#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1re9 s ALA 2 N 0.00 2.72 0.25 -1.18 0.00 0.14 -4.95 121.76 118.74 1re9 s ALA 2 Ca 0.00 0.66 -0.31 0.00 0.00 0.00 0.00 51.96 52.31 1re9 s ALA 2 Cb 0.00 -3.30 -0.12 0.00 0.00 0.00 0.00 23.12 19.70 1re9 s ALA 2 CO 0.00 -0.71 1.67 -2.30 0.00 0.00 0.00 175.76 174.42 1re9 n PRO 3 N -1.45 2.77 -2.06 0.00 -0.02 -1.26 -4.83 135.00 128.14 1re9 n PRO 3 Ca 0.10 0.99 -0.42 0.00 -2.02 0.00 0.00 63.50 62.15 1re9 n PRO 3 Cb 0.52 -2.81 -0.03 0.00 -0.02 0.00 0.00 33.50 31.16 1re9 n PRO 3 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1re9 s LEU 4 N 0.33 4.34 0.35 2.45 2.96 -1.26 -4.96 118.68 122.90 1re9 s LEU 4 Ca 0.69 2.31 -0.28 0.00 -0.22 0.00 0.00 54.13 56.63 1re9 s LEU 4 Cb -0.49 -3.56 -0.11 0.00 0.50 0.00 0.00 46.19 42.53 1re9 s LEU 4 CO 0.40 -0.82 1.40 -2.84 -1.32 0.00 0.00 176.35 173.18 1re9 s PRO 5 N 2.64 4.23 0.43 0.98 0.02 -1.26 -4.90 135.00 137.14 1re9 s PRO 5 Ca 0.70 2.40 0.29 0.00 0.02 0.00 0.00 61.00 64.41 1re9 s PRO 5 Cb -0.36 -3.02 1.55 0.00 0.02 0.00 0.00 34.50 32.69 1re9 s PRO 5 CO 0.30 -0.37 1.89 -1.00 -0.33 0.00 0.00 177.00 177.49 1re9 h PRO 6 N 3.19 0.00 -0.00 5.54 0.13 -2.04 -1.21 132.00 137.61 1re9 h PRO 6 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1re9 h PRO 6 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1re9 h PRO 6 CO 0.65 0.00 -0.07 -2.39 -0.23 0.00 0.00 178.00 175.96 1re9 n HIS 7 N -2.54 0.00 -3.26 1.56 1.44 -1.26 -4.77 115.22 106.40 1re9 n HIS 7 Ca -0.02 0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 55.30 1re9 n HIS 7 Cb 0.07 -0.42 -0.07 0.00 0.12 0.00 0.00 29.99 29.69 1re9 n HIS 7 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 1re9 s VAL 8 N -2.92 5.09 0.36 0.61 1.01 -0.46 -4.88 120.40 119.22 1re9 s VAL 8 Ca 0.16 0.87 -0.26 0.00 0.00 0.00 0.00 61.98 62.75 1re9 s VAL 8 Cb 0.19 -3.82 -0.09 0.00 0.00 0.00 0.00 36.38 32.66 1re9 s VAL 8 CO 0.54 0.13 1.10 -2.84 0.00 0.00 0.00 175.10 174.03 1re9 s PRO 9 N 2.05 4.28 0.50 2.72 0.02 -1.26 -4.88 135.00 138.42 1re9 s PRO 9 Ca 0.21 1.70 0.16 0.00 0.02 0.00 0.00 61.00 63.10 1re9 s PRO 9 Cb -0.15 -2.79 1.20 0.00 0.02 0.00 0.00 34.50 32.78 1re9 s PRO 9 CO 0.09 -0.08 2.10 0.93 -0.33 0.00 0.00 177.00 179.71 1re9 h GLU 10 N 2.96 0.12 0.00 5.54 4.39 -1.96 -2.09 114.58 123.54 1re9 h GLU 10 Ca -0.48 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.21 1re9 h GLU 10 Cb 1.22 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.84 1re9 h GLU 10 CO 0.64 0.08 0.00 -2.39 -1.16 0.00 0.00 179.01 176.18 1re9 n HIS 11 N -4.50 0.39 1.06 4.33 1.44 -1.26 -1.81 115.22 114.86 1re9 n HIS 11 Ca 0.01 0.15 0.12 0.00 -2.01 0.00 0.00 57.72 55.99 1re9 n HIS 11 Cb 0.19 -0.74 0.25 0.00 0.12 0.00 0.00 29.99 29.80 1re9 n HIS 11 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 1re9 n LEU 12 N -1.85 2.57 -4.70 2.39 4.77 -0.79 -4.93 117.00 114.46 1re9 n LEU 12 Ca 0.03 -0.91 -0.42 0.00 -0.03 0.00 0.00 56.01 54.68 1re9 n LEU 12 Cb 0.22 -0.04 -0.03 0.00 -2.33 0.00 0.00 43.42 41.24 1re9 n LEU 12 CO 0.18 0.46 0.81 -0.69 -1.33 0.00 0.00 177.39 176.81 1re9 s VAL 13 N -1.92 4.52 -0.24 4.08 1.01 -0.75 -0.61 120.40 126.49 1re9 s VAL 13 Ca 0.32 1.81 -0.03 0.00 0.00 0.00 0.00 61.98 64.09 1re9 s VAL 13 Cb 0.20 -4.16 0.11 0.00 0.00 0.00 0.00 36.38 32.54 1re9 s VAL 13 CO 0.31 0.09 0.26 0.12 0.00 0.00 0.00 175.10 175.88 1re9 s PHE 14 N 1.46 -0.40 -1.35 5.22 2.19 0.42 -4.90 117.98 120.62 1re9 s PHE 14 Ca 0.54 0.17 -0.10 0.00 0.33 0.00 0.00 56.93 57.86 1re9 s PHE 14 Cb -0.23 -0.35 0.12 0.00 -1.31 0.00 0.00 43.02 41.25 1re9 s PHE 14 CO 0.25 -0.72 2.07 -0.25 1.83 0.00 0.00 175.22 178.40 1re9 n ASP 15 N 5.32 5.24 -4.72 6.13 8.00 -1.26 -3.65 116.55 131.61 1re9 n ASP 15 Ca -0.04 -3.02 -0.41 0.00 0.71 0.00 0.00 54.79 52.02 1re9 n ASP 15 Cb 0.48 -1.51 -0.04 0.00 -0.02 0.00 0.00 41.12 40.03 1re9 n ASP 15 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1re9 s PHE 16 N 1.01 3.64 -0.40 1.24 5.36 -1.26 -4.88 117.98 122.68 1re9 s PHE 16 Ca 0.44 1.62 -0.09 0.00 -0.96 0.00 0.00 56.93 57.94 1re9 s PHE 16 Cb 0.12 -3.21 0.07 0.00 -0.34 0.00 0.00 43.02 39.66 1re9 s PHE 16 CO -0.03 -0.39 0.23 0.34 -1.46 0.00 0.00 175.22 173.91 1re9 s ASP 17 N 0.38 5.59 0.45 6.13 -1.08 -1.26 -4.58 116.67 122.30 1re9 s ASP 17 Ca 0.51 -1.43 0.31 0.00 -0.52 0.00 0.00 52.55 51.42 1re9 s ASP 17 Cb -0.26 -1.97 1.42 0.00 -1.46 0.00 0.00 42.92 40.66 1re9 s ASP 17 CO 0.31 -0.50 1.93 0.00 0.52 0.00 0.00 175.17 177.43 1re9 h MET 18 N 8.37 0.00 0.00 4.34 -0.00 -1.96 -1.00 114.93 124.68 1re9 h MET 18 Ca -0.23 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.47 1re9 h MET 18 Cb 1.08 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.68 1re9 h MET 18 CO 0.73 0.00 -0.87 0.66 -0.00 0.00 0.00 176.91 177.42 1re9 n TYR 19 N -2.70 0.01 -2.74 -0.10 4.01 -1.26 -2.67 117.16 111.71 1re9 n TYR 19 Ca 0.00 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.66 1re9 n TYR 19 Cb 0.20 -0.10 0.07 0.00 -0.31 0.00 0.00 39.34 39.19 1re9 n TYR 19 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1re9 n ASN 20 N -1.54 -2.62 -4.78 7.72 4.05 -0.75 -4.51 115.26 112.84 1re9 n ASN 20 Ca 0.04 -3.47 -0.35 0.00 0.45 0.00 0.00 54.58 51.25 1re9 n ASN 20 Cb 0.34 1.87 -0.01 0.00 1.23 0.00 0.00 39.78 43.21 1re9 n ASN 20 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 1re9 s PRO 21 N 0.49 3.49 0.65 1.20 0.04 -0.46 -4.70 135.00 135.71 1re9 s PRO 21 Ca 0.27 1.52 -0.15 0.00 0.04 0.00 0.00 61.00 62.69 1re9 s PRO 21 Cb 0.26 -2.03 -0.01 0.00 0.04 0.00 0.00 34.50 32.76 1re9 s PRO 21 CO -0.15 -0.72 1.09 -1.54 0.04 0.00 0.00 177.00 175.72 1re9 s SER 22 N -1.87 5.29 -1.28 6.66 1.04 -1.26 -2.73 113.70 119.54 1re9 s SER 22 Ca 0.71 1.91 0.00 0.00 0.48 0.00 0.00 55.95 59.05 1re9 s SER 22 Cb -0.21 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.37 1re9 s SER 22 CO 0.25 -1.51 0.00 0.59 0.98 0.00 0.00 173.24 173.55 1re9 n ASN 23 N -2.42 -4.45 0.03 7.02 3.02 -1.26 -4.76 115.26 112.44 1re9 n ASN 23 Ca 0.10 0.30 0.15 0.00 -0.03 0.00 0.00 54.58 55.09 1re9 n ASN 23 Cb 0.52 -3.03 0.62 0.00 -0.61 0.00 0.00 39.78 37.28 1re9 n ASN 23 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1re9 h LEU 24 N 0.00 0.12 -2.92 3.41 5.85 -1.79 0.91 115.31 120.89 1re9 h LEU 24 Ca -0.25 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.47 1re9 h LEU 24 Cb 0.80 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.81 1re9 h LEU 24 CO 0.36 0.07 -0.00 0.77 -0.34 0.00 0.00 178.44 179.30 1re9 h SER 25 N 0.13 0.00 0.74 1.25 4.64 -1.89 -0.55 113.55 117.87 1re9 h SER 25 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 1re9 h SER 25 Cb 0.64 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.73 1re9 h SER 25 CO -0.03 0.00 -0.05 0.00 -0.87 0.00 0.00 176.83 175.88 1re9 n ALA 26 N -2.08 2.53 0.00 5.18 0.00 0.31 -5.01 120.51 121.44 1re9 n ALA 26 Ca -0.03 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1re9 n ALA 26 Cb 0.08 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.10 1re9 n ALA 26 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1re9 n GLY 27 N 1.40 2.91 0.12 0.00 0.00 -0.21 -4.74 105.19 104.66 1re9 n GLY 27 Ca 0.10 -1.73 -0.21 0.00 0.00 0.00 0.00 46.02 44.19 1re9 n GLY 27 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1re9 h VAL 28 N 0.00 1.33 -0.93 1.61 3.04 -1.90 0.80 116.25 120.20 1re9 h VAL 28 Ca 0.00 -2.48 0.05 0.00 -1.01 0.00 0.00 66.70 63.26 1re9 h VAL 28 Cb 0.00 3.01 -0.06 0.00 -2.01 0.00 0.00 31.29 32.23 1re9 h VAL 28 CO 0.00 0.70 0.60 1.56 -1.01 0.00 0.00 177.57 179.42 1re9 h GLN 29 N -0.36 1.09 -0.75 4.17 7.50 -1.93 -0.59 115.11 124.23 1re9 h GLN 29 Ca -0.20 -0.07 -0.02 0.00 0.50 0.00 0.00 58.65 58.86 1re9 h GLN 29 Cb 1.68 -0.25 -0.04 0.00 0.05 0.00 0.00 27.48 28.92 1re9 h GLN 29 CO 0.11 0.72 0.40 0.93 -1.50 0.00 0.00 178.83 179.49 1re9 h GLU 30 N 1.12 1.06 -0.52 1.46 3.07 -1.80 -0.40 114.58 118.57 1re9 h GLU 30 Ca 0.39 -0.13 -0.08 0.00 -0.50 0.00 0.00 59.36 59.04 1re9 h GLU 30 Cb 0.09 -0.21 -0.02 0.00 -0.84 0.00 0.00 28.75 27.78 1re9 h GLU 30 CO -0.15 0.79 0.02 0.00 -1.40 0.00 0.00 179.01 178.27 1re9 h ALA 31 N 1.38 0.69 -0.02 3.43 0.00 0.33 -2.84 119.26 122.23 1re9 h ALA 31 Ca 0.26 -0.28 -0.12 0.00 0.00 0.00 0.00 54.91 54.78 1re9 h ALA 31 Cb 0.05 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1re9 h ALA 31 CO -0.04 0.49 -0.54 -1.49 0.00 0.00 0.00 179.25 177.67 1re9 h TRP 32 N 0.77 0.07 0.00 0.00 4.06 -0.92 -3.05 115.95 116.88 1re9 h TRP 32 Ca 0.15 -0.03 0.00 0.00 2.06 0.00 0.00 58.89 61.07 1re9 h TRP 32 Cb 0.50 -0.01 0.00 0.00 -1.00 0.00 0.00 29.16 28.64 1re9 h TRP 32 CO 0.04 0.58 0.00 0.00 -3.56 0.00 0.00 178.44 175.50 1re9 n ALA 33 N -2.45 1.39 0.26 1.49 0.00 -0.18 -1.31 120.51 119.71 1re9 n ALA 33 Ca -0.02 -0.03 0.13 0.00 0.00 0.00 0.00 53.44 53.53 1re9 n ALA 33 Cb 0.55 -1.13 0.80 0.00 0.00 0.00 0.00 19.45 19.67 1re9 n ALA 33 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1re9 h VAL 34 N 0.00 0.68 0.00 0.00 2.07 -1.52 -0.82 116.25 116.66 1re9 h VAL 34 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1re9 h VAL 34 Cb 0.14 0.96 0.00 0.00 -1.52 0.00 0.00 31.29 30.87 1re9 h VAL 34 CO 0.00 0.00 0.00 0.18 0.02 0.00 0.00 177.57 177.77 1re9 n LEU 35 N -4.09 0.49 -1.03 2.57 4.77 -0.43 -2.21 117.00 117.07 1re9 n LEU 35 Ca -0.02 0.62 0.08 0.00 -0.03 0.00 0.00 56.01 56.67 1re9 n LEU 35 Cb 0.15 -0.56 0.25 0.00 -2.33 0.00 0.00 43.42 40.93 1re9 n LEU 35 CO 0.30 -0.49 0.72 0.00 -1.33 0.00 0.00 177.39 176.59 1re9 n GLN 36 N -2.04 3.18 -1.88 3.23 6.02 -0.31 -4.78 117.38 120.79 1re9 n GLN 36 Ca 0.02 -2.57 -0.34 0.00 -0.01 0.00 0.00 57.00 54.10 1re9 n GLN 36 Cb 0.21 -1.65 0.04 0.00 1.02 0.00 0.00 30.24 29.85 1re9 n GLN 36 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1re9 s GLU 37 N -1.83 2.91 0.61 -1.09 2.02 -0.94 -4.91 118.70 115.47 1re9 s GLU 37 Ca 0.38 1.49 0.36 0.00 0.02 0.00 0.00 54.97 57.22 1re9 s GLU 37 Cb 0.26 -1.96 2.02 0.00 0.10 0.00 0.00 34.13 34.55 1re9 s GLU 37 CO 0.17 -1.18 2.27 0.66 0.02 0.00 0.00 175.26 177.20 1re9 h SER 38 N 0.34 0.00 -0.34 -0.19 4.64 -1.94 -0.94 113.55 115.12 1re9 h SER 38 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1re9 h SER 38 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 1re9 h SER 38 CO 0.55 0.01 0.00 -0.46 -0.87 0.00 0.00 176.83 176.06 1re9 n ASN 39 N -3.47 2.76 -4.64 4.97 6.94 -1.26 -4.85 115.26 115.71 1re9 n ASN 39 Ca -0.03 -1.90 -0.37 0.00 -0.02 0.00 0.00 54.58 52.26 1re9 n ASN 39 Cb 0.11 -0.22 -0.09 0.00 -2.36 0.00 0.00 39.78 37.21 1re9 n ASN 39 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1re9 s VAL 40 N -1.55 5.31 1.11 3.53 1.01 -0.36 -5.08 120.40 124.36 1re9 s VAL 40 Ca 0.36 0.29 -0.12 0.00 0.00 0.00 0.00 61.98 62.51 1re9 s VAL 40 Cb 0.20 -3.56 0.25 0.00 0.00 0.00 0.00 36.38 33.28 1re9 s VAL 40 CO 0.28 0.30 1.06 -2.84 0.00 0.00 0.00 175.10 173.90 1re9 s PRO 41 N 1.30 -0.50 0.35 2.72 0.02 -1.26 -4.81 135.00 132.82 1re9 s PRO 41 Ca 0.10 1.08 0.04 0.00 0.02 0.00 0.00 61.00 62.24 1re9 s PRO 41 Cb -0.14 -1.58 0.66 0.00 0.02 0.00 0.00 34.50 33.45 1re9 s PRO 41 CO 0.07 -3.52 1.94 -0.44 -0.33 0.00 0.00 177.00 174.72 1re9 h ASP 42 N -2.49 0.53 -3.21 2.53 3.32 -1.94 -3.41 116.42 111.76 1re9 h ASP 42 Ca -0.57 -0.07 -0.50 0.00 0.02 0.00 0.00 57.03 55.91 1re9 h ASP 42 Cb 1.32 -0.14 -0.37 0.00 0.22 0.00 0.00 39.33 40.36 1re9 h ASP 42 CO 0.47 0.51 -0.79 -0.22 -1.72 0.00 0.00 179.24 177.49 1re9 s LEU 43 N -9.27 1.07 0.29 1.55 2.96 -1.26 -1.30 118.68 112.72 1re9 s LEU 43 Ca -0.08 -0.25 0.07 0.00 -0.22 0.00 0.00 54.13 53.65 1re9 s LEU 43 Cb 0.16 -0.75 -0.06 0.00 0.50 0.00 0.00 46.19 46.05 1re9 s LEU 43 CO 0.76 -0.13 -0.07 0.68 -1.32 0.00 0.00 176.35 176.27 1re9 s VAL 44 N 1.71 1.79 -0.14 1.68 -7.23 -0.54 -4.92 120.40 112.75 1re9 s VAL 44 Ca 0.04 -2.15 -0.01 0.00 -1.81 0.00 0.00 61.98 58.05 1re9 s VAL 44 Cb -0.13 -2.48 -0.02 0.00 0.56 0.00 0.00 36.38 34.32 1re9 s VAL 44 CO -0.07 -0.29 -0.10 0.86 -0.31 0.00 0.00 175.10 175.19 1re9 s TRP 45 N -2.91 2.87 -0.10 2.82 -0.11 0.22 -0.46 118.94 121.26 1re9 s TRP 45 Ca 0.30 -0.63 -0.03 0.00 1.22 0.00 0.00 56.10 56.96 1re9 s TRP 45 Cb 0.03 -1.89 -0.03 0.00 -1.50 0.00 0.00 33.47 30.07 1re9 s TRP 45 CO 0.13 -0.22 0.02 -0.08 -4.62 0.00 0.00 176.95 172.18 1re9 s THR 46 N 0.49 4.49 -1.47 5.86 -1.32 0.05 -0.44 115.64 123.29 1re9 s THR 46 Ca -0.08 -0.18 0.28 0.00 -1.21 0.00 0.00 61.69 60.51 1re9 s THR 46 Cb -0.15 -2.91 0.36 0.00 -1.51 0.00 0.00 72.50 68.29 1re9 s THR 46 CO 0.04 0.60 1.80 0.54 -2.21 0.00 0.00 174.62 175.39 1re9 n ARG 47 N 2.22 0.50 -1.63 7.08 1.74 -1.26 -1.12 116.66 124.19 1re9 n ARG 47 Ca -0.19 -0.18 -0.33 0.00 -0.77 0.00 0.00 57.85 56.38 1re9 n ARG 47 Cb 0.54 -1.50 0.06 0.00 -1.02 0.00 0.00 32.46 30.54 1re9 n ARG 47 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1re9 n ASN 49 N -2.59 -5.88 0.00 0.00 4.13 -1.26 -1.01 115.26 108.65 1re9 n ASN 49 Ca 0.11 -0.25 0.00 0.00 1.68 0.00 0.00 54.58 56.12 1re9 n ASN 49 Cb 0.52 -4.78 0.00 0.00 -1.54 0.00 0.00 39.78 33.98 1re9 n ASN 49 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1re9 n GLY 50 N -1.42 2.03 0.08 7.41 0.00 -1.26 -4.56 105.19 107.46 1re9 n GLY 50 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1re9 n GLY 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1re9 n GLY 51 N -2.00 -0.23 3.48 -0.02 0.00 -0.18 -4.81 105.19 101.44 1re9 n GLY 51 Ca 0.00 -1.16 -0.09 0.00 0.00 0.00 0.00 46.02 44.77 1re9 n GLY 51 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1re9 s HIS 52 N -0.20 -0.39 0.63 1.61 -3.43 -0.27 -4.71 115.29 108.53 1re9 s HIS 52 Ca 0.00 0.24 -0.12 0.00 -0.80 0.00 0.00 55.06 54.38 1re9 s HIS 52 Cb 0.00 0.54 -0.03 0.00 -1.43 0.00 0.00 32.58 31.67 1re9 s HIS 52 CO 0.00 -0.62 1.04 -1.58 -2.00 0.00 0.00 174.74 171.58 1re9 s TRP 53 N -3.28 3.38 -0.04 0.38 0.52 -0.27 -0.77 118.94 118.85 1re9 s TRP 53 Ca 0.04 1.37 -0.01 0.00 0.02 0.00 0.00 56.10 57.52 1re9 s TRP 53 Cb -0.01 -2.81 0.03 0.00 -1.15 0.00 0.00 33.47 29.53 1re9 s TRP 53 CO -0.10 -0.88 0.02 0.42 0.02 0.00 0.00 176.95 176.43 1re9 s ILE 54 N -3.02 0.13 -0.07 2.03 1.01 0.39 -0.48 121.20 121.19 1re9 s ILE 54 Ca 0.57 0.21 -0.25 0.00 0.00 0.00 0.00 60.65 61.18 1re9 s ILE 54 Cb -0.12 -0.29 -0.03 0.00 0.01 0.00 0.00 42.46 42.02 1re9 s ILE 54 CO 0.51 0.18 0.79 0.00 0.00 0.00 0.00 174.94 176.42 1re9 s ALA 55 N 1.62 3.33 -0.96 9.38 0.00 -0.70 -1.47 121.76 132.97 1re9 s ALA 55 Ca -0.01 0.21 0.11 0.00 0.00 0.00 0.00 51.96 52.26 1re9 s ALA 55 Cb -0.13 -3.10 -0.01 0.00 0.00 0.00 0.00 23.12 19.89 1re9 s ALA 55 CO -0.03 -0.24 0.65 0.25 0.00 0.00 0.00 175.76 176.38 1re9 n THR 56 N 4.00 0.00 -4.34 0.00 -2.24 -0.42 -4.33 114.28 106.95 1re9 n THR 56 Ca 0.02 -0.38 -0.21 0.00 -2.27 0.00 0.00 64.05 61.20 1re9 n THR 56 Cb 0.51 1.12 -0.13 0.00 -2.10 0.00 0.00 70.33 69.73 1re9 n THR 56 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1re9 s ARG 57 N -1.45 1.01 0.28 -0.78 1.81 -1.26 -4.73 118.95 113.82 1re9 s ARG 57 Ca 0.09 -0.91 0.01 0.00 -1.72 0.00 0.00 55.73 53.19 1re9 s ARG 57 Cb 0.09 -1.08 0.55 0.00 -0.45 0.00 0.00 34.95 34.06 1re9 s ARG 57 CO 0.28 0.26 1.82 0.78 -0.68 0.00 0.00 175.30 177.75 1re9 h GLY 58 N 4.60 1.58 1.02 -3.53 0.00 -1.83 -0.93 103.07 103.99 1re9 h GLY 58 Ca -0.41 -0.39 -0.04 0.00 0.00 0.00 0.00 47.33 46.49 1re9 h GLY 58 CO 0.42 0.11 0.25 -1.61 0.00 0.00 0.00 176.54 175.71 1re9 h GLN 59 N 0.90 1.03 -0.08 4.80 4.15 -1.96 -0.34 115.11 123.61 1re9 h GLN 59 Ca 0.49 -0.20 -0.21 0.00 0.77 0.00 0.00 58.65 59.50 1re9 h GLN 59 Cb 0.53 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 28.06 1re9 h GLN 59 CO -0.28 0.87 -0.80 -0.07 -1.93 0.00 0.00 178.83 176.62 1re9 h LEU 60 N 0.98 0.64 0.00 -2.39 4.07 -1.78 -1.99 115.31 114.84 1re9 h LEU 60 Ca 0.22 -0.44 -0.00 0.00 0.08 0.00 0.00 57.88 57.75 1re9 h LEU 60 Cb 0.24 -0.19 0.00 0.00 1.08 0.00 0.00 40.66 41.79 1re9 h LEU 60 CO -0.01 1.21 -0.00 0.40 -1.08 0.00 0.00 178.44 178.95 1re9 h ILE 61 N 0.34 1.09 -0.72 1.22 2.04 -0.91 -0.93 117.51 119.65 1re9 h ILE 61 Ca -0.05 -0.28 -0.04 0.00 1.00 0.00 0.00 64.86 65.49 1re9 h ILE 61 Cb 1.40 1.28 -0.03 0.00 -0.74 0.00 0.00 36.82 38.73 1re9 h ILE 61 CO 0.15 0.07 0.29 0.03 0.00 0.00 0.00 178.15 178.69 1re9 h ARG 62 N -0.13 1.08 -0.75 2.37 3.08 -1.08 -1.78 114.38 117.17 1re9 h ARG 62 Ca -0.00 -0.19 0.01 0.00 0.07 0.00 0.00 59.98 59.86 1re9 h ARG 62 Cb 0.12 -0.18 -0.04 0.00 0.08 0.00 0.00 29.97 29.96 1re9 h ARG 62 CO 0.00 0.88 0.50 0.93 -1.07 0.00 0.00 179.97 181.21 1re9 h GLU 63 N 1.03 0.99 -0.20 0.04 5.08 -1.11 -1.29 114.58 119.12 1re9 h GLU 63 Ca 0.24 -0.06 -0.16 0.00 -1.00 0.00 0.00 59.36 58.38 1re9 h GLU 63 Cb 0.21 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 1re9 h GLU 63 CO -0.02 0.65 -0.54 0.00 -1.00 0.00 0.00 179.01 178.10 1re9 h ALA 64 N 1.28 0.68 0.00 3.43 0.00 -1.01 -1.91 119.26 121.74 1re9 h ALA 64 Ca 0.28 -0.51 -0.05 0.00 0.00 0.00 0.00 54.91 54.63 1re9 h ALA 64 Cb -0.11 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1re9 h ALA 64 CO -0.06 0.69 -0.23 1.88 0.00 0.00 0.00 179.25 181.52 1re9 h TYR 65 N 0.45 0.00 -0.02 0.00 0.05 -0.95 -2.50 116.97 113.99 1re9 h TYR 65 Ca 0.01 0.00 -0.18 0.00 0.05 0.00 0.00 58.73 58.61 1re9 h TYR 65 Cb 1.09 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.82 1re9 h TYR 65 CO 0.05 0.23 -0.78 0.93 -1.05 0.00 0.00 178.16 177.54 1re9 h GLU 66 N 0.00 0.20 -3.59 4.88 5.08 -0.87 -3.40 114.58 116.88 1re9 h GLU 66 Ca -0.00 -0.18 -0.77 0.00 -1.00 0.00 0.00 59.36 57.40 1re9 h GLU 66 Cb 0.45 0.05 -0.20 0.00 0.50 0.00 0.00 28.75 29.55 1re9 h GLU 66 CO 0.03 0.88 1.43 -3.47 -1.00 0.00 0.00 179.01 176.88 1re9 n ASP 67 N -3.73 5.50 0.27 1.42 2.03 -0.75 -4.78 116.55 116.52 1re9 n ASP 67 Ca -0.03 -3.16 0.16 0.00 0.52 0.00 0.00 54.79 52.28 1re9 n ASP 67 Cb 0.74 -1.43 0.68 0.00 -0.72 0.00 0.00 41.12 40.38 1re9 n ASP 67 CO 0.00 0.00 0.00 0.10 -1.92 0.00 0.00 177.20 175.38 1re9 h TYR 68 N 6.00 0.00 -0.57 -0.67 -0.00 -1.76 -1.41 116.97 118.57 1re9 h TYR 68 Ca 0.31 0.00 -0.08 0.00 -0.00 0.00 0.00 58.73 58.96 1re9 h TYR 68 Cb 0.69 0.00 -0.02 0.00 -0.00 0.00 0.00 36.73 37.40 1re9 h TYR 68 CO 1.11 0.06 0.03 0.00 -0.00 0.00 0.00 178.16 179.36 1re9 h ARG 69 N 0.00 0.96 0.10 0.10 3.08 -1.94 -3.23 114.38 113.45 1re9 h ARG 69 Ca -0.00 -0.27 -0.34 0.00 0.07 0.00 0.00 59.98 59.44 1re9 h ARG 69 Cb 0.52 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.44 1re9 h ARG 69 CO 0.01 0.93 -1.84 0.45 -1.07 0.00 0.00 179.97 178.44 1re9 h HIS 70 N 0.89 0.38 -3.54 3.04 3.86 -1.89 -3.43 115.15 114.46 1re9 h HIS 70 Ca 0.17 -0.28 -0.69 0.00 -1.16 0.00 0.00 60.37 58.41 1re9 h HIS 70 Cb 0.48 -0.02 -0.36 0.00 1.06 0.00 0.00 27.41 28.58 1re9 h HIS 70 CO 0.03 1.53 -0.37 -0.06 0.86 0.00 0.00 177.93 179.92 1re9 s PHE 71 N -2.58 3.40 0.24 2.45 0.08 -0.55 -1.20 117.98 119.82 1re9 s PHE 71 Ca -0.16 -2.75 -0.14 0.00 0.12 0.00 0.00 56.93 54.01 1re9 s PHE 71 Cb 0.07 -3.18 -0.08 0.00 -0.57 0.00 0.00 43.02 39.26 1re9 s PHE 71 CO 0.80 -0.83 0.63 0.45 -0.10 0.00 0.00 175.22 176.17 1re9 s SER 72 N 0.61 6.78 0.00 1.36 0.15 -0.16 -4.30 113.70 118.14 1re9 s SER 72 Ca 0.17 1.14 0.18 0.00 0.70 0.00 0.00 55.95 58.14 1re9 s SER 72 Cb -0.20 -2.32 0.78 0.00 -1.71 0.00 0.00 66.02 62.57 1re9 s SER 72 CO -0.03 -0.06 1.54 -1.20 1.20 0.00 0.00 173.24 174.69 1re9 n SER 73 N 0.14 0.98 0.21 5.45 7.64 -1.26 -0.69 113.62 126.09 1re9 n SER 73 Ca -0.00 -1.65 0.06 0.00 1.01 0.00 0.00 58.87 58.29 1re9 n SER 73 Cb 0.52 -0.07 0.46 0.00 -1.01 0.00 0.00 64.21 64.11 1re9 n SER 73 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1re9 h GLU 74 N 1.27 0.00 -2.64 1.43 4.81 -1.87 -3.30 114.58 114.27 1re9 h GLU 74 Ca 0.00 0.00 -0.60 0.00 -0.13 0.00 0.00 59.36 58.63 1re9 h GLU 74 Cb 0.28 0.00 -0.39 0.00 0.63 0.00 0.00 28.75 29.27 1re9 h GLU 74 CO 0.00 0.29 -0.84 0.00 -0.73 0.00 0.00 179.01 177.73 1re9 n PRO 76 N 3.01 2.15 -4.37 0.00 -0.04 -1.24 -3.94 135.00 130.57 1re9 n PRO 76 Ca 0.21 -1.68 -0.28 0.00 -0.04 0.00 0.00 63.50 61.71 1re9 n PRO 76 Cb 0.41 -1.47 -0.12 0.00 -0.04 0.00 0.00 33.50 32.29 1re9 n PRO 76 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1re9 s PHE 77 N -1.93 2.40 -0.14 0.54 0.08 -1.26 -1.02 117.98 116.65 1re9 s PHE 77 Ca 0.32 -0.33 -0.07 0.00 0.12 0.00 0.00 56.93 56.97 1re9 s PHE 77 Cb 0.20 -1.25 -0.04 0.00 -0.57 0.00 0.00 43.02 41.36 1re9 s PHE 77 CO 0.31 0.41 0.13 0.42 -0.10 0.00 0.00 175.22 176.39 1re9 s ILE 78 N -1.30 5.41 0.74 0.64 1.01 -1.26 -3.57 121.20 122.87 1re9 s ILE 78 Ca 0.18 0.18 -0.11 0.00 0.00 0.00 0.00 60.65 60.90 1re9 s ILE 78 Cb -0.09 -3.38 0.05 0.00 0.01 0.00 0.00 42.46 39.04 1re9 s ILE 78 CO 0.09 0.58 1.11 -2.16 0.00 0.00 0.00 174.94 174.56 1re9 s PRO 79 N -0.69 2.38 0.27 2.79 0.04 -1.26 -4.91 135.00 133.62 1re9 s PRO 79 Ca 0.13 0.18 0.01 0.00 0.04 0.00 0.00 61.00 61.36 1re9 s PRO 79 Cb -0.12 -2.03 0.57 0.00 0.04 0.00 0.00 34.50 32.96 1re9 s PRO 79 CO 0.03 -1.29 1.78 -0.09 0.04 0.00 0.00 177.00 177.47 1re9 h ARG 80 N -0.79 0.72 -0.25 4.56 2.43 -1.81 0.23 114.38 119.46 1re9 h ARG 80 Ca -0.45 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 58.66 1re9 h ARG 80 Cb 1.30 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 30.67 1re9 h ARG 80 CO 0.64 0.48 0.11 0.93 -1.51 0.00 0.00 179.97 180.62 1re9 h GLU 81 N 0.74 0.35 -0.14 0.20 3.07 -1.98 0.18 114.58 117.00 1re9 h GLU 81 Ca 0.49 -0.03 -0.11 0.00 -0.50 0.00 0.00 59.36 59.20 1re9 h GLU 81 Cb 0.65 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 28.49 1re9 h GLU 81 CO -0.34 0.29 -0.35 0.00 -1.40 0.00 0.00 179.01 177.21 1re9 h ALA 82 N 1.77 0.24 -0.39 3.43 0.00 -1.28 -2.11 119.26 120.92 1re9 h ALA 82 Ca 0.09 -0.44 -0.05 0.00 0.00 0.00 0.00 54.91 54.52 1re9 h ALA 82 Cb 0.07 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1re9 h ALA 82 CO -0.01 0.30 0.04 0.78 0.00 0.00 0.00 179.25 180.36 1re9 h GLY 83 N 0.11 0.64 0.98 0.00 0.00 -0.78 -0.07 103.07 103.96 1re9 h GLY 83 Ca -0.00 -0.37 -0.09 0.00 0.00 0.00 0.00 47.33 46.86 1re9 h GLY 83 CO 0.08 0.35 -0.11 0.83 0.00 0.00 0.00 176.54 177.68 1re9 h GLU 84 N 0.58 0.76 0.00 4.80 5.08 -0.63 -2.96 114.58 122.21 1re9 h GLU 84 Ca 0.13 -0.30 -0.02 0.00 -1.00 0.00 0.00 59.36 58.17 1re9 h GLU 84 Cb 0.31 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 1re9 h GLU 84 CO 0.01 0.91 -0.09 0.00 -1.00 0.00 0.00 179.01 178.84 1re9 h ALA 85 N 0.83 0.98 -2.41 3.43 0.00 -0.94 -3.45 119.26 117.71 1re9 h ALA 85 Ca 0.10 -0.08 -0.54 0.00 0.00 0.00 0.00 54.91 54.39 1re9 h ALA 85 Cb 0.64 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 1re9 h ALA 85 CO 0.04 0.11 0.71 -0.47 0.00 0.00 0.00 179.25 179.64 1re9 s TYR 86 N -3.49 3.14 -0.01 0.00 6.14 -0.08 -4.89 117.35 118.16 1re9 s TYR 86 Ca 0.03 1.06 0.19 0.00 0.64 0.00 0.00 57.07 59.00 1re9 s TYR 86 Cb 0.08 -3.54 0.33 0.00 0.42 0.00 0.00 41.96 39.26 1re9 s TYR 86 CO 0.61 -1.84 1.14 -0.40 0.64 0.00 0.00 175.55 175.70 1re9 n ASP 87 N 4.77 0.84 -4.75 4.32 5.75 -1.26 -4.89 116.55 121.33 1re9 n ASP 87 Ca 0.11 -2.11 -0.33 0.00 -0.01 0.00 0.00 54.79 52.44 1re9 n ASP 87 Cb 0.45 -0.29 0.07 0.00 -1.03 0.00 0.00 41.12 40.32 1re9 n ASP 87 CO 0.00 0.00 0.00 -0.36 -0.11 0.00 0.00 177.20 176.73 1re9 s PHE 88 N -0.21 2.35 -0.09 2.11 0.08 -1.26 -4.85 117.98 116.11 1re9 s PHE 88 Ca 0.27 1.58 0.03 0.00 0.12 0.00 0.00 56.93 58.93 1re9 s PHE 88 Cb 0.30 -3.30 -0.01 0.00 -0.57 0.00 0.00 43.02 39.44 1re9 s PHE 88 CO -0.13 -2.10 -0.18 0.42 -0.10 0.00 0.00 175.22 173.13 1re9 s ILE 89 N -2.20 2.65 -2.23 0.64 1.01 -0.68 -1.35 121.20 119.03 1re9 s ILE 89 Ca 0.70 -0.83 0.19 0.00 0.00 0.00 0.00 60.65 60.70 1re9 s ILE 89 Cb -0.24 -2.05 0.43 0.00 0.01 0.00 0.00 42.46 40.61 1re9 s ILE 89 CO 0.43 0.56 1.46 -0.81 0.00 0.00 0.00 174.94 176.58 1re9 n PRO 90 N 3.11 1.93 0.11 2.79 -0.05 -1.26 -4.15 135.00 137.48 1re9 n PRO 90 Ca -0.18 -1.41 0.11 0.00 -0.05 0.00 0.00 63.50 61.97 1re9 n PRO 90 Cb 0.52 -1.39 0.46 0.00 -0.05 0.00 0.00 33.50 33.04 1re9 n PRO 90 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 175.50 175.70 1re9 n THR 91 N 0.63 0.92 -0.81 0.52 -2.24 -1.20 -2.11 114.28 109.99 1re9 n THR 91 Ca 0.16 0.29 0.08 0.00 -2.27 0.00 0.00 64.05 62.31 1re9 n THR 91 Cb 0.38 -1.20 0.26 0.00 -2.10 0.00 0.00 70.33 67.67 1re9 n THR 91 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1re9 n SER 92 N -2.09 3.92 -4.37 3.42 3.41 -0.46 -4.80 113.62 112.64 1re9 n SER 92 Ca 0.02 -2.78 -0.28 0.00 -0.26 0.00 0.00 58.87 55.57 1re9 n SER 92 Cb 0.19 -0.50 -0.13 0.00 -0.26 0.00 0.00 64.21 63.51 1re9 n SER 92 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1re9 s MET 93 N -2.41 1.36 0.15 4.33 -1.94 -0.90 -3.95 119.30 115.95 1re9 s MET 93 Ca 0.40 -1.32 0.04 0.00 -1.71 0.00 0.00 55.69 53.10 1re9 s MET 93 Cb 0.30 -1.83 -0.04 0.00 2.01 0.00 0.00 34.83 35.28 1re9 s MET 93 CO 0.12 0.43 0.19 -0.51 -0.01 0.00 0.00 175.02 175.24 1re9 s ASP 94 N -2.03 5.87 0.82 3.03 1.01 -1.26 -4.70 116.67 119.40 1re9 s ASP 94 Ca 0.13 0.01 -0.11 0.00 0.71 0.00 0.00 52.55 53.29 1re9 s ASP 94 Cb -0.10 -1.65 0.09 0.00 1.01 0.00 0.00 42.92 42.27 1re9 s ASP 94 CO 0.06 0.07 1.14 -2.84 0.21 0.00 0.00 175.17 173.81 1re9 s PRO 95 N -3.08 1.74 0.42 8.23 0.02 -1.26 -1.50 135.00 139.56 1re9 s PRO 95 Ca 0.32 1.46 0.24 0.00 0.02 0.00 0.00 61.00 63.05 1re9 s PRO 95 Cb -0.11 -1.82 0.50 0.00 0.02 0.00 0.00 34.50 33.10 1re9 s PRO 95 CO 0.25 -2.08 1.67 -1.00 -0.33 0.00 0.00 177.00 175.51 1re9 h PRO 96 N -1.21 0.00 -0.68 5.54 0.13 -2.02 -3.45 132.00 130.31 1re9 h PRO 96 Ca -0.44 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 64.74 1re9 h PRO 96 Cb 1.26 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.35 1re9 h PRO 96 CO 0.47 0.00 0.45 1.05 -0.23 0.00 0.00 178.00 179.74 1re9 h GLU 97 N 0.00 0.74 -0.51 0.86 4.11 -1.95 -2.18 114.58 115.65 1re9 h GLU 97 Ca 0.00 -0.04 0.10 0.00 0.07 0.00 0.00 59.36 59.49 1re9 h GLU 97 Cb 0.92 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.97 1re9 h GLU 97 CO 0.00 0.49 0.35 0.37 0.07 0.00 0.00 179.01 180.29 1re9 h GLN 98 N 0.76 0.25 -0.66 1.06 4.15 -1.58 -3.25 115.11 115.83 1re9 h GLN 98 Ca 0.28 -0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.68 1re9 h GLN 98 Cb 0.16 -0.06 -0.03 0.00 0.21 0.00 0.00 27.48 27.77 1re9 h GLN 98 CO -0.09 0.16 0.37 0.00 -1.93 0.00 0.00 178.83 177.35 1re9 h ARG 99 N 0.25 0.92 0.00 1.69 3.08 -1.68 0.05 114.38 118.70 1re9 h ARG 99 Ca 0.24 -0.10 -0.13 0.00 0.07 0.00 0.00 59.98 60.05 1re9 h ARG 99 Cb 0.61 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.46 1re9 h ARG 99 CO -0.05 0.69 -0.64 1.96 -1.07 0.00 0.00 179.97 180.86 1re9 h GLN 100 N 0.91 0.00 -0.36 0.04 4.20 -1.75 -1.07 115.11 117.08 1re9 h GLN 100 Ca 0.23 0.00 -0.15 0.00 0.06 0.00 0.00 58.65 58.80 1re9 h GLN 100 Cb 0.03 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.80 1re9 h GLN 100 CO -0.04 0.64 -0.36 0.74 -0.67 0.00 0.00 178.83 179.14 1re9 h PHE 101 N 0.00 0.99 -0.73 2.96 0.04 -1.52 -2.42 116.94 116.25 1re9 h PHE 101 Ca -0.01 -0.28 -0.02 0.00 2.80 0.00 0.00 57.97 60.46 1re9 h PHE 101 Cb 1.34 -0.21 -0.03 0.00 2.20 0.00 0.00 35.95 39.24 1re9 h PHE 101 CO 0.00 1.07 0.38 -0.09 -0.60 0.00 0.00 178.31 179.08 1re9 h ARG 102 N 0.69 1.04 -0.63 1.51 2.43 -0.86 -0.87 114.38 117.69 1re9 h ARG 102 Ca 0.06 -0.13 -0.02 0.00 -0.81 0.00 0.00 59.98 59.08 1re9 h ARG 102 Cb 0.93 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 30.25 1re9 h ARG 102 CO 0.09 0.79 0.31 0.00 -1.51 0.00 0.00 179.97 179.65 1re9 h ALA 103 N 1.19 1.37 -0.17 2.80 0.00 -1.04 0.08 119.26 123.49 1re9 h ALA 103 Ca 0.26 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1re9 h ALA 103 Cb 0.07 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1re9 h ALA 103 CO -0.04 0.50 -0.01 1.25 0.00 0.00 0.00 179.25 180.95 1re9 h LEU 104 N 0.88 0.31 -1.42 0.00 5.85 -1.13 -2.89 115.31 116.91 1re9 h LEU 104 Ca 0.22 -0.33 0.04 0.00 0.84 0.00 0.00 57.88 58.65 1re9 h LEU 104 Cb 0.07 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 40.98 1re9 h LEU 104 CO -0.03 0.56 0.42 0.00 -0.34 0.00 0.00 178.44 179.05 1re9 h ALA 105 N 0.76 1.66 -0.11 1.25 0.00 -0.84 -2.00 119.26 119.98 1re9 h ALA 105 Ca 0.05 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1re9 h ALA 105 Cb 0.41 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1re9 h ALA 105 CO 0.01 0.27 0.07 -0.97 0.00 0.00 0.00 179.25 178.63 1re9 h ASN 106 N 0.75 0.12 0.59 0.00 -1.24 -0.79 -1.41 115.58 113.60 1re9 h ASN 106 Ca 0.26 -0.00 -0.02 0.00 0.71 0.00 0.00 56.30 57.25 1re9 h ASN 106 Cb 0.09 -0.03 -0.00 0.00 0.73 0.00 0.00 38.32 39.11 1re9 h ASN 106 CO -0.07 0.09 -0.08 1.56 -1.29 0.00 0.00 177.43 177.65 1re9 h GLN 107 N 0.15 0.00 0.00 6.67 4.20 -1.19 -0.89 115.11 124.05 1re9 h GLN 107 Ca 0.04 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.75 1re9 h GLN 107 Cb -0.01 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.77 1re9 h GLN 107 CO -0.01 0.08 -1.11 1.33 -0.67 0.00 0.00 178.83 178.44 1re9 n VAL 108 N -3.33 0.00 -0.52 -0.54 0.24 -0.58 -4.71 118.33 108.90 1re9 n VAL 108 Ca -0.01 -0.25 0.00 0.00 -2.04 0.00 0.00 64.34 62.04 1re9 n VAL 108 Cb 0.26 0.53 0.00 0.00 -1.47 0.00 0.00 33.84 33.16 1re9 n VAL 108 CO 0.00 0.00 0.00 1.33 -2.14 0.00 0.00 176.83 176.02 1re9 n VAL 109 N -1.64 0.04 -0.92 3.34 0.24 -0.93 -4.95 118.33 113.52 1re9 n VAL 109 Ca -0.01 -0.26 -0.28 0.00 -2.04 0.00 0.00 64.34 61.76 1re9 n VAL 109 Cb 0.23 1.45 0.24 0.00 -1.47 0.00 0.00 33.84 34.29 1re9 n VAL 109 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1re9 n GLY 110 N -0.02 -2.88 0.24 7.63 0.00 -0.34 -4.44 105.19 105.38 1re9 n GLY 110 Ca 0.00 -1.47 0.01 0.00 0.00 0.00 0.00 46.02 44.57 1re9 n GLY 110 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1re9 h MET 111 N 0.00 0.35 -0.46 1.61 1.85 -1.85 -3.21 114.93 113.22 1re9 h MET 111 Ca -0.38 -0.02 -0.10 0.00 -0.61 0.00 0.00 59.70 58.59 1re9 h MET 111 Cb 1.16 -0.08 -0.02 0.00 0.43 0.00 0.00 31.60 33.10 1re9 h MET 111 CO 0.24 0.23 -0.10 -1.00 -0.40 0.00 0.00 176.91 175.88 1re9 h PRO 112 N 0.36 0.84 -1.04 0.39 0.13 -1.94 -0.67 132.00 130.08 1re9 h PRO 112 Ca 0.34 -0.29 0.26 0.00 -0.87 0.00 0.00 66.00 65.44 1re9 h PRO 112 Cb 0.47 -0.07 -0.09 0.00 0.13 0.00 0.00 31.00 31.44 1re9 h PRO 112 CO -0.36 0.91 0.66 0.28 -0.23 0.00 0.00 178.00 179.26 1re9 h VAL 113 N 0.76 0.53 -0.64 1.56 2.07 -1.87 0.28 116.25 118.94 1re9 h VAL 113 Ca 0.13 -0.14 -0.02 0.00 0.82 0.00 0.00 66.70 67.49 1re9 h VAL 113 Cb 0.61 0.09 -0.03 0.00 -1.52 0.00 0.00 31.29 30.43 1re9 h VAL 113 CO 0.04 0.07 0.32 0.58 0.02 0.00 0.00 177.57 178.61 1re9 h VAL 114 N 0.41 1.21 0.00 2.57 2.07 -1.16 -0.06 116.25 121.29 1re9 h VAL 114 Ca 0.60 -0.57 -0.11 0.00 0.82 0.00 0.00 66.70 67.43 1re9 h VAL 114 Cb 1.48 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 31.66 1re9 h VAL 114 CO -0.30 0.24 -0.53 0.44 0.02 0.00 0.00 177.57 177.44 1re9 h ASP 115 N 0.87 0.00 0.05 0.57 3.32 -0.19 -0.06 116.42 120.97 1re9 h ASP 115 Ca 0.22 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.15 1re9 h ASP 115 Cb 0.09 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 1re9 h ASP 115 CO -0.03 0.53 -0.39 0.07 -1.72 0.00 0.00 179.24 177.70 1re9 h LYS 116 N 0.00 0.45 0.00 3.56 2.10 -0.75 -3.06 116.57 118.88 1re9 h LYS 116 Ca -0.01 -0.22 0.00 0.00 -2.00 0.00 0.00 60.65 58.43 1re9 h LYS 116 Cb 0.94 -0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.27 1re9 h LYS 116 CO 0.07 0.77 -0.40 1.28 -2.00 0.00 0.00 179.45 179.17 1re9 n LEU 117 N -4.04 0.74 -0.26 7.07 4.77 -0.11 -4.46 117.00 120.71 1re9 n LEU 117 Ca -0.01 0.35 0.12 0.00 -0.03 0.00 0.00 56.01 56.44 1re9 n LEU 117 Cb 0.49 -0.23 0.38 0.00 -2.33 0.00 0.00 43.42 41.73 1re9 n LEU 117 CO 0.44 -0.10 1.22 -0.08 -1.33 0.00 0.00 177.39 177.54 1re9 h GLU 118 N 0.00 0.67 -0.03 3.23 4.57 -0.90 0.73 114.58 122.85 1re9 h GLU 118 Ca 0.00 -0.04 -0.11 0.00 -1.18 0.00 0.00 59.36 58.03 1re9 h GLU 118 Cb 0.74 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 29.16 1re9 h GLU 118 CO 0.00 0.45 -0.48 -2.95 -1.18 0.00 0.00 179.01 174.84 1re9 h ASN 119 N 0.69 0.09 0.38 1.04 -1.07 -1.80 -1.00 115.58 113.91 1re9 h ASN 119 Ca 0.44 -0.04 -0.23 0.00 0.07 0.00 0.00 56.30 56.54 1re9 h ASN 119 Cb 0.70 -0.03 0.00 0.00 -2.07 0.00 0.00 38.32 36.93 1re9 h ASN 119 CO -0.20 0.56 -1.00 0.03 0.07 0.00 0.00 177.43 176.89 1re9 h ARG 120 N 0.07 0.39 -0.16 4.14 2.47 -1.20 -1.47 114.38 118.62 1re9 h ARG 120 Ca 0.00 -0.45 0.00 0.00 -1.26 0.00 0.00 59.98 58.27 1re9 h ARG 120 Cb 0.88 0.14 -0.01 0.00 -1.65 0.00 0.00 29.97 29.33 1re9 h ARG 120 CO 0.07 1.13 0.10 0.82 0.56 0.00 0.00 179.97 182.64 1re9 h ILE 121 N 0.20 1.05 -0.22 2.04 2.04 -0.90 -0.41 117.51 121.31 1re9 h ILE 121 Ca -0.09 -0.11 0.03 0.00 1.00 0.00 0.00 64.86 65.69 1re9 h ILE 121 Cb 1.65 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 38.54 1re9 h ILE 121 CO 0.17 0.05 0.01 -0.61 0.00 0.00 0.00 178.15 177.77 1re9 h GLN 122 N 0.20 0.08 -0.61 2.37 5.75 -1.17 -2.00 115.11 119.71 1re9 h GLN 122 Ca 0.06 -0.00 -0.05 0.00 -0.15 0.00 0.00 58.65 58.50 1re9 h GLN 122 Cb -0.01 -0.02 -0.03 0.00 1.07 0.00 0.00 27.48 28.50 1re9 h GLN 122 CO -0.01 0.05 0.19 1.49 -2.65 0.00 0.00 178.83 177.90 1re9 h GLU 123 N 0.08 0.95 -0.45 1.69 4.22 -1.06 -2.04 114.58 117.97 1re9 h GLU 123 Ca 0.10 -0.21 -0.02 0.00 0.08 0.00 0.00 59.36 59.32 1re9 h GLU 123 Cb 0.12 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 1re9 h GLU 123 CO -0.17 0.85 0.21 1.25 -2.18 0.00 0.00 179.01 178.97 1re9 h LEU 124 N 0.88 0.59 -0.21 1.64 5.85 -0.90 -0.06 115.31 123.09 1re9 h LEU 124 Ca 0.20 -0.13 0.02 0.00 0.84 0.00 0.00 57.88 58.80 1re9 h LEU 124 Cb 0.29 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 1re9 h LEU 124 CO -0.01 0.56 0.09 0.00 -0.34 0.00 0.00 178.44 178.74 1re9 h ALA 125 N 1.05 0.24 -0.69 1.25 0.00 -1.23 -0.86 119.26 119.03 1re9 h ALA 125 Ca 0.15 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 1re9 h ALA 125 Cb 0.13 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 1re9 h ALA 125 CO -0.02 -0.33 0.20 0.00 0.00 0.00 0.00 179.25 179.10 1re9 h SER 127 N 1.03 0.92 -0.46 0.00 4.64 -0.76 -0.09 113.55 118.83 1re9 h SER 127 Ca 0.22 -0.45 -0.04 0.00 -0.47 0.00 0.00 61.79 61.06 1re9 h SER 127 Cb 0.31 -0.26 -0.02 0.00 -0.31 0.00 0.00 62.40 62.13 1re9 h SER 127 CO -0.00 1.17 0.13 -0.07 -0.87 0.00 0.00 176.83 177.19 1re9 h LEU 128 N 0.68 0.67 -0.40 5.97 3.38 -0.91 -1.99 115.31 122.71 1re9 h LEU 128 Ca 0.07 -0.22 -0.11 0.00 0.09 0.00 0.00 57.88 57.72 1re9 h LEU 128 Cb 0.88 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 1re9 h LEU 128 CO 0.08 0.71 -0.17 0.40 0.09 0.00 0.00 178.44 179.55 1re9 h ILE 129 N 0.60 1.28 0.00 1.22 2.04 -1.08 -2.13 117.51 119.45 1re9 h ILE 129 Ca 0.15 -1.30 -0.03 0.00 1.00 0.00 0.00 64.86 64.68 1re9 h ILE 129 Cb 0.29 1.28 -0.00 0.00 -0.74 0.00 0.00 36.82 37.64 1re9 h ILE 129 CO -0.00 0.43 -0.16 -0.08 0.00 0.00 0.00 178.15 178.34 1re9 h GLU 130 N 0.62 0.00 -0.10 2.37 4.57 -0.91 -0.13 114.58 121.01 1re9 h GLU 130 Ca 0.09 0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 58.20 1re9 h GLU 130 Cb 0.72 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.30 1re9 h GLU 130 CO 0.05 0.16 -0.25 0.66 -1.18 0.00 0.00 179.01 178.45 1re9 h SER 131 N 0.00 0.16 0.46 1.04 4.64 -0.68 -3.15 113.55 116.02 1re9 h SER 131 Ca -0.00 -0.05 -0.30 0.00 -0.47 0.00 0.00 61.79 60.97 1re9 h SER 131 Cb 0.29 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 62.31 1re9 h SER 131 CO 0.02 0.43 -1.61 -0.07 -0.87 0.00 0.00 176.83 174.72 1re9 h LEU 132 N 0.15 0.25 -0.62 5.97 3.38 -1.10 -3.42 115.31 119.92 1re9 h LEU 132 Ca 0.02 -0.40 0.12 0.00 0.09 0.00 0.00 57.88 57.71 1re9 h LEU 132 Cb 0.54 -0.08 -0.12 0.00 0.09 0.00 0.00 40.66 41.09 1re9 h LEU 132 CO 0.04 1.35 -0.22 -0.09 0.09 0.00 0.00 178.44 179.60 1re9 h ARG 133 N 0.04 -0.06 0.00 1.13 2.43 -1.00 -0.66 114.38 116.26 1re9 h ARG 133 Ca -0.26 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.91 1re9 h ARG 133 Cb 2.00 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 31.56 1re9 h ARG 133 CO 0.12 -0.04 0.00 -2.30 -1.51 0.00 0.00 179.97 176.24 1re9 n PRO 134 N -5.44 0.21 0.16 0.20 -0.02 -1.26 -3.23 135.00 125.61 1re9 n PRO 134 Ca 0.06 0.44 0.03 0.00 -2.02 0.00 0.00 63.50 62.02 1re9 n PRO 134 Cb 0.34 -1.90 0.18 0.00 -0.02 0.00 0.00 33.50 32.11 1re9 n PRO 134 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1re9 h GLN 135 N 0.00 0.00 0.00 -0.52 4.20 -1.39 -3.46 115.11 113.94 1re9 h GLN 135 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1re9 h GLN 135 Cb 0.37 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.15 1re9 h GLN 135 CO 0.00 0.47 0.00 0.41 -0.67 0.00 0.00 178.83 179.04 1re9 n GLY 136 N 0.71 0.50 3.53 3.46 0.00 -1.20 -4.96 105.19 107.23 1re9 n GLY 136 Ca 0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.93 1re9 n GLY 136 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1re9 s GLN 137 N -0.31 0.77 0.27 1.61 -2.07 -1.26 -1.29 119.66 117.37 1re9 s GLN 137 Ca 0.00 -0.12 -0.21 0.00 -1.82 0.00 0.00 55.36 53.21 1re9 s GLN 137 Cb 0.00 0.36 0.03 0.00 -1.09 0.00 0.00 33.01 32.31 1re9 s GLN 137 CO 0.00 -0.30 0.76 0.00 -1.32 0.00 0.00 175.29 174.43 1re9 s ASN 139 N -2.94 6.00 0.24 0.00 3.84 -1.26 -1.72 114.94 119.10 1re9 s ASN 139 Ca 0.12 -1.50 -0.06 0.00 0.21 0.00 0.00 52.86 51.62 1re9 s ASN 139 Cb -0.05 -2.13 0.32 0.00 -0.55 0.00 0.00 41.25 38.84 1re9 s ASN 139 CO 0.07 -0.67 1.86 0.15 -2.79 0.00 0.00 177.10 175.72 1re9 h PHE 140 N 8.67 1.01 -0.71 0.43 3.57 -1.22 0.34 116.94 129.03 1re9 h PHE 140 Ca -0.27 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.26 1re9 h PHE 140 Cb 1.10 -0.33 -0.03 0.00 2.79 0.00 0.00 35.95 39.48 1re9 h PHE 140 CO 0.65 0.53 0.43 1.15 -2.23 0.00 0.00 178.31 178.84 1re9 h THR 141 N 1.01 1.20 0.11 4.41 2.02 -1.94 -1.07 112.91 118.65 1re9 h THR 141 Ca 0.37 -0.44 -0.28 0.00 0.77 0.00 0.00 66.41 66.83 1re9 h THR 141 Cb 0.12 0.21 -0.00 0.00 -1.74 0.00 0.00 68.15 66.74 1re9 h THR 141 CO -0.16 0.21 -1.32 -0.08 0.37 0.00 0.00 175.52 174.55 1re9 h GLU 142 N 0.97 0.23 0.00 6.66 4.57 -1.72 -0.44 114.58 124.85 1re9 h GLU 142 Ca 0.26 -0.40 0.00 0.00 -1.18 0.00 0.00 59.36 58.04 1re9 h GLU 142 Cb -0.04 0.15 0.00 0.00 -0.16 0.00 0.00 28.75 28.70 1re9 h GLU 142 CO -0.05 1.15 -1.65 -0.25 -1.18 0.00 0.00 179.01 177.03 1re9 n ASP 143 N -3.48 0.29 0.06 1.04 8.00 0.11 -4.45 116.55 118.13 1re9 n ASP 143 Ca -0.10 0.05 0.00 0.00 0.71 0.00 0.00 54.79 55.45 1re9 n ASP 143 Cb 1.02 1.49 0.00 0.00 -0.02 0.00 0.00 41.12 43.61 1re9 n ASP 143 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1re9 n TYR 144 N -2.34 -0.79 0.04 1.24 4.19 -0.66 -4.77 117.16 114.07 1re9 n TYR 144 Ca -0.02 0.14 0.02 0.00 3.31 0.00 0.00 57.90 61.34 1re9 n TYR 144 Cb 0.55 0.28 0.36 0.00 0.49 0.00 0.00 39.34 41.02 1re9 n TYR 144 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1re9 h ALA 145 N 0.00 1.49 0.01 2.98 0.00 -1.19 -2.13 119.26 120.42 1re9 h ALA 145 Ca 0.00 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 1re9 h ALA 145 Cb 0.20 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1re9 h ALA 145 CO 0.00 0.37 -0.00 0.93 0.00 0.00 0.00 179.25 180.54 1re9 h GLU 146 N 0.42 -0.01 0.00 0.00 5.08 -1.30 -3.37 114.58 115.39 1re9 h GLU 146 Ca 0.09 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.41 1re9 h GLU 146 Cb 0.26 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 1re9 h GLU 146 CO 0.01 0.79 -0.20 -1.35 -1.00 0.00 0.00 179.01 177.26 1re9 h PRO 147 N -0.94 0.00 0.60 2.33 0.11 -1.76 -3.24 132.00 129.10 1re9 h PRO 147 Ca -0.00 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.08 1re9 h PRO 147 Cb 0.81 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.93 1re9 h PRO 147 CO 0.00 0.20 -0.29 0.35 -0.21 0.00 0.00 178.00 178.05 1re9 h PHE 148 N 0.00 -0.75 -0.21 0.65 3.57 -1.54 -2.03 116.94 116.63 1re9 h PHE 148 Ca -0.00 -0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.41 1re9 h PHE 148 Cb 0.41 0.25 -0.01 0.00 2.79 0.00 0.00 35.95 39.39 1re9 h PHE 148 CO 0.00 -0.47 -0.20 -1.00 -2.23 0.00 0.00 178.31 174.41 1re9 h PRO 149 N -1.11 0.37 -0.14 6.41 0.13 -1.73 -2.47 132.00 133.44 1re9 h PRO 149 Ca -0.08 -0.11 -0.16 0.00 -0.87 0.00 0.00 66.00 64.77 1re9 h PRO 149 Cb 0.62 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 31.71 1re9 h PRO 149 CO 0.14 0.56 -0.59 0.97 -0.23 0.00 0.00 178.00 178.84 1re9 h ILE 150 N 0.33 1.34 -0.74 -3.56 6.09 -1.59 -0.78 117.51 118.61 1re9 h ILE 150 Ca 0.06 -1.88 -0.03 0.00 -1.37 0.00 0.00 64.86 61.64 1re9 h ILE 150 Cb 0.54 1.87 -0.03 0.00 0.47 0.00 0.00 36.82 39.67 1re9 h ILE 150 CO 0.04 0.58 0.35 0.03 -3.07 0.00 0.00 178.15 176.07 1re9 h ARG 151 N 0.35 1.05 -0.74 2.19 3.08 -1.17 -0.33 114.38 118.82 1re9 h ARG 151 Ca -0.00 -0.15 -0.06 0.00 0.07 0.00 0.00 59.98 59.85 1re9 h ARG 151 Cb 1.13 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 30.95 1re9 h ARG 151 CO 0.11 0.81 0.24 0.82 -1.07 0.00 0.00 179.97 180.88 1re9 h ILE 152 N 1.05 1.26 -0.57 2.04 2.04 -1.15 -2.34 117.51 119.83 1re9 h ILE 152 Ca 0.25 -0.88 -0.07 0.00 1.00 0.00 0.00 64.86 65.16 1re9 h ILE 152 Cb 0.11 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 36.60 1re9 h ILE 152 CO -0.03 0.35 0.07 0.15 0.00 0.00 0.00 178.15 178.69 1re9 h PHE 153 N 1.09 1.02 -0.39 1.37 3.57 -0.54 -1.29 116.94 121.77 1re9 h PHE 153 Ca 0.24 -0.15 -0.00 0.00 3.53 0.00 0.00 57.97 61.59 1re9 h PHE 153 Cb 0.28 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 38.73 1re9 h PHE 153 CO 0.02 0.90 0.23 0.52 -2.23 0.00 0.00 178.31 177.76 1re9 h MET 154 N 0.85 0.53 -0.28 1.11 2.86 -0.83 0.11 114.93 119.28 1re9 h MET 154 Ca 0.17 -0.04 -0.07 0.00 -2.06 0.00 0.00 59.70 57.70 1re9 h MET 154 Cb 0.44 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.98 1re9 h MET 154 CO 0.01 0.37 -0.10 -0.07 1.06 0.00 0.00 176.91 178.18 1re9 h LEU 155 N 0.54 0.57 -0.99 1.22 3.38 -0.96 -0.30 115.31 118.77 1re9 h LEU 155 Ca 0.14 -0.39 -0.10 0.00 0.09 0.00 0.00 57.88 57.62 1re9 h LEU 155 Cb -0.02 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1re9 h LEU 155 CO -0.03 0.83 -0.47 0.17 0.09 0.00 0.00 178.44 179.04 1re9 h LEU 156 N 0.31 0.00 -1.21 1.67 8.10 -0.53 -2.89 115.31 120.76 1re9 h LEU 156 Ca 0.07 0.00 0.00 0.00 0.11 0.00 0.00 57.88 58.06 1re9 h LEU 156 Cb 0.60 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.82 1re9 h LEU 156 CO 0.03 0.47 0.00 0.00 -4.11 0.00 0.00 178.44 174.83 1re9 n ALA 157 N -2.40 2.54 -3.50 0.17 0.00 0.31 -0.95 120.51 116.68 1re9 n ALA 157 Ca -0.01 -0.52 -0.21 0.00 0.00 0.00 0.00 53.44 52.70 1re9 n ALA 157 Cb 0.52 -1.08 0.08 0.00 0.00 0.00 0.00 19.45 18.97 1re9 n ALA 157 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1re9 n GLY 158 N 1.21 -0.44 3.66 0.00 0.00 -0.45 -4.41 105.19 104.76 1re9 n GLY 158 Ca 0.18 0.18 -0.31 0.00 0.00 0.00 0.00 46.02 46.07 1re9 n GLY 158 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1re9 s LEU 159 N -6.82 3.37 0.34 0.99 1.43 -0.25 -5.05 118.68 112.69 1re9 s LEU 159 Ca 0.42 -0.19 -0.26 0.00 -1.03 0.00 0.00 54.13 53.08 1re9 s LEU 159 Cb -0.19 -2.08 -0.10 0.00 0.03 0.00 0.00 46.19 43.86 1re9 s LEU 159 CO 0.70 0.20 0.99 -2.16 0.23 0.00 0.00 176.35 176.31 1re9 s PRO 160 N -2.12 4.46 0.42 1.29 0.04 -1.26 -4.62 135.00 133.21 1re9 s PRO 160 Ca 0.23 1.43 0.17 0.00 0.04 0.00 0.00 61.00 62.88 1re9 s PRO 160 Cb -0.12 -2.76 1.07 0.00 0.04 0.00 0.00 34.50 32.74 1re9 s PRO 160 CO 0.16 0.14 1.86 0.93 0.04 0.00 0.00 177.00 180.13 1re9 h GLU 161 N 3.03 0.41 0.00 4.56 5.08 -1.99 -0.45 114.58 125.21 1re9 h GLU 161 Ca -0.47 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 1re9 h GLU 161 Cb 1.20 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.36 1re9 h GLU 161 CO 0.64 0.27 0.00 -0.85 -1.00 0.00 0.00 179.01 178.07 1re9 n GLU 162 N -4.51 0.18 0.00 2.33 0.00 -1.26 -1.19 120.64 116.19 1re9 n GLU 162 Ca 0.19 0.50 0.14 0.00 0.00 0.00 0.00 57.16 57.98 1re9 n GLU 162 Cb 0.68 -1.91 0.61 0.00 0.00 0.00 0.00 31.44 30.81 1re9 n GLU 162 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1re9 n ASP 163 N -2.27 0.00 -0.04 -1.84 9.92 -0.18 -4.23 116.55 117.92 1re9 n ASP 163 Ca 0.01 0.47 -0.10 0.00 -0.53 0.00 0.00 54.79 54.64 1re9 n ASP 163 Cb 0.17 -0.49 -0.03 0.00 -0.64 0.00 0.00 41.12 40.12 1re9 n ASP 163 CO 0.00 0.00 0.00 0.40 0.13 0.00 0.00 177.20 177.73 1re9 h ILE 164 N 0.00 1.02 0.00 0.53 2.04 -1.28 -1.14 117.51 118.68 1re9 h ILE 164 Ca 0.00 -0.08 -0.07 0.00 1.00 0.00 0.00 64.86 65.71 1re9 h ILE 164 Cb 0.47 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 1re9 h ILE 164 CO 0.00 0.04 -0.34 1.55 0.00 0.00 0.00 178.15 179.40 1re9 h PRO 165 N 0.23 0.00 -0.31 2.37 0.13 -1.82 -0.90 132.00 131.70 1re9 h PRO 165 Ca 0.08 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 65.04 1re9 h PRO 165 Cb -0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.12 1re9 h PRO 165 CO -0.04 0.34 -0.46 1.25 -0.23 0.00 0.00 178.00 178.87 1re9 h HIS 166 N 0.00 1.00 -0.41 1.56 -0.00 -1.72 -1.09 115.15 114.49 1re9 h HIS 166 Ca -0.00 -0.32 -0.11 0.00 -0.00 0.00 0.00 60.37 59.93 1re9 h HIS 166 Cb 0.62 -0.20 -0.02 0.00 -0.00 0.00 0.00 27.41 27.81 1re9 h HIS 166 CO 0.00 1.12 -0.18 1.25 -0.00 0.00 0.00 177.93 180.12 1re9 h LEU 167 N 0.65 0.80 -0.27 0.26 5.85 -0.74 -0.79 115.31 121.07 1re9 h LEU 167 Ca 0.04 -0.27 -0.01 0.00 0.84 0.00 0.00 57.88 58.48 1re9 h LEU 167 Cb 1.04 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.84 1re9 h LEU 167 CO 0.10 0.97 0.13 0.50 -0.34 0.00 0.00 178.44 179.81 1re9 h LYS 168 N 0.70 0.38 -0.56 1.25 3.64 -1.12 0.37 116.57 121.24 1re9 h LYS 168 Ca 0.10 -0.05 0.10 0.00 -1.27 0.00 0.00 60.65 59.54 1re9 h LYS 168 Cb 0.69 -0.07 -0.08 0.00 -0.41 0.00 0.00 32.23 32.36 1re9 h LYS 168 CO 0.05 0.36 0.08 -0.92 -2.27 0.00 0.00 179.45 176.76 1re9 h TYR 169 N 0.30 0.12 -0.37 1.91 3.20 -0.79 0.18 116.97 121.52 1re9 h TYR 169 Ca 0.09 0.04 -0.11 0.00 3.14 0.00 0.00 58.73 61.88 1re9 h TYR 169 Cb 0.10 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.39 1re9 h TYR 169 CO -0.02 -0.06 -0.22 -0.07 -1.64 0.00 0.00 178.16 176.15 1re9 h LEU 170 N 0.21 0.83 -0.52 2.82 3.38 -0.56 -2.22 115.31 119.24 1re9 h LEU 170 Ca 0.29 -0.42 -0.16 0.00 0.09 0.00 0.00 57.88 57.67 1re9 h LEU 170 Cb 0.43 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1re9 h LEU 170 CO -0.40 1.07 -0.70 0.71 0.09 0.00 0.00 178.44 179.21 1re9 h THR 171 N 0.59 1.43 -0.95 0.22 1.35 0.24 -3.06 112.91 112.73 1re9 h THR 171 Ca 0.08 -2.21 -0.00 0.00 -0.55 0.00 0.00 66.41 63.73 1re9 h THR 171 Cb 0.77 2.17 -0.05 0.00 -1.73 0.00 0.00 68.15 69.31 1re9 h THR 171 CO 0.06 0.65 0.59 0.44 -0.25 0.00 0.00 175.52 177.01 1re9 h ASP 172 N 0.15 1.12 -0.29 5.36 3.32 -0.53 0.01 116.42 125.57 1re9 h ASP 172 Ca -0.02 -0.06 0.07 0.00 0.02 0.00 0.00 57.03 57.04 1re9 h ASP 172 Cb 1.25 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 40.50 1re9 h ASP 172 CO 0.11 0.85 0.20 1.56 -1.72 0.00 0.00 179.24 180.23 1re9 h GLN 173 N 1.30 0.08 0.09 3.56 4.20 -1.30 0.29 115.11 123.33 1re9 h GLN 173 Ca 0.34 -0.00 -0.23 0.00 0.06 0.00 0.00 58.65 58.82 1re9 h GLN 173 Cb -0.09 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 27.67 1re9 h GLN 173 CO -0.07 0.05 -1.15 1.98 -0.67 0.00 0.00 178.83 178.98 1re9 h MET 174 N 0.08 0.20 0.00 1.46 4.05 -1.16 -3.40 114.93 116.16 1re9 h MET 174 Ca 0.13 -0.34 0.00 0.00 -0.28 0.00 0.00 59.70 59.21 1re9 h MET 174 Cb 0.42 0.13 0.00 0.00 -0.80 0.00 0.00 31.60 31.35 1re9 h MET 174 CO -0.01 1.16 -0.62 0.25 0.23 0.00 0.00 176.91 177.92 1re9 n THR 175 N -4.09 0.00 -2.89 -0.77 -2.24 -0.15 -4.45 114.28 99.69 1re9 n THR 175 Ca -0.22 -0.21 -0.24 0.00 -2.27 0.00 0.00 64.05 61.11 1re9 n THR 175 Cb 0.82 0.97 -0.03 0.00 -2.10 0.00 0.00 70.33 69.99 1re9 n THR 175 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1re9 n ARG 176 N -1.32 2.65 -2.24 -0.78 0.63 0.99 -5.03 116.66 111.56 1re9 n ARG 176 Ca 0.02 -4.38 -0.32 0.00 -0.92 0.00 0.00 57.85 52.26 1re9 n ARG 176 Cb 0.20 -2.06 -0.02 0.00 0.45 0.00 0.00 32.46 31.03 1re9 n ARG 176 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 1re9 s PRO 177 N -3.24 3.81 -0.02 -0.14 0.05 -1.25 -4.72 135.00 129.48 1re9 s PRO 177 Ca 0.45 0.85 0.03 0.00 0.05 0.00 0.00 61.00 62.38 1re9 s PRO 177 Cb 0.33 -2.13 0.05 0.00 0.05 0.00 0.00 34.50 32.80 1re9 s PRO 177 CO -0.12 -0.36 0.92 -0.40 0.05 0.00 0.00 177.00 177.09 1re9 n ASP 178 N -1.98 1.48 0.00 6.66 3.85 -1.26 -5.00 116.55 120.29 1re9 n ASP 178 Ca 0.06 -1.98 0.00 0.00 -0.71 0.00 0.00 54.79 52.16 1re9 n ASP 178 Cb 0.54 -0.09 0.00 0.00 -1.35 0.00 0.00 41.12 40.22 1re9 n ASP 178 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1re9 n GLY 179 N -0.53 0.70 0.14 6.12 0.00 -1.26 -4.91 105.19 105.46 1re9 n GLY 179 Ca 0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 1re9 n GLY 179 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1re9 h SER 180 N 0.00 0.46 -3.73 1.61 4.64 -1.98 -3.46 113.55 111.10 1re9 h SER 180 Ca 0.00 -0.39 -0.37 0.00 -0.47 0.00 0.00 61.79 60.56 1re9 h SER 180 Cb 0.00 -0.14 -0.14 0.00 -0.31 0.00 0.00 62.40 61.80 1re9 h SER 180 CO 0.00 1.20 -0.71 0.00 -0.87 0.00 0.00 176.83 176.45 1re9 s MET 181 N -3.17 1.19 0.68 4.77 0.23 -1.26 -5.15 119.30 116.58 1re9 s MET 181 Ca -0.05 -1.53 -0.05 0.00 -1.03 0.00 0.00 55.69 53.03 1re9 s MET 181 Cb 0.09 -0.76 0.06 0.00 -1.53 0.00 0.00 34.83 32.69 1re9 s MET 181 CO 0.86 0.07 0.97 0.95 -2.03 0.00 0.00 175.02 175.84 1re9 s THR 182 N -3.25 2.34 0.17 3.16 -4.23 -1.26 -4.90 115.64 107.67 1re9 s THR 182 Ca 0.20 -0.35 -0.15 0.00 -1.18 0.00 0.00 61.69 60.22 1re9 s THR 182 Cb 0.02 -2.99 0.05 0.00 1.34 0.00 0.00 72.50 70.92 1re9 s THR 182 CO 0.04 0.00 1.81 0.15 -0.54 0.00 0.00 174.62 176.08 1re9 h PHE 183 N -0.48 0.65 -0.93 3.99 3.04 -1.95 -1.86 116.94 119.40 1re9 h PHE 183 Ca -0.44 0.00 0.15 0.00 3.98 0.00 0.00 57.97 61.67 1re9 h PHE 183 Cb 1.31 -0.21 -0.10 0.00 2.56 0.00 0.00 35.95 39.51 1re9 h PHE 183 CO 0.31 0.44 0.53 0.00 -2.02 0.00 0.00 178.31 177.57 1re9 h ALA 184 N 1.16 1.44 -0.14 2.41 0.00 -1.93 0.31 119.26 122.51 1re9 h ALA 184 Ca 0.18 0.07 -0.23 0.00 0.00 0.00 0.00 54.91 54.93 1re9 h ALA 184 Cb -0.03 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.69 1re9 h ALA 184 CO -0.04 -0.01 -0.80 0.93 0.00 0.00 0.00 179.25 179.34 1re9 h GLU 185 N 0.75 0.77 -0.19 0.00 5.08 -1.78 -1.85 114.58 117.36 1re9 h GLU 185 Ca 0.50 -0.64 -0.11 0.00 -1.00 0.00 0.00 59.36 58.11 1re9 h GLU 185 Cb 0.69 0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.06 1re9 h GLU 185 CO -0.34 1.25 -0.36 0.00 -1.00 0.00 0.00 179.01 178.55 1re9 h ALA 186 N 0.56 1.03 -0.48 3.43 0.00 -0.83 -1.38 119.26 121.59 1re9 h ALA 186 Ca -0.06 -0.40 -0.08 0.00 0.00 0.00 0.00 54.91 54.37 1re9 h ALA 186 Cb 1.43 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.10 1re9 h ALA 186 CO 0.16 0.60 -0.01 -0.22 0.00 0.00 0.00 179.25 179.78 1re9 h LYS 187 N 0.35 0.86 -0.37 0.00 3.64 -0.26 -2.39 116.57 118.39 1re9 h LYS 187 Ca 0.04 -0.28 -0.07 0.00 -1.27 0.00 0.00 60.65 59.06 1re9 h LYS 187 Cb 0.80 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.53 1re9 h LYS 187 CO 0.06 0.91 -0.08 0.93 -2.27 0.00 0.00 179.45 179.00 1re9 h GLU 188 N 0.71 0.62 -0.52 1.90 4.39 -1.02 -0.49 114.58 120.16 1re9 h GLU 188 Ca 0.13 -0.18 -0.07 0.00 0.34 0.00 0.00 59.36 59.58 1re9 h GLU 188 Cb 0.53 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.09 1re9 h GLU 188 CO 0.03 0.70 0.04 0.00 -1.16 0.00 0.00 179.01 178.62 1re9 h ALA 189 N 1.34 1.08 -0.62 3.43 0.00 -1.00 0.18 119.26 123.67 1re9 h ALA 189 Ca 0.11 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 1re9 h ALA 189 Cb 0.49 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1re9 h ALA 189 CO 0.03 0.59 0.13 1.25 0.00 0.00 0.00 179.25 181.25 1re9 h LEU 190 N 0.80 0.95 -1.29 0.00 5.85 -0.89 -2.93 115.31 117.81 1re9 h LEU 190 Ca 0.16 -0.24 -0.04 0.00 0.84 0.00 0.00 57.88 58.60 1re9 h LEU 190 Cb 0.43 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 1re9 h LEU 190 CO 0.02 0.95 0.05 1.88 -0.34 0.00 0.00 178.44 180.99 1re9 h TYR 191 N 0.91 0.53 -0.53 1.25 0.05 -0.51 -2.26 116.97 116.42 1re9 h TYR 191 Ca 0.19 -0.04 0.05 0.00 0.05 0.00 0.00 58.73 58.98 1re9 h TYR 191 Cb 0.38 -0.16 -0.03 0.00 1.01 0.00 0.00 36.73 37.93 1re9 h TYR 191 CO 0.03 0.50 0.35 -0.44 -1.05 0.00 0.00 178.16 177.55 1re9 h ASP 192 N 0.51 0.47 -0.10 3.88 3.32 -0.79 0.12 116.42 123.82 1re9 h ASP 192 Ca 0.12 -0.00 -0.11 0.00 0.02 0.00 0.00 57.03 57.06 1re9 h ASP 192 Cb 0.26 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.71 1re9 h ASP 192 CO 0.00 0.32 -0.36 0.22 -1.72 0.00 0.00 179.24 177.71 1re9 h TYR 193 N 0.55 0.55 -0.02 4.55 3.20 -1.34 -3.35 116.97 121.11 1re9 h TYR 193 Ca 0.22 -0.23 -0.17 0.00 3.14 0.00 0.00 58.73 61.69 1re9 h TYR 193 Cb 0.20 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.36 1re9 h TYR 193 CO -0.00 0.97 -0.75 -0.07 -1.64 0.00 0.00 178.16 176.67 1re9 h LEU 194 N -0.02 0.21 -0.61 2.82 3.38 -1.14 -3.36 115.31 116.59 1re9 h LEU 194 Ca -0.02 -0.15 0.04 0.00 0.09 0.00 0.00 57.88 57.84 1re9 h LEU 194 Cb 0.99 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.63 1re9 h LEU 194 CO 0.08 0.88 0.36 0.40 0.09 0.00 0.00 178.44 180.24 1re9 h ILE 195 N 0.11 1.04 -0.14 1.22 2.04 -0.92 -0.81 117.51 120.05 1re9 h ILE 195 Ca -0.02 -0.24 -0.07 0.00 1.00 0.00 0.00 64.86 65.53 1re9 h ILE 195 Cb 1.32 0.28 -0.01 0.00 -0.74 0.00 0.00 36.82 37.67 1re9 h ILE 195 CO 0.11 0.13 -0.21 -0.65 0.00 0.00 0.00 178.15 177.53 1re9 h PRO 196 N 0.69 0.24 -0.17 2.37 0.11 -1.76 -1.74 132.00 131.75 1re9 h PRO 196 Ca 0.25 -0.07 -0.05 0.00 0.11 0.00 0.00 66.00 66.24 1re9 h PRO 196 Cb 0.07 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 31.15 1re9 h PRO 196 CO -0.12 0.45 -0.10 0.82 -0.21 0.00 0.00 178.00 178.84 1re9 h ILE 197 N 0.22 1.32 -0.98 4.15 2.04 -1.50 -1.66 117.51 121.10 1re9 h ILE 197 Ca 0.04 -1.17 0.01 0.00 1.00 0.00 0.00 64.86 64.74 1re9 h ILE 197 Cb 0.50 1.72 -0.05 0.00 -0.74 0.00 0.00 36.82 38.25 1re9 h ILE 197 CO 0.03 0.35 0.65 0.40 0.00 0.00 0.00 178.15 179.58 1re9 h ILE 198 N 0.04 1.25 -0.55 -0.67 2.04 -1.08 -0.65 117.51 117.90 1re9 h ILE 198 Ca 0.04 -0.46 0.04 0.00 1.00 0.00 0.00 64.86 65.48 1re9 h ILE 198 Cb 0.58 -0.20 -0.04 0.00 -0.74 0.00 0.00 36.82 36.42 1re9 h ILE 198 CO 0.03 0.24 0.30 -0.08 0.00 0.00 0.00 178.15 178.64 1re9 h GLU 199 N 1.33 0.56 -0.49 2.37 4.81 -1.06 -0.77 114.58 121.33 1re9 h GLU 199 Ca 0.36 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.54 1re9 h GLU 199 Cb -0.15 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.08 1re9 h GLU 199 CO -0.08 0.37 0.24 1.96 -0.73 0.00 0.00 179.01 180.77 1re9 h GLN 200 N 0.57 0.71 -0.00 1.92 4.20 -0.85 -2.37 115.11 119.30 1re9 h GLN 200 Ca 0.24 -0.11 0.00 0.00 0.06 0.00 0.00 58.65 58.84 1re9 h GLN 200 Cb 0.12 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.77 1re9 h GLN 200 CO -0.15 0.60 -0.17 0.54 -0.67 0.00 0.00 178.83 178.98 1re9 n ARG 201 N -4.61 0.26 0.06 1.46 1.74 -0.29 -0.31 116.66 114.97 1re9 n ARG 201 Ca 0.02 -0.08 -0.07 0.00 -0.77 0.00 0.00 57.85 56.95 1re9 n ARG 201 Cb 0.12 -1.50 -0.12 0.00 -1.02 0.00 0.00 32.46 29.94 1re9 n ARG 201 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1re9 h ARG 202 N 0.20 0.00 0.15 5.56 3.08 -0.88 -2.60 114.38 119.88 1re9 h ARG 202 Ca 0.00 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 59.81 1re9 h ARG 202 Cb 0.44 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.51 1re9 h ARG 202 CO 0.00 0.96 -1.10 0.37 -1.07 0.00 0.00 179.97 179.13 1re9 h GLN 203 N 0.00 0.31 -2.47 0.04 4.15 -0.90 -3.41 115.11 112.83 1re9 h GLN 203 Ca -0.02 -0.53 -0.60 0.00 0.77 0.00 0.00 58.65 58.27 1re9 h GLN 203 Cb 1.77 0.20 -0.41 0.00 0.21 0.00 0.00 27.48 29.24 1re9 h GLN 203 CO 0.13 1.25 -0.71 1.63 -1.93 0.00 0.00 178.83 179.20 1re9 n LYS 204 N -4.01 1.73 -1.86 1.69 5.02 0.58 -5.10 118.16 116.21 1re9 n LYS 204 Ca -0.18 -4.20 -0.37 0.00 -2.02 0.00 0.00 58.31 51.54 1re9 n LYS 204 Cb 0.88 -2.03 0.05 0.00 -0.02 0.00 0.00 35.03 33.91 1re9 n LYS 204 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1re9 s PRO 205 N -1.64 2.87 0.00 1.97 0.04 -0.98 -4.52 135.00 132.74 1re9 s PRO 205 Ca 0.33 2.01 0.00 0.00 0.04 0.00 0.00 61.00 63.39 1re9 s PRO 205 Cb 0.08 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.63 1re9 s PRO 205 CO -0.10 -1.34 0.00 0.41 0.04 0.00 0.00 177.00 176.01 1re9 n GLY 206 N 0.72 4.18 0.40 0.56 0.00 -1.26 -5.06 105.19 104.72 1re9 n GLY 206 Ca 0.14 -1.83 0.06 0.00 0.00 0.00 0.00 46.02 44.39 1re9 n GLY 206 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1re9 n THR 207 N 0.00 1.58 -1.93 2.61 -2.24 -1.26 -4.69 114.28 108.34 1re9 n THR 207 Ca 0.00 -1.57 -0.29 0.00 -2.27 0.00 0.00 64.05 59.92 1re9 n THR 207 Cb 0.00 0.10 0.12 0.00 -2.10 0.00 0.00 70.33 68.46 1re9 n THR 207 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1re9 s ASP 208 N -1.74 4.02 0.36 3.42 -4.77 -1.26 -4.87 116.67 111.82 1re9 s ASP 208 Ca 0.25 0.57 0.07 0.00 -3.30 0.00 0.00 52.55 50.14 1re9 s ASP 208 Cb 0.19 -0.91 0.68 0.00 -1.09 0.00 0.00 42.92 41.79 1re9 s ASP 208 CO 0.07 -2.19 1.87 0.00 0.70 0.00 0.00 175.17 175.62 1re9 h ALA 209 N -1.24 1.41 -0.23 2.11 0.00 -1.27 -1.88 119.26 118.16 1re9 h ALA 209 Ca -0.45 -0.23 -0.20 0.00 0.00 0.00 0.00 54.91 54.03 1re9 h ALA 209 Cb 1.29 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1re9 h ALA 209 CO 0.56 0.41 -0.64 0.82 0.00 0.00 0.00 179.25 180.39 1re9 h ILE 210 N 0.31 1.28 -0.79 0.00 2.04 -1.82 -1.43 117.51 117.11 1re9 h ILE 210 Ca 0.06 -1.84 -0.01 0.00 1.00 0.00 0.00 64.86 64.07 1re9 h ILE 210 Cb 0.42 1.78 -0.04 0.00 -0.74 0.00 0.00 36.82 38.25 1re9 h ILE 210 CO 0.02 0.59 0.46 0.28 0.00 0.00 0.00 178.15 179.51 1re9 h SER 211 N 0.60 0.96 -0.20 1.72 0.02 -1.80 0.14 113.55 114.98 1re9 h SER 211 Ca -0.01 -0.08 -0.04 0.00 -0.84 0.00 0.00 61.79 60.83 1re9 h SER 211 Cb 1.25 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.54 1re9 h SER 211 CO 0.14 0.76 -0.01 0.40 -1.14 0.00 0.00 176.83 176.97 1re9 h ILE 212 N 1.09 1.26 -0.18 3.27 2.04 -1.17 -2.17 117.51 121.64 1re9 h ILE 212 Ca 0.28 -0.92 -0.02 0.00 1.00 0.00 0.00 64.86 65.21 1re9 h ILE 212 Cb -0.01 1.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.53 1re9 h ILE 212 CO -0.05 0.28 0.05 0.58 0.00 0.00 0.00 178.15 179.01 1re9 h VAL 213 N 0.10 1.20 0.00 1.67 2.07 -1.09 -2.64 116.25 117.57 1re9 h VAL 213 Ca 0.05 -0.62 0.00 0.00 0.82 0.00 0.00 66.70 66.95 1re9 h VAL 213 Cb 0.42 1.26 0.00 0.00 -1.52 0.00 0.00 31.29 31.46 1re9 h VAL 213 CO 0.01 0.19 0.00 0.00 0.02 0.00 0.00 177.57 177.80 1re9 h ALA 214 N 0.86 1.00 -0.29 1.67 0.00 -0.64 -2.03 119.26 119.82 1re9 h ALA 214 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1re9 h ALA 214 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1re9 h ALA 214 CO -0.00 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.34 1re9 n ASN 215 N -2.81 3.22 -4.66 0.00 4.13 -0.82 -4.81 115.26 109.50 1re9 n ASN 215 Ca -0.00 -2.38 -0.29 0.00 1.68 0.00 0.00 54.58 53.58 1re9 n ASN 215 Cb 0.19 -0.34 0.14 0.00 -1.54 0.00 0.00 39.78 38.23 1re9 n ASN 215 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 1re9 s GLY 216 N -1.37 1.61 -0.06 7.41 0.00 -0.77 -4.87 107.32 109.27 1re9 s GLY 216 Ca 0.29 -0.67 0.03 0.00 0.00 0.00 0.00 44.72 44.36 1re9 s GLY 216 CO 0.12 -0.08 -0.12 1.20 0.00 0.00 0.00 173.10 174.22 1re9 s GLN 217 N -5.44 2.66 -0.01 2.90 -1.52 -1.26 -1.37 119.66 115.61 1re9 s GLN 217 Ca 0.65 -0.66 -0.01 0.00 -1.95 0.00 0.00 55.36 53.39 1re9 s GLN 217 Cb -0.12 -2.46 0.01 0.00 -0.22 0.00 0.00 33.01 30.22 1re9 s GLN 217 CO 0.52 0.58 0.03 0.14 -0.25 0.00 0.00 175.29 176.32 1re9 s VAL 218 N -0.62 -0.01 -0.94 1.09 -7.23 0.14 -4.84 120.40 108.00 1re9 s VAL 218 Ca 0.09 0.02 -0.03 0.00 -1.81 0.00 0.00 61.98 60.25 1re9 s VAL 218 Cb -0.11 -0.05 0.03 0.00 0.56 0.00 0.00 36.38 36.80 1re9 s VAL 218 CO 0.01 0.01 0.08 0.59 -0.31 0.00 0.00 175.10 175.48 1re9 n ASN 219 N 3.19 0.21 0.00 4.85 3.02 -1.26 -1.17 115.26 124.10 1re9 n ASN 219 Ca -0.14 -0.74 0.00 0.00 -0.03 0.00 0.00 54.58 53.68 1re9 n ASN 219 Cb 0.59 -0.92 0.00 0.00 -0.61 0.00 0.00 39.78 38.84 1re9 n ASN 219 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1re9 n GLY 220 N -1.68 0.62 3.22 7.41 0.00 -1.26 -5.06 105.19 108.44 1re9 n GLY 220 Ca -0.13 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.75 1re9 n GLY 220 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1re9 s ARG 221 N -0.77 1.28 0.40 1.61 1.04 -0.32 -5.13 118.95 117.05 1re9 s ARG 221 Ca 0.00 -1.68 -0.24 0.00 -1.04 0.00 0.00 55.73 52.76 1re9 s ARG 221 Cb 0.00 0.20 -0.09 0.00 -2.04 0.00 0.00 34.95 33.02 1re9 s ARG 221 CO 0.00 -0.40 1.08 -2.14 -0.04 0.00 0.00 175.30 173.80 1re9 s PRO 222 N -4.08 4.15 0.47 3.89 0.02 -1.26 0.25 135.00 138.44 1re9 s PRO 222 Ca 0.39 1.60 -0.24 0.00 0.02 0.00 0.00 61.00 62.77 1re9 s PRO 222 Cb 0.07 -2.60 -0.07 0.00 0.02 0.00 0.00 34.50 31.92 1re9 s PRO 222 CO 0.13 -0.18 1.29 -1.50 -0.33 0.00 0.00 177.00 176.42 1re9 s ILE 223 N -1.58 2.54 0.66 2.83 2.07 -0.47 -4.75 121.20 122.50 1re9 s ILE 223 Ca 0.57 0.43 -0.06 0.00 -1.41 0.00 0.00 60.65 60.19 1re9 s ILE 223 Cb -0.25 -3.23 0.04 0.00 0.13 0.00 0.00 42.46 39.16 1re9 s ILE 223 CO 0.31 0.02 0.97 0.42 -1.91 0.00 0.00 174.94 174.74 1re9 s THR 224 N -1.35 2.67 0.29 4.00 -4.23 -1.26 -4.90 115.64 110.85 1re9 s THR 224 Ca 0.64 -0.23 0.01 0.00 -1.18 0.00 0.00 61.69 60.93 1re9 s THR 224 Cb -0.36 -3.12 0.28 0.00 1.34 0.00 0.00 72.50 70.64 1re9 s THR 224 CO 0.45 -0.12 1.88 0.28 -0.54 0.00 0.00 174.62 176.57 1re9 h SER 225 N -0.43 0.92 -0.10 3.99 0.02 -1.94 -0.90 113.55 115.11 1re9 h SER 225 Ca -0.44 0.02 -0.16 0.00 -0.84 0.00 0.00 61.79 60.36 1re9 h SER 225 Cb 1.30 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 63.66 1re9 h SER 225 CO 0.60 0.56 -0.51 -0.78 -1.14 0.00 0.00 176.83 175.55 1re9 h ASP 226 N 1.02 0.74 -0.31 3.07 1.82 -2.00 -1.78 116.42 118.99 1re9 h ASP 226 Ca 0.43 -0.38 -0.04 0.00 -0.39 0.00 0.00 57.03 56.64 1re9 h ASP 226 Cb 0.31 -0.21 -0.01 0.00 0.68 0.00 0.00 39.33 40.09 1re9 h ASP 226 CO -0.18 1.12 0.02 -0.33 -1.61 0.00 0.00 179.24 178.26 1re9 h GLU 227 N 0.53 0.53 -0.41 0.28 5.08 -1.90 -1.87 114.58 116.81 1re9 h GLU 227 Ca 0.02 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 1re9 h GLU 227 Cb 1.07 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.25 1re9 h GLU 227 CO 0.10 0.65 0.26 0.00 -1.00 0.00 0.00 179.01 179.02 1re9 h ALA 228 N 0.86 0.52 -0.51 3.43 0.00 -1.00 -1.39 119.26 121.17 1re9 h ALA 228 Ca 0.09 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 54.99 1re9 h ALA 228 Cb 0.40 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 1re9 h ALA 228 CO 0.01 -0.00 0.27 -0.22 0.00 0.00 0.00 179.25 179.31 1re9 h LYS 229 N 0.54 0.52 0.00 0.00 3.64 -1.11 0.09 116.57 120.25 1re9 h LYS 229 Ca 0.15 -0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.44 1re9 h LYS 229 Cb -0.03 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.67 1re9 h LYS 229 CO -0.03 0.34 -0.27 0.00 -2.27 0.00 0.00 179.45 177.22 1re9 h ARG 230 N 0.53 0.00 0.07 1.90 3.08 -1.14 -0.34 114.38 118.49 1re9 h ARG 230 Ca 0.22 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 60.09 1re9 h ARG 230 Cb 0.11 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.17 1re9 h ARG 230 CO -0.14 0.27 -0.74 0.52 -1.07 0.00 0.00 179.97 178.81 1re9 h MET 231 N 0.00 0.37 -0.10 0.04 2.86 -0.86 -1.81 114.93 115.43 1re9 h MET 231 Ca -0.00 -0.50 -0.07 0.00 -2.06 0.00 0.00 59.70 57.07 1re9 h MET 231 Cb 0.50 0.16 -0.01 0.00 0.06 0.00 0.00 31.60 32.32 1re9 h MET 231 CO 0.03 1.18 -0.25 0.00 1.06 0.00 0.00 176.91 178.94 1re9 h GLY 233 N 0.92 0.91 1.01 0.00 0.00 -1.16 -1.37 103.07 103.38 1re9 h GLY 233 Ca 0.03 -0.59 -0.14 0.00 0.00 0.00 0.00 47.33 46.62 1re9 h GLY 233 CO 0.04 0.55 -0.39 -2.00 0.00 0.00 0.00 176.54 174.74 1re9 h LEU 234 N 0.80 0.80 -1.79 3.11 5.85 -1.47 -2.09 115.31 120.52 1re9 h LEU 234 Ca 0.16 -0.51 -0.00 0.00 0.84 0.00 0.00 57.88 58.37 1re9 h LEU 234 Cb 0.42 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 1re9 h LEU 234 CO 0.01 1.16 0.12 -0.07 -0.34 0.00 0.00 178.44 179.32 1re9 h LEU 235 N 0.47 0.22 0.11 2.25 3.38 -1.00 0.25 115.31 121.00 1re9 h LEU 235 Ca 0.03 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1re9 h LEU 235 Cb 0.98 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.68 1re9 h LEU 235 CO 0.09 0.17 -0.05 0.25 0.09 0.00 0.00 178.44 178.99 1re9 h LEU 236 N 0.26 -0.12 0.00 1.67 6.46 -1.10 -3.37 115.31 119.11 1re9 h LEU 236 Ca 0.07 -0.44 -0.04 0.00 -0.12 0.00 0.00 57.88 57.35 1re9 h LEU 236 Cb -0.01 0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 39.94 1re9 h LEU 236 CO -0.01 0.43 -0.45 -0.37 -0.62 0.00 0.00 178.44 177.41 1re9 h VAL 237 N -0.75 0.27 -0.96 1.05 -1.51 -1.08 -3.37 116.25 109.90 1re9 h VAL 237 Ca -0.02 -1.40 0.05 0.00 -1.23 0.00 0.00 66.70 64.10 1re9 h VAL 237 Cb 0.55 2.01 -0.06 0.00 -2.13 0.00 0.00 31.29 31.67 1re9 h VAL 237 CO 0.02 0.15 0.63 1.23 -1.23 0.00 0.00 177.57 178.37 1re9 h GLY 238 N 3.85 1.41 -2.21 5.19 0.00 -0.66 -2.46 103.07 108.18 1re9 h GLY 238 Ca -0.02 -0.47 -0.03 0.00 0.00 0.00 0.00 47.33 46.81 1re9 h GLY 238 CO 0.02 0.38 0.02 0.61 0.00 0.00 0.00 176.54 177.57 1re9 n GLY 239 N -1.38 3.87 0.00 4.60 0.00 -1.26 -4.50 105.19 106.52 1re9 n GLY 239 Ca 0.14 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 45.12 1re9 n GLY 239 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1re9 n LEU 240 N -0.30 0.61 0.18 0.99 4.77 -0.92 -4.22 117.00 118.11 1re9 n LEU 240 Ca 0.25 0.00 0.04 0.00 -0.03 0.00 0.00 56.01 56.27 1re9 n LEU 240 Cb 1.01 0.00 0.43 0.00 -2.33 0.00 0.00 43.42 42.53 1re9 n LEU 240 CO 0.22 0.00 0.85 0.44 -1.33 0.00 0.00 177.39 177.56 1re9 h ASP 241 N 0.00 0.07 -0.29 -1.43 3.45 -1.85 -0.29 116.42 116.08 1re9 h ASP 241 Ca 0.00 -0.02 0.06 0.00 0.43 0.00 0.00 57.03 57.50 1re9 h ASP 241 Cb 0.00 -0.02 -0.05 0.00 -0.56 0.00 0.00 39.33 38.70 1re9 h ASP 241 CO 0.00 0.30 -0.05 0.71 -1.57 0.00 0.00 179.24 178.63 1re9 h THR 242 N 0.07 0.73 -0.09 0.35 1.35 -1.84 -0.15 112.91 113.33 1re9 h THR 242 Ca 0.01 -0.01 -0.21 0.00 -0.55 0.00 0.00 66.41 65.65 1re9 h THR 242 Cb 0.44 0.71 0.01 0.00 -1.73 0.00 0.00 68.15 67.58 1re9 h THR 242 CO 0.03 0.00 -0.78 0.58 -0.25 0.00 0.00 175.52 175.11 1re9 h VAL 243 N 0.02 1.31 -0.04 6.82 2.07 -1.50 -0.24 116.25 124.69 1re9 h VAL 243 Ca 0.14 -2.02 0.02 0.00 0.82 0.00 0.00 66.70 65.66 1re9 h VAL 243 Cb 0.20 2.19 -0.03 0.00 -1.52 0.00 0.00 31.29 32.14 1re9 h VAL 243 CO -0.28 0.63 -0.11 0.58 0.02 0.00 0.00 177.57 178.41 1re9 h VAL 244 N 0.36 0.72 -0.05 2.57 2.07 -0.98 -0.47 116.25 120.48 1re9 h VAL 244 Ca -0.07 0.00 -0.21 0.00 0.82 0.00 0.00 66.70 67.24 1re9 h VAL 244 Cb 1.43 0.72 0.00 0.00 -1.52 0.00 0.00 31.29 31.92 1re9 h VAL 244 CO 0.16 0.00 -0.84 0.78 0.02 0.00 0.00 177.57 177.68 1re9 h ASN 245 N -0.16 0.56 -0.28 0.57 2.35 -0.99 -2.40 115.58 115.21 1re9 h ASN 245 Ca 0.05 -0.40 -0.04 0.00 -0.55 0.00 0.00 56.30 55.36 1re9 h ASN 245 Cb 0.23 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.43 1re9 h ASN 245 CO -0.13 1.18 0.04 0.15 -1.65 0.00 0.00 177.43 177.01 1re9 h PHE 246 N 0.28 0.51 -0.81 1.19 3.57 -0.83 -0.56 116.94 120.30 1re9 h PHE 246 Ca -0.06 -0.07 0.05 0.00 3.53 0.00 0.00 57.97 61.42 1re9 h PHE 246 Cb 1.45 -0.14 -0.05 0.00 2.79 0.00 0.00 35.95 40.01 1re9 h PHE 246 CO 0.06 0.58 0.53 -0.07 -2.23 0.00 0.00 178.31 177.18 1re9 h LEU 247 N 0.29 0.82 -0.47 0.59 3.38 -1.09 -1.54 115.31 117.28 1re9 h LEU 247 Ca 0.09 -0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.95 1re9 h LEU 247 Cb 0.35 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1re9 h LEU 247 CO 0.01 0.55 -0.12 0.28 0.09 0.00 0.00 178.44 179.24 1re9 h SER 248 N 0.94 0.93 -0.68 -0.43 0.02 -0.88 0.18 113.55 113.62 1re9 h SER 248 Ca 0.33 -0.36 0.00 0.00 -0.84 0.00 0.00 61.79 60.92 1re9 h SER 248 Cb 0.13 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.38 1re9 h SER 248 CO -0.11 1.08 0.44 -0.26 -1.14 0.00 0.00 176.83 176.84 1re9 h PHE 249 N 0.76 0.87 -0.45 3.45 0.04 -0.75 -0.06 116.94 120.81 1re9 h PHE 249 Ca 0.12 0.01 -0.03 0.00 2.80 0.00 0.00 57.97 60.87 1re9 h PHE 249 Cb 0.67 -0.29 -0.02 0.00 2.20 0.00 0.00 35.95 38.51 1re9 h PHE 249 CO 0.05 0.56 0.17 0.77 -0.60 0.00 0.00 178.31 179.26 1re9 h SER 250 N 0.92 0.63 0.50 2.17 0.02 -0.98 -1.84 113.55 114.97 1re9 h SER 250 Ca 0.25 -0.18 -0.17 0.00 -0.84 0.00 0.00 61.79 60.85 1re9 h SER 250 Cb -0.08 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.28 1re9 h SER 250 CO -0.05 0.63 -0.74 0.24 -1.14 0.00 0.00 176.83 175.77 1re9 h MET 251 N 0.59 0.20 -0.59 3.45 2.86 -0.82 -1.29 114.93 119.32 1re9 h MET 251 Ca 0.15 -0.17 0.02 0.00 -2.06 0.00 0.00 59.70 57.63 1re9 h MET 251 Cb 0.21 0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.87 1re9 h MET 251 CO -0.01 0.85 0.38 1.49 1.06 0.00 0.00 176.91 180.67 1re9 h GLU 252 N 0.13 0.73 -0.24 1.72 4.81 -0.79 -0.18 114.58 120.75 1re9 h GLU 252 Ca -0.02 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.15 1re9 h GLU 252 Cb 1.31 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.51 1re9 h GLU 252 CO 0.11 0.48 0.11 0.35 -0.73 0.00 0.00 179.01 179.34 1re9 h PHE 253 N 0.75 0.34 -0.25 0.92 3.57 -1.18 -2.47 116.94 118.63 1re9 h PHE 253 Ca 0.23 -0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.62 1re9 h PHE 253 Cb -0.02 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.60 1re9 h PHE 253 CO -0.05 0.33 -0.24 -0.07 -2.23 0.00 0.00 178.31 176.05 1re9 h LEU 254 N 0.25 0.48 -1.77 0.59 3.38 -1.01 -1.60 115.31 115.63 1re9 h LEU 254 Ca 0.08 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 1re9 h LEU 254 Cb 0.12 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 1re9 h LEU 254 CO -0.01 0.72 -0.15 0.00 0.09 0.00 0.00 178.44 179.10 1re9 h ALA 255 N 1.32 1.64 -0.01 1.53 0.00 -0.85 -2.31 119.26 120.57 1re9 h ALA 255 Ca 0.06 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1re9 h ALA 255 Cb 0.66 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1re9 h ALA 255 CO 0.05 0.18 -0.34 1.63 0.00 0.00 0.00 179.25 180.77 1re9 n LYS 256 N -4.19 1.04 -3.54 0.00 5.02 -0.80 -4.23 118.16 111.45 1re9 n LYS 256 Ca -0.02 -0.73 -0.27 0.00 -2.02 0.00 0.00 58.31 55.26 1re9 n LYS 256 Cb 0.22 -1.48 -0.10 0.00 -0.02 0.00 0.00 35.03 33.64 1re9 n LYS 256 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1re9 n SER 257 N -0.34 1.05 -0.14 4.39 7.64 -0.67 -4.96 113.62 120.59 1re9 n SER 257 Ca 0.11 -2.76 0.21 0.00 1.01 0.00 0.00 58.87 57.44 1re9 n SER 257 Cb 0.40 -0.64 0.61 0.00 -1.01 0.00 0.00 64.21 63.58 1re9 n SER 257 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 1re9 h PRO 258 N 5.28 0.19 -0.28 1.43 0.11 -1.84 -0.56 132.00 136.33 1re9 h PRO 258 Ca 0.20 -0.01 -0.12 0.00 0.11 0.00 0.00 66.00 66.19 1re9 h PRO 258 Cb 0.84 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.89 1re9 h PRO 258 CO 0.53 0.13 -0.31 0.93 -0.21 0.00 0.00 178.00 179.06 1re9 h GLU 259 N 0.20 0.58 0.00 1.05 3.07 -1.93 -1.20 114.58 116.35 1re9 h GLU 259 Ca 0.38 -0.26 -0.17 0.00 -0.50 0.00 0.00 59.36 58.81 1re9 h GLU 259 Cb 1.19 -0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 29.06 1re9 h GLU 259 CO -0.07 0.83 -0.82 0.45 -1.40 0.00 0.00 179.01 177.99 1re9 h HIS 260 N 0.50 0.02 -0.36 4.33 3.86 -1.48 -1.74 115.15 120.29 1re9 h HIS 260 Ca 0.06 -0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.25 1re9 h HIS 260 Cb 0.79 -0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.24 1re9 h HIS 260 CO 0.03 0.83 0.19 0.00 0.86 0.00 0.00 177.93 179.84 1re9 h ARG 261 N 0.01 0.50 -0.10 2.45 3.08 -1.11 -2.67 114.38 116.54 1re9 h ARG 261 Ca -0.01 -0.06 -0.06 0.00 0.07 0.00 0.00 59.98 59.91 1re9 h ARG 261 Cb 1.45 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 31.40 1re9 h ARG 261 CO 0.11 0.43 -0.21 0.37 -1.07 0.00 0.00 179.97 179.60 1re9 h GLN 262 N 0.44 0.17 -0.31 0.04 5.75 -1.16 -1.16 115.11 118.88 1re9 h GLN 262 Ca 0.12 -0.05 -0.01 0.00 -0.15 0.00 0.00 58.65 58.57 1re9 h GLN 262 Cb 0.08 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.60 1re9 h GLN 262 CO -0.02 0.38 0.16 1.49 -2.65 0.00 0.00 178.83 178.20 1re9 h GLU 263 N 0.16 0.43 0.00 1.69 4.81 -1.11 -0.58 114.58 119.98 1re9 h GLU 263 Ca 0.03 -0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 59.15 1re9 h GLU 263 Cb 0.47 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.76 1re9 h GLU 263 CO 0.03 0.38 -0.25 -0.07 -0.73 0.00 0.00 179.01 178.37 1re9 h LEU 264 N 0.37 0.00 -0.27 1.64 3.38 -1.05 0.22 115.31 119.60 1re9 h LEU 264 Ca 0.11 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.95 1re9 h LEU 264 Cb 0.08 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 1re9 h LEU 264 CO -0.02 0.25 -0.32 0.40 0.09 0.00 0.00 178.44 178.84 1re9 h ILE 265 N 0.00 1.30 0.00 1.22 2.04 -0.92 -2.97 117.51 118.18 1re9 h ILE 265 Ca -0.00 -1.50 -0.14 0.00 1.00 0.00 0.00 64.86 64.22 1re9 h ILE 265 Cb 0.94 1.63 -0.02 0.00 -0.74 0.00 0.00 36.82 38.63 1re9 h ILE 265 CO 0.03 0.48 -0.88 -0.33 0.00 0.00 0.00 178.15 177.45 1re9 h GLU 266 N 0.43 0.00 -2.12 2.37 5.08 -1.05 -3.38 114.58 115.92 1re9 h GLU 266 Ca 0.04 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.82 1re9 h GLU 266 Cb 0.89 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 29.74 1re9 h GLU 266 CO 0.08 0.50 -0.83 0.54 -1.00 0.00 0.00 179.01 178.29 1re9 n ARG 267 N -3.13 1.66 0.32 2.33 5.12 0.06 -4.95 116.66 118.08 1re9 n ARG 267 Ca -0.02 -3.99 0.21 0.00 -1.93 0.00 0.00 57.85 52.12 1re9 n ARG 267 Cb 0.80 -1.77 1.10 0.00 -1.16 0.00 0.00 32.46 31.43 1re9 n ARG 267 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 1re9 h PRO 268 N 4.13 0.00 0.00 5.56 0.13 -1.71 -0.12 132.00 139.99 1re9 h PRO 268 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 1re9 h PRO 268 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 1re9 h PRO 268 CO 0.66 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.58 1re9 n GLU 269 N -3.13 0.15 0.00 0.86 0.00 -1.26 -1.58 120.64 115.68 1re9 n GLU 269 Ca -0.02 0.48 0.14 0.00 0.00 0.00 0.00 57.16 57.76 1re9 n GLU 269 Cb 0.12 -1.84 0.60 0.00 0.00 0.00 0.00 31.44 30.32 1re9 n GLU 269 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 1re9 n ARG 270 N -2.14 1.10 -0.17 3.44 1.74 -0.06 -4.36 116.66 116.22 1re9 n ARG 270 Ca 0.01 -0.49 -0.06 0.00 -0.77 0.00 0.00 57.85 56.54 1re9 n ARG 270 Cb 0.15 -1.49 0.03 0.00 -1.02 0.00 0.00 32.46 30.13 1re9 n ARG 270 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 1re9 h ILE 271 N 1.19 1.09 -0.69 0.55 2.04 -1.46 0.84 117.51 121.08 1re9 h ILE 271 Ca 0.00 -0.22 0.08 0.00 1.00 0.00 0.00 64.86 65.72 1re9 h ILE 271 Cb 0.37 0.38 -0.07 0.00 -0.74 0.00 0.00 36.82 36.76 1re9 h ILE 271 CO 0.00 0.12 0.34 -0.65 0.00 0.00 0.00 178.15 177.96 1re9 h PRO 272 N 0.65 0.58 -0.59 2.37 0.11 -1.83 0.20 132.00 133.50 1re9 h PRO 272 Ca 0.20 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 66.23 1re9 h PRO 272 Cb -0.02 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 30.93 1re9 h PRO 272 CO -0.07 0.38 0.19 0.00 -0.21 0.00 0.00 178.00 178.29 1re9 h ALA 273 N 1.41 1.23 -0.56 -0.75 0.00 -1.70 -2.13 119.26 116.75 1re9 h ALA 273 Ca 0.33 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 1re9 h ALA 273 Cb 0.32 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1re9 h ALA 273 CO -0.25 0.55 0.13 0.00 0.00 0.00 0.00 179.25 179.68 1re9 h ALA 274 N 1.35 0.73 -0.66 0.00 0.00 -0.16 -1.45 119.26 119.08 1re9 h ALA 274 Ca 0.19 -0.22 0.10 0.00 0.00 0.00 0.00 54.91 54.98 1re9 h ALA 274 Cb 0.24 -0.21 -0.07 0.00 0.00 0.00 0.00 17.79 17.75 1re9 h ALA 274 CO -0.01 0.44 0.28 0.00 0.00 0.00 0.00 179.25 179.96 1re9 h GLU 276 N 0.47 0.63 0.00 0.00 4.57 -0.85 -0.53 114.58 118.87 1re9 h GLU 276 Ca 0.33 -0.30 -0.14 0.00 -1.18 0.00 0.00 59.36 58.07 1re9 h GLU 276 Cb 0.40 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.96 1re9 h GLU 276 CO -0.30 0.89 -0.66 1.49 -1.18 0.00 0.00 179.01 179.26 1re9 h GLU 277 N 0.53 0.00 -0.14 1.92 4.57 -0.80 -1.46 114.58 119.19 1re9 h GLU 277 Ca 0.05 0.00 -0.20 0.00 -1.18 0.00 0.00 59.36 58.03 1re9 h GLU 277 Cb 0.86 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.45 1re9 h GLU 277 CO 0.07 0.66 -0.72 -0.07 -1.18 0.00 0.00 179.01 177.77 1re9 h LEU 278 N 0.00 0.74 -1.53 1.64 3.38 -0.75 -1.92 115.31 116.88 1re9 h LEU 278 Ca -0.01 -0.47 -0.01 0.00 0.09 0.00 0.00 57.88 57.48 1re9 h LEU 278 Cb 1.27 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.78 1re9 h LEU 278 CO 0.09 1.24 0.15 -0.07 0.09 0.00 0.00 178.44 179.94 1re9 h LEU 279 N 0.44 0.42 0.36 1.67 3.38 -0.80 0.17 115.31 120.95 1re9 h LEU 279 Ca -0.03 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 1re9 h LEU 279 Cb 1.32 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.97 1re9 h LEU 279 CO 0.14 0.37 -0.17 -0.09 0.09 0.00 0.00 178.44 178.77 1re9 h ARG 280 N 0.47 -0.47 -0.19 1.13 2.43 -1.22 -2.85 114.38 113.69 1re9 h ARG 280 Ca 0.12 0.03 -0.12 0.00 -0.81 0.00 0.00 59.98 59.20 1re9 h ARG 280 Cb 0.07 0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.71 1re9 h ARG 280 CO -0.02 -0.15 -0.40 -0.09 -1.51 0.00 0.00 179.97 177.80 1re9 h ARG 281 N -0.93 0.43 -0.40 0.20 9.65 -1.07 -3.22 114.38 119.03 1re9 h ARG 281 Ca -0.05 -0.21 -0.23 0.00 -1.10 0.00 0.00 59.98 58.39 1re9 h ARG 281 Cb 0.53 -0.00 -0.14 0.00 -1.39 0.00 0.00 29.97 28.97 1re9 h ARG 281 CO 0.08 0.76 -0.13 1.19 2.80 0.00 0.00 179.97 184.67 1re9 n PHE 282 N -4.03 1.28 -1.58 2.20 3.72 0.58 -4.97 117.46 114.67 1re9 n PHE 282 Ca -0.01 -1.74 -0.39 0.00 -0.05 0.00 0.00 57.45 55.26 1re9 n PHE 282 Cb 0.50 -0.51 0.03 0.00 -0.94 0.00 0.00 39.48 38.56 1re9 n PHE 282 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1re9 n SER 283 N -1.08 0.49 0.00 4.37 2.88 -1.07 -4.90 113.62 114.30 1re9 n SER 283 Ca 0.35 0.87 0.00 0.00 -1.33 0.00 0.00 58.87 58.76 1re9 n SER 283 Cb 1.00 -1.32 0.00 0.00 -0.75 0.00 0.00 64.21 63.14 1re9 n SER 283 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1re9 n LEU 284 N -0.02 0.00 -4.90 2.46 -0.00 -1.26 -4.81 117.00 108.47 1re9 n LEU 284 Ca 0.12 0.00 -0.34 0.00 -0.00 0.00 0.00 56.01 55.79 1re9 n LEU 284 Cb 0.44 0.00 -0.05 0.00 -0.00 0.00 0.00 43.42 43.81 1re9 n LEU 284 CO 0.52 0.07 -0.16 -0.69 -0.00 0.00 0.00 177.39 177.13 1re9 s VAL 285 N 0.00 5.45 -0.36 1.47 1.01 -1.26 -0.93 120.40 125.78 1re9 s VAL 285 Ca 0.00 -0.06 0.01 0.00 0.00 0.00 0.00 61.98 61.93 1re9 s VAL 285 Cb 0.00 -3.51 0.15 0.00 0.00 0.00 0.00 36.38 33.02 1re9 s VAL 285 CO 0.00 0.39 0.30 0.00 0.00 0.00 0.00 175.10 175.79 1re9 s ALA 286 N -1.26 0.17 0.00 5.51 0.00 0.38 -1.63 121.76 124.93 1re9 s ALA 286 Ca 0.25 -1.33 0.00 0.00 0.00 0.00 0.00 51.96 50.88 1re9 s ALA 286 Cb -0.13 -1.83 0.00 0.00 0.00 0.00 0.00 23.12 21.16 1re9 s ALA 286 CO 0.15 -2.10 0.00 -0.40 0.00 0.00 0.00 175.76 173.41 1re9 n ASP 287 N 4.22 1.00 -0.14 0.00 3.85 -1.26 -4.47 116.55 119.76 1re9 n ASP 287 Ca 0.11 0.00 0.00 0.00 -0.71 0.00 0.00 54.79 54.19 1re9 n ASP 287 Cb 0.42 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.19 1re9 n ASP 287 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1re9 n GLY 288 N 5.00 1.77 3.41 6.12 0.00 -0.19 -1.27 105.19 120.03 1re9 n GLY 288 Ca 0.00 -0.71 -0.11 0.00 0.00 0.00 0.00 46.02 45.21 1re9 n GLY 288 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1re9 s ARG 289 N 0.59 1.43 -0.00 1.61 1.81 -0.22 -4.37 118.95 119.80 1re9 s ARG 289 Ca 0.00 -1.46 0.06 0.00 -1.72 0.00 0.00 55.73 52.61 1re9 s ARG 289 Cb 0.00 0.38 -0.02 0.00 -0.45 0.00 0.00 34.95 34.86 1re9 s ARG 289 CO 0.00 -0.55 -0.20 -1.50 -0.68 0.00 0.00 175.30 172.38 1re9 s ILE 290 N -4.00 1.57 0.06 1.52 2.07 0.13 -1.00 121.20 121.55 1re9 s ILE 290 Ca 0.30 -0.90 -0.31 0.00 -1.41 0.00 0.00 60.65 58.33 1re9 s ILE 290 Cb 0.03 -1.31 -0.06 0.00 0.13 0.00 0.00 42.46 41.24 1re9 s ILE 290 CO 0.11 0.40 1.34 -0.76 -1.91 0.00 0.00 174.94 174.11 1re9 s LEU 291 N -0.59 4.35 0.07 8.50 2.01 -0.32 -0.99 118.68 131.71 1re9 s LEU 291 Ca 0.07 2.16 0.26 0.00 0.01 0.00 0.00 54.13 56.63 1re9 s LEU 291 Cb -0.08 -3.58 0.65 0.00 0.01 0.00 0.00 46.19 43.19 1re9 s LEU 291 CO -0.00 -0.62 1.54 0.35 1.01 0.00 0.00 176.35 178.63 1re9 n THR 292 N 4.19 0.21 -3.55 5.49 -2.24 -0.34 -1.28 114.28 116.76 1re9 n THR 292 Ca 0.11 -0.14 -0.09 0.00 -2.27 0.00 0.00 64.05 61.67 1re9 n THR 292 Cb 0.44 -0.16 -0.02 0.00 -2.10 0.00 0.00 70.33 68.49 1re9 n THR 292 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1re9 s SER 293 N -3.66 -0.39 0.35 3.42 1.04 -1.26 -4.87 113.70 108.33 1re9 s SER 293 Ca 0.10 -0.11 -0.28 0.00 0.48 0.00 0.00 55.95 56.13 1re9 s SER 293 Cb 0.16 0.49 -0.11 0.00 0.10 0.00 0.00 66.02 66.66 1re9 s SER 293 CO 0.66 -0.83 1.41 -1.81 0.98 0.00 0.00 173.24 173.64 1re9 s ASP 294 N -2.67 6.55 -0.24 7.02 1.01 -1.26 -3.64 116.67 123.44 1re9 s ASP 294 Ca 0.05 2.86 -0.14 0.00 0.71 0.00 0.00 52.55 56.04 1re9 s ASP 294 Cb -0.01 -2.66 0.07 0.00 1.01 0.00 0.00 42.92 41.33 1re9 s ASP 294 CO -0.07 -0.71 0.58 -0.47 0.21 0.00 0.00 175.17 174.71 1re9 s TYR 295 N -1.04 -0.87 -0.19 4.23 5.04 -0.38 -4.91 117.35 119.23 1re9 s TYR 295 Ca 0.52 1.80 -0.16 0.00 -2.44 0.00 0.00 57.07 56.78 1re9 s TYR 295 Cb -0.43 0.47 -0.04 0.00 0.35 0.00 0.00 41.96 42.31 1re9 s TYR 295 CO 0.57 -0.45 0.40 -2.00 -1.34 0.00 0.00 175.55 172.73 1re9 s GLU 296 N 1.44 4.20 -0.13 4.97 2.12 -1.26 -0.67 118.70 129.37 1re9 s GLU 296 Ca -0.09 0.22 -0.01 0.00 0.36 0.00 0.00 54.97 55.45 1re9 s GLU 296 Cb -0.06 -3.51 0.04 0.00 0.26 0.00 0.00 34.13 30.85 1re9 s GLU 296 CO -0.16 0.01 -0.04 0.12 -0.54 0.00 0.00 175.26 174.66 1re9 s PHE 297 N 1.14 1.32 -1.53 5.30 5.36 0.45 -4.77 117.98 125.26 1re9 s PHE 297 Ca 0.20 -0.74 -0.13 0.00 -0.96 0.00 0.00 56.93 55.30 1re9 s PHE 297 Cb -0.15 -1.14 0.09 0.00 -0.34 0.00 0.00 43.02 41.48 1re9 s PHE 297 CO 0.08 -0.52 0.91 0.72 -1.46 0.00 0.00 175.22 174.95 1re9 n HIS 298 N 4.98 -2.17 -1.00 10.12 8.25 -1.26 -1.32 115.22 132.82 1re9 n HIS 298 Ca -0.11 0.88 -0.00 0.00 -0.26 0.00 0.00 57.72 58.23 1re9 n HIS 298 Cb 0.49 -3.86 -0.00 0.00 1.12 0.00 0.00 29.99 27.73 1re9 n HIS 298 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1re9 n GLY 299 N -1.65 0.47 3.18 -1.41 0.00 -1.26 -5.01 105.19 99.51 1re9 n GLY 299 Ca 0.00 -0.15 -0.32 0.00 0.00 0.00 0.00 46.02 45.55 1re9 n GLY 299 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1re9 s VAL 300 N -1.97 1.98 -0.36 1.61 1.01 -0.43 -5.09 120.40 117.15 1re9 s VAL 300 Ca 0.00 -0.95 -0.29 0.00 0.00 0.00 0.00 61.98 60.74 1re9 s VAL 300 Cb 0.00 -1.73 0.01 0.00 0.00 0.00 0.00 36.38 34.66 1re9 s VAL 300 CO 0.00 0.54 1.24 -1.58 0.00 0.00 0.00 175.10 175.30 1re9 s GLN 301 N 0.58 3.84 -0.01 2.72 2.00 -1.26 -0.41 119.66 127.12 1re9 s GLN 301 Ca -0.13 1.01 -0.05 0.00 -2.00 0.00 0.00 55.36 54.19 1re9 s GLN 301 Cb -0.17 -3.88 -0.04 0.00 0.80 0.00 0.00 33.01 29.71 1re9 s GLN 301 CO 0.04 -1.22 0.21 -0.51 -0.50 0.00 0.00 175.29 173.32 1re9 s LEU 302 N 4.45 4.37 -0.08 3.68 1.43 0.15 -4.88 118.68 127.81 1re9 s LEU 302 Ca 0.53 0.44 0.01 0.00 -1.03 0.00 0.00 54.13 54.08 1re9 s LEU 302 Cb -0.13 -2.60 -0.03 0.00 0.03 0.00 0.00 46.19 43.46 1re9 s LEU 302 CO 0.25 0.27 -0.08 -0.75 0.23 0.00 0.00 176.35 176.27 1re9 s LYS 303 N -1.81 2.82 -0.12 1.70 2.20 -1.26 -1.25 119.74 122.02 1re9 s LYS 303 Ca 0.27 -0.58 -0.40 0.00 -0.36 0.00 0.00 55.97 54.90 1re9 s LYS 303 Cb -0.13 -2.58 -0.18 0.00 -1.51 0.00 0.00 37.83 33.43 1re9 s LYS 303 CO 0.17 0.60 1.43 1.17 -0.36 0.00 0.00 175.35 178.35 1re9 n LYS 304 N 2.42 0.70 0.00 4.03 4.81 -1.24 -0.80 118.16 128.07 1re9 n LYS 304 Ca -0.18 0.25 0.00 0.00 -0.87 0.00 0.00 58.31 57.52 1re9 n LYS 304 Cb 0.53 -1.85 0.00 0.00 0.02 0.00 0.00 35.03 33.73 1re9 n LYS 304 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1re9 n GLY 305 N 2.96 1.11 3.77 3.14 0.00 -0.41 -4.94 105.19 110.82 1re9 n GLY 305 Ca 0.23 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.85 1re9 n GLY 305 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1re9 s ASP 306 N -2.52 5.93 0.09 1.61 1.01 0.02 -4.69 116.67 118.12 1re9 s ASP 306 Ca 0.00 2.85 -0.14 0.00 0.71 0.00 0.00 52.55 55.96 1re9 s ASP 306 Cb 0.00 -2.65 -0.06 0.00 1.01 0.00 0.00 42.92 41.22 1re9 s ASP 306 CO 0.00 -1.13 0.49 -1.10 0.21 0.00 0.00 175.17 173.64 1re9 s GLN 307 N -2.44 3.95 -0.09 8.23 -0.21 -1.26 -1.18 119.66 126.66 1re9 s GLN 307 Ca 0.61 0.44 0.00 0.00 0.02 0.00 0.00 55.36 56.43 1re9 s GLN 307 Cb -0.42 -3.06 0.02 0.00 1.00 0.00 0.00 33.01 30.56 1re9 s GLN 307 CO 0.54 0.57 -0.08 -1.50 -2.12 0.00 0.00 175.29 172.70 1re9 s ILE 308 N -1.31 0.94 -0.07 1.08 2.07 -0.17 -1.12 121.20 122.63 1re9 s ILE 308 Ca 0.32 -0.28 -0.29 0.00 -1.41 0.00 0.00 60.65 59.00 1re9 s ILE 308 Cb -0.16 -0.95 -0.02 0.00 0.13 0.00 0.00 42.46 41.46 1re9 s ILE 308 CO 0.18 0.34 0.94 -0.22 -1.91 0.00 0.00 174.94 174.27 1re9 s LEU 309 N 1.44 4.29 -0.62 8.50 2.96 0.37 -1.06 118.68 134.56 1re9 s LEU 309 Ca -0.01 1.50 0.06 0.00 -0.22 0.00 0.00 54.13 55.46 1re9 s LEU 309 Cb -0.13 -3.47 0.22 0.00 0.50 0.00 0.00 46.19 43.30 1re9 s LEU 309 CO -0.05 -0.34 0.61 0.18 -1.32 0.00 0.00 176.35 175.43 1re9 n LEU 310 N 4.50 2.82 -4.62 -0.68 4.77 -0.40 -1.72 117.00 121.69 1re9 n LEU 310 Ca 0.06 -5.21 -0.43 0.00 -0.03 0.00 0.00 56.01 50.41 1re9 n LEU 310 Cb 0.50 -0.47 -0.03 0.00 -2.33 0.00 0.00 43.42 41.09 1re9 n LEU 310 CO 0.51 1.94 1.48 -2.84 -1.33 0.00 0.00 177.39 177.16 1re9 s PRO 311 N -1.81 3.58 0.36 3.23 0.02 -1.26 -4.37 135.00 134.75 1re9 s PRO 311 Ca 0.34 1.64 0.10 0.00 0.02 0.00 0.00 61.00 63.10 1re9 s PRO 311 Cb 0.08 -4.13 0.85 0.00 0.02 0.00 0.00 34.50 31.32 1re9 s PRO 311 CO -0.09 -1.57 1.87 1.96 -0.33 0.00 0.00 177.00 178.84 1re9 h GLN 312 N 11.92 0.63 -1.01 5.54 7.50 -1.71 -1.21 115.11 136.77 1re9 h GLN 312 Ca -0.35 -0.04 0.20 0.00 0.50 0.00 0.00 58.65 58.96 1re9 h GLN 312 Cb 1.17 -0.14 -0.11 0.00 0.05 0.00 0.00 27.48 28.45 1re9 h GLN 312 CO 1.01 0.42 0.61 1.98 -1.50 0.00 0.00 178.83 181.35 1re9 h MET 313 N 0.65 0.71 0.00 1.46 4.05 -1.58 -3.17 114.93 117.04 1re9 h MET 313 Ca 0.44 -0.04 -0.11 0.00 -0.28 0.00 0.00 59.70 59.71 1re9 h MET 313 Cb 0.75 -0.16 -0.02 0.00 -0.80 0.00 0.00 31.60 31.38 1re9 h MET 313 CO -0.20 0.47 -0.50 -0.07 0.23 0.00 0.00 176.91 176.84 1re9 h LEU 314 N 0.73 0.00 -0.61 3.39 3.38 -1.52 -3.35 115.31 117.32 1re9 h LEU 314 Ca 0.59 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.56 1re9 h LEU 314 Cb 0.97 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.69 1re9 h LEU 314 CO -0.40 0.50 0.36 0.28 0.09 0.00 0.00 178.44 179.27 1re9 h SER 315 N 0.00 0.74 1.36 -0.43 0.02 -1.68 -1.95 113.55 111.61 1re9 h SER 315 Ca -0.01 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.87 1re9 h SER 315 Cb 1.36 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.71 1re9 h SER 315 CO 0.07 0.60 0.00 1.23 -1.14 0.00 0.00 176.83 177.58 1re9 h GLY 316 N 0.83 0.00 0.50 -3.77 0.00 -1.74 -2.87 103.07 96.03 1re9 h GLY 316 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.55 1re9 h GLY 316 CO -0.04 0.00 -0.46 1.04 0.00 0.00 0.00 176.54 177.08 1re9 n LEU 317 N -2.45 0.83 -4.64 3.11 4.77 -0.81 -4.73 117.00 113.08 1re9 n LEU 317 Ca 0.04 -0.19 -0.43 0.00 -0.03 0.00 0.00 56.01 55.41 1re9 n LEU 317 Cb 0.39 -0.16 -0.03 0.00 -2.33 0.00 0.00 43.42 41.29 1re9 n LEU 317 CO 0.28 0.18 1.36 -0.62 -1.33 0.00 0.00 177.39 177.26 1re9 s ASP 318 N -2.78 6.52 0.66 -1.43 -1.08 -0.80 -4.72 116.67 113.04 1re9 s ASP 318 Ca 0.16 1.89 0.44 0.00 -0.52 0.00 0.00 52.55 54.52 1re9 s ASP 318 Cb 0.18 -2.53 2.37 0.00 -1.46 0.00 0.00 42.92 41.48 1re9 s ASP 318 CO 0.64 -1.10 2.36 1.05 0.52 0.00 0.00 175.17 178.64 1re9 h GLU 319 N 10.14 0.00 0.00 4.34 -0.00 -1.90 0.42 114.58 127.58 1re9 h GLU 319 Ca -0.36 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.00 1re9 h GLU 319 Cb 1.16 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.91 1re9 h GLU 319 CO 0.98 0.00 0.00 0.00 -0.00 0.00 0.00 179.01 179.99 1re9 h ARG 320 N 0.00 0.00 0.00 1.06 3.08 -1.95 -3.32 114.38 113.25 1re9 h ARG 320 Ca -0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 1re9 h ARG 320 Cb 0.02 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.07 1re9 h ARG 320 CO 0.00 0.00 -1.24 -0.85 -1.07 0.00 0.00 179.97 176.81 1re9 n GLU 321 N -2.72 0.36 -3.71 0.04 0.28 0.01 -4.97 120.64 109.92 1re9 n GLU 321 Ca 0.03 -0.04 -0.22 0.00 -0.16 0.00 0.00 57.16 56.77 1re9 n GLU 321 Cb 0.39 -1.12 -0.18 0.00 1.43 0.00 0.00 31.44 31.97 1re9 n GLU 321 CO 0.00 0.00 0.00 -0.80 -0.16 0.00 0.00 177.13 176.17 1re9 s ASN 322 N -2.65 1.56 0.46 -1.84 0.01 -0.43 -4.80 114.94 107.25 1re9 s ASN 322 Ca -0.02 -0.11 -0.25 0.00 -0.71 0.00 0.00 52.86 51.77 1re9 s ASN 322 Cb 0.03 -0.31 -0.08 0.00 0.41 0.00 0.00 41.25 41.30 1re9 s ASN 322 CO 0.21 -0.24 1.41 0.00 -1.51 0.00 0.00 177.10 176.97 1re9 s ALA 323 N 2.06 3.19 -1.16 0.60 0.00 -1.26 -3.44 121.76 121.75 1re9 s ALA 323 Ca 0.04 1.42 -0.27 0.00 0.00 0.00 0.00 51.96 53.15 1re9 s ALA 323 Cb -0.13 -3.58 0.02 0.00 0.00 0.00 0.00 23.12 19.44 1re9 s ALA 323 CO -0.05 -1.17 0.72 0.00 0.00 0.00 0.00 175.76 175.26 1re9 h PRO 325 N -2.19 0.00 -0.00 0.00 0.13 -1.84 -1.02 132.00 127.08 1re9 h PRO 325 Ca -0.68 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.45 1re9 h PRO 325 Cb 1.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.51 1re9 h PRO 325 CO 0.49 0.06 -0.17 -1.33 -0.23 0.00 0.00 178.00 176.82 1re9 n MET 326 N -3.42 0.24 -3.06 0.86 2.81 -1.26 -4.80 117.12 108.49 1re9 n MET 326 Ca -0.02 -0.08 -0.39 0.00 -1.81 0.00 0.00 57.70 55.40 1re9 n MET 326 Cb 0.20 -1.50 -0.05 0.00 -0.71 0.00 0.00 33.22 31.15 1re9 n MET 326 CO 0.00 0.00 0.00 -1.58 1.51 0.00 0.00 175.97 175.90 1re9 s HIS 327 N -2.81 3.77 -0.32 2.03 5.04 -0.39 -5.04 115.29 117.57 1re9 s HIS 327 Ca 0.19 1.43 -0.16 0.00 -1.54 0.00 0.00 55.06 54.97 1re9 s HIS 327 Cb 0.19 -2.73 -0.02 0.00 0.04 0.00 0.00 32.58 30.06 1re9 s HIS 327 CO 0.55 0.37 0.42 0.08 -2.34 0.00 0.00 174.74 173.83 1re9 s VAL 328 N -0.42 5.11 -0.27 0.89 1.01 -1.26 -5.03 120.40 120.43 1re9 s VAL 328 Ca 0.35 0.32 0.00 0.00 0.00 0.00 0.00 61.98 62.65 1re9 s VAL 328 Cb -0.20 -3.84 0.08 0.00 0.00 0.00 0.00 36.38 32.42 1re9 s VAL 328 CO 0.22 -0.06 0.03 -0.62 0.00 0.00 0.00 175.10 174.66 1re9 s ASP 329 N 1.71 3.90 0.46 3.32 -1.08 -1.26 -5.01 116.67 118.72 1re9 s ASP 329 Ca 0.15 -1.43 0.32 0.00 -0.52 0.00 0.00 52.55 51.07 1re9 s ASP 329 Cb -0.16 -1.04 1.63 0.00 -1.46 0.00 0.00 42.92 41.89 1re9 s ASP 329 CO 0.12 -0.33 1.96 -0.26 0.52 0.00 0.00 175.17 177.18 1re9 h PHE 330 N 8.00 0.00 -0.59 -5.34 0.04 -1.96 0.71 116.94 117.80 1re9 h PHE 330 Ca -0.14 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.63 1re9 h PHE 330 Cb 1.05 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.20 1re9 h PHE 330 CO 0.41 0.00 0.00 0.43 -0.60 0.00 0.00 178.31 178.55 1re9 n SER 331 N -2.64 3.45 -4.70 2.17 7.64 -1.26 -4.57 113.62 113.71 1re9 n SER 331 Ca -0.01 -2.09 -0.43 0.00 1.01 0.00 0.00 58.87 57.35 1re9 n SER 331 Cb 0.10 -0.44 -0.01 0.00 -1.01 0.00 0.00 64.21 62.85 1re9 n SER 331 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 1re9 n ARG 332 N 1.19 2.23 -3.99 1.43 0.63 0.24 -4.98 116.66 113.41 1re9 n ARG 332 Ca 0.21 0.79 -0.28 0.00 -0.92 0.00 0.00 57.85 57.65 1re9 n ARG 332 Cb 0.57 -2.44 -0.04 0.00 0.45 0.00 0.00 32.46 31.00 1re9 n ARG 332 CO 0.00 0.00 0.00 -0.65 -2.51 0.00 0.00 177.63 174.47 1re9 s GLN 333 N -1.15 3.21 -1.19 -0.14 -0.21 -1.26 -4.54 119.66 114.38 1re9 s GLN 333 Ca 0.61 -0.65 -0.10 0.00 0.02 0.00 0.00 55.36 55.25 1re9 s GLN 333 Cb -0.58 -2.86 -0.02 0.00 1.00 0.00 0.00 33.01 30.55 1re9 s GLN 333 CO 0.56 0.54 0.76 1.63 -2.12 0.00 0.00 175.29 176.66 1re9 n LYS 334 N -0.15 -2.85 -2.01 2.91 5.02 -1.26 -4.87 118.16 114.95 1re9 n LYS 334 Ca -0.07 0.59 -0.43 0.00 -2.02 0.00 0.00 58.31 56.38 1re9 n LYS 334 Cb 0.53 -4.85 -0.03 0.00 -0.02 0.00 0.00 35.03 30.66 1re9 n LYS 334 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1re9 s VAL 335 N -3.55 3.53 -0.00 -0.18 1.01 -1.26 -4.94 120.40 115.01 1re9 s VAL 335 Ca 0.28 0.59 0.08 0.00 0.00 0.00 0.00 61.98 62.93 1re9 s VAL 335 Cb -0.08 -3.58 -0.02 0.00 0.00 0.00 0.00 36.38 32.70 1re9 s VAL 335 CO 0.82 -0.28 -0.25 -0.94 0.00 0.00 0.00 175.10 174.45 1re9 s SER 336 N 5.06 2.98 0.18 3.32 1.04 -1.26 -5.12 113.70 119.91 1re9 s SER 336 Ca 0.77 -0.49 -0.24 0.00 0.48 0.00 0.00 55.95 56.48 1re9 s SER 336 Cb -0.26 -0.32 0.05 0.00 0.10 0.00 0.00 66.02 65.60 1re9 s SER 336 CO 0.32 0.29 0.82 -1.38 0.98 0.00 0.00 173.24 174.27 1re9 s HIS 337 N -0.64 -0.23 -0.19 5.02 -3.43 -1.26 -4.23 115.29 110.32 1re9 s HIS 337 Ca 0.10 -0.10 0.15 0.00 -0.80 0.00 0.00 55.06 54.41 1re9 s HIS 337 Cb -0.10 0.64 0.44 0.00 -1.43 0.00 0.00 32.58 32.14 1re9 s HIS 337 CO -0.00 -0.94 1.19 0.25 -2.00 0.00 0.00 174.74 173.24 1re9 n THR 338 N -0.43 1.71 -0.34 -5.38 -2.24 -1.26 -4.89 114.28 101.44 1re9 n THR 338 Ca -0.07 -2.98 0.16 0.00 -2.27 0.00 0.00 64.05 58.88 1re9 n THR 338 Cb 0.61 -0.01 0.37 0.00 -2.10 0.00 0.00 70.33 69.20 1re9 n THR 338 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 1re9 h THR 339 N 3.16 0.61 -0.56 4.28 2.02 -1.86 0.10 112.91 120.66 1re9 h THR 339 Ca 0.03 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 66.99 1re9 h THR 339 Cb 1.36 -0.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.69 1re9 h THR 339 CO 0.24 0.12 0.00 0.49 0.37 0.00 0.00 175.52 176.74 1re9 n PHE 340 N -4.80 1.34 -3.39 3.16 3.72 -1.26 -4.76 117.46 111.47 1re9 n PHE 340 Ca 0.25 -0.53 0.00 0.00 -0.05 0.00 0.00 57.45 57.12 1re9 n PHE 340 Cb 0.68 -0.24 0.00 0.00 -0.94 0.00 0.00 39.48 38.98 1re9 n PHE 340 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1re9 n GLY 341 N 0.99 -1.62 3.60 1.37 0.00 0.02 -0.79 105.19 108.77 1re9 n GLY 341 Ca 0.23 -1.43 -0.13 0.00 0.00 0.00 0.00 46.02 44.69 1re9 n GLY 341 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1re9 s HIS 342 N 0.00 -0.58 0.00 1.61 2.46 -1.26 -4.71 115.29 112.81 1re9 s HIS 342 Ca 0.00 1.25 0.00 0.00 0.47 0.00 0.00 55.06 56.78 1re9 s HIS 342 Cb 0.00 0.37 0.00 0.00 -0.13 0.00 0.00 32.58 32.82 1re9 s HIS 342 CO 0.00 -0.37 0.00 0.41 -2.47 0.00 0.00 174.74 172.31 1re9 n GLY 343 N 1.76 -0.71 0.30 1.59 0.00 -1.26 -4.35 105.19 102.53 1re9 n GLY 343 Ca -0.14 -1.38 0.17 0.00 0.00 0.00 0.00 46.02 44.67 1re9 n GLY 343 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1re9 h SER 344 N 3.95 0.00 -0.61 1.61 4.64 -1.92 -1.98 113.55 119.25 1re9 h SER 344 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1re9 h SER 344 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1re9 h SER 344 CO 0.00 0.03 0.00 1.41 -0.87 0.00 0.00 176.83 177.40 1re9 n HIS 345 N -3.57 1.18 -1.60 4.77 -0.00 -1.26 -5.02 115.22 109.71 1re9 n HIS 345 Ca -0.03 -0.58 -0.57 0.00 -0.00 0.00 0.00 57.72 56.54 1re9 n HIS 345 Cb 0.12 -0.15 -0.07 0.00 -0.00 0.00 0.00 29.99 29.89 1re9 n HIS 345 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.34 176.23 1re9 n LEU 346 N 1.08 1.23 -4.67 2.41 7.94 -0.75 -4.65 117.00 119.60 1re9 n LEU 346 Ca 0.23 1.13 -0.59 0.00 -1.11 0.00 0.00 56.01 55.67 1re9 n LEU 346 Cb 0.76 -1.07 -0.08 0.00 0.53 0.00 0.00 43.42 43.56 1re9 n LEU 346 CO 0.19 -1.18 1.12 0.00 -1.11 0.00 0.00 177.39 176.41 1re9 h LEU 348 N 5.69 0.00 0.00 0.00 3.38 -1.91 -3.22 115.31 119.25 1re9 h LEU 348 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1re9 h LEU 348 Cb 1.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.10 1re9 h LEU 348 CO 0.90 0.44 0.00 0.61 0.09 0.00 0.00 178.44 180.48 1re9 n GLY 349 N 0.41 -0.99 0.19 0.83 0.00 -1.26 -4.12 105.19 100.25 1re9 n GLY 349 Ca -0.00 -0.14 0.02 0.00 0.00 0.00 0.00 46.02 45.91 1re9 n GLY 349 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 1re9 h GLN 350 N 0.00 0.04 -0.13 1.61 3.07 -1.87 0.12 115.11 117.96 1re9 h GLN 350 Ca 0.00 -0.02 -0.21 0.00 0.09 0.00 0.00 58.65 58.51 1re9 h GLN 350 Cb 0.00 -0.00 0.01 0.00 0.08 0.00 0.00 27.48 27.56 1re9 h GLN 350 CO 0.00 0.39 -0.77 0.45 0.09 0.00 0.00 178.83 178.98 1re9 h HIS 351 N 0.04 0.92 -0.39 0.06 3.86 -1.87 -0.91 115.15 116.86 1re9 h HIS 351 Ca 0.00 -0.41 -0.03 0.00 -1.16 0.00 0.00 60.37 58.78 1re9 h HIS 351 Cb 0.63 -0.14 -0.02 0.00 1.06 0.00 0.00 27.41 28.95 1re9 h HIS 351 CO 0.00 1.22 0.14 1.25 0.86 0.00 0.00 177.93 181.41 1re9 h LEU 352 N 0.46 0.55 -0.23 2.43 5.85 -1.65 -2.07 115.31 120.66 1re9 h LEU 352 Ca -0.05 -0.18 0.01 0.00 0.84 0.00 0.00 57.88 58.50 1re9 h LEU 352 Cb 1.39 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 42.26 1re9 h LEU 352 CO 0.15 0.58 0.13 0.00 -0.34 0.00 0.00 178.44 178.96 1re9 h ALA 353 N 0.99 0.28 -0.53 1.25 0.00 -0.71 -0.18 119.26 120.36 1re9 h ALA 353 Ca 0.13 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 1re9 h ALA 353 Cb 0.21 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1re9 h ALA 353 CO -0.01 -0.27 0.22 0.00 0.00 0.00 0.00 179.25 179.19 1re9 h ARG 354 N 0.27 0.76 -0.46 0.00 3.08 -1.12 -0.83 114.38 116.07 1re9 h ARG 354 Ca 0.09 -0.11 -0.03 0.00 0.07 0.00 0.00 59.98 60.01 1re9 h ARG 354 Cb -0.00 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 29.89 1re9 h ARG 354 CO -0.05 0.62 0.18 -0.09 -1.07 0.00 0.00 179.97 179.56 1re9 h ARG 355 N 0.75 0.69 -0.88 0.04 9.65 -0.80 0.04 114.38 123.86 1re9 h ARG 355 Ca 0.18 -0.13 0.02 0.00 -1.10 0.00 0.00 59.98 58.95 1re9 h ARG 355 Cb 0.14 -0.11 -0.05 0.00 -1.39 0.00 0.00 29.97 28.56 1re9 h ARG 355 CO -0.02 0.63 0.58 0.93 2.80 0.00 0.00 179.97 184.89 1re9 h GLU 356 N 0.60 1.12 -0.21 0.20 5.08 -0.44 -0.96 114.58 119.98 1re9 h GLU 356 Ca 0.15 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.39 1re9 h GLU 356 Cb 0.21 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 1re9 h GLU 356 CO -0.01 0.74 -0.07 0.82 -1.00 0.00 0.00 179.01 179.49 1re9 h ILE 357 N 1.16 1.29 -0.36 3.13 2.04 -0.90 -1.87 117.51 122.01 1re9 h ILE 357 Ca 0.34 -1.09 -0.17 0.00 1.00 0.00 0.00 64.86 64.94 1re9 h ILE 357 Cb -0.07 1.58 -0.00 0.00 -0.74 0.00 0.00 36.82 37.58 1re9 h ILE 357 CO -0.09 0.33 -0.43 0.40 0.00 0.00 0.00 178.15 178.36 1re9 h ILE 358 N 0.13 1.27 -0.77 -0.67 2.04 -0.82 -1.05 117.51 117.63 1re9 h ILE 358 Ca 0.05 -1.61 -0.04 0.00 1.00 0.00 0.00 64.86 64.26 1re9 h ILE 358 Cb 0.54 1.45 -0.03 0.00 -0.74 0.00 0.00 36.82 38.03 1re9 h ILE 358 CO 0.02 0.54 0.33 0.58 0.00 0.00 0.00 178.15 179.63 1re9 h VAL 359 N 0.74 1.25 -0.16 1.67 2.07 -1.23 -1.54 116.25 119.06 1re9 h VAL 359 Ca 0.05 -0.76 -0.01 0.00 0.82 0.00 0.00 66.70 66.80 1re9 h VAL 359 Cb 1.04 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 1re9 h VAL 359 CO 0.10 0.31 0.07 0.74 0.02 0.00 0.00 177.57 178.82 1re9 h THR 360 N 1.11 1.16 -0.19 2.57 2.02 -0.98 -0.02 112.91 118.58 1re9 h THR 360 Ca 0.26 -0.47 0.02 0.00 0.77 0.00 0.00 66.41 66.99 1re9 h THR 360 Cb 0.18 1.16 -0.02 0.00 -1.74 0.00 0.00 68.15 67.73 1re9 h THR 360 CO -0.03 0.15 0.06 -0.07 0.37 0.00 0.00 175.52 176.00 1re9 h LEU 361 N 0.11 0.07 -0.20 2.58 3.38 -1.07 0.13 115.31 120.31 1re9 h LEU 361 Ca 0.05 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 1re9 h LEU 361 Cb 0.17 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1re9 h LEU 361 CO -0.00 0.07 -0.08 0.50 0.09 0.00 0.00 178.44 179.01 1re9 h LYS 362 N 0.15 0.41 -0.01 1.13 1.63 -1.15 -2.02 116.57 116.71 1re9 h LYS 362 Ca 0.08 -0.17 -0.18 0.00 -0.85 0.00 0.00 60.65 59.53 1re9 h LYS 362 Cb 0.05 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.65 1re9 h LYS 362 CO -0.09 0.69 -0.79 0.93 -3.45 0.00 0.00 179.45 176.74 1re9 h GLU 363 N 0.12 0.14 0.41 1.90 4.39 -0.91 -1.60 114.58 119.04 1re9 h GLU 363 Ca 0.05 -0.14 -0.02 0.00 0.34 0.00 0.00 59.36 59.59 1re9 h GLU 363 Cb 0.56 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.25 1re9 h GLU 363 CO 0.03 0.86 -0.20 2.35 -1.16 0.00 0.00 179.01 180.89 1re9 h TRP 364 N 0.09 -0.52 0.00 4.33 2.91 -0.76 -3.03 115.95 118.97 1re9 h TRP 364 Ca -0.03 -0.01 -0.05 0.00 1.13 0.00 0.00 58.89 59.94 1re9 h TRP 364 Cb 1.38 0.17 -0.01 0.00 -0.51 0.00 0.00 29.16 30.20 1re9 h TRP 364 CO 0.02 -0.19 -0.22 -0.07 -1.03 0.00 0.00 178.44 176.95 1re9 h LEU 365 N -0.87 0.00 -0.71 0.65 3.38 -1.36 0.20 115.31 116.60 1re9 h LEU 365 Ca -0.06 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.92 1re9 h LEU 365 Cb 0.55 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.27 1re9 h LEU 365 CO 0.09 0.22 0.47 0.74 0.09 0.00 0.00 178.44 180.05 1re9 h THR 366 N 0.00 1.18 0.02 0.22 2.02 -1.30 -3.09 112.91 111.96 1re9 h THR 366 Ca -0.00 -0.33 -0.36 0.00 0.77 0.00 0.00 66.41 66.49 1re9 h THR 366 Cb 0.55 0.14 -0.06 0.00 -1.74 0.00 0.00 68.15 67.04 1re9 h THR 366 CO 0.03 0.17 -2.22 0.54 0.37 0.00 0.00 175.52 174.42 1re9 n ARG 367 N -4.59 0.68 -3.29 6.66 1.74 -0.92 -4.61 116.66 112.34 1re9 n ARG 367 Ca 0.06 0.14 -0.25 0.00 -0.77 0.00 0.00 57.85 57.03 1re9 n ARG 367 Cb 0.02 -1.61 -0.07 0.00 -1.02 0.00 0.00 32.46 29.78 1re9 n ARG 367 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1re9 n ILE 368 N -3.08 0.54 0.20 0.55 5.41 0.67 -1.40 119.36 122.25 1re9 n ILE 368 Ca -0.33 -4.50 0.04 0.00 1.00 0.00 0.00 62.75 58.96 1re9 n ILE 368 Cb 1.07 -2.02 0.43 0.00 -0.71 0.00 0.00 39.64 38.41 1re9 n ILE 368 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 176.55 178.10 1re9 h PRO 369 N 4.08 0.00 -5.08 0.38 0.13 -1.71 -3.40 132.00 126.41 1re9 h PRO 369 Ca 0.12 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.58 1re9 h PRO 369 Cb 0.79 0.00 -0.34 0.00 0.13 0.00 0.00 31.00 31.58 1re9 h PRO 369 CO 0.61 0.31 -0.84 0.34 -0.23 0.00 0.00 178.00 178.19 1re9 s ASP 370 N -6.83 3.30 0.17 1.44 2.15 -1.26 -4.89 116.67 110.74 1re9 s ASP 370 Ca -0.03 -0.60 -0.19 0.00 0.43 0.00 0.00 52.55 52.16 1re9 s ASP 370 Cb 0.14 -1.51 0.04 0.00 -0.30 0.00 0.00 42.92 41.30 1re9 s ASP 370 CO 0.70 0.01 0.52 0.72 -0.17 0.00 0.00 175.17 176.96 1re9 s PHE 371 N 1.22 -0.29 0.12 -5.34 -0.71 -1.26 -4.63 117.98 107.09 1re9 s PHE 371 Ca 0.03 -0.01 -0.03 0.00 -1.04 0.00 0.00 56.93 55.87 1re9 s PHE 371 Cb -0.14 0.43 -0.03 0.00 -1.21 0.00 0.00 43.02 42.07 1re9 s PHE 371 CO -0.09 -0.85 0.10 -1.12 -1.34 0.00 0.00 175.22 171.91 1re9 s SER 372 N -2.82 0.27 0.33 1.98 0.01 -0.32 -4.67 113.70 108.50 1re9 s SER 372 Ca 0.05 -1.06 -0.29 0.00 1.31 0.00 0.00 55.95 55.96 1re9 s SER 372 Cb -0.00 0.31 -0.11 0.00 0.21 0.00 0.00 66.02 66.43 1re9 s SER 372 CO -0.08 -0.74 1.41 -0.63 0.41 0.00 0.00 173.24 173.60 1re9 s ILE 373 N -3.99 2.43 0.18 1.44 -1.09 -1.26 -0.82 121.20 118.09 1re9 s ILE 373 Ca 0.18 0.42 -0.33 0.00 -2.23 0.00 0.00 60.65 58.69 1re9 s ILE 373 Cb 0.07 -3.27 -0.14 0.00 -1.58 0.00 0.00 42.46 37.54 1re9 s ILE 373 CO -0.02 0.09 1.47 0.00 -1.23 0.00 0.00 174.94 175.26 1re9 n ALA 374 N 0.95 0.95 -1.67 9.38 0.00 -0.04 -4.69 120.51 125.40 1re9 n ALA 374 Ca 0.02 0.44 -0.45 0.00 0.00 0.00 0.00 53.44 53.44 1re9 n ALA 374 Cb 0.40 -2.28 -0.03 0.00 0.00 0.00 0.00 19.45 17.54 1re9 n ALA 374 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1re9 n PRO 375 N 2.72 2.01 0.00 0.00 -0.02 -1.26 -1.97 135.00 136.49 1re9 n PRO 375 Ca 0.15 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.35 1re9 n PRO 375 Cb 0.29 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.37 1re9 n PRO 375 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1re9 n GLY 376 N 2.44 2.83 3.77 -1.23 0.00 -1.26 -5.02 105.19 106.72 1re9 n GLY 376 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 1re9 n GLY 376 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1re9 s ALA 377 N -1.94 3.25 -0.31 4.61 0.00 -0.83 -4.99 121.76 121.55 1re9 s ALA 377 Ca 0.00 0.87 -0.09 0.00 0.00 0.00 0.00 51.96 52.74 1re9 s ALA 377 Cb 0.00 -3.33 0.00 0.00 0.00 0.00 0.00 23.12 19.79 1re9 s ALA 377 CO 0.00 -0.28 0.14 -1.14 0.00 0.00 0.00 175.76 174.48 1re9 s GLN 378 N -1.97 3.20 0.13 0.00 2.00 -1.26 -4.96 119.66 116.80 1re9 s GLN 378 Ca 0.52 -0.81 -0.30 0.00 -2.00 0.00 0.00 55.36 52.77 1re9 s GLN 378 Cb -0.29 -3.53 -0.07 0.00 0.80 0.00 0.00 33.01 29.92 1re9 s GLN 378 CO 0.37 -0.46 1.17 0.42 -0.50 0.00 0.00 175.29 176.29 1re9 s ILE 379 N 1.57 3.85 -0.11 -2.34 -1.09 -1.26 -5.02 121.20 116.80 1re9 s ILE 379 Ca 0.04 1.46 0.02 0.00 -2.23 0.00 0.00 60.65 59.93 1re9 s ILE 379 Cb -0.17 -3.93 -0.01 0.00 -1.58 0.00 0.00 42.46 36.76 1re9 s ILE 379 CO 0.05 0.19 -0.16 -1.10 -1.23 0.00 0.00 174.94 172.69 1re9 s GLN 380 N 0.28 3.15 0.36 2.79 -0.21 -1.26 -5.05 119.66 119.72 1re9 s GLN 380 Ca 0.54 -0.74 0.07 0.00 0.02 0.00 0.00 55.36 55.25 1re9 s GLN 380 Cb -0.30 -2.50 -0.01 0.00 1.00 0.00 0.00 33.01 31.20 1re9 s GLN 380 CO 0.33 0.27 0.48 -1.01 -2.12 0.00 0.00 175.29 173.24 1re9 s HIS 381 N 0.17 2.99 0.09 0.91 3.76 -1.26 -0.81 115.29 121.14 1re9 s HIS 381 Ca -0.09 -0.29 0.05 0.00 -0.15 0.00 0.00 55.06 54.57 1re9 s HIS 381 Cb -0.15 -2.10 -0.03 0.00 1.11 0.00 0.00 32.58 31.40 1re9 s HIS 381 CO 0.06 -0.12 -0.13 -1.59 -0.85 0.00 0.00 174.74 172.11 1re9 s LYS 382 N -4.21 0.87 0.07 1.40 -2.85 0.07 -4.82 119.74 110.26 1re9 s LYS 382 Ca 0.48 -1.08 0.08 0.00 -1.00 0.00 0.00 55.97 54.44 1re9 s LYS 382 Cb -0.09 -0.74 -0.03 0.00 -2.06 0.00 0.00 37.83 34.91 1re9 s LYS 382 CO 0.31 0.14 -0.22 0.45 0.10 0.00 0.00 175.35 176.14 1re9 s SER 383 N -2.14 2.65 0.00 0.03 0.15 -1.26 -1.12 113.70 112.01 1re9 s SER 383 Ca 0.03 -0.59 0.00 0.00 0.70 0.00 0.00 55.95 56.09 1re9 s SER 383 Cb -0.06 -0.20 0.00 0.00 -1.71 0.00 0.00 66.02 64.04 1re9 s SER 383 CO 0.02 0.15 0.00 0.61 1.20 0.00 0.00 173.24 175.22 1re9 n GLY 384 N 1.57 -0.74 0.32 9.45 0.00 -1.09 -4.38 105.19 110.32 1re9 n GLY 384 Ca -0.18 -0.30 -0.07 0.00 0.00 0.00 0.00 46.02 45.48 1re9 n GLY 384 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1re9 h ILE 385 N 0.00 1.26 -3.66 -0.61 2.04 -1.86 -3.37 117.51 111.31 1re9 h ILE 385 Ca 0.00 -1.01 -0.63 0.00 1.00 0.00 0.00 64.86 64.22 1re9 h ILE 385 Cb 0.00 0.61 -0.38 0.00 -0.74 0.00 0.00 36.82 36.31 1re9 h ILE 385 CO 0.00 0.38 -0.78 -0.69 0.00 0.00 0.00 178.15 177.06 1re9 s VAL 386 N -5.23 1.76 0.72 1.67 1.01 -1.26 -0.47 120.40 118.60 1re9 s VAL 386 Ca -0.12 -1.53 -0.11 0.00 0.00 0.00 0.00 61.98 60.22 1re9 s VAL 386 Cb 0.15 -2.05 0.02 0.00 0.00 0.00 0.00 36.38 34.49 1re9 s VAL 386 CO 0.84 -0.22 1.07 -0.44 0.00 0.00 0.00 175.10 176.36 1re9 s SER 387 N 1.26 5.21 0.00 3.32 0.01 -0.10 -4.85 113.70 118.54 1re9 s SER 387 Ca -0.02 1.41 0.00 0.00 1.31 0.00 0.00 55.95 58.65 1re9 s SER 387 Cb -0.19 -2.25 0.00 0.00 0.21 0.00 0.00 66.02 63.79 1re9 s SER 387 CO -0.08 -1.53 0.00 0.61 0.41 0.00 0.00 173.24 172.65 1re9 n GLY 388 N -2.29 1.58 3.30 3.44 0.00 -0.27 -4.83 105.19 106.13 1re9 n GLY 388 Ca 0.07 -0.88 -0.33 0.00 0.00 0.00 0.00 46.02 44.89 1re9 n GLY 388 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1re9 s VAL 389 N -2.63 2.72 0.16 1.61 1.01 -1.26 -0.75 120.40 121.25 1re9 s VAL 389 Ca 0.00 -0.77 -0.09 0.00 0.00 0.00 0.00 61.98 61.12 1re9 s VAL 389 Cb 0.00 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.22 1re9 s VAL 389 CO 0.00 0.53 1.49 1.56 0.00 0.00 0.00 175.10 178.68 1re9 h GLN 390 N 6.89 0.86 -2.05 2.72 1.08 -1.29 -3.47 115.11 119.85 1re9 h GLN 390 Ca -0.26 -0.46 0.01 0.00 -1.45 0.00 0.00 58.65 56.49 1re9 h GLN 390 Cb 1.21 0.02 -0.19 0.00 -0.05 0.00 0.00 27.48 28.48 1re9 h GLN 390 CO 0.54 1.11 0.35 0.00 -0.95 0.00 0.00 178.83 179.87 1re9 s ALA 391 N -4.33 -1.80 -0.40 3.87 0.00 -1.26 -5.01 121.76 112.83 1re9 s ALA 391 Ca -0.10 1.24 0.03 0.00 0.00 0.00 0.00 51.96 53.13 1re9 s ALA 391 Cb 0.11 -0.03 0.16 0.00 0.00 0.00 0.00 23.12 23.36 1re9 s ALA 391 CO 0.87 -0.45 0.32 -1.17 0.00 0.00 0.00 175.76 175.33 1re9 s LEU 392 N -1.57 1.21 -0.17 0.00 2.96 -1.26 -4.63 118.68 115.21 1re9 s LEU 392 Ca -0.04 -2.81 -0.29 0.00 -0.22 0.00 0.00 54.13 50.76 1re9 s LEU 392 Cb -0.00 -0.36 -0.01 0.00 0.50 0.00 0.00 46.19 46.32 1re9 s LEU 392 CO 0.01 -0.20 1.23 -2.16 -1.32 0.00 0.00 176.35 173.91 1re9 s PRO 393 N 0.33 4.24 0.13 0.98 0.04 -1.26 -0.58 135.00 138.88 1re9 s PRO 393 Ca 0.29 1.62 0.09 0.00 0.04 0.00 0.00 61.00 63.04 1re9 s PRO 393 Cb -0.03 -3.74 -0.04 0.00 0.04 0.00 0.00 34.50 30.73 1re9 s PRO 393 CO -0.15 -0.69 -0.16 -0.51 0.04 0.00 0.00 177.00 175.54 1re9 s LEU 394 N 3.43 2.79 0.06 -3.56 1.43 -0.70 -0.86 118.68 121.28 1re9 s LEU 394 Ca 0.53 -0.54 0.00 0.00 -1.03 0.00 0.00 54.13 53.09 1re9 s LEU 394 Cb -0.21 -1.60 -0.04 0.00 0.03 0.00 0.00 46.19 44.37 1re9 s LEU 394 CO 0.14 0.17 -0.05 0.68 0.23 0.00 0.00 176.35 177.51 1re9 s VAL 395 N -1.25 0.41 0.16 -1.59 -7.23 0.00 -1.85 120.40 109.05 1re9 s VAL 395 Ca 0.20 -1.71 -0.24 0.00 -1.81 0.00 0.00 61.98 58.42 1re9 s VAL 395 Cb -0.10 -1.38 0.06 0.00 0.56 0.00 0.00 36.38 35.52 1re9 s VAL 395 CO 0.11 -0.86 0.71 -1.66 -0.31 0.00 0.00 175.10 173.10 1re9 s TRP 396 N -3.37 -0.39 -0.41 2.82 -2.14 -0.41 -1.18 118.94 113.86 1re9 s TRP 396 Ca 0.05 0.13 -0.23 0.00 2.66 0.00 0.00 56.10 58.71 1re9 s TRP 396 Cb 0.04 0.60 0.02 0.00 -3.10 0.00 0.00 33.47 31.02 1re9 s TRP 396 CO -0.06 -0.88 0.79 0.34 -2.66 0.00 0.00 176.95 174.48 1re9 s ASP 397 N -2.76 6.48 0.60 -2.66 -1.08 -1.26 -4.41 116.67 111.59 1re9 s ASP 397 Ca 0.05 0.12 0.30 0.00 -0.52 0.00 0.00 52.55 52.50 1re9 s ASP 397 Cb -0.02 -2.39 1.65 0.00 -1.46 0.00 0.00 42.92 40.69 1re9 s ASP 397 CO -0.07 -0.84 2.04 -0.65 0.52 0.00 0.00 175.17 176.17 1re9 h PRO 398 N 8.75 0.00 0.00 4.34 0.11 -1.88 -0.12 132.00 143.20 1re9 h PRO 398 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1re9 h PRO 398 Cb 1.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1re9 h PRO 398 CO 0.94 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.73 1re9 h ALA 399 N 1.64 1.00 -0.02 -0.75 0.00 -1.95 -2.05 119.26 117.12 1re9 h ALA 399 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1re9 h ALA 399 Cb 0.66 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1re9 h ALA 399 CO -0.00 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.50 1re9 n THR 400 N -2.50 0.02 -3.16 0.00 -2.24 -0.06 -4.94 114.28 101.39 1re9 n THR 400 Ca 0.01 -0.23 -0.18 0.00 -2.27 0.00 0.00 64.05 61.37 1re9 n THR 400 Cb 0.20 0.37 0.01 0.00 -2.10 0.00 0.00 70.33 68.81 1re9 n THR 400 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1re9 s THR 401 N -1.98 2.76 -0.08 4.28 -4.23 -0.77 -4.59 115.64 111.02 1re9 s THR 401 Ca 0.39 -1.09 -0.05 0.00 -1.18 0.00 0.00 61.69 59.75 1re9 s THR 401 Cb 0.21 -2.86 0.03 0.00 1.34 0.00 0.00 72.50 71.22 1re9 s THR 401 CO 0.33 0.00 0.20 -1.59 -0.54 0.00 0.00 174.62 173.03 1re9 s LYS 402 N -4.34 0.19 0.12 3.99 -2.85 -0.49 -5.03 119.74 111.33 1re9 s LYS 402 Ca 0.54 0.38 -0.30 0.00 -1.00 0.00 0.00 55.97 55.59 1re9 s LYS 402 Cb -0.08 -0.03 -0.06 0.00 -2.06 0.00 0.00 37.83 35.60 1re9 s LYS 402 CO 0.32 -0.10 1.10 0.00 0.10 0.00 0.00 175.35 176.77 1re9 s ALA 403 N 0.72 3.34 0.00 0.59 0.00 -1.26 -4.39 121.76 120.76 1re9 s ALA 403 Ca -0.05 0.77 0.00 0.00 0.00 0.00 0.00 51.96 52.68 1re9 s ALA 403 Cb -0.07 -3.37 0.00 0.00 0.00 0.00 0.00 23.12 19.68 1re9 s ALA 403 CO -0.04 -0.26 0.24 0.28 0.00 0.00 0.00 175.76 175.97