50 62.44 1bi9 n PRO 171 Cb 0.62 -1.33 -0.05 0.00 -0.02 0.00 0.00 33.50 32.72 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 0.92 0.01 2.45 5.85 -1.94 -2.36 115.31 120.24 1bi9 h LEU 172 Ca 0.09 -0.54 0.00 0.00 0.84 0.00 0.00 57.88 58.27 1bi9 h LEU 172 Cb 0.23 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 40.99 1bi9 h LEU 172 CO -0.52 1.29 -0.02 -0.07 -0.34 0.00 0.00 178.44 178.78 1bi9 h LEU 173 N 0.58 -0.06 -0.35 2.25 3.38 -1.49 -1.31 115.31 118.30 1bi9 h LEU 173 Ca 0.01 0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.04 1bi9 h LEU 173 Cb 1.14 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.87 1bi9 h LEU 173 CO 0.12 -0.04 0.08 0.24 0.09 0.00 0.00 178.44 178.93 1bi9 h MET 174 N -0.05 0.20 -0.50 1.13 2.86 -0.40 0.12 114.93 118.30 1bi9 h MET 174 Ca 0.01 -0.01 0.05 0.00 -2.06 0.00 0.00 59.70 57.68 1bi9 h MET 174 Cb 0.05 -0.05 -0.04 0.00 0.06 0.00 0.00 31.60 31.62 1bi9 h MET 174 CO -0.02 0.13 0.25 0.35 1.06 0.00 0.00 176.91 178.68 1bi9 h PHE 175 N 0.21 0.46 -0.34 -0.22 3.04 -1.27 -2.29 116.94 116.53 1bi9 h PHE 175 Ca 0.16 0.02 -0.05 0.00 3.98 0.00 0.00 57.97 62.09 1bi9 h PHE 175 Cb 0.18 -0.13 -0.01 0.00 2.56 0.00 0.00 35.95 38.54 1bi9 h PHE 175 CO -0.18 0.22 0.02 1.15 -2.02 0.00 0.00 178.31 177.50 1bi9 h THR 176 N 0.49 1.25 0.00 4.41 2.02 -0.67 -1.22 112.91 119.19 1bi9 h THR 176 Ca 0.22 -0.91 -0.01 0.00 0.77 0.00 0.00 66.41 66.48 1bi9 h THR 176 Cb 0.14 1.19 -0.00 0.00 -1.74 0.00 0.00 68.15 67.74 1bi9 h THR 176 CO -0.16 0.30 -0.05 -0.50 0.37 0.00 0.00 175.52 175.48 1bi9 h TRP 177 N 0.40 0.00 0.08 3.16 6.55 -0.47 -1.41 115.95 124.25 1bi9 h TRP 177 Ca 0.10 0.00 -0.32 0.00 0.95 0.00 0.00 58.89 59.62 1bi9 h TRP 177 Cb 0.41 0.00 -0.03 0.00 -0.86 0.00 0.00 29.16 28.69 1bi9 h TRP 177 CO 0.03 0.05 -1.74 0.87 -1.05 0.00 0.00 178.44 176.59 1bi9 h LYS 178 N 0.00 0.16 0.48 0.49 1.57 -1.28 -3.39 116.57 114.61 1bi9 h LYS 178 Ca -0.00 -0.28 -0.02 0.00 -1.87 0.00 0.00 60.65 58.48 1bi9 h LYS 178 Cb 0.09 0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.51 1bi9 h LYS 178 CO 0.01 0.93 -0.23 0.82 -0.57 0.00 0.00 179.45 180.40 1bi9 h ILE 179 N 0.04 0.00 -0.59 1.86 1.08 -0.85 -3.23 117.51 115.83 1bi9 h ILE 179 Ca -0.32 -0.46 0.08 0.00 -0.39 0.00 0.00 64.86 63.78 1bi9 h ILE 179 Cb 2.02 0.00 -0.10 0.00 -3.07 0.00 0.00 36.82 35.66 1bi9 h ILE 179 CO 0.11 0.00 -0.46 0.00 -0.69 0.00 0.00 178.15 177.10 1bi9 h ALA 180 N -1.24 -0.40 -0.97 1.87 0.00 -1.50 0.05 119.26 117.07 1bi9 h ALA 180 Ca -0.07 0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.95 1bi9 h ALA 180 Cb 0.50 1.02 -0.05 0.00 0.00 0.00 0.00 17.79 19.25 1bi9 h ALA 180 CO 0.11 -0.87 0.63 -1.35 0.00 0.00 0.00 179.25 177.77 1bi9 h PRO 181 N -0.23 1.28 -0.20 0.00 0.11 -1.75 0.61 132.00 131.82 1bi9 h PRO 181 Ca 0.17 -0.08 -0.11 0.00 0.11 0.00 0.00 66.00 66.08 1bi9 h PRO 181 Cb 0.56 -0.29 -0.00 0.00 0.11 0.00 0.00 31.00 31.38 1bi9 h PRO 181 CO -0.70 0.86 -0.32 0.00 -0.21 0.00 0.00 178.00 177.62 1bi9 h ALA 182 N 1.35 0.31 -0.38 -0.75 0.00 -1.38 -2.42 119.26 115.99 1bi9 h ALA 182 Ca 0.35 -0.42 -0.16 0.00 0.00 0.00 0.00 54.91 54.69 1bi9 h ALA 182 Cb -0.14 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1bi9 h ALA 182 CO -0.07 0.35 -0.37 -0.07 0.00 0.00 0.00 179.25 179.08 1bi9 h LEU 183 N 0.25 0.97 -0.94 0.00 3.38 -0.96 -1.29 115.31 116.73 1bi9 h LEU 183 Ca 0.02 -0.44 0.21 0.00 0.09 0.00 0.00 57.88 57.75 1bi9 h LEU 183 Cb 0.91 -0.27 -0.12 0.00 0.09 0.00 0.00 40.66 41.27 1bi9 h LEU 183 CO 0.07 1.23 0.50 0.00 0.09 0.00 0.00 178.44 180.34 1bi9 n GLY 186 N 1.47 1.04 3.95 0.00 0.00 0.38 -3.87 105.19 108.15 1bi9 n GLY 186 Ca 0.07 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.00 3.43 0.17 1.61 0.01 -0.51 -4.84 114.94 112.81 1bi9 s ASN 187 Ca 0.00 0.11 0.11 0.00 -0.71 0.00 0.00 52.86 52.37 1bi9 s ASN 187 Cb 0.00 -0.23 -0.04 0.00 0.41 0.00 0.00 41.25 41.39 1bi9 s ASN 187 CO 0.00 -2.51 -0.24 0.42 -1.51 0.00 0.00 177.10 173.26 1bi9 s THR 188 N -3.70 2.39 0.01 1.60 -4.23 -0.63 -4.64 115.64 106.44 1bi9 s THR 188 Ca 0.72 -1.90 0.05 0.00 -1.18 0.00 0.00 61.69 59.38 1bi9 s THR 188 Cb -0.04 -2.12 -0.02 0.00 1.34 0.00 0.00 72.50 71.66 1bi9 s THR 188 CO 0.51 -0.04 -0.17 -0.69 -0.54 0.00 0.00 174.62 173.69 1bi9 s VAL 189 N -1.46 1.34 -0.39 2.29 1.01 0.22 -1.13 120.40 122.29 1bi9 s VAL 189 Ca 0.19 -0.86 0.02 0.00 0.00 0.00 0.00 61.98 61.33 1bi9 s VAL 189 Cb -0.09 -1.15 0.12 0.00 0.00 0.00 0.00 36.38 35.26 1bi9 s VAL 189 CO 0.09 0.27 0.16 -0.69 0.00 0.00 0.00 175.10 174.93 1bi9 s VAL 190 N -0.56 1.63 -0.14 2.92 1.01 -0.67 -0.15 120.40 124.44 1bi9 s VAL 190 Ca 0.06 -2.29 -0.04 0.00 0.00 0.00 0.00 61.98 59.70 1bi9 s VAL 190 Cb -0.07 -2.17 -0.03 0.00 0.00 0.00 0.00 36.38 34.10 1bi9 s VAL 190 CO 0.00 -0.75 0.01 -0.51 0.00 0.00 0.00 175.10 173.85 1bi9 s ILE 191 N 0.74 4.33 -0.40 2.22 2.07 0.49 -1.55 121.20 129.11 1bi9 s ILE 191 Ca 0.14 -0.21 -0.04 0.00 -1.41 0.00 0.00 60.65 59.13 1bi9 s ILE 191 Cb -0.21 -2.89 0.10 0.00 0.13 0.00 0.00 42.46 39.58 1bi9 s ILE 191 CO -0.09 0.52 0.19 -0.75 -1.91 0.00 0.00 174.94 172.91 1bi9 s LYS 192 N -0.07 2.17 1.11 3.50 2.36 0.13 -1.50 119.74 127.44 1bi9 s LYS 192 Ca 0.04 -1.69 -0.15 0.00 -2.55 0.00 0.00 55.97 51.61 1bi9 s LYS 192 Cb -0.13 -3.58 0.24 0.00 -1.05 0.00 0.00 37.83 33.32 1bi9 s LYS 192 CO 0.02 -1.00 1.09 -1.25 1.55 0.00 0.00 175.35 175.76 1bi9 s PRO 193 N 1.21 -0.47 0.75 4.03 0.04 -1.26 -2.99 135.00 136.31 1bi9 s PRO 193 Ca 0.06 0.26 -0.11 0.00 0.04 0.00 0.00 61.00 61.25 1bi9 s PRO 193 Cb -0.23 -1.65 0.05 0.00 0.04 0.00 0.00 34.50 32.70 1bi9 s PRO 193 CO -0.03 -3.28 1.09 0.00 0.04 0.00 0.00 177.00 174.83 1bi9 s ALA 194 N -2.94 2.31 0.21 8.56 0.00 -1.11 -4.49 121.76 124.30 1bi9 s ALA 194 Ca 0.68 0.30 0.13 0.00 0.00 0.00 0.00 51.96 53.07 1bi9 s ALA 194 Cb -0.15 -3.27 0.43 0.00 0.00 0.00 0.00 23.12 20.12 1bi9 s ALA 194 CO 0.57 -1.66 1.63 1.05 0.00 0.00 0.00 175.76 177.35 1bi9 h GLU 195 N -0.93 0.00 0.00 0.00 9.09 -1.91 -3.16 114.58 117.68 1bi9 h GLU 195 Ca -0.44 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.97 1bi9 h GLU 195 Cb 1.23 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.33 1bi9 h GLU 195 CO 0.52 0.55 -0.41 -0.56 0.05 0.00 0.00 179.01 179.16 1bi9 h GLN 196 N 0.00 0.00 -2.04 1.06 -0.00 -1.93 -3.40 115.11 108.79 1bi9 h GLN 196 Ca -0.01 0.00 -0.53 0.00 -0.00 0.00 0.00 58.65 58.12 1bi9 h GLN 196 Cb 1.07 0.00 -0.40 0.00 -0.00 0.00 0.00 27.48 28.15 1bi9 h GLN 196 CO 0.07 0.00 -1.07 0.25 -0.00 0.00 0.00 178.83 178.08 1bi9 n THR 197 N -2.76 0.14 0.35 1.86 -2.24 -1.20 -4.70 114.28 105.73 1bi9 n THR 197 Ca 0.03 -4.53 0.12 0.00 -2.27 0.00 0.00 64.05 57.40 1bi9 n THR 197 Cb 0.52 -1.10 0.06 0.00 -2.10 0.00 0.00 70.33 67.71 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 0.66 0.44 0.25 -0.78 -0.04 -1.20 -4.37 135.00 129.96 1bi9 n PRO 198 Ca 0.25 0.08 -0.10 0.00 -0.04 0.00 0.00 63.50 63.68 1bi9 n PRO 198 Cb 0.57 -1.73 -0.05 0.00 -0.04 0.00 0.00 33.50 32.25 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 0.00 -0.62 -1.10 1.53 3.38 -1.92 -2.17 115.31 114.41 1bi9 h LEU 199 Ca 0.00 0.03 0.29 0.00 0.09 0.00 0.00 57.88 58.29 1bi9 h LEU 199 Cb 0.86 0.17 -0.13 0.00 0.09 0.00 0.00 40.66 41.66 1bi9 h LEU 199 CO 0.00 -0.41 0.62 0.77 0.09 0.00 0.00 178.44 179.51 1bi9 h SER 200 N -0.66 0.55 -0.14 -0.43 4.64 -1.90 0.12 113.55 115.73 1bi9 h SER 200 Ca -0.06 0.15 -0.02 0.00 -0.47 0.00 0.00 61.79 61.38 1bi9 h SER 200 Cb 0.52 0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.67 1bi9 h SER 200 CO 0.08 -0.01 -0.00 0.00 -0.87 0.00 0.00 176.83 176.04 1bi9 h ALA 201 N 1.74 0.19 -0.91 5.18 0.00 -1.83 -2.70 119.26 120.93 1bi9 h ALA 201 Ca 0.68 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 55.43 1bi9 h ALA 201 Cb 1.54 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 19.23 1bi9 h ALA 201 CO -0.48 -0.11 0.60 -0.07 0.00 0.00 0.00 179.25 179.18 1bi9 h LEU 202 N -0.01 0.99 -1.36 0.00 3.38 -0.12 -0.59 115.31 117.59 1bi9 h LEU 202 Ca 0.04 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 1bi9 h LEU 202 Cb 0.37 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 1bi9 h LEU 202 CO 0.01 0.68 0.06 0.22 0.09 0.00 0.00 178.44 179.50 1bi9 h TYR 203 N 1.14 0.49 0.00 1.13 5.03 -1.17 -0.87 116.97 122.72 1bi9 h TYR 203 Ca 0.36 -0.03 -0.03 0.00 2.58 0.00 0.00 58.73 61.61 1bi9 h TYR 203 Cb 0.01 -0.15 -0.00 0.00 1.55 0.00 0.00 36.73 38.14 1bi9 h TYR 203 CO -0.00 0.45 -0.13 0.52 -1.32 0.00 0.00 178.16 177.68 1bi9 h MET 204 N 0.48 0.00 -0.38 1.82 2.86 -0.78 -0.18 114.93 118.75 1bi9 h MET 204 Ca 0.11 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.68 1bi9 h MET 204 Cb 0.22 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.86 1bi9 h MET 204 CO -0.00 0.13 -0.05 0.78 1.06 0.00 0.00 176.91 178.83 1bi9 h GLY 205 N 0.82 0.68 0.78 8.32 0.00 -0.89 -0.30 103.07 112.48 1bi9 h GLY 205 Ca -0.00 -0.45 -0.01 0.00 0.00 0.00 0.00 47.33 46.87 1bi9 h GLY 205 CO 0.02 0.42 -0.06 0.00 0.00 0.00 0.00 176.54 176.92 1bi9 h ALA 206 N 1.36 -0.15 0.00 3.60 0.00 -0.97 -2.47 119.26 120.62 1bi9 h ALA 206 Ca 0.11 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1bi9 h ALA 206 Cb 0.45 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 1bi9 h ALA 206 CO 0.02 -0.47 -0.14 -0.07 0.00 0.00 0.00 179.25 178.59 1bi9 h LEU 207 N -0.38 0.00 -0.24 0.00 3.38 -1.17 -1.91 115.31 114.99 1bi9 h LEU 207 Ca -0.02 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 1bi9 h LEU 207 Cb 0.31 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1bi9 h LEU 207 CO 0.03 0.14 -0.01 0.40 0.09 0.00 0.00 178.44 179.09 1bi9 h ILE 208 N 0.00 1.26 -0.51 1.22 2.04 -0.89 0.38 117.51 121.01 1bi9 h ILE 208 Ca -0.00 -0.93 -0.01 0.00 1.00 0.00 0.00 64.86 64.92 1bi9 h ILE 208 Cb 0.26 1.38 -0.02 0.00 -0.74 0.00 0.00 36.82 37.70 1bi9 h ILE 208 CO 0.02 0.29 0.28 0.50 0.00 0.00 0.00 178.15 179.23 1bi9 h LYS 209 N 0.21 0.71 0.35 2.37 3.64 -1.11 -2.82 116.57 119.91 1bi9 h LYS 209 Ca 0.07 -0.09 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 1bi9 h LYS 209 Cb 0.43 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 1bi9 h LYS 209 CO 0.01 0.56 -0.17 1.49 -2.27 0.00 0.00 179.45 179.08 1bi9 h GLU 210 N 0.68 -0.45 -0.99 1.90 4.81 -1.12 -2.91 114.58 116.50 1bi9 h GLU 210 Ca 0.18 0.03 0.27 0.00 -0.13 0.00 0.00 59.36 59.71 1bi9 h GLU 210 Cb 0.06 0.10 -0.06 0.00 0.63 0.00 0.00 28.75 29.48 1bi9 h GLU 210 CO -0.03 -0.29 0.69 0.00 -0.73 0.00 0.00 179.01 178.65 1bi9 h ALA 211 N 0.18 2.64 0.00 2.92 0.00 -0.11 -3.45 119.26 121.44 1bi9 h ALA 211 Ca -0.05 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1bi9 h ALA 211 Cb 0.36 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1bi9 h ALA 211 CO 0.08 -0.96 0.00 0.41 0.00 0.00 0.00 179.25 178.78 1bi9 n GLY 212 N -1.63 0.95 3.72 0.00 0.00 -1.10 -4.89 105.19 102.24 1bi9 n GLY 212 Ca 0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 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 -1.70 3.11 0.49 1.61 0.08 -1.08 -4.94 117.98 115.54 1bi9 s PHE 213 Ca 0.00 0.81 -0.23 0.00 0.12 0.00 0.00 56.93 57.63 1bi9 s PHE 213 Cb 0.00 -3.83 -0.08 0.00 -0.57 0.00 0.00 43.02 38.54 1bi9 s PHE 213 CO 0.00 -2.95 1.16 -2.30 -0.10 0.00 0.00 175.22 171.03 1bi9 n PRO 214 N 3.60 1.51 -1.74 0.24 -0.02 -1.26 -4.79 135.00 132.53 1bi9 n PRO 214 Ca 0.12 0.55 -0.40 0.00 -2.02 0.00 0.00 63.50 61.74 1bi9 n PRO 214 Cb 0.40 -2.30 0.02 0.00 -0.02 0.00 0.00 33.50 31.60 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 -0.41 2.17 0.00 0.52 -0.04 -1.26 -2.54 135.00 133.44 1bi9 n PRO 215 Ca 0.10 0.77 0.00 0.00 -0.04 0.00 0.00 63.50 64.33 1bi9 n PRO 215 Cb 0.42 -2.55 0.00 0.00 -0.04 0.00 0.00 33.50 31.33 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 0.65 1.97 0.29 0.55 0.00 -1.26 -4.64 105.19 102.74 1bi9 n GLY 216 Ca 0.05 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.97 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 1.27 -3.28 1.61 2.07 -1.79 -3.28 116.25 112.85 1bi9 h VAL 217 Ca 0.00 -1.36 -0.50 0.00 0.82 0.00 0.00 66.70 65.66 1bi9 h VAL 217 Cb 0.00 1.10 -0.36 0.00 -1.52 0.00 0.00 31.29 30.51 1bi9 h VAL 217 CO 0.00 0.47 -0.80 -0.69 0.02 0.00 0.00 177.57 176.58 1bi9 s VAL 218 N -4.70 0.89 -0.14 2.57 1.01 -1.26 0.73 120.40 119.50 1bi9 s VAL 218 Ca -0.11 -0.25 0.01 0.00 0.00 0.00 0.00 61.98 61.63 1bi9 s VAL 218 Cb 0.12 -0.91 0.02 0.00 0.00 0.00 0.00 36.38 35.62 1bi9 s VAL 218 CO 0.87 0.33 -0.15 0.20 0.00 0.00 0.00 175.10 176.35 1bi9 s ASN 219 N 1.43 2.67 -0.19 3.32 0.01 0.78 -4.65 114.94 118.31 1bi9 s ASN 219 Ca -0.01 -0.48 -0.04 0.00 -0.71 0.00 0.00 52.86 51.62 1bi9 s ASN 219 Cb -0.13 -1.18 -0.02 0.00 0.41 0.00 0.00 41.25 40.32 1bi9 s ASN 219 CO -0.04 -0.03 -0.03 -0.63 -1.51 0.00 0.00 177.10 174.85 1bi9 s ILE 220 N 1.35 3.72 -0.32 0.60 1.01 -0.42 -0.38 121.20 126.76 1bi9 s ILE 220 Ca 0.02 -0.40 -0.00 0.00 0.00 0.00 0.00 60.65 60.27 1bi9 s ILE 220 Cb -0.13 -2.66 0.10 0.00 0.01 0.00 0.00 42.46 39.78 1bi9 s ILE 220 CO -0.08 0.45 0.10 -0.76 0.00 0.00 0.00 174.94 174.65 1bi9 s LEU 221 N 0.87 2.51 0.48 2.97 1.02 -0.56 -1.28 118.68 124.70 1bi9 s LEU 221 Ca -0.00 -1.74 -0.22 0.00 0.02 0.00 0.00 54.13 52.18 1bi9 s LEU 221 Cb -0.14 -0.95 -0.07 0.00 0.02 0.00 0.00 46.19 45.05 1bi9 s LEU 221 CO 0.02 -0.40 1.20 -2.16 0.02 0.00 0.00 176.35 175.02 1bi9 s PRO 222 N 1.48 3.60 0.00 1.29 0.04 -1.26 -4.21 135.00 135.94 1bi9 s PRO 222 Ca 0.10 1.85 0.00 0.00 0.04 0.00 0.00 61.00 62.99 1bi9 s PRO 222 Cb -0.18 -2.34 0.00 0.00 0.04 0.00 0.00 34.50 32.02 1bi9 s PRO 222 CO -0.22 -0.71 0.00 0.41 0.04 0.00 0.00 177.00 176.52 1bi9 n GLY 223 N 0.48 -2.05 3.94 0.56 0.00 -1.26 -1.95 105.19 104.91 1bi9 n GLY 223 Ca 0.08 -1.25 -0.24 0.00 0.00 0.00 0.00 46.02 44.61 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 -2.54 3.46 0.02 1.61 2.02 -1.26 -4.13 117.35 116.53 1bi9 s TYR 224 Ca 0.00 0.43 -0.28 0.00 -0.37 0.00 0.00 57.07 56.85 1bi9 s TYR 224 Cb 0.00 -2.06 -0.16 0.00 -0.40 0.00 0.00 41.96 39.35 1bi9 s TYR 224 CO 0.00 -0.05 1.19 0.78 -1.57 0.00 0.00 175.55 175.90 1bi9 h GLY 225 N 0.57 -0.96 1.22 0.71 0.00 -1.95 0.23 103.07 102.89 1bi9 h GLY 225 Ca -0.49 0.36 0.06 0.00 0.00 0.00 0.00 47.33 47.26 1bi9 h GLY 225 CO 0.61 -0.35 0.34 -2.55 0.00 0.00 0.00 176.54 174.58 1bi9 h PRO 226 N -1.18 0.00 0.00 4.80 0.11 -1.96 0.25 132.00 134.02 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 0.73 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.84 1bi9 h PRO 226 CO 0.15 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.19 1bi9 n THR 227 N -3.39 0.00 0.17 -1.15 -2.24 -1.20 -4.36 114.28 102.11 1bi9 n THR 227 Ca 0.02 0.26 -0.14 0.00 -2.27 0.00 0.00 64.05 61.92 1bi9 n THR 227 Cb 0.45 -1.23 -0.08 0.00 -2.10 0.00 0.00 70.33 67.37 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 -1.25 -0.39 -0.28 6.98 0.00 -0.72 -1.18 119.26 122.42 1bi9 h ALA 228 Ca 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1bi9 h ALA 228 Cb 0.00 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1bi9 h ALA 228 CO 0.00 -0.68 0.15 0.78 0.00 0.00 0.00 179.25 179.50 1bi9 h GLY 229 N -0.46 0.43 1.03 0.00 0.00 -0.85 -2.48 103.07 100.74 1bi9 h GLY 229 Ca -0.04 -0.20 0.05 0.00 0.00 0.00 0.00 47.33 47.14 1bi9 h GLY 229 CO 0.06 0.19 0.51 0.00 0.00 0.00 0.00 176.54 177.31 1bi9 h ALA 230 N 1.01 1.59 0.00 3.60 0.00 -0.43 -1.27 119.26 123.77 1bi9 h ALA 230 Ca 0.10 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 1bi9 h ALA 230 Cb 0.09 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1bi9 h ALA 230 CO -0.01 0.31 -0.36 0.00 0.00 0.00 0.00 179.25 179.18 1bi9 h ALA 231 N 1.56 1.17 0.08 0.00 0.00 -0.93 -2.01 119.26 119.13 1bi9 h ALA 231 Ca 0.33 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1bi9 h ALA 231 Cb 0.15 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1bi9 h ALA 231 CO -0.11 0.45 -0.04 0.82 0.00 0.00 0.00 179.25 180.37 1bi9 h ILE 232 N 0.00 1.19 -0.77 0.00 2.04 -0.81 -2.12 117.51 117.04 1bi9 h ILE 232 Ca -0.00 -1.30 0.04 0.00 1.00 0.00 0.00 64.86 64.60 1bi9 h ILE 232 Cb 0.75 1.99 -0.04 0.00 -0.74 0.00 0.00 36.82 38.77 1bi9 h ILE 232 CO 0.05 0.30 0.51 0.00 0.00 0.00 0.00 178.15 179.01 1bi9 h ALA 233 N 0.06 1.57 -0.01 1.87 0.00 -1.27 -2.24 119.26 119.25 1bi9 h ALA 233 Ca -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1bi9 h ALA 233 Cb 0.58 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1bi9 h ALA 233 CO 0.02 0.34 -0.31 0.43 0.00 0.00 0.00 179.25 179.73 1bi9 n SER 234 N -4.46 1.36 -4.72 0.00 7.64 -0.76 -4.04 113.62 108.62 1bi9 n SER 234 Ca 0.10 -1.11 -0.42 0.00 1.01 0.00 0.00 58.87 58.45 1bi9 n SER 234 Cb 0.14 0.23 -0.03 0.00 -1.01 0.00 0.00 64.21 63.54 1bi9 n SER 234 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 1bi9 s HIS 235 N -2.47 2.89 -0.47 1.43 5.04 -0.80 -4.77 115.29 116.14 1bi9 s HIS 235 Ca 0.23 0.42 0.26 0.00 -1.54 0.00 0.00 55.06 54.43 1bi9 s HIS 235 Cb 0.19 -4.12 0.95 0.00 0.04 0.00 0.00 32.58 29.64 1bi9 s HIS 235 CO 0.53 -4.17 1.76 0.97 -2.34 0.00 0.00 174.74 171.48 1bi9 h ILE 236 N 3.76 0.00 -0.40 0.89 6.09 -1.89 -3.20 117.51 122.75 1bi9 h ILE 236 Ca -0.44 -0.38 0.00 0.00 -1.37 0.00 0.00 64.86 62.68 1bi9 h ILE 236 Cb 1.20 1.23 0.00 0.00 0.47 0.00 0.00 36.82 39.72 1bi9 h ILE 236 CO 0.93 0.00 0.00 0.61 -3.07 0.00 0.00 178.15 176.62 1bi9 n GLY 237 N 0.41 2.19 3.64 8.18 0.00 -1.26 -4.92 105.19 113.43 1bi9 n GLY 237 Ca 0.03 -0.51 -0.35 0.00 0.00 0.00 0.00 46.02 45.18 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 -1.06 4.98 0.09 -0.61 1.01 -1.21 -4.81 121.20 119.60 1bi9 s ILE 238 Ca 0.30 0.04 0.08 0.00 0.00 0.00 0.00 60.65 61.07 1bi9 s ILE 238 Cb 0.16 -3.28 -0.20 0.00 0.01 0.00 0.00 42.46 39.16 1bi9 s ILE 238 CO 0.22 0.42 1.23 0.44 0.00 0.00 0.00 174.94 177.24 1bi9 h ASP 239 N 7.04 0.00 -4.78 3.58 3.32 -1.63 -3.44 116.42 120.51 1bi9 h ASP 239 Ca -0.38 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.54 1bi9 h ASP 239 Cb 1.17 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 40.51 1bi9 h ASP 239 CO 0.69 0.97 -0.32 -0.75 -1.72 0.00 0.00 179.24 178.11 1bi9 s LYS 240 N -2.72 0.59 -0.03 3.56 2.36 -1.01 -2.18 119.74 120.31 1bi9 s LYS 240 Ca 0.01 -0.11 0.01 0.00 -2.55 0.00 0.00 55.97 53.33 1bi9 s LYS 240 Cb 0.10 0.26 0.01 0.00 -1.05 0.00 0.00 37.83 37.15 1bi9 s LYS 240 CO 0.82 -0.15 -0.05 -1.50 1.55 0.00 0.00 175.35 176.02 1bi9 s ILE 241 N -1.07 0.48 -0.18 5.43 2.07 -0.43 0.79 121.20 128.28 1bi9 s ILE 241 Ca -0.11 -0.15 0.00 0.00 -1.41 0.00 0.00 60.65 58.97 1bi9 s ILE 241 Cb -0.05 -0.47 0.01 0.00 0.13 0.00 0.00 42.46 42.08 1bi9 s ILE 241 CO 0.03 0.18 -0.16 0.00 -1.91 0.00 0.00 174.94 173.08 1bi9 s ALA 242 N 0.51 2.45 0.01 1.50 0.00 0.71 -2.24 121.76 124.70 1bi9 s ALA 242 Ca -0.06 -1.17 0.06 0.00 0.00 0.00 0.00 51.96 50.79 1bi9 s ALA 242 Cb -0.10 -1.28 -0.02 0.00 0.00 0.00 0.00 23.12 21.72 1bi9 s ALA 242 CO -0.00 -0.29 -0.20 0.12 0.00 0.00 0.00 175.76 175.39 1bi9 s PHE 243 N 1.22 1.76 -0.02 0.00 2.19 -0.74 -1.26 117.98 121.12 1bi9 s PHE 243 Ca 0.03 -0.35 -0.00 0.00 0.33 0.00 0.00 56.93 56.94 1bi9 s PHE 243 Cb -0.14 -1.09 0.03 0.00 -1.31 0.00 0.00 43.02 40.51 1bi9 s PHE 243 CO -0.08 0.02 0.04 0.95 1.83 0.00 0.00 175.22 177.97 1bi9 s THR 244 N -0.60 -0.06 -3.22 0.12 -4.23 -1.01 0.10 115.64 106.74 1bi9 s THR 244 Ca 0.07 0.20 0.00 0.00 -1.18 0.00 0.00 61.69 60.79 1bi9 s THR 244 Cb -0.08 -0.09 0.00 0.00 1.34 0.00 0.00 72.50 73.67 1bi9 s THR 244 CO 0.00 0.08 0.00 0.61 -0.54 0.00 0.00 174.62 174.78 1bi9 n GLY 245 N 4.12 -0.57 3.78 3.99 0.00 -1.01 -3.57 105.19 111.93 1bi9 n GLY 245 Ca -0.27 -0.61 -0.37 0.00 0.00 0.00 0.00 46.02 44.78 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 6.46 0.42 1.61 1.04 -1.26 -3.76 113.70 114.21 1bi9 s SER 246 Ca 0.00 2.18 0.19 0.00 0.48 0.00 0.00 55.95 58.80 1bi9 s SER 246 Cb 0.00 -2.59 0.95 0.00 0.10 0.00 0.00 66.02 64.47 1bi9 s SER 246 CO 0.00 -0.71 1.89 0.71 0.98 0.00 0.00 173.24 176.11 1bi9 h THR 247 N 2.04 0.93 -0.96 2.02 1.35 -1.96 0.35 112.91 116.68 1bi9 h THR 247 Ca -0.49 -1.08 0.01 0.00 -0.55 0.00 0.00 66.41 64.31 1bi9 h THR 247 Cb 1.23 1.63 -0.05 0.00 -1.73 0.00 0.00 68.15 69.23 1bi9 h THR 247 CO 0.61 0.28 0.63 1.05 -0.25 0.00 0.00 175.52 177.84 1bi9 h GLU 248 N 0.00 1.24 0.00 4.72 9.09 -2.01 -0.77 114.58 126.85 1bi9 h GLU 248 Ca -0.00 -0.07 -0.09 0.00 0.05 0.00 0.00 59.36 59.25 1bi9 h GLU 248 Cb 0.61 -0.28 -0.01 0.00 -1.65 0.00 0.00 28.75 27.41 1bi9 h GLU 248 CO 0.04 0.82 -0.60 0.28 0.05 0.00 0.00 179.01 179.60 1bi9 h VAL 249 N 1.28 0.56 -0.61 -1.06 2.07 -1.76 -3.20 116.25 113.53 1bi9 h VAL 249 Ca 0.36 -1.84 0.03 0.00 0.82 0.00 0.00 66.70 66.06 1bi9 h VAL 249 Cb -0.12 2.20 -0.03 0.00 -1.52 0.00 0.00 31.29 31.81 1bi9 h VAL 249 CO -0.08 0.32 0.40 1.23 0.02 0.00 0.00 177.57 179.46 1bi9 h GLY 250 N 3.67 0.82 1.23 2.17 0.00 0.49 -2.09 103.07 109.37 1bi9 h GLY 250 Ca -0.03 -0.29 -0.13 0.00 0.00 0.00 0.00 47.33 46.88 1bi9 h GLY 250 CO 0.04 0.26 -0.28 0.50 0.00 0.00 0.00 176.54 177.06 1bi9 h LYS 251 N 0.74 0.87 -0.18 4.80 1.57 -1.37 -2.77 116.57 120.22 1bi9 h LYS 251 Ca 0.24 -0.39 -0.09 0.00 -1.87 0.00 0.00 60.65 58.54 1bi9 h LYS 251 Cb 0.04 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 1bi9 h LYS 251 CO -0.06 1.04 -0.27 -0.07 -0.57 0.00 0.00 179.45 179.51 1bi9 h LEU 252 N 0.74 0.34 -0.06 2.94 3.38 -1.49 -2.24 115.31 118.92 1bi9 h LEU 252 Ca 0.09 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 1bi9 h LEU 252 Cb 0.84 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.49 1bi9 h LEU 252 CO 0.07 0.62 0.01 0.40 0.09 0.00 0.00 178.44 179.63 1bi9 h ILE 253 N 0.30 1.22 -0.46 1.22 1.08 -1.21 -0.11 117.51 119.56 1bi9 h ILE 253 Ca 0.04 -0.69 -0.08 0.00 -0.39 0.00 0.00 64.86 63.75 1bi9 h ILE 253 Cb 0.65 1.58 -0.02 0.00 -3.07 0.00 0.00 36.82 35.96 1bi9 h ILE 253 CO 0.05 0.19 -0.03 -0.61 -0.69 0.00 0.00 178.15 177.06 1bi9 h GLN 254 N -0.17 0.78 -0.32 2.37 4.15 -1.46 -1.43 115.11 119.04 1bi9 h GLN 254 Ca 0.02 -0.22 -0.05 0.00 0.77 0.00 0.00 58.65 59.16 1bi9 h GLN 254 Cb 0.29 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 27.89 1bi9 h GLN 254 CO 0.00 0.81 -0.01 1.49 -1.93 0.00 0.00 178.83 179.19 1bi9 h GLU 255 N 0.73 0.58 -0.86 1.69 4.81 -1.33 -0.86 114.58 119.34 1bi9 h GLU 255 Ca 0.14 -0.19 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1bi9 h GLU 255 Cb 0.48 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.77 1bi9 h GLU 255 CO 0.02 0.72 0.55 0.00 -0.73 0.00 0.00 179.01 179.57 1bi9 h ALA 256 N 0.84 1.09 0.41 2.92 0.00 -0.80 0.29 119.26 124.01 1bi9 h ALA 256 Ca 0.09 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1bi9 h ALA 256 Cb 0.47 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1bi9 h ALA 256 CO 0.02 0.51 -0.30 0.00 0.00 0.00 0.00 179.25 179.48 1bi9 h ALA 257 N 1.30 -0.71 -0.23 0.00 0.00 -1.02 0.64 119.26 119.24 1bi9 h ALA 257 Ca 0.31 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.05 1bi9 h ALA 257 Cb -0.11 0.40 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1bi9 h ALA 257 CO -0.06 -0.92 -0.05 0.78 0.00 0.00 0.00 179.25 179.00 1bi9 h GLY 258 N -0.70 0.38 2.00 0.00 0.00 -0.90 -1.61 103.07 102.24 1bi9 h GLY 258 Ca -0.04 -0.22 -0.04 0.00 0.00 0.00 0.00 47.33 47.03 1bi9 h GLY 258 CO 0.01 0.21 -0.21 3.21 0.00 0.00 0.00 176.54 179.76 1bi9 h ARG 259 N 0.35 0.00 0.00 4.80 3.08 -0.58 -3.41 114.38 118.61 1bi9 h ARG 259 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 1bi9 h ARG 259 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.36 1bi9 h ARG 259 CO 0.01 0.21 0.00 -1.13 -1.07 0.00 0.00 179.97 177.99 1bi9 n SER 260 N -3.23 0.00 -0.21 7.04 3.41 0.19 -4.96 113.62 115.85 1bi9 n SER 260 Ca 0.02 0.00 0.07 0.00 -0.26 0.00 0.00 58.87 58.70 1bi9 n SER 260 Cb 0.51 0.00 0.11 0.00 -0.26 0.00 0.00 64.21 64.57 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 -0.62 1.74 -2.94 4.04 6.94 -1.17 -5.00 115.26 118.25 1bi9 n ASN 261 Ca 0.00 -2.84 -0.20 0.00 -0.02 0.00 0.00 54.58 51.52 1bi9 n ASN 261 Cb 0.00 -0.38 0.01 0.00 -2.36 0.00 0.00 39.78 37.05 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 -1.06 -1.92 -4.71 -4.53 4.77 -0.64 -4.94 117.00 103.97 1bi9 n LEU 262 Ca 0.12 -0.19 -0.34 0.00 -0.03 0.00 0.00 56.01 55.57 1bi9 n LEU 262 Cb 0.66 -2.53 0.11 0.00 -2.33 0.00 0.00 43.42 39.33 1bi9 n LEU 262 CO 0.01 0.08 0.79 -1.59 -1.33 0.00 0.00 177.39 175.35 1bi9 s LYS 263 N -5.59 1.87 0.43 3.23 -2.85 -1.26 -4.94 119.74 110.63 1bi9 s LYS 263 Ca 0.24 1.79 -0.25 0.00 -1.00 0.00 0.00 55.97 56.75 1bi9 s LYS 263 Cb -0.11 -1.80 -0.08 0.00 -2.06 0.00 0.00 37.83 33.78 1bi9 s LYS 263 CO 0.29 -2.05 1.25 1.03 0.10 0.00 0.00 175.35 175.97 1bi9 s ARG 264 N -4.00 3.88 -0.05 1.78 3.00 -0.93 -4.87 118.95 117.76 1bi9 s ARG 264 Ca 0.74 2.01 0.01 0.00 0.00 0.00 0.00 55.73 58.50 1bi9 s ARG 264 Cb -0.30 -2.63 0.02 0.00 0.00 0.00 0.00 34.95 32.04 1bi9 s ARG 264 CO 0.48 -0.52 -0.06 0.08 0.00 0.00 0.00 175.30 175.29 1bi9 s VAL 265 N -1.35 0.65 -0.07 3.52 1.01 -1.26 -1.32 120.40 121.57 1bi9 s VAL 265 Ca 0.59 -0.17 0.05 0.00 0.00 0.00 0.00 61.98 62.45 1bi9 s VAL 265 Cb -0.35 -0.66 -0.00 0.00 0.00 0.00 0.00 36.38 35.37 1bi9 s VAL 265 CO 0.44 0.25 -0.22 -0.89 0.00 0.00 0.00 175.10 174.67 1bi9 s THR 266 N 0.96 1.89 -0.16 3.92 2.01 -0.95 -5.02 115.64 118.29 1bi9 s THR 266 Ca -0.10 -0.95 0.00 0.00 0.31 0.00 0.00 61.69 60.95 1bi9 s THR 266 Cb -0.14 -1.62 0.03 0.00 0.01 0.00 0.00 72.50 70.78 1bi9 s THR 266 CO 0.00 0.53 -0.12 -0.76 -0.69 0.00 0.00 174.62 173.57 1bi9 s LEU 267 N 0.09 1.78 -0.65 4.42 1.43 -1.26 -1.80 118.68 122.69 1bi9 s LEU 267 Ca -0.09 -0.58 -0.11 0.00 -1.03 0.00 0.00 54.13 52.32 1bi9 s LEU 267 Cb -0.15 -1.15 0.17 0.00 0.03 0.00 0.00 46.19 45.09 1bi9 s LEU 267 CO 0.05 -0.09 0.56 -0.70 0.23 0.00 0.00 176.35 176.40 1bi9 s GLU 268 N 1.49 3.03 0.17 1.70 2.12 0.12 -5.00 118.70 122.33 1bi9 s GLU 268 Ca 0.03 -2.16 0.04 0.00 0.36 0.00 0.00 54.97 53.24 1bi9 s GLU 268 Cb -0.14 -4.16 -0.04 0.00 0.26 0.00 0.00 34.13 30.05 1bi9 s GLU 268 CO -0.10 -1.26 0.24 -0.51 -0.54 0.00 0.00 175.26 173.09 1bi9 s LEU 269 N 0.70 4.13 0.00 2.70 1.43 -1.26 -2.41 118.68 123.97 1bi9 s LEU 269 Ca 0.12 0.04 0.00 0.00 -1.03 0.00 0.00 54.13 53.26 1bi9 s LEU 269 Cb -0.20 -2.71 0.00 0.00 0.03 0.00 0.00 46.19 43.31 1bi9 s LEU 269 CO -0.04 0.04 0.00 0.61 0.23 0.00 0.00 176.35 177.20 1bi9 n GLY 270 N -0.58 -2.63 0.00 -3.19 0.00 -1.25 -5.00 105.19 92.54 1bi9 n GLY 270 Ca -0.08 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.10 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 0.00 1.83 3.87 -0.02 0.00 -1.26 -4.75 105.19 104.85 1bi9 n GLY 271 Ca 0.00 -1.58 -0.32 0.00 0.00 0.00 0.00 46.02 44.12 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 -1.76 3.85 -0.54 1.61 -2.85 -1.26 -4.96 119.74 113.83 1bi9 s LYS 272 Ca 0.00 0.36 0.07 0.00 -1.00 0.00 0.00 55.97 55.40 1bi9 s LYS 272 Cb 0.00 -2.62 0.26 0.00 -2.06 0.00 0.00 37.83 33.41 1bi9 s LYS 272 CO 0.00 0.30 0.69 0.45 0.10 0.00 0.00 175.35 176.89 1bi9 n SER 273 N -0.13 2.53 -4.68 0.03 2.88 -1.26 -2.50 113.62 110.50 1bi9 n SER 273 Ca 0.01 -3.20 -0.39 0.00 -1.33 0.00 0.00 58.87 53.96 1bi9 n SER 273 Cb 0.52 -0.65 0.04 0.00 -0.75 0.00 0.00 64.21 63.38 1bi9 n SER 273 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1bi9 n PRO 274 N 0.91 1.31 -5.23 -1.46 -0.04 -1.18 -3.84 135.00 125.47 1bi9 n PRO 274 Ca 0.27 0.49 -0.30 0.00 -0.04 0.00 0.00 63.50 63.92 1bi9 n PRO 274 Cb 0.46 -2.35 -0.16 0.00 -0.04 0.00 0.00 33.50 31.41 1bi9 n PRO 274 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1bi9 s ASN 275 N -1.04 2.91 -0.14 3.54 -0.87 -1.12 -2.53 114.94 115.69 1bi9 s ASN 275 Ca 0.73 -0.46 0.00 0.00 -1.57 0.00 0.00 52.86 51.56 1bi9 s ASN 275 Cb -0.43 -0.47 0.02 0.00 -0.02 0.00 0.00 41.25 40.35 1bi9 s ASN 275 CO 0.49 0.28 -0.11 -0.63 -2.57 0.00 0.00 177.10 174.56 1bi9 s ILE 276 N -0.45 1.36 -0.30 0.60 1.01 -0.50 -0.15 121.20 122.76 1bi9 s ILE 276 Ca 0.06 -0.52 0.01 0.00 0.00 0.00 0.00 60.65 60.19 1bi9 s ILE 276 Cb -0.11 -1.32 0.07 0.00 0.01 0.00 0.00 42.46 41.11 1bi9 s ILE 276 CO 0.00 0.40 -0.02 -0.63 0.00 0.00 0.00 174.94 174.69 1bi9 s ILE 277 N 1.57 2.59 0.32 2.92 1.01 -0.27 -1.14 121.20 128.20 1bi9 s ILE 277 Ca 0.05 -1.68 -0.15 0.00 0.00 0.00 0.00 60.65 58.86 1bi9 s ILE 277 Cb -0.13 -2.59 -0.09 0.00 0.01 0.00 0.00 42.46 39.66 1bi9 s ILE 277 CO -0.10 -0.20 0.73 -0.36 0.00 0.00 0.00 174.94 175.02 1bi9 s PHE 278 N 1.13 3.39 -0.13 3.97 0.08 -0.98 -1.82 117.98 123.61 1bi9 s PHE 278 Ca -0.03 1.22 0.23 0.00 0.12 0.00 0.00 56.93 58.47 1bi9 s PHE 278 Cb -0.20 -2.53 1.26 0.00 -0.57 0.00 0.00 43.02 40.98 1bi9 s PHE 278 CO -0.04 0.11 1.71 0.00 -0.10 0.00 0.00 175.22 176.90 1bi9 h ALA 279 N 2.31 1.00 -0.30 5.36 0.00 -1.89 -1.65 119.26 124.10 1bi9 h ALA 279 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1bi9 h ALA 279 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1bi9 h ALA 279 CO 0.65 -0.00 0.00 -0.40 0.00 0.00 0.00 179.25 179.50 1bi9 n ASP 280 N -2.32 1.63 -4.70 0.00 5.68 -1.26 -4.84 116.55 110.74 1bi9 n ASP 280 Ca -0.02 -1.99 -0.35 0.00 -0.50 0.00 0.00 54.79 51.93 1bi9 n ASP 280 Cb 0.04 -0.20 -0.09 0.00 -1.14 0.00 0.00 41.12 39.73 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 -1.60 3.45 -0.76 2.12 0.00 -0.62 -4.16 121.76 120.19 1bi9 s ALA 281 Ca 0.21 -0.75 -0.31 0.00 0.00 0.00 0.00 51.96 51.11 1bi9 s ALA 281 Cb 0.11 -1.76 -0.16 0.00 0.00 0.00 0.00 23.12 21.30 1bi9 s ALA 281 CO 0.14 0.42 2.54 -0.40 0.00 0.00 0.00 175.76 178.46 1bi9 n ASP 282 N 2.70 1.09 -0.35 0.00 5.68 -1.26 -4.76 116.55 119.66 1bi9 n ASP 282 Ca -0.18 0.02 0.25 0.00 -0.50 0.00 0.00 54.79 54.38 1bi9 n ASP 282 Cb 0.53 -1.15 0.52 0.00 -1.14 0.00 0.00 41.12 39.89 1bi9 n ASP 282 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 1bi9 h LEU 283 N 14.18 0.43 0.35 -2.12 5.85 -1.93 -1.88 115.31 130.19 1bi9 h LEU 283 Ca -0.13 0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.68 1bi9 h LEU 283 Cb 1.30 0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.38 1bi9 h LEU 283 CO 1.27 0.02 -0.17 0.44 -0.34 0.00 0.00 178.44 179.67 1bi9 h ASP 284 N 0.34 -0.39 0.28 1.25 3.32 -2.01 -2.53 116.42 116.68 1bi9 h ASP 284 Ca 0.65 -0.09 -0.06 0.00 0.02 0.00 0.00 57.03 57.55 1bi9 h ASP 284 Cb 1.70 0.10 -0.01 0.00 0.22 0.00 0.00 39.33 41.34 1bi9 h ASP 284 CO -0.35 -0.15 -0.28 0.22 -1.72 0.00 0.00 179.24 176.96 1bi9 h TYR 285 N -0.63 0.00 -0.10 4.55 3.20 -1.82 -2.75 116.97 119.42 1bi9 h TYR 285 Ca -0.05 -0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.71 1bi9 h TYR 285 Cb 0.46 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.71 1bi9 h TYR 285 CO -0.01 0.29 -0.46 0.00 -1.64 0.00 0.00 178.16 176.34 1bi9 h ALA 286 N 1.71 1.05 -0.12 1.82 0.00 -1.27 -1.68 119.26 120.78 1bi9 h ALA 286 Ca -0.00 -0.44 -0.22 0.00 0.00 0.00 0.00 54.91 54.24 1bi9 h ALA 286 Cb 0.50 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.21 1bi9 h ALA 286 CO 0.04 0.62 -0.81 0.28 0.00 0.00 0.00 179.25 179.38 1bi9 h VAL 287 N 0.19 1.30 0.07 0.00 2.07 -1.16 -1.40 116.25 117.33 1bi9 h VAL 287 Ca 0.01 -2.05 -0.00 0.00 0.82 0.00 0.00 66.70 65.48 1bi9 h VAL 287 Cb 0.88 2.06 0.00 0.00 -1.52 0.00 0.00 31.29 32.72 1bi9 h VAL 287 CO 0.07 0.64 -0.04 -0.08 0.02 0.00 0.00 177.57 178.19 1bi9 h GLU 288 N 0.47 -0.10 0.41 1.57 4.57 -1.43 -1.28 114.58 118.79 1bi9 h GLU 288 Ca -0.06 0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.11 1bi9 h GLU 288 Cb 1.43 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 30.05 1bi9 h GLU 288 CO 0.16 0.30 -0.20 1.96 -1.18 0.00 0.00 179.01 180.06 1bi9 h GLN 289 N -0.52 -0.53 -0.44 1.92 1.08 -1.39 0.39 115.11 115.61 1bi9 h GLN 289 Ca -0.01 0.04 0.10 0.00 -1.45 0.00 0.00 58.65 57.32 1bi9 h GLN 289 Cb 0.45 0.12 -0.02 0.00 -0.05 0.00 0.00 27.48 27.97 1bi9 h GLN 289 CO 0.02 -0.33 0.31 0.00 -0.95 0.00 0.00 178.83 177.87 1bi9 h ALA 290 N -0.01 2.19 -0.04 3.87 0.00 -1.33 0.30 119.26 124.24 1bi9 h ALA 290 Ca -0.06 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.68 1bi9 h ALA 290 Cb 0.45 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.23 1bi9 h ALA 290 CO 0.09 -0.30 -0.62 1.25 0.00 0.00 0.00 179.25 179.68 1bi9 h HIS 291 N 0.17 0.70 -0.05 0.00 -0.00 -0.75 -2.91 115.15 112.31 1bi9 h HIS 291 Ca 0.21 -0.35 -0.10 0.00 -0.00 0.00 0.00 60.37 60.13 1bi9 h HIS 291 Cb 0.59 -0.09 -0.01 0.00 -0.00 0.00 0.00 27.41 27.90 1bi9 h HIS 291 CO -0.00 1.16 -0.42 1.96 -0.00 0.00 0.00 177.93 180.63 1bi9 h GLN 292 N 0.05 0.10 0.00 5.26 1.08 0.15 -1.39 115.11 120.36 1bi9 h GLN 292 Ca -0.06 -0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.09 1bi9 h GLN 292 Cb 1.29 -0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.72 1bi9 h GLN 292 CO 0.12 0.51 -0.24 0.78 -0.95 0.00 0.00 178.83 179.05 1bi9 h GLY 293 N 1.26 0.00 0.16 3.46 0.00 -0.53 -2.45 103.07 104.96 1bi9 h GLY 293 Ca 0.01 0.00 -0.38 0.00 0.00 0.00 0.00 47.33 46.95 1bi9 h GLY 293 CO 0.06 0.00 -2.35 -0.62 0.00 0.00 0.00 176.54 173.62 1bi9 n VAL 294 N -2.34 1.56 1.06 4.60 0.31 -1.10 -3.21 118.33 119.22 1bi9 n VAL 294 Ca 0.04 -0.60 0.12 0.00 -0.01 0.00 0.00 64.34 63.89 1bi9 n VAL 294 Cb 0.45 -1.48 0.10 0.00 -0.91 0.00 0.00 33.84 32.00 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 -3.30 0.00 -1.45 3.52 3.72 -0.54 -4.07 117.46 115.33 1bi9 n PHE 295 Ca -0.42 0.00 -0.36 0.00 -0.05 0.00 0.00 57.45 56.62 1bi9 n PHE 295 Cb 1.01 -0.02 0.09 0.00 -0.94 0.00 0.00 39.48 39.62 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 0.17 1.35 -4.35 1.38 7.35 -0.92 -2.53 117.46 119.91 1bi9 n PHE 296 Ca 0.11 0.41 -0.38 0.00 -0.76 0.00 0.00 57.45 56.83 1bi9 n PHE 296 Cb 0.47 -2.17 -0.05 0.00 0.35 0.00 0.00 39.48 38.09 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 -2.16 -2.54 -1.34 -2.13 5.15 -1.26 0.25 115.26 111.24 1bi9 n ASN 297 Ca 0.14 -1.11 -0.15 0.00 -0.60 0.00 0.00 54.58 52.87 1bi9 n ASN 297 Cb 0.49 -2.29 -0.04 0.00 -0.53 0.00 0.00 39.78 37.41 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 -4.27 -1.09 0.00 1.20 3.00 -1.05 -3.04 117.38 112.14 1bi9 n GLN 298 Ca 0.07 0.91 0.00 0.00 -0.01 0.00 0.00 57.00 57.97 1bi9 n GLN 298 Cb 0.49 -5.11 0.00 0.00 0.00 0.00 0.00 30.24 25.62 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 1.37 3.46 1.08 0.00 0.14 -3.10 105.19 107.03 1bi9 n GLY 299 Ca -0.16 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.42 1bi9 n GLY 299 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1bi9 s GLN 300 N 0.00 4.06 -0.29 1.61 -2.07 -1.08 -2.97 119.66 118.91 1bi9 s GLN 300 Ca 0.00 -2.55 -0.14 0.00 -1.82 0.00 0.00 55.36 50.85 1bi9 s GLN 300 Cb 0.00 -5.03 0.13 0.00 -1.09 0.00 0.00 33.01 27.03 1bi9 s GLN 300 CO 0.00 -1.74 0.81 0.00 -1.32 0.00 0.00 175.29 173.04 1bi9 n THR 303 N -3.93 0.01 -4.22 0.00 -2.24 -1.26 -4.75 114.28 97.88 1bi9 n THR 303 Ca 0.31 -0.04 -0.34 0.00 -2.27 0.00 0.00 64.05 61.71 1bi9 n THR 303 Cb 1.54 -0.31 -0.11 0.00 -2.10 0.00 0.00 70.33 69.36 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 -1.99 3.22 -0.41 6.98 0.00 0.90 -4.81 121.76 125.65 1bi9 s ALA 304 Ca 0.40 -0.78 -0.06 0.00 0.00 0.00 0.00 51.96 51.52 1bi9 s ALA 304 Cb 0.19 -1.71 0.10 0.00 0.00 0.00 0.00 23.12 21.70 1bi9 s ALA 304 CO 0.31 0.25 0.23 0.20 0.00 0.00 0.00 175.76 176.76 1bi9 s GLY 305 N 0.18 1.97 0.20 0.00 0.00 -1.20 -4.65 107.32 103.82 1bi9 s GLY 305 Ca 0.01 -2.34 -0.11 0.00 0.00 0.00 0.00 44.72 42.28 1bi9 s GLY 305 CO 0.02 0.99 1.86 1.48 0.00 0.00 0.00 173.10 177.44 1bi9 h SER 306 N 8.24 0.81 -3.73 1.64 4.64 -1.82 -3.42 113.55 119.90 1bi9 h SER 306 Ca -0.19 -0.04 -0.52 0.00 -0.47 0.00 0.00 61.79 60.58 1bi9 h SER 306 Cb 1.07 -0.20 0.04 0.00 -0.31 0.00 0.00 62.40 62.99 1bi9 h SER 306 CO 0.73 0.61 0.58 0.00 -0.87 0.00 0.00 176.83 177.88 1bi9 s ARG 307 N -6.07 4.47 -0.20 4.77 1.70 -1.26 -1.97 118.95 120.39 1bi9 s ARG 307 Ca -0.13 2.02 -0.04 0.00 -0.47 0.00 0.00 55.73 57.11 1bi9 s ARG 307 Cb 0.14 -3.15 0.07 0.00 -0.57 0.00 0.00 34.95 31.44 1bi9 s ARG 307 CO 0.77 -0.06 0.08 0.42 -1.08 0.00 0.00 175.30 175.44 1bi9 s ILE 308 N -0.83 0.07 -0.24 4.99 1.01 0.29 -2.77 121.20 123.72 1bi9 s ILE 308 Ca 0.49 -0.36 -0.27 0.00 0.00 0.00 0.00 60.65 60.50 1bi9 s ILE 308 Cb -0.36 -0.76 0.01 0.00 0.01 0.00 0.00 42.46 41.36 1bi9 s ILE 308 CO 0.45 -0.34 0.96 -0.36 0.00 0.00 0.00 174.94 175.65 1bi9 s PHE 309 N 2.06 3.31 -0.03 3.97 0.40 0.78 -0.74 117.98 127.74 1bi9 s PHE 309 Ca 0.03 1.30 0.05 0.00 -0.60 0.00 0.00 56.93 57.71 1bi9 s PHE 309 Cb -0.16 -3.23 -0.03 0.00 0.51 0.00 0.00 43.02 40.12 1bi9 s PHE 309 CO -0.13 -0.48 -0.18 0.08 0.70 0.00 0.00 175.22 175.21 1bi9 s VAL 310 N 3.10 2.76 0.06 -0.44 1.01 0.15 -1.11 120.40 125.93 1bi9 s VAL 310 Ca 0.40 -0.89 -0.31 0.00 0.00 0.00 0.00 61.98 61.19 1bi9 s VAL 310 Cb -0.15 -2.07 -0.06 0.00 0.00 0.00 0.00 36.38 34.11 1bi9 s VAL 310 CO 0.07 0.55 1.29 -0.70 0.00 0.00 0.00 175.10 176.32 1bi9 s GLU 311 N -0.81 4.36 0.21 2.72 2.12 -0.76 -1.78 118.70 124.78 1bi9 s GLU 311 Ca 0.12 1.89 -0.12 0.00 0.36 0.00 0.00 54.97 57.22 1bi9 s GLU 311 Cb -0.10 -3.37 0.28 0.00 0.26 0.00 0.00 34.13 31.19 1bi9 s GLU 311 CO 0.01 -0.39 1.34 0.39 -0.54 0.00 0.00 175.26 176.07 1bi9 n GLU 312 N 4.30 -0.15 -0.57 4.30 1.02 -0.70 0.26 120.64 129.10 1bi9 n GLU 312 Ca 0.11 1.33 0.46 0.00 -0.02 0.00 0.00 57.16 59.03 1bi9 n GLU 312 Cb 0.45 -1.98 0.76 0.00 -0.02 0.00 0.00 31.44 30.65 1bi9 n GLU 312 CO 0.00 0.00 0.00 0.77 1.18 0.00 0.00 177.13 179.08 1bi9 h SER 313 N 0.00 0.09 0.00 1.62 0.02 -1.91 -0.76 113.55 112.60 1bi9 h SER 313 Ca 0.34 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 61.35 1bi9 h SER 313 Cb 0.56 0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.15 1bi9 h SER 313 CO -0.87 -0.07 0.00 2.30 -1.14 0.00 0.00 176.83 177.05 1bi9 n ILE 314 N -4.24 0.16 -0.17 3.27 -5.35 0.14 -4.79 119.36 108.38 1bi9 n ILE 314 Ca 0.40 -0.51 -0.04 0.00 -0.27 0.00 0.00 62.75 62.33 1bi9 n ILE 314 Cb 1.73 1.04 0.03 0.00 -1.74 0.00 0.00 39.64 40.69 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 0.00 -0.59 -0.22 4.28 3.20 0.50 -1.20 116.97 122.93 1bi9 h TYR 315 Ca 0.00 0.06 0.02 0.00 3.14 0.00 0.00 58.73 61.95 1bi9 h TYR 315 Cb 0.17 0.34 -0.03 0.00 1.54 0.00 0.00 36.73 38.75 1bi9 h TYR 315 CO 0.00 -0.32 -0.17 1.49 -1.64 0.00 0.00 178.16 177.52 1bi9 h GLU 316 N -0.11 -0.04 0.14 1.82 4.57 -1.87 -0.29 114.58 118.79 1bi9 h GLU 316 Ca 0.24 0.00 0.02 0.00 -1.18 0.00 0.00 59.36 58.44 1bi9 h GLU 316 Cb 0.49 0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 29.05 1bi9 h GLU 316 CO -0.60 -0.03 -0.31 0.93 -1.18 0.00 0.00 179.01 177.82 1bi9 h GLU 317 N -0.05 -0.52 -0.80 1.92 4.39 -1.82 -2.83 114.58 114.87 1bi9 h GLU 317 Ca 0.04 0.04 0.18 0.00 0.34 0.00 0.00 59.36 59.95 1bi9 h GLU 317 Cb 0.14 0.12 -0.11 0.00 -0.10 0.00 0.00 28.75 28.80 1bi9 h GLU 317 CO -0.24 -0.35 0.27 0.35 -1.16 0.00 0.00 179.01 177.89 1bi9 h PHE 318 N -0.54 0.44 -0.68 4.33 3.04 -0.92 0.19 116.94 122.79 1bi9 h PHE 318 Ca 0.03 0.04 0.02 0.00 3.98 0.00 0.00 57.97 62.04 1bi9 h PHE 318 Cb 0.56 -0.07 -0.04 0.00 2.56 0.00 0.00 35.95 38.96 1bi9 h PHE 318 CO -0.27 -0.04 0.43 0.28 -2.02 0.00 0.00 178.31 176.69 1bi9 h VAL 319 N 0.35 1.12 -0.30 1.41 2.07 -0.82 -1.47 116.25 118.61 1bi9 h VAL 319 Ca 0.46 -0.30 -0.06 0.00 0.82 0.00 0.00 66.70 67.63 1bi9 h VAL 319 Cb 0.81 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.75 1bi9 h VAL 319 CO -0.50 0.16 -0.04 0.11 0.02 0.00 0.00 177.57 177.32 1bi9 h LYS 320 N 0.86 0.56 -0.78 1.57 1.57 -0.54 -2.74 116.57 117.08 1bi9 h LYS 320 Ca 0.27 -0.20 -0.05 0.00 -1.87 0.00 0.00 60.65 58.80 1bi9 h LYS 320 Cb -0.02 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.22 1bi9 h LYS 320 CO -0.09 0.73 0.31 0.00 -0.57 0.00 0.00 179.45 179.83 1bi9 h ARG 321 N 0.33 1.17 -0.08 3.15 2.47 -0.85 -3.04 114.38 117.55 1bi9 h ARG 321 Ca 0.08 -0.22 -0.09 0.00 -1.26 0.00 0.00 59.98 58.49 1bi9 h ARG 321 Cb 0.51 -0.19 -0.01 0.00 -1.65 0.00 0.00 29.97 28.63 1bi9 h ARG 321 CO 0.02 0.96 -0.37 0.77 0.56 0.00 0.00 179.97 181.91 1bi9 h SER 322 N 1.14 0.16 -0.24 7.04 0.02 -1.25 -2.84 113.55 117.59 1bi9 h SER 322 Ca 0.26 -0.06 -0.19 0.00 -0.84 0.00 0.00 61.79 60.96 1bi9 h SER 322 Cb 0.22 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.72 1bi9 h SER 322 CO -0.02 0.53 -0.59 -0.37 -1.14 0.00 0.00 176.83 175.24 1bi9 h VAL 323 N 0.14 1.28 -0.63 2.27 -1.51 -1.38 -2.88 116.25 113.55 1bi9 h VAL 323 Ca 0.01 -1.78 0.05 0.00 -1.23 0.00 0.00 66.70 63.76 1bi9 h VAL 323 Cb 0.73 1.70 -0.05 0.00 -2.13 0.00 0.00 31.29 31.53 1bi9 h VAL 323 CO 0.05 0.58 0.34 -0.33 -1.23 0.00 0.00 177.57 176.98 1bi9 h GLU 324 N 0.64 0.62 -0.96 5.19 5.08 -1.43 -1.14 114.58 122.58 1bi9 h GLU 324 Ca 0.00 -0.04 0.08 0.00 -1.00 0.00 0.00 59.36 58.40 1bi9 h GLU 324 Cb 1.20 -0.14 -0.07 0.00 0.50 0.00 0.00 28.75 30.24 1bi9 h GLU 324 CO 0.13 0.41 0.62 0.00 -1.00 0.00 0.00 179.01 179.17 1bi9 h ARG 325 N 0.64 1.04 -0.15 2.33 2.47 -1.39 -1.68 114.38 117.63 1bi9 h ARG 325 Ca 0.28 -0.06 -0.08 0.00 -1.26 0.00 0.00 59.98 58.85 1bi9 h ARG 325 Cb 0.17 -0.23 -0.00 0.00 -1.65 0.00 0.00 29.97 28.25 1bi9 h ARG 325 CO -0.17 0.69 -0.23 0.00 0.56 0.00 0.00 179.97 180.82 1bi9 h ALA 326 N 1.50 0.24 -0.77 0.04 0.00 -1.12 -2.26 119.26 116.88 1bi9 h ALA 326 Ca 0.43 -0.37 0.04 0.00 0.00 0.00 0.00 54.91 55.01 1bi9 h ALA 326 Cb 0.26 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 1bi9 h ALA 326 CO -0.18 0.20 0.51 0.87 0.00 0.00 0.00 179.25 180.64 1bi9 h LYS 327 N 0.05 0.89 -0.05 0.00 1.57 -0.84 -0.70 116.57 117.49 1bi9 h LYS 327 Ca 0.02 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1bi9 h LYS 327 Cb 0.80 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.91 1bi9 h LYS 327 CO 0.05 0.59 0.00 0.54 -0.57 0.00 0.00 179.45 180.06 1bi9 n ARG 328 N -4.46 1.57 -2.07 3.15 1.74 -0.67 -4.86 116.66 111.07 1bi9 n ARG 328 Ca 0.10 -0.84 -0.43 0.00 -0.77 0.00 0.00 57.85 55.92 1bi9 n ARG 328 Cb 0.15 -1.46 -0.03 0.00 -1.02 0.00 0.00 32.46 30.10 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 -1.95 3.87 -0.23 5.56 6.06 -0.27 -4.95 118.95 127.03 1bi9 s ARG 329 Ca 0.38 1.81 -0.29 0.00 -2.50 0.00 0.00 55.73 55.13 1bi9 s ARG 329 Cb 0.20 -4.04 0.00 0.00 0.06 0.00 0.00 34.95 31.17 1bi9 s ARG 329 CO 0.32 -1.21 1.18 0.42 -2.50 0.00 0.00 175.30 173.51 1bi9 s ILE 330 N 5.03 4.39 -0.31 4.11 1.09 -1.26 -4.99 121.20 129.27 1bi9 s ILE 330 Ca 0.73 1.65 0.02 0.00 -1.10 0.00 0.00 60.65 61.96 1bi9 s ILE 330 Cb -0.27 -4.18 0.08 0.00 -1.06 0.00 0.00 42.46 37.02 1bi9 s ILE 330 CO 0.29 -0.27 -0.01 -0.69 -0.10 0.00 0.00 174.94 174.17 1bi9 s VAL 331 N 3.62 2.45 0.00 2.92 1.01 -1.26 -1.93 120.40 127.20 1bi9 s VAL 331 Ca 0.51 -1.88 0.00 0.00 0.00 0.00 0.00 61.98 60.60 1bi9 s VAL 331 Cb -0.17 -2.59 0.00 0.00 0.00 0.00 0.00 36.38 33.62 1bi9 s VAL 331 CO 0.14 -0.30 0.00 0.61 0.00 0.00 0.00 175.10 175.55 1bi9 n GLY 332 N 4.42 2.78 3.60 4.51 0.00 -1.12 -5.01 105.19 114.37 1bi9 n GLY 332 Ca -0.07 -1.11 -0.51 0.00 0.00 0.00 0.00 46.02 44.33 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 -1.12 1.81 0.07 1.61 2.88 -1.26 -4.56 113.62 113.04 1bi9 n SER 333 Ca 0.00 1.11 0.04 0.00 -1.33 0.00 0.00 58.87 58.70 1bi9 n SER 333 Cb 0.00 -1.21 0.24 0.00 -0.75 0.00 0.00 64.21 62.48 1bi9 n SER 333 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1bi9 n PRO 334 N 2.65 0.06 0.03 -1.46 -0.04 -1.26 -1.60 135.00 133.38 1bi9 n PRO 334 Ca 0.18 0.54 0.12 0.00 -0.04 0.00 0.00 63.50 64.30 1bi9 n PRO 334 Cb 0.20 -1.71 0.19 0.00 -0.04 0.00 0.00 33.50 32.14 1bi9 n PRO 334 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1bi9 n PHE 335 N -1.80 0.32 -2.49 0.54 3.72 -1.26 -0.75 117.46 115.74 1bi9 n PHE 335 Ca -0.01 0.09 -0.43 0.00 -0.05 0.00 0.00 57.45 57.06 1bi9 n PHE 335 Cb 0.04 -0.49 -0.02 0.00 -0.94 0.00 0.00 39.48 38.07 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 -3.74 6.80 0.00 4.37 2.15 -0.63 -4.88 116.67 120.75 1bi9 s ASP 336 Ca 0.08 1.23 0.00 0.00 0.43 0.00 0.00 52.55 54.29 1bi9 s ASP 336 Cb 0.15 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 40.23 1bi9 s ASP 336 CO 0.72 -0.96 0.21 -0.81 -0.17 0.00 0.00 175.17 174.15 1bi9 n PRO 337 N 7.05 0.00 0.00 4.34 -0.04 -1.26 -1.01 135.00 144.08 1bi9 n PRO 337 Ca 0.14 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.64 1bi9 n PRO 337 Cb 0.46 -1.22 -0.03 0.00 -0.04 0.00 0.00 33.50 32.66 1bi9 n PRO 337 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1bi9 n THR 338 N -0.68 0.00 -2.31 0.52 -2.24 -1.26 -4.98 114.28 103.33 1bi9 n THR 338 Ca 0.00 -0.33 -0.42 0.00 -2.27 0.00 0.00 64.05 61.02 1bi9 n THR 338 Cb 0.00 1.02 -0.03 0.00 -2.10 0.00 0.00 70.33 69.23 1bi9 n THR 338 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1bi9 s THR 339 N -1.63 3.99 -0.87 4.28 -4.23 -0.18 -4.80 115.64 112.20 1bi9 s THR 339 Ca 0.04 1.29 0.22 0.00 -1.18 0.00 0.00 61.69 62.06 1bi9 s THR 339 Cb 0.06 -3.83 -0.19 0.00 1.34 0.00 0.00 72.50 69.89 1bi9 s THR 339 CO 0.30 -0.05 0.97 -0.62 -0.54 0.00 0.00 174.62 174.67 1bi9 n GLU 340 N 5.99 0.09 -3.72 3.99 1.02 -0.81 -4.76 120.64 122.43 1bi9 n GLU 340 Ca 0.13 -0.02 -0.13 0.00 -0.02 0.00 0.00 57.16 57.13 1bi9 n GLU 340 Cb 0.44 -1.51 -0.13 0.00 -0.02 0.00 0.00 31.44 30.22 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 -3.07 0.17 0.00 3.49 0.74 -1.12 -4.83 119.66 115.04 1bi9 s GLN 341 Ca 0.07 0.53 0.00 0.00 0.05 0.00 0.00 55.36 56.00 1bi9 s GLN 341 Cb 0.16 -0.13 0.00 0.00 1.10 0.00 0.00 33.01 34.14 1bi9 s GLN 341 CO 0.84 -0.18 0.00 0.41 -0.55 0.00 0.00 175.29 175.80 1bi9 n GLY 342 N 4.40 2.13 3.83 2.59 0.00 -1.26 -2.77 105.19 114.11 1bi9 n GLY 342 Ca -0.23 -2.14 -0.29 0.00 0.00 0.00 0.00 46.02 43.37 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 -1.94 1.47 0.66 1.61 0.04 -1.25 -4.81 135.00 130.77 1bi9 s PRO 343 Ca 0.00 0.21 -0.11 0.00 0.04 0.00 0.00 61.00 61.14 1bi9 s PRO 343 Cb 0.00 -1.88 -0.01 0.00 0.04 0.00 0.00 34.50 32.64 1bi9 s PRO 343 CO 0.00 -1.96 1.05 -0.65 0.04 0.00 0.00 177.00 175.48 1bi9 s GLN 344 N -5.41 3.24 0.22 4.56 -1.52 0.59 -4.89 119.66 116.46 1bi9 s GLN 344 Ca 0.63 0.72 -0.07 0.00 -1.95 0.00 0.00 55.36 54.69 1bi9 s GLN 344 Cb -0.13 -2.04 0.19 0.00 -0.22 0.00 0.00 33.01 30.80 1bi9 s GLN 344 CO 0.52 -0.82 1.82 0.97 -0.25 0.00 0.00 175.29 177.52 1bi9 h ILE 345 N -0.50 1.26 -4.73 1.08 6.09 -1.88 -3.41 117.51 115.42 1bi9 h ILE 345 Ca -0.44 -0.74 -0.47 0.00 -1.37 0.00 0.00 64.86 61.83 1bi9 h ILE 345 Cb 1.21 0.18 -0.12 0.00 0.47 0.00 0.00 36.82 38.56 1bi9 h ILE 345 CO 0.61 0.32 -0.44 0.47 -3.07 0.00 0.00 178.15 176.04 1bi9 n ASP 346 N -4.30 -0.15 0.11 2.19 8.00 -1.26 -4.72 116.55 116.42 1bi9 n ASP 346 Ca 0.08 -3.07 -0.19 0.00 0.71 0.00 0.00 54.79 52.32 1bi9 n ASP 346 Cb 0.14 1.42 -0.15 0.00 -0.02 0.00 0.00 41.12 42.51 1bi9 n ASP 346 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 1bi9 h LYS 347 N 0.00 0.36 -0.12 -1.24 3.64 -1.98 -1.95 116.57 115.28 1bi9 h LYS 347 Ca -0.24 -0.61 0.01 0.00 -1.27 0.00 0.00 60.65 58.54 1bi9 h LYS 347 Cb 1.14 0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 33.17 1bi9 h LYS 347 CO 0.37 1.27 0.03 -0.22 -2.27 0.00 0.00 179.45 178.62 1bi9 h LYS 348 N 0.10 0.08 -0.07 1.90 3.64 -1.99 0.29 116.57 120.52 1bi9 h LYS 348 Ca -0.20 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.17 1bi9 h LYS 348 Cb 2.05 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 33.85 1bi9 h LYS 348 CO 0.22 0.05 0.03 0.37 -2.27 0.00 0.00 179.45 177.85 1bi9 h GLN 349 N 0.08 0.10 -0.17 1.90 5.75 -1.96 -1.53 115.11 119.27 1bi9 h GLN 349 Ca 0.05 -0.02 0.03 0.00 -0.15 0.00 0.00 58.65 58.56 1bi9 h GLN 349 Cb 0.04 -0.02 -0.05 0.00 1.07 0.00 0.00 27.48 28.53 1bi9 h GLN 349 CO -0.07 0.20 -0.37 -0.92 -2.65 0.00 0.00 178.83 175.03 1bi9 h TYR 350 N -0.04 -1.11 -0.53 3.99 3.20 -0.90 -1.54 116.97 120.04 1bi9 h TYR 350 Ca 0.02 0.05 0.10 0.00 3.14 0.00 0.00 58.73 62.03 1bi9 h TYR 350 Cb 0.14 0.50 -0.08 0.00 1.54 0.00 0.00 36.73 38.84 1bi9 h TYR 350 CO -0.03 -0.35 0.10 -0.91 -1.64 0.00 0.00 178.16 175.34 1bi9 h ASN 351 N -0.34 -0.02 -1.00 -2.11 2.35 -0.40 -1.73 115.58 112.34 1bi9 h ASN 351 Ca 0.03 0.10 0.12 0.00 -0.55 0.00 0.00 56.30 56.00 1bi9 h ASN 351 Cb 0.43 0.14 -0.08 0.00 0.05 0.00 0.00 38.32 38.86 1bi9 h ASN 351 CO -0.34 0.01 0.63 0.50 -1.65 0.00 0.00 177.43 176.59 1bi9 h LYS 352 N 0.23 0.96 -0.09 0.81 3.64 -0.72 -0.13 116.57 121.27 1bi9 h LYS 352 Ca 0.27 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.56 1bi9 h LYS 352 Cb 0.38 -0.22 -0.00 0.00 -0.41 0.00 0.00 32.23 31.99 1bi9 h LYS 352 CO -0.36 0.63 -0.07 0.82 -2.27 0.00 0.00 179.45 178.20 1bi9 h ILE 353 N 0.99 1.35 0.45 2.00 2.04 -0.44 -2.43 117.51 121.47 1bi9 h ILE 353 Ca 0.49 -1.19 -0.02 0.00 1.00 0.00 0.00 64.86 65.15 1bi9 h ILE 353 Cb 0.49 1.94 -0.00 0.00 -0.74 0.00 0.00 36.82 38.51 1bi9 h ILE 353 CO -0.26 0.33 -0.29 -0.07 0.00 0.00 0.00 178.15 177.86 1bi9 h LEU 354 N -0.19 -0.74 -1.80 1.44 3.38 -0.74 0.27 115.31 116.92 1bi9 h LEU 354 Ca 0.02 0.04 0.30 0.00 0.09 0.00 0.00 57.88 58.33 1bi9 h LEU 354 Cb 0.57 0.22 -0.06 0.00 0.09 0.00 0.00 40.66 41.48 1bi9 h LEU 354 CO 0.02 -0.44 0.76 -0.33 0.09 0.00 0.00 178.44 178.54 1bi9 h GLU 355 N -0.70 0.12 -0.09 1.13 3.07 -1.16 0.84 114.58 117.80 1bi9 h GLU 355 Ca -0.06 -0.01 -0.23 0.00 -0.50 0.00 0.00 59.36 58.56 1bi9 h GLU 355 Cb 0.56 -0.03 0.01 0.00 -0.84 0.00 0.00 28.75 28.46 1bi9 h GLU 355 CO 0.05 0.08 -0.86 1.25 -1.40 0.00 0.00 179.01 178.13 1bi9 h LEU 356 N 0.12 0.82 -0.62 1.33 5.85 -0.99 -2.66 115.31 119.17 1bi9 h LEU 356 Ca 0.55 -0.58 -0.07 0.00 0.84 0.00 0.00 57.88 58.61 1bi9 h LEU 356 Cb 1.93 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 42.69 1bi9 h LEU 356 CO -0.10 1.38 0.11 0.40 -0.34 0.00 0.00 178.44 179.89 1bi9 h ILE 357 N 0.43 1.26 -0.65 4.05 2.04 0.42 -2.45 117.51 122.61 1bi9 h ILE 357 Ca -0.07 -0.99 0.06 0.00 1.00 0.00 0.00 64.86 64.86 1bi9 h ILE 357 Cb 1.49 0.70 -0.06 0.00 -0.74 0.00 0.00 36.82 38.21 1bi9 h ILE 357 CO 0.17 0.37 0.34 1.56 0.00 0.00 0.00 178.15 180.59 1bi9 h GLN 358 N 0.93 0.61 -0.03 2.37 4.20 -0.66 -2.44 115.11 120.09 1bi9 h GLN 358 Ca 0.19 -0.04 0.02 0.00 0.06 0.00 0.00 58.65 58.88 1bi9 h GLN 358 Cb 0.41 -0.14 -0.05 0.00 0.30 0.00 0.00 27.48 28.01 1bi9 h GLN 358 CO 0.01 0.40 -0.44 1.03 -0.67 0.00 0.00 178.83 179.17 1bi9 h SER 359 N 0.63 -1.36 -0.69 1.46 0.87 -1.08 0.63 113.55 114.01 1bi9 h SER 359 Ca 0.30 0.15 0.08 0.00 -1.23 0.00 0.00 61.79 61.09 1bi9 h SER 359 Cb 0.22 0.52 -0.11 0.00 -0.44 0.00 0.00 62.40 62.59 1bi9 h SER 359 CO -0.20 -0.41 -0.51 1.23 -0.53 0.00 0.00 176.83 176.41 1bi9 h GLY 360 N -0.52 -0.68 0.16 5.77 0.00 -1.24 0.74 103.07 107.30 1bi9 h GLY 360 Ca 0.01 0.67 0.10 0.00 0.00 0.00 0.00 47.33 48.11 1bi9 h GLY 360 CO -0.31 -0.09 -0.02 -2.08 0.00 0.00 0.00 176.54 174.04 1bi9 h VAL 361 N -0.19 0.60 -0.91 4.60 2.07 -1.10 -2.04 116.25 119.28 1bi9 h VAL 361 Ca 0.16 -0.03 -0.49 0.00 0.82 0.00 0.00 66.70 67.16 1bi9 h VAL 361 Cb 0.53 0.50 -0.15 0.00 -1.52 0.00 0.00 31.29 30.65 1bi9 h VAL 361 CO -0.77 0.02 0.57 0.00 0.02 0.00 0.00 177.57 177.42 1bi9 n ALA 362 N -2.69 6.51 -0.94 1.67 0.00 0.21 -3.44 120.51 121.83 1bi9 n ALA 362 Ca 0.05 -3.01 0.00 0.00 0.00 0.00 0.00 53.44 50.48 1bi9 n ALA 362 Cb 0.26 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.45 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 1.25 0.00 0.00 0.00 2.13 -0.80 -4.86 120.64 118.36 1bi9 n GLU 363 Ca 0.50 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.32 1bi9 n GLU 363 Cb 0.56 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.27 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 4.27 3.58 8.31 0.00 -1.05 -5.04 105.19 115.26 1bi9 n GLY 364 Ca 0.00 -0.84 -0.49 0.00 0.00 0.00 0.00 46.02 44.68 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 -0.89 -2.61 4.61 0.00 -1.01 -4.89 120.51 115.72 1bi9 n ALA 365 Ca 0.00 0.47 -0.43 0.00 0.00 0.00 0.00 53.44 53.48 1bi9 n ALA 365 Cb 0.00 -2.02 -0.04 0.00 0.00 0.00 0.00 19.45 17.39 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 -0.31 3.41 -0.90 0.00 2.20 -1.00 -4.37 119.74 118.77 1bi9 s LYS 366 Ca 0.74 -0.10 -0.24 0.00 -0.36 0.00 0.00 55.97 56.01 1bi9 s LYS 366 Cb -0.87 -4.01 -0.03 0.00 -1.51 0.00 0.00 37.83 31.41 1bi9 s LYS 366 CO 0.52 -1.39 1.86 -1.17 -0.36 0.00 0.00 175.35 174.80 1bi9 s LEU 367 N 3.90 3.23 0.38 5.43 2.96 -1.26 -1.57 118.68 131.75 1bi9 s LEU 367 Ca 0.33 -0.73 0.05 0.00 -0.22 0.00 0.00 54.13 53.56 1bi9 s LEU 367 Cb -0.11 -2.56 0.74 0.00 0.50 0.00 0.00 46.19 44.76 1bi9 s LEU 367 CO 0.22 -2.52 2.02 -0.33 -1.32 0.00 0.00 176.35 174.43 1bi9 h GLU 368 N 11.27 0.67 -1.66 1.98 4.39 -1.58 -3.47 114.58 126.18 1bi9 h GLU 368 Ca 0.09 -0.05 0.24 0.00 0.34 0.00 0.00 59.36 59.97 1bi9 h GLU 368 Cb 1.02 -0.15 -0.17 0.00 -0.10 0.00 0.00 28.75 29.35 1bi9 h GLU 368 CO 1.25 0.46 0.74 0.00 -1.16 0.00 0.00 179.01 180.29 1bi9 n GLY 370 N -0.20 -1.85 0.00 0.00 0.00 -1.26 -2.73 105.19 99.15 1bi9 n GLY 370 Ca -0.03 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.95 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 -4.01 0.17 3.38 -0.02 0.00 -1.26 -4.80 105.19 98.66 1bi9 n GLY 371 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.82 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 1.68 0.06 1.61 -2.85 -1.26 -4.84 119.74 114.14 1bi9 s LYS 372 Ca 0.00 -1.97 -0.01 0.00 -1.00 0.00 0.00 55.97 52.99 1bi9 s LYS 372 Cb 0.00 -0.26 0.02 0.00 -2.06 0.00 0.00 37.83 35.53 1bi9 s LYS 372 CO 0.00 -0.44 0.07 0.41 0.10 0.00 0.00 175.35 175.49 1bi9 n GLY 373 N -0.67 -1.83 0.00 0.59 0.00 -1.26 -2.03 105.19 99.99 1bi9 n GLY 373 Ca -0.01 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.46 1bi9 n GLY 373 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1bi9 n LEU 374 N 0.00 0.00 0.00 0.99 4.77 -0.55 -4.51 117.00 117.70 1bi9 n LEU 374 Ca 0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 1bi9 n LEU 374 Cb 0.03 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 1bi9 n LEU 374 CO 0.02 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.69 1bi9 n GLY 375 N 5.00 1.65 3.93 -0.72 0.00 -1.26 -5.09 105.19 108.69 1bi9 n GLY 375 Ca 0.00 -1.95 -0.25 0.00 0.00 0.00 0.00 46.02 43.82 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 2.90 3.32 0.26 1.61 3.52 -1.26 -4.91 118.95 124.38 1bi9 s ARG 376 Ca 0.00 -0.10 0.00 0.00 -0.13 0.00 0.00 55.73 55.50 1bi9 s ARG 376 Cb 0.00 -2.46 0.00 0.00 -1.56 0.00 0.00 34.95 30.93 1bi9 s ARG 376 CO 0.00 -0.23 0.00 1.63 -0.81 0.00 0.00 175.30 175.89 1bi9 n LYS 377 N -2.18 -1.88 -1.33 5.12 5.02 -1.26 -5.01 118.16 116.64 1bi9 n LYS 377 Ca 0.00 1.45 0.18 0.00 -2.02 0.00 0.00 58.31 57.92 1bi9 n LYS 377 Cb 0.56 -1.78 -0.05 0.00 -0.02 0.00 0.00 35.03 33.74 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 -1.83 -2.12 2.73 0.72 0.00 -1.12 -4.63 105.19 98.93 1bi9 n GLY 378 Ca 0.00 -1.17 -0.25 0.00 0.00 0.00 0.00 46.02 44.60 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 -4.06 3.33 -3.01 1.61 3.72 -0.80 -4.88 117.46 113.37 1bi9 n PHE 379 Ca -0.01 -3.70 -0.39 0.00 -0.05 0.00 0.00 57.45 53.30 1bi9 n PHE 379 Cb 0.61 -0.37 -0.06 0.00 -0.94 0.00 0.00 39.48 38.72 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 -3.36 3.90 -0.01 1.38 0.40 -1.26 -0.30 117.98 118.73 1bi9 s PHE 380 Ca 0.47 1.60 0.04 0.00 -0.60 0.00 0.00 56.93 58.45 1bi9 s PHE 380 Cb 0.33 -2.74 -0.01 0.00 0.51 0.00 0.00 43.02 41.10 1bi9 s PHE 380 CO -0.14 0.52 -0.15 0.42 0.70 0.00 0.00 175.22 176.58 1bi9 s ILE 381 N -1.15 1.16 0.35 0.64 1.01 -1.26 -1.48 121.20 120.47 1bi9 s ILE 381 Ca 0.35 -0.62 -0.26 0.00 0.00 0.00 0.00 60.65 60.12 1bi9 s ILE 381 Cb -0.23 -0.97 -0.09 0.00 0.01 0.00 0.00 42.46 41.18 1bi9 s ILE 381 CO 0.26 0.33 1.05 -1.83 0.00 0.00 0.00 174.94 174.74 1bi9 s GLU 382 N -0.31 4.39 -0.43 2.79 -1.05 -0.86 -4.89 118.70 118.34 1bi9 s GLU 382 Ca 0.05 1.57 -0.31 0.00 -0.15 0.00 0.00 54.97 56.13 1bi9 s GLU 382 Cb -0.06 -2.80 -0.10 0.00 -0.44 0.00 0.00 34.13 30.73 1bi9 s GLU 382 CO -0.00 0.05 2.31 -2.30 0.95 0.00 0.00 175.26 176.26 1bi9 n PRO 383 N 0.45 1.12 -3.77 -4.83 -0.02 -1.26 -4.28 135.00 122.41 1bi9 n PRO 383 Ca 0.02 0.23 -0.34 0.00 -2.02 0.00 0.00 63.50 61.40 1bi9 n PRO 383 Cb 0.48 -2.74 -0.05 0.00 -0.02 0.00 0.00 33.50 31.17 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 8.88 5.31 -0.08 3.45 2.01 -0.71 -3.97 115.64 130.53 1bi9 s THR 384 Ca 1.08 0.14 -0.01 0.00 0.31 0.00 0.00 61.69 63.21 1bi9 s THR 384 Cb -0.64 -3.56 0.03 0.00 0.01 0.00 0.00 72.50 68.33 1bi9 s THR 384 CO 0.41 0.36 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.99 1bi9 s VAL 385 N -1.31 0.51 -0.02 3.82 1.01 -1.11 -2.19 120.40 121.12 1bi9 s VAL 385 Ca 0.28 0.02 -0.01 0.00 0.00 0.00 0.00 61.98 62.27 1bi9 s VAL 385 Cb -0.13 -0.63 -0.04 0.00 0.00 0.00 0.00 36.38 35.58 1bi9 s VAL 385 CO 0.16 0.28 0.09 -0.36 0.00 0.00 0.00 175.10 175.27 1bi9 s PHE 386 N 1.81 3.31 0.43 5.22 0.08 0.56 -1.35 117.98 128.05 1bi9 s PHE 386 Ca 0.03 0.23 0.02 0.00 0.12 0.00 0.00 56.93 57.34 1bi9 s PHE 386 Cb -0.13 -1.76 -0.01 0.00 -0.57 0.00 0.00 43.02 40.56 1bi9 s PHE 386 CO -0.05 0.56 0.08 0.45 -0.10 0.00 0.00 175.22 176.16 1bi9 n SER 387 N 1.27 2.10 -4.04 1.36 2.88 -0.61 -1.26 113.62 115.32 1bi9 n SER 387 Ca -0.14 -3.11 -0.31 0.00 -1.33 0.00 0.00 58.87 53.98 1bi9 n SER 387 Cb 0.53 0.73 -0.08 0.00 -0.75 0.00 0.00 64.21 64.64 1bi9 n SER 387 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1bi9 n ASN 388 N -1.44 -0.34 -4.84 -3.46 4.13 -1.25 -2.38 115.26 105.69 1bi9 n ASN 388 Ca -0.12 -1.06 -0.36 0.00 1.68 0.00 0.00 54.58 54.73 1bi9 n ASN 388 Cb 0.60 -1.33 -0.06 0.00 -1.54 0.00 0.00 39.78 37.45 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 -3.54 4.83 0.11 2.41 1.01 -1.24 -4.43 120.40 119.56 1bi9 s VAL 389 Ca 0.34 0.91 0.08 0.00 0.00 0.00 0.00 61.98 63.32 1bi9 s VAL 389 Cb -0.20 -3.77 -0.04 0.00 0.00 0.00 0.00 36.38 32.38 1bi9 s VAL 389 CO 0.85 0.31 -0.21 0.42 0.00 0.00 0.00 175.10 176.47 1bi9 s THR 390 N -1.39 1.75 0.33 3.92 -4.23 -1.26 -4.66 115.64 110.09 1bi9 s THR 390 Ca 0.36 -1.60 0.11 0.00 -1.18 0.00 0.00 61.69 59.38 1bi9 s THR 390 Cb -0.16 -1.61 0.32 0.00 1.34 0.00 0.00 72.50 72.39 1bi9 s THR 390 CO 0.19 -0.09 1.72 0.44 -0.54 0.00 0.00 174.62 176.34 1bi9 h ASP 391 N 3.95 0.63 0.12 3.99 5.19 -1.98 -0.87 116.42 127.44 1bi9 h ASP 391 Ca -0.46 0.14 -0.02 0.00 -0.62 0.00 0.00 57.03 56.07 1bi9 h ASP 391 Cb 1.18 0.05 -0.00 0.00 0.18 0.00 0.00 39.33 40.74 1bi9 h ASP 391 CO 0.41 0.07 -0.09 -2.24 -3.12 0.00 0.00 179.24 174.27 1bi9 h ASP 392 N 0.53 0.00 -3.86 6.45 2.03 -1.97 -3.38 116.42 116.23 1bi9 h ASP 392 Ca 0.66 0.00 -0.53 0.00 -0.73 0.00 0.00 57.03 56.42 1bi9 h ASP 392 Cb 1.32 0.00 0.20 0.00 -0.83 0.00 0.00 39.33 40.02 1bi9 h ASP 392 CO -0.48 0.09 -0.07 0.23 -1.03 0.00 0.00 179.24 177.98 1bi9 n MET 393 N -4.24 -0.14 -0.01 4.15 2.81 -0.33 -4.85 117.12 114.50 1bi9 n MET 393 Ca -0.03 0.02 -0.18 0.00 -1.81 0.00 0.00 57.70 55.71 1bi9 n MET 393 Cb 0.17 -2.17 -0.08 0.00 -0.71 0.00 0.00 33.22 30.43 1bi9 n MET 393 CO 0.00 0.00 0.00 -0.09 1.51 0.00 0.00 175.97 177.39 1bi9 h ARG 394 N -1.34 0.70 0.00 0.03 2.43 -1.87 -2.39 114.38 111.94 1bi9 h ARG 394 Ca -0.44 -0.62 -0.02 0.00 -0.81 0.00 0.00 59.98 58.09 1bi9 h ARG 394 Cb 1.29 0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 30.98 1bi9 h ARG 394 CO 0.40 1.23 -0.10 -0.84 -1.51 0.00 0.00 179.97 179.15 1bi9 h ILE 395 N 0.39 0.93 -0.04 1.20 3.07 -1.88 0.78 117.51 121.95 1bi9 h ILE 395 Ca -0.07 -0.37 -0.26 0.00 1.55 0.00 0.00 64.86 65.71 1bi9 h ILE 395 Cb 1.42 1.21 0.02 0.00 -0.27 0.00 0.00 36.82 39.19 1bi9 h ILE 395 CO 0.16 0.10 -0.97 0.00 -1.05 0.00 0.00 178.15 176.39 1bi9 h ALA 396 N 1.90 0.18 0.11 0.16 0.00 -1.80 -3.32 119.26 116.47 1bi9 h ALA 396 Ca -0.00 -0.67 -0.27 0.00 0.00 0.00 0.00 54.91 53.96 1bi9 h ALA 396 Cb 0.20 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 1bi9 h ALA 396 CO 0.01 0.69 -1.29 0.87 0.00 0.00 0.00 179.25 179.53 1bi9 h LYS 397 N 0.44 0.22 -5.57 0.00 1.57 -0.82 -3.44 116.57 108.98 1bi9 h LYS 397 Ca -0.11 -0.38 -0.60 0.00 -1.87 0.00 0.00 60.65 57.69 1bi9 h LYS 397 Cb 1.62 0.14 -0.09 0.00 0.08 0.00 0.00 32.23 33.98 1bi9 h LYS 397 CO 0.19 1.15 -0.32 -1.21 -0.57 0.00 0.00 179.45 178.69 1bi9 s GLU 398 N -2.65 4.15 0.64 3.15 2.02 0.26 -5.06 118.70 121.20 1bi9 s GLU 398 Ca -0.05 0.11 -0.17 0.00 0.02 0.00 0.00 54.97 54.89 1bi9 s GLU 398 Cb 0.07 -3.38 -0.01 0.00 0.10 0.00 0.00 34.13 30.91 1bi9 s GLU 398 CO 0.87 0.34 1.18 -2.00 0.02 0.00 0.00 175.26 175.66 1bi9 s GLU 399 N 0.16 2.74 -0.53 1.61 2.12 -1.26 -4.57 118.70 118.97 1bi9 s GLU 399 Ca 0.17 1.69 -0.03 0.00 0.36 0.00 0.00 54.97 57.17 1bi9 s GLU 399 Cb -0.13 -1.91 0.14 0.00 0.26 0.00 0.00 34.13 32.48 1bi9 s GLU 399 CO 0.05 -1.35 0.33 0.42 -0.54 0.00 0.00 175.26 174.17 1bi9 s ILE 400 N -1.88 3.49 0.00 -3.70 1.09 -1.26 -4.96 121.20 113.98 1bi9 s ILE 400 Ca 0.74 -2.60 0.00 0.00 -1.10 0.00 0.00 60.65 57.69 1bi9 s ILE 400 Cb -0.27 -3.33 0.00 0.00 -1.06 0.00 0.00 42.46 37.80 1bi9 s ILE 400 CO 0.38 -0.80 1.41 2.22 -0.10 0.00 0.00 174.94 178.05 1bi9 n PHE 401 N 3.93 0.00 -4.01 3.97 -1.74 -1.26 -4.71 117.46 113.64 1bi9 n PHE 401 Ca 0.04 -0.71 -0.11 0.00 -0.56 0.00 0.00 57.45 56.11 1bi9 n PHE 401 Cb 0.39 -0.39 -0.03 0.00 1.52 0.00 0.00 39.48 40.96 1bi9 n PHE 401 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1bi9 n GLY 402 N 1.34 2.73 2.74 4.97 0.00 -1.16 -2.64 105.19 113.17 1bi9 n GLY 402 Ca 0.00 -1.64 -0.22 0.00 0.00 0.00 0.00 46.02 44.16 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 -0.41 1.71 -4.00 1.61 -0.04 -1.18 -4.36 135.00 128.34 1bi9 n PRO 403 Ca 0.02 -1.38 -0.20 0.00 -0.04 0.00 0.00 63.50 61.90 1bi9 n PRO 403 Cb 0.40 -2.45 -0.17 0.00 -0.04 0.00 0.00 33.50 31.25 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 3.87 0.40 -0.04 0.52 1.01 -1.26 -1.73 120.40 123.16 1bi9 s VAL 404 Ca 0.37 -0.00 0.04 0.00 0.00 0.00 0.00 61.98 62.39 1bi9 s VAL 404 Cb 0.09 -0.48 -0.00 0.00 0.00 0.00 0.00 36.38 35.99 1bi9 s VAL 404 CO -0.00 0.21 -0.16 0.00 0.00 0.00 0.00 175.10 175.15 1bi9 s GLN 405 N 1.23 1.75 -0.16 2.72 -2.07 -0.93 -4.64 119.66 117.56 1bi9 s GLN 405 Ca -0.06 -0.58 -0.05 0.00 -1.82 0.00 0.00 55.36 52.84 1bi9 s GLN 405 Cb -0.14 -1.52 -0.03 0.00 -1.09 0.00 0.00 33.01 30.23 1bi9 s GLN 405 CO -0.02 0.22 0.00 -1.21 -1.32 0.00 0.00 175.29 172.97 1bi9 s GLU 406 N 0.10 3.75 -0.23 9.60 2.02 -0.83 -0.32 118.70 132.79 1bi9 s GLU 406 Ca -0.05 -0.44 -0.05 0.00 0.02 0.00 0.00 54.97 54.45 1bi9 s GLU 406 Cb -0.12 -3.03 -0.02 0.00 0.10 0.00 0.00 34.13 31.07 1bi9 s GLU 406 CO 0.02 0.29 -0.01 0.42 0.02 0.00 0.00 175.26 176.00 1bi9 s ILE 407 N 0.28 3.69 0.23 -1.63 1.01 -0.39 -0.54 121.20 123.84 1bi9 s ILE 407 Ca -0.00 -0.39 0.09 0.00 0.00 0.00 0.00 60.65 60.36 1bi9 s ILE 407 Cb -0.13 -2.69 -0.04 0.00 0.01 0.00 0.00 42.46 39.60 1bi9 s ILE 407 CO 0.02 0.40 -0.07 -0.76 0.00 0.00 0.00 174.94 174.53 1bi9 s LEU 408 N 1.47 3.03 -0.04 2.97 1.02 0.08 -3.66 118.68 123.56 1bi9 s LEU 408 Ca 0.05 -0.65 0.04 0.00 0.02 0.00 0.00 54.13 53.59 1bi9 s LEU 408 Cb -0.15 -1.63 -0.03 0.00 0.02 0.00 0.00 46.19 44.41 1bi9 s LEU 408 CO -0.01 0.05 -0.14 0.00 0.02 0.00 0.00 176.35 176.28 1bi9 s ARG 409 N -3.26 2.48 0.08 1.70 1.70 -1.26 0.35 118.95 120.73 1bi9 s ARG 409 Ca 0.28 -0.72 -0.00 0.00 -0.47 0.00 0.00 55.73 54.82 1bi9 s ARG 409 Cb -0.07 -2.37 -0.04 0.00 -0.57 0.00 0.00 34.95 31.89 1bi9 s ARG 409 CO 0.17 0.62 -0.03 -0.59 -1.08 0.00 0.00 175.30 174.39 1bi9 s PHE 410 N -0.76 0.67 0.01 5.89 -0.71 -0.73 -4.89 117.98 117.45 1bi9 s PHE 410 Ca 0.12 -1.05 -0.01 0.00 -1.04 0.00 0.00 56.93 54.94 1bi9 s PHE 410 Cb -0.11 -0.44 -0.00 0.00 -1.21 0.00 0.00 43.02 41.26 1bi9 s PHE 410 CO 0.01 -0.34 -0.03 1.17 -1.34 0.00 0.00 175.22 174.70 1bi9 n LYS 411 N 0.04 0.04 -1.97 1.99 4.81 -1.26 -1.72 118.16 120.09 1bi9 n LYS 411 Ca -0.12 0.02 -0.28 0.00 -0.87 0.00 0.00 58.31 57.05 1bi9 n LYS 411 Cb 0.61 -0.32 0.10 0.00 0.02 0.00 0.00 35.03 35.45 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 -1.36 2.05 -0.12 3.15 -4.23 -1.26 -4.92 115.64 108.96 1bi9 s THR 412 Ca -0.02 -0.06 -0.09 0.00 -1.18 0.00 0.00 61.69 60.33 1bi9 s THR 412 Cb 0.00 -2.99 -0.08 0.00 1.34 0.00 0.00 72.50 70.77 1bi9 s THR 412 CO 0.03 0.00 0.21 -0.03 -0.54 0.00 0.00 174.62 174.30 1bi9 h MET 413 N -1.06 0.00 -0.99 3.99 4.05 -2.00 -3.27 114.93 115.65 1bi9 h MET 413 Ca -0.45 0.00 0.35 0.00 -0.28 0.00 0.00 59.70 59.31 1bi9 h MET 413 Cb 1.31 0.00 -0.16 0.00 -0.80 0.00 0.00 31.60 31.95 1bi9 h MET 413 CO 0.60 0.31 0.53 -0.44 0.23 0.00 0.00 176.91 178.13 1bi9 h ASP 414 N -1.00 0.40 0.21 1.39 3.32 -1.99 0.13 116.42 118.88 1bi9 h ASP 414 Ca -0.01 0.22 -0.00 0.00 0.02 0.00 0.00 57.03 57.25 1bi9 h ASP 414 Cb 0.34 0.20 -0.02 0.00 0.22 0.00 0.00 39.33 40.07 1bi9 h ASP 414 CO -0.01 -0.24 -0.27 -0.08 -1.72 0.00 0.00 179.24 176.93 1bi9 h GLU 415 N 0.21 -0.47 -0.62 3.56 4.81 -1.97 0.37 114.58 120.46 1bi9 h GLU 415 Ca 0.76 0.03 0.12 0.00 -0.13 0.00 0.00 59.36 60.14 1bi9 h GLU 415 Cb 1.81 0.11 -0.12 0.00 0.63 0.00 0.00 28.75 31.18 1bi9 h GLU 415 CO -0.67 -0.31 -0.20 0.28 -0.73 0.00 0.00 179.01 177.38 1bi9 h VAL 416 N -0.49 0.32 0.29 0.32 2.07 -1.06 0.38 116.25 118.08 1bi9 h VAL 416 Ca -0.02 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.50 1bi9 h VAL 416 Cb 0.44 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.50 1bi9 h VAL 416 CO -0.07 0.00 -0.34 0.40 0.02 0.00 0.00 177.57 177.58 1bi9 h ILE 417 N -0.04 0.29 -0.41 4.57 2.04 -0.89 0.85 117.51 123.93 1bi9 h ILE 417 Ca 0.29 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.16 1bi9 h ILE 417 Cb 0.49 0.29 -0.02 0.00 -0.74 0.00 0.00 36.82 36.84 1bi9 h ILE 417 CO -0.66 0.00 0.26 -0.33 0.00 0.00 0.00 178.15 177.42 1bi9 h GLU 418 N -0.68 0.52 0.71 2.37 3.07 0.46 0.23 114.58 121.26 1bi9 h GLU 418 Ca -0.01 -0.03 -0.03 0.00 -0.50 0.00 0.00 59.36 58.78 1bi9 h GLU 418 Cb 0.63 -0.12 0.01 0.00 -0.84 0.00 0.00 28.75 28.43 1bi9 h GLU 418 CO -0.10 0.35 -0.34 0.00 -1.40 0.00 0.00 179.01 177.52 1bi9 h ARG 419 N 0.54 -0.92 -0.68 2.33 3.08 -0.01 -2.80 114.38 115.92 1bi9 h ARG 419 Ca 0.15 0.06 0.03 0.00 0.07 0.00 0.00 59.98 60.30 1bi9 h ARG 419 Cb -0.05 0.21 -0.04 0.00 0.08 0.00 0.00 29.97 30.16 1bi9 h ARG 419 CO -0.04 -0.61 0.42 0.00 -1.07 0.00 0.00 179.97 178.68 1bi9 h ALA 420 N -0.71 0.90 -0.02 0.04 0.00 0.82 -2.18 119.26 118.10 1bi9 h ALA 420 Ca -0.10 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.80 1bi9 h ALA 420 Cb 0.74 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 1bi9 h ALA 420 CO 0.16 0.18 0.04 -0.91 0.00 0.00 0.00 179.25 178.72 1bi9 h ASN 421 N 0.82 0.00 -1.91 0.00 2.35 -0.47 -3.41 115.58 112.96 1bi9 h ASN 421 Ca 0.28 0.00 -0.53 0.00 -0.55 0.00 0.00 56.30 55.49 1bi9 h ASN 421 Cb 0.04 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.41 1bi9 h ASN 421 CO -0.12 0.00 1.52 0.21 -1.65 0.00 0.00 177.43 177.39 1bi9 s ASN 422 N -5.64 5.09 0.19 5.81 3.84 -0.82 -4.86 114.94 118.55 1bi9 s ASN 422 Ca -0.05 1.44 -0.23 0.00 0.21 0.00 0.00 52.86 54.23 1bi9 s ASN 422 Cb 0.14 -2.51 0.05 0.00 -0.55 0.00 0.00 41.25 38.38 1bi9 s ASN 422 CO 0.48 -2.32 0.81 -0.55 -2.79 0.00 0.00 177.10 172.73 1bi9 s SER 423 N 9.60 -0.28 -0.28 -4.21 0.15 -1.26 -5.08 113.70 112.34 1bi9 s SER 423 Ca 0.96 -0.41 0.03 0.00 0.70 0.00 0.00 55.95 57.23 1bi9 s SER 423 Cb -0.25 0.60 0.07 0.00 -1.71 0.00 0.00 66.02 64.73 1bi9 s SER 423 CO 0.31 -1.08 -0.06 -1.81 1.20 0.00 0.00 173.24 171.80 1bi9 s ASP 424 N -2.87 4.54 -0.14 5.45 1.01 -1.26 -4.92 116.67 118.48 1bi9 s ASP 424 Ca 0.10 -1.62 -0.05 0.00 0.71 0.00 0.00 52.55 51.68 1bi9 s ASP 424 Cb -0.03 -1.57 0.01 0.00 1.01 0.00 0.00 42.92 42.33 1bi9 s ASP 424 CO 0.01 -0.25 0.10 0.49 0.21 0.00 0.00 175.17 175.74 1bi9 n PHE 425 N 4.38 -1.39 0.00 4.23 3.01 -1.26 -4.98 117.46 121.44 1bi9 n PHE 425 Ca -0.09 0.60 0.00 0.00 1.01 0.00 0.00 57.45 58.98 1bi9 n PHE 425 Cb 0.42 -1.92 0.00 0.00 -0.01 0.00 0.00 39.48 37.97 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 0.92 3.96 3.60 1.37 0.00 -1.26 -4.90 105.19 108.88 1bi9 n GLY 426 Ca -0.01 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 45.05 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 -0.28 0.09 0.99 2.96 -1.26 -4.18 118.68 116.99 1bi9 s LEU 427 Ca 0.00 0.44 0.10 0.00 -0.22 0.00 0.00 54.13 54.45 1bi9 s LEU 427 Cb 0.00 1.40 -0.03 0.00 0.50 0.00 0.00 46.19 48.06 1bi9 s LEU 427 CO 0.00 -0.07 -0.25 -0.69 -1.32 0.00 0.00 176.35 174.02 1bi9 s VAL 428 N 1.32 2.08 -0.12 1.68 1.01 -1.04 -0.60 120.40 124.73 1bi9 s VAL 428 Ca -0.08 -1.54 -0.11 0.00 0.00 0.00 0.00 61.98 60.25 1bi9 s VAL 428 Cb -0.03 -1.82 0.03 0.00 0.00 0.00 0.00 36.38 34.56 1bi9 s VAL 428 CO -0.13 0.18 0.32 0.00 0.00 0.00 0.00 175.10 175.47 1bi9 s ALA 429 N -0.95 -0.79 -0.08 5.51 0.00 -0.75 -3.13 121.76 121.56 1bi9 s ALA 429 Ca 0.12 0.91 0.02 0.00 0.00 0.00 0.00 51.96 53.00 1bi9 s ALA 429 Cb -0.10 -0.53 -0.02 0.00 0.00 0.00 0.00 23.12 22.47 1bi9 s ALA 429 CO 0.04 -0.15 -0.13 0.00 0.00 0.00 0.00 175.76 175.52 1bi9 s ALA 430 N 0.18 2.69 0.02 0.00 0.00 -1.05 0.23 121.76 123.82 1bi9 s ALA 430 Ca -0.00 -0.94 0.05 0.00 0.00 0.00 0.00 51.96 51.07 1bi9 s ALA 430 Cb -0.02 -1.09 -0.02 0.00 0.00 0.00 0.00 23.12 21.99 1bi9 s ALA 430 CO 0.00 0.45 -0.15 0.08 0.00 0.00 0.00 175.76 176.14 1bi9 s VAL 431 N -0.36 1.21 -0.18 0.00 1.01 0.16 -1.42 120.40 120.82 1bi9 s VAL 431 Ca 0.04 -0.85 -0.00 0.00 0.00 0.00 0.00 61.98 61.17 1bi9 s VAL 431 Cb -0.12 -1.05 0.04 0.00 0.00 0.00 0.00 36.38 35.25 1bi9 s VAL 431 CO 0.02 0.18 -0.06 -0.36 0.00 0.00 0.00 175.10 174.89 1bi9 s PHE 432 N -0.61 1.85 0.22 5.22 0.40 -0.29 0.76 117.98 125.54 1bi9 s PHE 432 Ca 0.04 -1.21 -0.23 0.00 -0.60 0.00 0.00 56.93 54.93 1bi9 s PHE 432 Cb -0.07 -1.38 0.04 0.00 0.51 0.00 0.00 43.02 42.12 1bi9 s PHE 432 CO 0.00 -0.65 0.78 0.99 0.70 0.00 0.00 175.22 177.04 1bi9 s THR 433 N 1.58 0.00 0.00 0.64 2.01 -1.26 -2.33 115.64 116.28 1bi9 s THR 433 Ca -0.00 -0.75 0.00 0.00 0.31 0.00 0.00 61.69 61.24 1bi9 s THR 433 Cb -0.16 -1.84 0.00 0.00 0.01 0.00 0.00 72.50 70.51 1bi9 s THR 433 CO -0.08 0.00 0.45 0.59 -0.69 0.00 0.00 174.62 174.89 1bi9 n ASN 434 N -0.44 0.90 -4.56 3.53 3.02 -1.26 -4.90 115.26 111.55 1bi9 n ASN 434 Ca -0.06 -0.97 -0.43 0.00 -0.03 0.00 0.00 54.58 53.09 1bi9 n ASN 434 Cb 0.60 0.06 -0.05 0.00 -0.61 0.00 0.00 39.78 39.78 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 -0.06 6.49 0.21 6.41 -1.08 -1.26 -4.93 116.67 122.45 1bi9 s ASP 435 Ca 0.00 0.12 -0.09 0.00 -0.52 0.00 0.00 52.55 52.06 1bi9 s ASP 435 Cb 0.00 -2.40 0.26 0.00 -1.46 0.00 0.00 42.92 39.32 1bi9 s ASP 435 CO 0.00 -0.88 1.80 0.40 0.52 0.00 0.00 175.17 177.02 1bi9 h ILE 436 N 5.92 0.94 0.19 4.11 2.04 -1.99 -1.56 117.51 127.15 1bi9 h ILE 436 Ca -0.25 -0.23 -0.01 0.00 1.00 0.00 0.00 64.86 65.38 1bi9 h ILE 436 Cb 1.09 0.21 -0.00 0.00 -0.74 0.00 0.00 36.82 37.37 1bi9 h ILE 436 CO 0.96 0.12 -0.11 0.78 0.00 0.00 0.00 178.15 179.90 1bi9 h ASN 437 N 0.67 -0.27 -0.44 1.72 2.35 -1.99 -0.32 115.58 117.30 1bi9 h ASN 437 Ca 0.31 0.02 0.04 0.00 -0.55 0.00 0.00 56.30 56.12 1bi9 h ASN 437 Cb 0.23 0.08 -0.04 0.00 0.05 0.00 0.00 38.32 38.63 1bi9 h ASN 437 CO -0.20 -0.18 0.20 0.11 -1.65 0.00 0.00 177.43 175.72 1bi9 h LYS 438 N -0.28 0.40 -0.49 0.81 1.57 -1.92 0.32 116.57 116.98 1bi9 h LYS 438 Ca -0.02 -0.02 0.07 0.00 -1.87 0.00 0.00 60.65 58.81 1bi9 h LYS 438 Cb 0.23 -0.09 -0.06 0.00 0.08 0.00 0.00 32.23 32.39 1bi9 h LYS 438 CO 0.02 0.26 0.14 0.00 -0.57 0.00 0.00 179.45 179.31 1bi9 h ALA 439 N 1.25 0.58 0.09 3.86 0.00 -1.03 0.66 119.26 124.66 1bi9 h ALA 439 Ca 0.20 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 1bi9 h ALA 439 Cb 0.13 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1bi9 h ALA 439 CO -0.16 -0.26 -0.04 -0.07 0.00 0.00 0.00 179.25 178.72 1bi9 h LEU 440 N 0.30 -0.10 0.18 0.00 3.38 -0.17 0.42 115.31 119.32 1bi9 h LEU 440 Ca 0.24 -0.33 0.01 0.00 0.09 0.00 0.00 57.88 57.90 1bi9 h LEU 440 Cb 0.28 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.02 1bi9 h LEU 440 CO -0.27 0.29 -0.34 0.24 0.09 0.00 0.00 178.44 178.45 1bi9 h MET 441 N -0.50 -0.58 -0.96 1.13 2.86 -0.19 -1.70 114.93 115.01 1bi9 h MET 441 Ca -0.01 0.04 0.01 0.00 -2.06 0.00 0.00 59.70 57.68 1bi9 h MET 441 Cb 0.42 0.13 -0.05 0.00 0.06 0.00 0.00 31.60 32.16 1bi9 h MET 441 CO 0.02 -0.38 0.64 0.28 1.06 0.00 0.00 176.91 178.52 1bi9 h VAL 442 N -0.60 1.24 -0.40 -2.22 2.07 -0.90 -0.33 116.25 115.12 1bi9 h VAL 442 Ca 0.02 -0.44 -0.02 0.00 0.82 0.00 0.00 66.70 67.08 1bi9 h VAL 442 Cb 0.60 -0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 30.19 1bi9 h VAL 442 CO -0.16 0.24 0.19 0.77 0.02 0.00 0.00 177.57 178.62 1bi9 h SER 443 N 1.30 0.52 -0.10 0.57 4.64 0.21 -2.44 113.55 118.24 1bi9 h SER 443 Ca 0.35 -0.13 -0.18 0.00 -0.47 0.00 0.00 61.79 61.36 1bi9 h SER 443 Cb -0.14 -0.13 0.01 0.00 -0.31 0.00 0.00 62.40 61.82 1bi9 h SER 443 CO -0.08 0.51 -0.66 0.77 -0.87 0.00 0.00 176.83 176.50 1bi9 h SER 444 N 0.50 0.76 0.67 4.97 4.64 -1.11 -3.24 113.55 120.75 1bi9 h SER 444 Ca 0.14 -0.66 0.00 0.00 -0.47 0.00 0.00 61.79 60.80 1bi9 h SER 444 Cb 0.13 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 61.99 1bi9 h SER 444 CO -0.02 1.29 0.00 0.00 -0.87 0.00 0.00 176.83 177.24 1bi9 n ALA 445 N -2.58 1.67 -2.53 5.18 0.00 -0.15 -4.70 120.51 117.39 1bi9 n ALA 445 Ca -0.08 0.04 -0.43 0.00 0.00 0.00 0.00 53.44 52.97 1bi9 n ALA 445 Cb 0.68 -1.34 -0.02 0.00 0.00 0.00 0.00 19.45 18.77 1bi9 n ALA 445 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 1bi9 s MET 446 N -3.22 4.08 -1.50 0.00 0.00 -0.92 -4.91 119.30 112.83 1bi9 s MET 446 Ca 0.05 1.28 -0.12 0.00 0.00 0.00 0.00 55.69 56.91 1bi9 s MET 446 Cb 0.09 -3.77 -0.05 0.00 0.00 0.00 0.00 34.83 31.11 1bi9 s MET 446 CO 0.36 -0.89 2.63 1.04 0.00 0.00 0.00 175.02 178.16 1bi9 n GLN 447 N 6.87 3.24 -4.31 4.11 6.02 -1.26 -4.85 117.38 127.20 1bi9 n GLN 447 Ca 0.13 -2.28 -0.20 0.00 -0.01 0.00 0.00 57.00 54.64 1bi9 n GLN 447 Cb 0.46 -2.95 -0.11 0.00 1.02 0.00 0.00 30.24 28.66 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 2.69 1.88 -0.38 -1.58 0.00 -1.26 -4.52 121.76 118.59 1bi9 s ALA 448 Ca 0.60 -1.49 0.21 0.00 0.00 0.00 0.00 51.96 51.28 1bi9 s ALA 448 Cb 0.16 -0.13 0.28 0.00 0.00 0.00 0.00 23.12 23.43 1bi9 s ALA 448 CO -0.06 0.15 1.56 0.78 0.00 0.00 0.00 175.76 178.19 1bi9 h GLY 449 N 3.12 0.00 -5.30 0.00 0.00 -1.18 -3.45 103.07 96.25 1bi9 h GLY 449 Ca -0.40 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 46.80 1bi9 h GLY 449 CO 0.54 0.00 -0.26 -0.51 0.00 0.00 0.00 176.54 176.32 1bi9 s THR 450 N -3.16 -0.00 -0.08 4.70 -4.23 -1.25 -5.09 115.64 106.52 1bi9 s THR 450 Ca 0.06 0.01 0.02 0.00 -1.18 0.00 0.00 61.69 60.60 1bi9 s THR 450 Cb 0.06 -0.57 0.01 0.00 1.34 0.00 0.00 72.50 73.34 1bi9 s THR 450 CO 0.69 0.01 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.95 1bi9 s VAL 451 N 0.37 1.25 -0.11 2.29 1.01 -1.26 -1.81 120.40 122.14 1bi9 s VAL 451 Ca -0.01 -0.52 -0.05 0.00 0.00 0.00 0.00 61.98 61.40 1bi9 s VAL 451 Cb -0.04 -1.15 -0.04 0.00 0.00 0.00 0.00 36.38 35.16 1bi9 s VAL 451 CO -0.01 0.39 0.07 0.26 0.00 0.00 0.00 175.10 175.80 1bi9 s TRP 452 N 0.84 3.35 -0.23 5.22 0.52 0.14 -4.99 118.94 123.79 1bi9 s TRP 452 Ca -0.11 0.33 0.02 0.00 0.02 0.00 0.00 56.10 56.36 1bi9 s TRP 452 Cb -0.15 -1.88 0.05 0.00 -1.15 0.00 0.00 33.47 30.34 1bi9 s TRP 452 CO 0.01 0.56 -0.13 0.42 0.02 0.00 0.00 176.95 177.83 1bi9 s ILE 453 N -0.84 2.10 -1.09 2.03 1.01 -1.26 0.35 121.20 123.51 1bi9 s ILE 453 Ca 0.13 -1.41 -0.01 0.00 0.00 0.00 0.00 60.65 59.36 1bi9 s ILE 453 Cb -0.12 -2.13 0.00 0.00 0.01 0.00 0.00 42.46 40.23 1bi9 s ILE 453 CO 0.03 0.13 0.91 0.59 0.00 0.00 0.00 174.94 176.60 1bi9 n ASN 454 N 4.50 -2.47 0.00 3.58 3.02 0.23 -4.96 115.26 119.16 1bi9 n ASN 454 Ca -0.16 -0.55 0.00 0.00 -0.03 0.00 0.00 54.58 53.85 1bi9 n ASN 454 Cb 0.44 -4.63 0.00 0.00 -0.61 0.00 0.00 39.78 34.99 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 -0.53 0.00 -1.57 0.00 4.01 -1.26 -4.71 117.16 113.11 1bi9 n TYR 456 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1bi9 n TYR 456 Cb 0.00 -0.06 0.00 0.00 -0.31 0.00 0.00 39.34 38.97 1bi9 n TYR 456 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1bi9 n ASN 457 N -2.84 -8.45 -4.66 7.72 4.05 -1.26 -4.69 115.26 105.13 1bi9 n ASN 457 Ca -0.02 1.79 -0.42 0.00 0.45 0.00 0.00 54.58 56.38 1bi9 n ASN 457 Cb 0.06 -5.02 -0.03 0.00 1.23 0.00 0.00 39.78 36.02 1bi9 n ASN 457 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1bi9 s ALA 458 N -5.16 3.54 0.38 5.20 0.00 -1.26 -4.93 121.76 119.53 1bi9 s ALA 458 Ca 0.00 1.18 -0.24 0.00 0.00 0.00 0.00 51.96 52.91 1bi9 s ALA 458 Cb 0.00 -3.83 -0.10 0.00 0.00 0.00 0.00 23.12 19.18 1bi9 s ALA 458 CO 0.00 -1.60 0.96 -1.17 0.00 0.00 0.00 175.76 173.94 1bi9 s LEU 459 N 4.58 4.15 0.32 0.00 2.96 -1.26 -5.19 118.68 124.23 1bi9 s LEU 459 Ca 0.85 1.80 0.00 0.00 -0.22 0.00 0.00 54.13 56.56 1bi9 s LEU 459 Cb -0.39 -4.26 0.00 0.00 0.50 0.00 0.00 46.19 42.04 1bi9 s LEU 459 CO 0.38 -0.24 0.00 0.59 -1.32 0.00 0.00 176.35 175.76 1bi9 n ASN 460 N -0.03 -8.40 0.00 3.68 3.02 -1.26 -4.99 115.26 107.28 1bi9 n ASN 460 Ca 0.04 1.36 0.00 0.00 -0.03 0.00 0.00 54.58 55.95 1bi9 n ASN 460 Cb 0.52 -4.80 0.00 0.00 -0.61 0.00 0.00 39.78 34.89 1bi9 n ASN 460 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1bi9 n GLY 478 N 0.80 3.20 0.67 7.41 0.00 -1.26 -5.09 105.19 110.92 1bi9 n GLY 478 Ca 0.00 -0.38 0.48 0.00 0.00 0.00 0.00 46.02 46.13 1bi9 n GLY 478 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1bi9 h GLU 479 N 0.00 0.00 0.00 1.61 4.57 -2.03 1.53 114.58 120.26 1bi9 h GLU 479 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1bi9 h GLU 479 Cb 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 1bi9 h GLU 479 CO 0.00 0.00 -0.17 0.74 -1.18 0.00 0.00 179.01 178.40 1bi9 h PHE 480 N 0.00 0.00 -0.29 0.92 -1.00 -2.08 -3.36 116.94 111.13 1bi9 h PHE 480 Ca 0.84 0.00 -0.07 0.00 2.81 0.00 0.00 57.97 61.55 1bi9 h PHE 480 Cb 3.43 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 42.98 1bi9 h PHE 480 CO 0.00 0.00 -0.09 0.78 -1.61 0.00 0.00 178.31 177.39 1bi9 h GLY 481 N 4.31 0.62 -2.28 -1.45 0.00 0.17 -3.25 103.07 101.19 1bi9 h GLY 481 Ca 0.00 -0.52 -0.05 0.00 0.00 0.00 0.00 47.33 46.75 1bi9 h GLY 481 CO 0.00 0.48 0.07 1.47 0.00 0.00 0.00 176.54 178.55 1bi9 n LEU 482 N -4.47 3.41 0.00 3.11 -0.00 -1.25 -3.77 117.00 114.03 1bi9 n LEU 482 Ca -0.03 -1.74 -0.13 0.00 -0.00 0.00 0.00 56.01 54.10 1bi9 n LEU 482 Cb 0.33 -0.60 -0.14 0.00 -0.00 0.00 0.00 43.42 43.02 1bi9 n LEU 482 CO 0.41 0.49 -0.55 0.03 -0.00 0.00 0.00 177.39 177.76 1bi9 h ARG 483 N 1.43 0.11 0.00 1.47 3.08 -1.77 -3.33 114.38 115.37 1bi9 h ARG 483 Ca 0.06 -0.19 0.00 0.00 0.07 0.00 0.00 59.98 59.93 1bi9 h ARG 483 Cb 1.30 0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.41 1bi9 h ARG 483 CO 0.27 0.80 0.00 -0.85 -1.07 0.00 0.00 179.97 179.12 1bi9 n GLU 484 N -3.23 0.22 -1.13 0.04 0.28 -1.25 -3.39 120.64 112.17 1bi9 n GLU 484 Ca -0.20 0.28 -0.18 0.00 -0.16 0.00 0.00 57.16 56.90 1bi9 n GLU 484 Cb 1.05 -1.81 0.17 0.00 1.43 0.00 0.00 31.44 32.27 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 -2.20 2.36 -3.59 -1.84 4.01 -1.25 -4.95 117.16 109.71 1bi9 n TYR 485 Ca 0.04 -1.92 -0.12 0.00 -0.16 0.00 0.00 57.90 55.74 1bi9 n TYR 485 Cb 0.34 -0.82 -0.06 0.00 -0.31 0.00 0.00 39.34 38.50 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 -1.92 -0.47 0.18 7.72 1.04 -1.22 -4.24 113.70 114.78 1bi9 s SER 486 Ca 0.53 0.66 0.08 0.00 0.48 0.00 0.00 55.95 57.71 1bi9 s SER 486 Cb 0.45 0.58 -0.04 0.00 0.10 0.00 0.00 66.02 67.11 1bi9 s SER 486 CO 0.05 -0.34 -0.08 -1.83 0.98 0.00 0.00 173.24 172.02 1bi9 s GLU 487 N -0.68 2.13 -0.01 4.02 -1.05 0.01 -4.91 118.70 118.21 1bi9 s GLU 487 Ca -0.02 -1.23 -0.17 0.00 -0.15 0.00 0.00 54.97 53.39 1bi9 s GLU 487 Cb -0.02 -2.20 -0.06 0.00 -0.44 0.00 0.00 34.13 31.41 1bi9 s GLU 487 CO 0.01 0.44 0.49 0.08 0.95 0.00 0.00 175.26 177.23 1bi9 s VAL 488 N -1.69 4.97 -0.10 1.83 1.01 -1.26 -1.80 120.40 123.36 1bi9 s VAL 488 Ca 0.25 1.02 0.03 0.00 0.00 0.00 0.00 61.98 63.28 1bi9 s VAL 488 Cb -0.09 -3.81 0.01 0.00 0.00 0.00 0.00 36.38 32.48 1bi9 s VAL 488 CO 0.16 0.50 -0.19 -0.75 0.00 0.00 0.00 175.10 174.81 1bi9 s LYS 489 N -0.61 2.60 0.06 2.72 2.20 -0.50 -4.98 119.74 121.23 1bi9 s LYS 489 Ca 0.27 -0.71 0.09 0.00 -0.36 0.00 0.00 55.97 55.25 1bi9 s LYS 489 Cb -0.17 -2.05 -0.03 0.00 -1.51 0.00 0.00 37.83 34.07 1bi9 s LYS 489 CO 0.15 0.07 -0.24 0.95 -0.36 0.00 0.00 175.35 175.92 1bi9 s THR 490 N 0.60 2.35 -0.06 3.43 -4.23 -1.26 -0.24 115.64 116.24 1bi9 s THR 490 Ca -0.14 -1.41 0.01 0.00 -1.18 0.00 0.00 61.69 58.98 1bi9 s THR 490 Cb -0.17 -1.96 0.02 0.00 1.34 0.00 0.00 72.50 71.73 1bi9 s THR 490 CO 0.04 0.30 -0.08 -0.69 -0.54 0.00 0.00 174.62 173.65 1bi9 s VAL 491 N -0.89 0.82 -0.10 2.29 1.01 -0.14 -4.99 120.40 118.40 1bi9 s VAL 491 Ca 0.13 -0.28 0.02 0.00 0.00 0.00 0.00 61.98 61.85 1bi9 s VAL 491 Cb -0.10 -0.79 0.01 0.00 0.00 0.00 0.00 36.38 35.50 1bi9 s VAL 491 CO 0.04 0.29 -0.16 0.42 0.00 0.00 0.00 175.10 175.69 1bi9 s THR 492 N 0.85 1.50 -0.13 3.92 -4.23 -1.26 -0.76 115.64 115.53 1bi9 s THR 492 Ca -0.12 -0.66 -0.03 0.00 -1.18 0.00 0.00 61.69 59.70 1bi9 s THR 492 Cb -0.15 -1.36 -0.03 0.00 1.34 0.00 0.00 72.50 72.31 1bi9 s THR 492 CO 0.01 0.44 -0.03 -0.69 -0.54 0.00 0.00 174.62 173.81 1bi9 s VAL 493 N 0.83 4.00 0.02 2.29 1.01 0.23 -4.90 120.40 123.89 1bi9 s VAL 493 Ca -0.10 -0.33 -0.30 0.00 0.00 0.00 0.00 61.98 61.24 1bi9 s VAL 493 Cb -0.16 -2.73 -0.05 0.00 0.00 0.00 0.00 36.38 33.45 1bi9 s VAL 493 CO 0.01 0.53 1.24 -0.75 0.00 0.00 0.00 175.10 176.13 1bi9 s LYS 494 N -0.05 4.38 0.14 2.72 2.47 -1.26 -0.98 119.74 127.16 1bi9 s LYS 494 Ca 0.02 1.79 0.10 0.00 -1.56 0.00 0.00 55.97 56.32 1bi9 s LYS 494 Cb -0.13 -3.44 -0.04 0.00 -1.46 0.00 0.00 37.83 32.76 1bi9 s LYS 494 CO 0.02 -0.38 -0.23 0.96 0.16 0.00 0.00 175.35 175.89 1bi9 s ILE 495 N 1.64 2.02 0.25 5.43 -4.36 -0.57 -4.96 121.20 120.64 1bi9 s ILE 495 Ca 0.59 -1.78 -0.04 0.00 -0.26 0.00 0.00 60.65 59.15 1bi9 s ILE 495 Cb -0.29 -1.86 0.24 0.00 1.25 0.00 0.00 42.46 41.80 1bi9 s ILE 495 CO 0.27 -0.08 1.69 -0.65 0.24 0.00 0.00 174.94 176.40 1bi9 h PRO 496 N 3.67 0.28 -1.85 0.37 0.11 -1.96 -3.44 132.00 129.19 1bi9 h PRO 496 Ca -0.47 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 65.67 1bi9 h PRO 496 Cb 1.19 -0.06 -0.23 0.00 0.11 0.00 0.00 31.00 32.01 1bi9 h PRO 496 CO 0.43 0.19 0.16 -1.14 -0.21 0.00 0.00 178.00 177.43 1bi9 s GLN 497 N -6.03 0.62 -0.23 1.05 0.74 -1.26 -5.04 119.66 109.50 1bi9 s GLN 497 Ca -0.13 1.01 -0.19 0.00 0.05 0.00 0.00 55.36 56.10 1bi9 s GLN 497 Cb 0.21 0.15 -0.03 0.00 1.10 0.00 0.00 33.01 34.45 1bi9 s GLN 497 CO 0.76 -0.12 0.58 0.21 -0.55 0.00 0.00 175.29 176.16 1bi9 s LYS 498 N 1.37 4.14 0.23 1.67 2.20 -1.26 -5.04 119.74 123.05 1bi9 s LYS 498 Ca -0.08 0.48 0.11 0.00 -0.36 0.00 0.00 55.97 56.12 1bi9 s LYS 498 Cb -0.05 -3.61 -0.05 0.00 -1.51 0.00 0.00 37.83 32.61 1bi9 s LYS 498 CO -0.16 -0.30 -0.21 -0.80 -0.36 0.00 0.00 175.35 173.53 1bi9 s ASN 499 N 1.35 3.37 0.00 1.43 0.01 -1.26 -5.03 114.94 114.81 1bi9 s ASN 499 Ca 0.25 -0.95 0.00 0.00 -0.71 0.00 0.00 52.86 51.45 1bi9 s ASN 499 Cb -0.16 -0.26 0.00 0.00 0.41 0.00 0.00 41.25 41.25 1bi9 s ASN 499 CO 0.09 0.05 0.32 -1.20 -1.51 0.00 0.00 177.10 174.85