#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ar8 n LEU 2 N 0.00 4.02 -4.68 0.99 7.94 -1.26 -4.93 117.00 119.08 1ar8 n LEU 2 Ca 0.00 0.97 -0.44 0.00 -1.11 0.00 0.00 56.01 55.43 1ar8 n LEU 2 Cb 0.00 -1.53 -0.03 0.00 0.53 0.00 0.00 43.42 42.39 1ar8 n LEU 2 CO 0.00 0.16 1.51 -2.65 -1.11 0.00 0.00 177.39 175.30 1ar8 n PRO 3 N 6.12 2.68 -4.23 1.96 -0.02 -1.26 -5.00 135.00 135.25 1ar8 n PRO 3 Ca 0.19 0.98 -0.14 0.00 -2.02 0.00 0.00 63.50 62.51 1ar8 n PRO 3 Cb 0.37 -2.88 -0.10 0.00 -0.02 0.00 0.00 33.50 30.87 1ar8 n PRO 3 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1ar8 s VAL 4 N 3.49 1.09 -0.14 -1.45 -7.23 -1.26 -5.14 120.40 109.75 1ar8 s VAL 4 Ca 0.86 -1.97 -0.02 0.00 -1.81 0.00 0.00 61.98 59.03 1ar8 s VAL 4 Cb -0.51 -1.75 0.05 0.00 0.56 0.00 0.00 36.38 34.73 1ar8 s VAL 4 CO 0.42 -0.72 0.03 -0.32 -0.31 0.00 0.00 175.10 174.19 1ar8 s MET 5 N -3.58 0.58 0.10 4.82 1.75 -1.26 -5.11 119.30 116.60 1ar8 s MET 5 Ca 0.14 -0.18 -0.31 0.00 -1.25 0.00 0.00 55.69 54.10 1ar8 s MET 5 Cb 0.02 -1.63 -0.09 0.00 2.84 0.00 0.00 34.83 35.96 1ar8 s MET 5 CO -0.00 -0.51 1.77 -0.80 -0.65 0.00 0.00 175.02 174.83 1ar8 s ASN 6 N 1.93 6.49 0.46 1.11 0.01 -1.26 -5.02 114.94 118.67 1ar8 s ASN 6 Ca 0.02 2.65 -0.01 0.00 -0.71 0.00 0.00 52.86 54.81 1ar8 s ASN 6 Cb -0.15 -2.56 -0.01 0.00 0.41 0.00 0.00 41.25 38.94 1ar8 s ASN 6 CO -0.07 -0.96 0.69 0.42 -1.51 0.00 0.00 177.10 175.67 1ar8 s THR 7 N 2.81 4.07 0.58 1.60 -4.23 -1.26 -5.05 115.64 114.16 1ar8 s THR 7 Ca 0.79 -0.41 -0.19 0.00 -1.18 0.00 0.00 61.69 60.70 1ar8 s THR 7 Cb -0.43 -3.52 -0.05 0.00 1.34 0.00 0.00 72.50 69.84 1ar8 s THR 7 CO 0.35 -0.39 1.02 -2.65 -0.54 0.00 0.00 174.62 172.42 1ar8 n PRO 8 N -2.13 1.04 0.00 3.99 -0.02 -1.26 -2.89 135.00 133.74 1ar8 n PRO 8 Ca 0.01 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 1ar8 n PRO 8 Cb 0.57 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 1ar8 n PRO 8 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ar8 n GLY 9 N 1.20 1.41 3.70 -1.23 0.00 -1.26 -5.06 105.19 103.95 1ar8 n GLY 9 Ca 0.13 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.71 1ar8 n GLY 9 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ar8 n SER 10 N 0.00 3.45 0.00 1.61 7.64 -1.14 -2.43 113.62 122.75 1ar8 n SER 10 Ca 0.00 1.10 0.00 0.00 1.01 0.00 0.00 58.87 60.98 1ar8 n SER 10 Cb 0.00 -1.50 0.00 0.00 -1.01 0.00 0.00 64.21 61.70 1ar8 n SER 10 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1ar8 n ASN 11 N 3.18 0.00 -4.81 6.43 3.02 -1.26 -5.00 115.26 116.81 1ar8 n ASN 11 Ca 0.14 0.00 -0.30 0.00 -0.03 0.00 0.00 54.58 54.39 1ar8 n ASN 11 Cb 0.32 -1.03 0.07 0.00 -0.61 0.00 0.00 39.78 38.53 1ar8 n ASN 11 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ar8 s GLN 12 N -0.38 2.47 -0.35 3.52 -2.07 -1.02 -5.04 119.66 116.79 1ar8 s GLN 12 Ca 0.00 0.80 0.03 0.00 -1.82 0.00 0.00 55.36 54.37 1ar8 s GLN 12 Cb 0.00 -1.95 0.10 0.00 -1.09 0.00 0.00 33.01 30.07 1ar8 s GLN 12 CO 0.00 -1.39 0.08 -0.47 -1.32 0.00 0.00 175.29 172.19 1ar8 s TYR 13 N -3.09 3.26 -0.25 9.60 5.04 -1.26 -5.08 117.35 125.57 1ar8 s TYR 13 Ca 0.60 -2.75 -0.25 0.00 -2.44 0.00 0.00 57.07 52.23 1ar8 s TYR 13 Cb -0.14 -2.65 -0.00 0.00 0.35 0.00 0.00 41.96 39.51 1ar8 s TYR 13 CO 0.55 -0.91 0.83 -1.17 -1.34 0.00 0.00 175.55 173.50 1ar8 s LEU 14 N 0.93 4.08 0.60 6.97 2.96 -1.26 -4.94 118.68 128.01 1ar8 s LEU 14 Ca 0.11 1.00 0.38 0.00 -0.22 0.00 0.00 54.13 55.40 1ar8 s LEU 14 Cb -0.19 -3.18 1.81 0.00 0.50 0.00 0.00 46.19 45.12 1ar8 s LEU 14 CO -0.10 -0.53 2.15 0.71 -1.32 0.00 0.00 176.35 177.25 1ar8 h THR 15 N 5.45 0.06 -0.34 3.68 1.35 -2.07 -1.07 112.91 119.97 1ar8 h THR 15 Ca -0.23 -0.32 0.00 0.00 -0.55 0.00 0.00 66.41 65.31 1ar8 h THR 15 Cb 1.09 1.29 0.00 0.00 -1.73 0.00 0.00 68.15 68.81 1ar8 h THR 15 CO 0.88 0.01 0.00 0.00 -0.25 0.00 0.00 175.52 176.16 1ar8 n ALA 16 N -2.11 2.46 -1.18 6.62 0.00 -1.26 -4.98 120.51 120.06 1ar8 n ALA 16 Ca -0.01 -0.66 -0.29 0.00 0.00 0.00 0.00 53.44 52.48 1ar8 n ALA 16 Cb 0.21 -0.99 0.20 0.00 0.00 0.00 0.00 19.45 18.86 1ar8 n ALA 16 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1ar8 s ASP 17 N -1.15 2.00 -0.42 0.00 -4.77 -0.41 -5.04 116.67 106.88 1ar8 s ASP 17 Ca 0.28 0.93 0.08 0.00 -3.30 0.00 0.00 52.55 50.53 1ar8 s ASP 17 Cb 0.15 -1.42 0.26 0.00 -1.09 0.00 0.00 42.92 40.82 1ar8 s ASP 17 CO 0.20 -3.49 0.68 -3.20 0.70 0.00 0.00 175.17 170.07 1ar8 n ASN 18 N -4.38 -0.87 -4.81 2.11 5.15 -1.26 -5.11 115.26 106.09 1ar8 n ASN 18 Ca 0.08 -2.96 -0.24 0.00 -0.60 0.00 0.00 54.58 50.87 1ar8 n ASN 18 Cb 0.58 0.27 -0.05 0.00 -0.53 0.00 0.00 39.78 40.05 1ar8 n ASN 18 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 1ar8 s PHE 19 N -0.61 2.52 0.55 1.20 0.08 -1.26 -5.13 117.98 115.33 1ar8 s PHE 19 Ca 0.34 -0.59 -0.08 0.00 0.12 0.00 0.00 56.93 56.72 1ar8 s PHE 19 Cb 0.21 -2.03 -0.04 0.00 -0.57 0.00 0.00 43.02 40.59 1ar8 s PHE 19 CO -0.15 0.00 0.91 -0.65 -0.10 0.00 0.00 175.22 175.23 1ar8 s GLN 20 N -4.03 3.56 0.04 0.44 -0.21 -1.26 -5.11 119.66 113.10 1ar8 s GLN 20 Ca 0.42 0.46 -0.19 0.00 0.02 0.00 0.00 55.36 56.08 1ar8 s GLN 20 Cb 0.01 -2.23 0.04 0.00 1.00 0.00 0.00 33.01 31.82 1ar8 s GLN 20 CO 0.24 -0.39 0.43 -1.54 -2.12 0.00 0.00 175.29 171.91 1ar8 s SER 21 N -4.15 -0.31 0.38 5.90 1.04 -1.26 -5.15 113.70 110.15 1ar8 s SER 21 Ca 0.51 0.04 -0.27 0.00 0.48 0.00 0.00 55.95 56.71 1ar8 s SER 21 Cb -0.11 0.43 -0.11 0.00 0.10 0.00 0.00 66.02 66.33 1ar8 s SER 21 CO 0.49 -0.66 1.39 -0.81 0.98 0.00 0.00 173.24 174.63 1ar8 n PRO 22 N 0.53 2.36 -3.02 4.02 -0.04 -1.26 -4.98 135.00 132.61 1ar8 n PRO 22 Ca -0.19 0.83 -0.40 0.00 -0.04 0.00 0.00 63.50 63.70 1ar8 n PRO 22 Cb 0.60 -2.51 -0.05 0.00 -0.04 0.00 0.00 33.50 31.50 1ar8 n PRO 22 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ar8 h ALA 24 N 7.00 1.00 -2.53 0.00 0.00 -2.09 -3.37 119.26 119.27 1ar8 h ALA 24 Ca -0.37 0.00 -0.60 0.00 0.00 0.00 0.00 54.91 53.94 1ar8 h ALA 24 Cb 1.17 0.00 -0.41 0.00 0.00 0.00 0.00 17.79 18.56 1ar8 h ALA 24 CO 0.77 0.00 -0.74 1.28 0.00 0.00 0.00 179.25 180.57 1ar8 n LEU 25 N -2.62 2.11 -4.75 0.00 4.77 -1.26 -5.11 117.00 110.14 1ar8 n LEU 25 Ca 0.04 -5.04 -0.39 0.00 -0.03 0.00 0.00 56.01 50.60 1ar8 n LEU 25 Cb 0.40 -0.26 0.04 0.00 -2.33 0.00 0.00 43.42 41.27 1ar8 n LEU 25 CO 0.29 1.91 1.00 -2.16 -1.33 0.00 0.00 177.39 177.10 1ar8 s PRO 26 N -1.41 3.23 -1.00 3.23 0.04 -1.26 -3.28 135.00 134.55 1ar8 s PRO 26 Ca 0.32 2.26 0.00 0.00 0.04 0.00 0.00 61.00 63.62 1ar8 s PRO 26 Cb 0.06 -2.32 0.00 0.00 0.04 0.00 0.00 34.50 32.28 1ar8 s PRO 26 CO -0.12 -1.13 0.00 0.39 0.04 0.00 0.00 177.00 176.18 1ar8 n GLU 27 N -0.89 -1.68 -1.70 4.56 -0.58 -1.26 -4.92 120.64 114.16 1ar8 n GLU 27 Ca 0.09 0.75 -0.43 0.00 -0.42 0.00 0.00 57.16 57.16 1ar8 n GLU 27 Cb 0.45 -5.02 -0.03 0.00 -0.57 0.00 0.00 31.44 26.26 1ar8 n GLU 27 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1ar8 n PHE 28 N -1.95 2.57 -2.49 -0.32 -0.00 -1.21 -4.91 117.46 109.15 1ar8 n PHE 28 Ca -0.09 0.20 -0.40 0.00 -0.00 0.00 0.00 57.45 57.16 1ar8 n PHE 28 Cb 0.51 -2.60 -0.03 0.00 -0.00 0.00 0.00 39.48 37.36 1ar8 n PHE 28 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.76 177.10 1ar8 s ASP 29 N 0.85 6.26 0.14 -2.13 2.15 -1.26 -4.98 116.67 117.69 1ar8 s ASP 29 Ca 0.73 -1.11 -0.31 0.00 0.43 0.00 0.00 52.55 52.29 1ar8 s ASP 29 Cb -0.57 -2.57 -0.09 0.00 -0.30 0.00 0.00 42.92 39.39 1ar8 s ASP 29 CO 0.39 -1.73 1.53 -0.69 -0.17 0.00 0.00 175.17 174.51 1ar8 s VAL 30 N 5.76 2.84 0.00 1.11 1.01 -1.26 -4.96 120.40 124.90 1ar8 s VAL 30 Ca 0.47 0.57 -0.30 0.00 0.00 0.00 0.00 61.98 62.72 1ar8 s VAL 30 Cb -0.03 -3.37 -0.07 0.00 0.00 0.00 0.00 36.38 32.92 1ar8 s VAL 30 CO -0.03 0.04 1.63 -0.89 0.00 0.00 0.00 175.10 175.85 1ar8 s THR 31 N 1.32 3.37 0.86 3.92 2.01 -1.26 -4.99 115.64 120.88 1ar8 s THR 31 Ca 0.69 0.66 -0.11 0.00 0.31 0.00 0.00 61.69 63.23 1ar8 s THR 31 Cb -0.42 -3.42 0.12 0.00 0.01 0.00 0.00 72.50 68.79 1ar8 s THR 31 CO 0.31 -0.03 1.16 -2.16 -0.69 0.00 0.00 174.62 173.21 1ar8 s PRO 32 N 3.27 1.34 0.55 4.92 0.04 -1.26 -5.02 135.00 138.84 1ar8 s PRO 32 Ca 0.73 1.59 -0.17 0.00 0.04 0.00 0.00 61.00 63.19 1ar8 s PRO 32 Cb -0.36 -1.76 -0.06 0.00 0.04 0.00 0.00 34.50 32.37 1ar8 s PRO 32 CO 0.31 -2.41 1.04 -1.25 0.04 0.00 0.00 177.00 174.73 1ar8 s PRO 33 N -4.48 3.54 0.42 0.56 0.04 -1.26 -5.08 135.00 128.74 1ar8 s PRO 33 Ca 0.69 1.21 0.07 0.00 0.04 0.00 0.00 61.00 63.01 1ar8 s PRO 33 Cb -0.24 -2.06 -0.05 0.00 0.04 0.00 0.00 34.50 32.18 1ar8 s PRO 33 CO 0.55 -0.63 0.16 0.96 0.04 0.00 0.00 177.00 178.08 1ar8 s ILE 34 N -2.35 2.20 -1.27 0.56 -4.36 -1.26 -5.05 121.20 109.68 1ar8 s ILE 34 Ca 0.64 -1.73 -0.12 0.00 -0.26 0.00 0.00 60.65 59.18 1ar8 s ILE 34 Cb -0.15 -2.94 0.15 0.00 1.25 0.00 0.00 42.46 40.78 1ar8 s ILE 34 CO 0.31 0.00 1.73 -0.67 0.24 0.00 0.00 174.94 176.55 1ar8 n ASP 35 N -1.23 5.03 -4.72 4.36 2.03 -1.26 -4.97 116.55 115.79 1ar8 n ASP 35 Ca -0.02 -3.03 -0.42 0.00 0.52 0.00 0.00 54.79 51.84 1ar8 n ASP 35 Cb 0.65 -1.55 -0.03 0.00 -0.72 0.00 0.00 41.12 39.47 1ar8 n ASP 35 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1ar8 s ILE 36 N 1.32 3.09 0.65 5.18 1.01 -1.26 -5.00 121.20 126.19 1ar8 s ILE 36 Ca 0.42 0.82 -0.17 0.00 0.00 0.00 0.00 60.65 61.72 1ar8 s ILE 36 Cb 0.05 -3.52 -0.00 0.00 0.01 0.00 0.00 42.46 38.99 1ar8 s ILE 36 CO 0.00 0.08 1.22 -2.16 0.00 0.00 0.00 174.94 174.08 1ar8 s PRO 37 N 0.68 2.61 0.00 2.79 0.05 -1.26 -4.29 135.00 135.58 1ar8 s PRO 37 Ca 0.63 1.82 0.00 0.00 0.05 0.00 0.00 61.00 63.51 1ar8 s PRO 37 Cb -0.39 -1.88 0.00 0.00 0.05 0.00 0.00 34.50 32.28 1ar8 s PRO 37 CO 0.34 -1.49 0.00 0.41 0.05 0.00 0.00 177.00 176.31 1ar8 n GLY 38 N 0.48 0.64 3.77 0.56 0.00 -1.26 -5.04 105.19 104.35 1ar8 n GLY 38 Ca 0.14 -0.75 -0.40 0.00 0.00 0.00 0.00 46.02 45.01 1ar8 n GLY 38 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ar8 s GLU 39 N -3.76 4.38 -0.06 1.61 2.12 -1.26 -5.04 118.70 116.70 1ar8 s GLU 39 Ca 0.00 1.95 0.03 0.00 0.36 0.00 0.00 54.97 57.31 1ar8 s GLU 39 Cb 0.00 -3.00 -0.02 0.00 0.26 0.00 0.00 34.13 31.36 1ar8 s GLU 39 CO 0.00 -0.07 -0.14 0.08 -0.54 0.00 0.00 175.26 174.59 1ar8 s VAL 40 N -1.23 3.05 -0.03 3.70 1.01 -1.26 -5.03 120.40 120.62 1ar8 s VAL 40 Ca 0.49 -0.72 0.09 0.00 0.00 0.00 0.00 61.98 61.84 1ar8 s VAL 40 Cb -0.34 -2.20 -0.14 0.00 0.00 0.00 0.00 36.38 33.70 1ar8 s VAL 40 CO 0.44 0.59 0.18 0.29 0.00 0.00 0.00 175.10 176.60 1ar8 n LYS 41 N 2.41 0.66 -3.74 2.72 4.76 -1.26 -5.03 118.16 118.68 1ar8 n LYS 41 Ca -0.17 -0.07 -0.12 0.00 -2.87 0.00 0.00 58.31 55.07 1ar8 n LYS 41 Cb 0.52 -1.22 -0.12 0.00 -1.84 0.00 0.00 35.03 32.37 1ar8 n LYS 41 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 1ar8 s ASN 42 N -3.25 -0.33 0.54 4.39 3.84 -1.26 -5.04 114.94 113.84 1ar8 s ASN 42 Ca -0.04 0.63 0.24 0.00 0.21 0.00 0.00 52.86 53.90 1ar8 s ASN 42 Cb 0.05 0.58 1.44 0.00 -0.55 0.00 0.00 41.25 42.77 1ar8 s ASN 42 CO 0.39 -0.14 2.06 0.24 -2.79 0.00 0.00 177.10 176.86 1ar8 h MET 43 N 6.37 0.00 0.00 0.43 2.86 -2.03 -0.89 114.93 121.67 1ar8 h MET 43 Ca -0.32 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.31 1ar8 h MET 43 Cb 1.18 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.84 1ar8 h MET 43 CO 0.33 0.00 -0.06 0.52 1.06 0.00 0.00 176.91 178.76 1ar8 h MET 44 N 0.00 0.00 -0.89 1.72 2.86 -1.96 -1.13 114.93 115.53 1ar8 h MET 44 Ca 0.14 0.00 0.06 0.00 -2.06 0.00 0.00 59.70 57.85 1ar8 h MET 44 Cb 0.63 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 32.23 1ar8 h MET 44 CO -0.00 0.06 0.58 0.93 1.06 0.00 0.00 176.91 179.54 1ar8 h GLU 45 N 0.00 0.98 -0.09 1.72 5.08 -1.58 -1.80 114.58 118.89 1ar8 h GLU 45 Ca -0.00 -0.06 -0.18 0.00 -1.00 0.00 0.00 59.36 58.12 1ar8 h GLU 45 Cb 0.21 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 1ar8 h GLU 45 CO 0.01 0.65 -0.69 -0.07 -1.00 0.00 0.00 179.01 177.90 1ar8 h LEU 46 N 1.01 0.47 -2.05 1.33 3.38 -1.36 -2.78 115.31 115.31 1ar8 h LEU 46 Ca 0.38 -0.30 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1ar8 h LEU 46 Cb 0.20 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 1ar8 h LEU 46 CO -0.14 1.02 -0.04 0.00 0.09 0.00 0.00 178.44 179.37 1ar8 h ALA 47 N 0.97 1.08 -0.00 1.53 0.00 -1.21 -2.58 119.26 119.05 1ar8 h ALA 47 Ca -0.02 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1ar8 h ALA 47 Cb 1.25 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1ar8 h ALA 47 CO 0.12 0.05 -0.11 0.39 0.00 0.00 0.00 179.25 179.70 1ar8 n GLU 48 N -3.25 0.33 -2.97 0.00 1.02 -0.91 -0.69 120.64 114.17 1ar8 n GLU 48 Ca -0.01 -0.08 -0.40 0.00 -0.02 0.00 0.00 57.16 56.65 1ar8 n GLU 48 Cb 0.22 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 30.09 1ar8 n GLU 48 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1ar8 s ILE 49 N -2.72 4.81 0.11 -3.67 1.01 -0.98 -4.52 121.20 115.25 1ar8 s ILE 49 Ca 0.22 1.62 -0.31 0.00 0.00 0.00 0.00 60.65 62.18 1ar8 s ILE 49 Cb 0.19 -4.12 -0.10 0.00 0.01 0.00 0.00 42.46 38.45 1ar8 s ILE 49 CO 0.52 0.32 1.79 -1.81 0.00 0.00 0.00 174.94 175.76 1ar8 s ASP 50 N 0.23 6.46 0.09 3.58 1.01 -1.26 -4.56 116.67 122.21 1ar8 s ASP 50 Ca 0.39 2.70 0.06 0.00 0.71 0.00 0.00 52.55 56.42 1ar8 s ASP 50 Cb -0.20 -2.57 -0.03 0.00 1.01 0.00 0.00 42.92 41.13 1ar8 s ASP 50 CO 0.22 -0.98 -0.16 0.42 0.21 0.00 0.00 175.17 174.88 1ar8 s THR 51 N 2.65 1.32 -0.01 -1.27 -4.23 -0.99 -4.92 115.64 108.20 1ar8 s THR 51 Ca 0.79 -1.43 -0.30 0.00 -1.18 0.00 0.00 61.69 59.57 1ar8 s THR 51 Cb -0.45 -1.27 -0.05 0.00 1.34 0.00 0.00 72.50 72.07 1ar8 s THR 51 CO 0.35 -0.20 1.26 -0.32 -0.54 0.00 0.00 174.62 175.18 1ar8 s MET 52 N -1.90 4.35 -0.02 3.99 1.75 -1.26 -2.02 119.30 124.18 1ar8 s MET 52 Ca 0.02 1.79 -0.30 0.00 -1.25 0.00 0.00 55.69 55.95 1ar8 s MET 52 Cb -0.09 -3.51 -0.03 0.00 2.84 0.00 0.00 34.83 34.04 1ar8 s MET 52 CO 0.03 -0.44 1.11 0.42 -0.65 0.00 0.00 175.02 175.49 1ar8 s ILE 53 N 1.97 4.45 -1.40 10.11 1.01 0.34 -4.89 121.20 132.79 1ar8 s ILE 53 Ca 0.59 1.76 -0.12 0.00 0.00 0.00 0.00 60.65 62.88 1ar8 s ILE 53 Cb -0.28 -4.13 -0.05 0.00 0.01 0.00 0.00 42.46 38.02 1ar8 s ILE 53 CO 0.25 0.07 2.52 -0.81 0.00 0.00 0.00 174.94 176.97 1ar8 n PRO 54 N 4.53 3.02 -0.35 2.79 -0.04 -1.25 -4.56 135.00 139.13 1ar8 n PRO 54 Ca 0.09 -2.20 0.12 0.00 -0.04 0.00 0.00 63.50 61.47 1ar8 n PRO 54 Cb 0.48 -2.92 0.32 0.00 -0.04 0.00 0.00 33.50 31.33 1ar8 n PRO 54 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1ar8 h PHE 55 N 5.75 1.08 -3.51 0.54 0.04 -1.72 -3.34 116.94 115.78 1ar8 h PHE 55 Ca 0.69 0.03 -0.80 0.00 2.80 0.00 0.00 57.97 60.69 1ar8 h PHE 55 Cb 0.42 -0.33 -0.28 0.00 2.20 0.00 0.00 35.95 37.96 1ar8 h PHE 55 CO 1.70 0.26 0.48 -3.47 -0.60 0.00 0.00 178.31 176.68 1ar8 n ASP 56 N -4.75 5.59 -1.57 2.17 -0.08 -0.37 -4.82 116.55 112.72 1ar8 n ASP 56 Ca 0.23 -3.07 -0.11 0.00 -1.51 0.00 0.00 54.79 50.34 1ar8 n ASP 56 Cb 0.55 -1.37 0.07 0.00 2.34 0.00 0.00 41.12 42.71 1ar8 n ASP 56 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1ar8 n LEU 57 N 2.57 4.84 -4.71 -2.67 4.77 -1.25 -3.99 117.00 116.56 1ar8 n LEU 57 Ca 0.24 -2.51 -0.34 0.00 -0.03 0.00 0.00 56.01 53.37 1ar8 n LEU 57 Cb 0.39 -0.71 0.10 0.00 -2.33 0.00 0.00 43.42 40.87 1ar8 n LEU 57 CO 0.49 0.80 0.78 -0.94 -1.33 0.00 0.00 177.39 177.19 1ar8 s SER 58 N 0.08 4.00 0.27 -1.43 1.04 -1.26 -4.52 113.70 111.89 1ar8 s SER 58 Ca 0.25 2.34 -0.00 0.00 0.48 0.00 0.00 55.95 59.01 1ar8 s SER 58 Cb 0.20 -2.59 0.61 0.00 0.10 0.00 0.00 66.02 64.34 1ar8 s SER 58 CO 0.04 -2.39 1.70 0.00 0.98 0.00 0.00 173.24 173.57 1ar8 h ALA 59 N -0.54 1.24 0.00 5.32 0.00 -1.97 0.10 119.26 123.42 1ar8 h ALA 59 Ca -0.47 0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1ar8 h ALA 59 Cb 1.29 0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.24 1ar8 h ALA 59 CO 0.48 -0.31 -0.39 1.79 0.00 0.00 0.00 179.25 180.83 1ar8 h THR 60 N 0.38 0.00 0.00 0.00 1.35 -1.96 -3.36 112.91 109.32 1ar8 h THR 60 Ca 0.49 -0.74 -0.13 0.00 -0.55 0.00 0.00 66.41 65.49 1ar8 h THR 60 Cb 0.88 1.51 -0.02 0.00 -1.73 0.00 0.00 68.15 68.78 1ar8 h THR 60 CO -0.50 0.00 -1.93 0.29 -0.25 0.00 0.00 175.52 173.13 1ar8 n LYS 61 N -2.54 0.66 -0.99 4.72 5.02 -0.11 -4.97 118.16 119.96 1ar8 n LYS 61 Ca 0.03 -0.06 -0.32 0.00 -2.02 0.00 0.00 58.31 55.94 1ar8 n LYS 61 Cb 0.49 -1.59 0.14 0.00 -0.02 0.00 0.00 35.03 34.04 1ar8 n LYS 61 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1ar8 s LYS 62 N -3.13 1.49 -1.41 1.97 -2.85 0.17 -3.16 119.74 112.82 1ar8 s LYS 62 Ca -0.07 1.62 -0.12 0.00 -1.00 0.00 0.00 55.97 56.39 1ar8 s LYS 62 Cb 0.11 -1.77 0.10 0.00 -2.06 0.00 0.00 37.83 34.20 1ar8 s LYS 62 CO 0.86 -2.30 0.61 0.09 0.10 0.00 0.00 175.35 174.72 1ar8 n ASN 63 N -3.65 -3.68 -3.93 0.03 3.02 -1.26 -4.95 115.26 100.85 1ar8 n ASN 63 Ca 0.12 -0.58 -0.10 0.00 -0.03 0.00 0.00 54.58 54.00 1ar8 n ASN 63 Cb 0.51 -3.03 -0.06 0.00 -0.61 0.00 0.00 39.78 36.59 1ar8 n ASN 63 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1ar8 s THR 64 N -3.04 0.06 0.57 3.41 -4.23 -1.19 -5.05 115.64 106.16 1ar8 s THR 64 Ca 0.52 -1.30 0.26 0.00 -1.18 0.00 0.00 61.69 59.98 1ar8 s THR 64 Cb -0.27 -1.81 0.35 0.00 1.34 0.00 0.00 72.50 72.10 1ar8 s THR 64 CO 0.63 -0.26 2.12 0.24 -0.54 0.00 0.00 174.62 176.81 1ar8 h MET 65 N 2.49 0.00 0.00 3.99 2.86 -1.92 -2.48 114.93 119.86 1ar8 h MET 65 Ca -0.31 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.33 1ar8 h MET 65 Cb 1.23 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.89 1ar8 h MET 65 CO 0.46 0.00 -0.02 0.93 1.06 0.00 0.00 176.91 179.35 1ar8 h GLU 66 N 0.00 0.00 0.00 1.72 4.39 -1.97 -2.78 114.58 115.94 1ar8 h GLU 66 Ca 0.08 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.78 1ar8 h GLU 66 Cb 0.41 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.06 1ar8 h GLU 66 CO -0.00 0.02 -0.02 0.00 -1.16 0.00 0.00 179.01 177.85 1ar8 h MET 67 N 0.00 0.00 -0.00 2.33 -0.00 -1.40 -1.60 114.93 114.26 1ar8 h MET 67 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 1ar8 h MET 67 Cb 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.63 1ar8 h MET 67 CO 0.00 0.02 -0.22 0.66 -0.00 0.00 0.00 176.91 177.37 1ar8 n TYR 68 N -3.33 0.00 -3.68 -0.10 4.01 -1.05 -1.24 117.16 111.78 1ar8 n TYR 68 Ca -0.02 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.34 1ar8 n TYR 68 Cb 0.12 -0.32 -0.12 0.00 -0.31 0.00 0.00 39.34 38.72 1ar8 n TYR 68 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1ar8 s ARG 69 N -2.85 3.48 -0.44 -0.72 0.52 -0.60 -4.63 118.95 113.72 1ar8 s ARG 69 Ca 0.17 -0.61 -0.17 0.00 -0.52 0.00 0.00 55.73 54.60 1ar8 s ARG 69 Cb 0.19 -3.49 0.03 0.00 0.52 0.00 0.00 34.95 32.19 1ar8 s ARG 69 CO 0.58 -0.32 0.46 0.08 0.02 0.00 0.00 175.30 176.11 1ar8 s VAL 70 N 1.62 5.07 -0.05 3.52 1.01 -0.53 -4.80 120.40 126.25 1ar8 s VAL 70 Ca 0.05 -0.42 -0.30 0.00 0.00 0.00 0.00 61.98 61.31 1ar8 s VAL 70 Cb -0.16 -4.08 -0.02 0.00 0.00 0.00 0.00 36.38 32.11 1ar8 s VAL 70 CO 0.06 -0.49 1.02 -0.60 0.00 0.00 0.00 175.10 175.10 1ar8 s ARG 71 N 2.16 4.48 0.40 2.72 3.52 -1.26 -0.82 118.95 130.14 1ar8 s ARG 71 Ca 0.12 1.45 0.08 0.00 -0.13 0.00 0.00 55.73 57.25 1ar8 s ARG 71 Cb -0.18 -3.50 -0.04 0.00 -1.56 0.00 0.00 34.95 29.67 1ar8 s ARG 71 CO 0.13 -0.21 0.21 -0.51 -0.81 0.00 0.00 175.30 174.11 1ar8 s LEU 72 N 1.54 3.20 0.20 -0.88 1.43 0.12 -4.97 118.68 119.32 1ar8 s LEU 72 Ca 0.51 -0.95 -0.13 0.00 -1.03 0.00 0.00 54.13 52.53 1ar8 s LEU 72 Cb -0.21 -1.63 0.01 0.00 0.03 0.00 0.00 46.19 44.39 1ar8 s LEU 72 CO 0.23 -0.51 0.43 -0.94 0.23 0.00 0.00 176.35 175.80 1ar8 s SER 73 N -3.94 -0.11 0.00 2.29 1.04 -1.26 -1.73 113.70 110.00 1ar8 s SER 73 Ca 0.42 -0.76 0.00 0.00 0.48 0.00 0.00 55.95 56.09 1ar8 s SER 73 Cb 0.01 0.54 0.00 0.00 0.10 0.00 0.00 66.02 66.67 1ar8 s SER 73 CO 0.24 -1.04 0.73 -0.90 0.98 0.00 0.00 173.24 173.25 1ar8 n ASP 74 N -0.32 0.45 -4.55 7.02 5.75 -0.27 -4.27 116.55 120.36 1ar8 n ASP 74 Ca -0.06 -1.91 -0.34 0.00 -0.01 0.00 0.00 54.79 52.47 1ar8 n ASP 74 Cb 0.62 -0.22 0.11 0.00 -1.03 0.00 0.00 41.12 40.60 1ar8 n ASP 74 CO 0.00 0.00 0.00 2.29 -0.11 0.00 0.00 177.20 179.38 1ar8 n LYS 75 N -0.26 0.03 -1.31 0.11 2.85 -1.26 -4.75 118.16 113.57 1ar8 n LYS 75 Ca 0.00 0.07 -0.34 0.00 -1.05 0.00 0.00 58.31 56.99 1ar8 n LYS 75 Cb 0.11 -2.11 0.11 0.00 -0.65 0.00 0.00 35.03 32.49 1ar8 n LYS 75 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 1ar8 s PRO 76 N -3.67 1.93 0.21 -1.58 0.04 -1.26 -4.60 135.00 126.07 1ar8 s PRO 76 Ca 0.66 1.79 -0.32 0.00 0.04 0.00 0.00 61.00 63.17 1ar8 s PRO 76 Cb -0.28 -1.81 -0.15 0.00 0.04 0.00 0.00 34.50 32.31 1ar8 s PRO 76 CO 0.58 -2.00 1.25 1.58 0.04 0.00 0.00 177.00 178.45 1ar8 n HIS 77 N -2.93 1.63 -3.98 0.56 -0.00 -1.26 -5.01 115.22 104.23 1ar8 n HIS 77 Ca 0.14 0.59 -0.09 0.00 -0.00 0.00 0.00 57.72 58.35 1ar8 n HIS 77 Cb 0.50 -2.35 -0.11 0.00 -0.00 0.00 0.00 29.99 28.04 1ar8 n HIS 77 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 176.34 176.26 1ar8 s THR 78 N -0.21 0.11 -2.16 3.57 -1.32 -1.26 -5.04 115.64 109.34 1ar8 s THR 78 Ca 0.70 -0.95 0.17 0.00 -1.21 0.00 0.00 61.69 60.41 1ar8 s THR 78 Cb -0.76 -0.32 0.42 0.00 -1.51 0.00 0.00 72.50 70.33 1ar8 s THR 78 CO 0.52 -0.52 1.41 0.47 -2.21 0.00 0.00 174.62 174.29 1ar8 n ASP 79 N 1.53 2.29 -4.79 8.08 8.00 -1.26 -4.51 116.55 125.90 1ar8 n ASP 79 Ca -0.24 -1.90 -0.36 0.00 0.71 0.00 0.00 54.79 53.00 1ar8 n ASP 79 Cb 0.55 -0.23 -0.06 0.00 -0.02 0.00 0.00 41.12 41.36 1ar8 n ASP 79 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1ar8 s ASP 80 N -1.25 7.17 0.36 -2.24 1.01 -1.26 -1.31 116.67 119.14 1ar8 s ASP 80 Ca 0.32 1.86 -0.28 0.00 0.71 0.00 0.00 52.55 55.16 1ar8 s ASP 80 Cb 0.17 -2.58 -0.11 0.00 1.01 0.00 0.00 42.92 41.41 1ar8 s ASP 80 CO 0.24 -0.19 1.52 -0.81 0.21 0.00 0.00 175.17 176.13 1ar8 n PRO 81 N 0.28 2.71 0.05 8.23 -0.04 -1.26 -4.63 135.00 140.33 1ar8 n PRO 81 Ca 0.03 0.95 -0.20 0.00 -0.04 0.00 0.00 63.50 64.24 1ar8 n PRO 81 Cb 0.50 -2.70 -0.12 0.00 -0.04 0.00 0.00 33.50 31.15 1ar8 n PRO 81 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1ar8 h ILE 82 N 3.04 1.35 -2.97 0.52 2.04 -0.56 -3.48 117.51 117.45 1ar8 h ILE 82 Ca -0.50 -2.31 -0.08 0.00 1.00 0.00 0.00 64.86 62.97 1ar8 h ILE 82 Cb 1.24 2.64 -0.17 0.00 -0.74 0.00 0.00 36.82 39.79 1ar8 h ILE 82 CO 0.67 0.69 -0.10 -1.48 0.00 0.00 0.00 178.15 177.93 1ar8 s LEU 83 N -8.07 0.37 -0.00 1.44 0.05 -1.24 -4.98 118.68 106.25 1ar8 s LEU 83 Ca -0.11 0.05 0.04 0.00 0.05 0.00 0.00 54.13 54.17 1ar8 s LEU 83 Cb 0.05 1.75 -0.01 0.00 -2.05 0.00 0.00 46.19 45.92 1ar8 s LEU 83 CO 0.89 -0.64 -0.14 0.00 -0.55 0.00 0.00 176.35 175.91 1ar8 s LEU 85 N -0.46 0.50 0.02 0.00 0.20 0.57 -5.00 118.68 114.52 1ar8 s LEU 85 Ca 0.05 0.60 -0.24 0.00 0.69 0.00 0.00 54.13 55.23 1ar8 s LEU 85 Cb -0.06 0.92 -0.05 0.00 -0.43 0.00 0.00 46.19 46.57 1ar8 s LEU 85 CO -0.00 -0.15 0.73 -0.44 -0.29 0.00 0.00 176.35 176.20 1ar8 s SER 86 N 0.90 7.14 -1.27 3.68 0.01 -1.26 -0.67 113.70 122.23 1ar8 s SER 86 Ca -0.06 1.37 -0.18 0.00 1.31 0.00 0.00 55.95 58.39 1ar8 s SER 86 Cb -0.07 -2.45 0.00 0.00 0.21 0.00 0.00 66.02 63.72 1ar8 s SER 86 CO -0.06 0.00 1.99 -0.11 0.41 0.00 0.00 173.24 175.47 1ar8 n LEU 87 N 2.96 5.36 -3.59 2.44 7.94 -0.09 -4.68 117.00 127.34 1ar8 n LEU 87 Ca -0.03 -3.77 -0.27 0.00 -1.11 0.00 0.00 56.01 50.84 1ar8 n LEU 87 Cb 0.50 -1.62 -0.10 0.00 0.53 0.00 0.00 43.42 42.74 1ar8 n LEU 87 CO 0.47 0.23 -0.11 -1.20 -1.11 0.00 0.00 177.39 175.67 1ar8 n SER 88 N 8.04 2.03 -0.02 1.96 7.64 -1.26 -3.78 113.62 128.22 1ar8 n SER 88 Ca 0.50 -3.01 0.16 0.00 1.01 0.00 0.00 58.87 57.53 1ar8 n SER 88 Cb 0.42 -0.68 0.60 0.00 -1.01 0.00 0.00 64.21 63.55 1ar8 n SER 88 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1ar8 h PRO 89 N 5.00 0.17 0.00 1.43 0.13 -1.93 0.02 132.00 136.83 1ar8 h PRO 89 Ca 0.18 -0.01 -0.24 0.00 -0.87 0.00 0.00 66.00 65.05 1ar8 h PRO 89 Cb 0.78 -0.04 -0.04 0.00 0.13 0.00 0.00 31.00 31.83 1ar8 h PRO 89 CO 0.63 0.12 -1.77 0.00 -0.23 0.00 0.00 178.00 176.75 1ar8 n ALA 90 N -2.58 1.74 -0.08 -0.56 0.00 -1.26 -3.46 120.51 114.32 1ar8 n ALA 90 Ca 0.09 -0.80 -0.08 0.00 0.00 0.00 0.00 53.44 52.65 1ar8 n ALA 90 Cb 0.48 -0.73 -0.12 0.00 0.00 0.00 0.00 19.45 19.08 1ar8 n ALA 90 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1ar8 n SER 91 N -2.87 1.39 -4.71 0.00 3.41 -0.68 -4.46 113.62 105.70 1ar8 n SER 91 Ca -0.17 -0.02 -0.42 0.00 -0.26 0.00 0.00 58.87 58.00 1ar8 n SER 91 Cb 0.97 0.71 -0.03 0.00 -0.26 0.00 0.00 64.21 65.59 1ar8 n SER 91 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1ar8 s ASP 92 N -5.04 6.54 0.50 4.04 -1.08 -0.09 -4.77 116.67 116.76 1ar8 s ASP 92 Ca -0.10 2.65 0.25 0.00 -0.52 0.00 0.00 52.55 54.82 1ar8 s ASP 92 Cb 0.05 -2.59 1.32 0.00 -1.46 0.00 0.00 42.92 40.24 1ar8 s ASP 92 CO 0.61 -0.88 1.92 1.55 0.52 0.00 0.00 175.17 178.89 1ar8 h PRO 93 N 7.28 0.13 0.00 4.34 0.13 -1.93 0.32 132.00 142.28 1ar8 h PRO 93 Ca -0.43 -0.01 -0.10 0.00 -0.87 0.00 0.00 66.00 64.60 1ar8 h PRO 93 Cb 1.20 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 1ar8 h PRO 93 CO 0.93 0.09 -0.46 0.00 -0.23 0.00 0.00 178.00 178.33 1ar8 h ARG 94 N 0.14 0.00 0.00 0.86 3.08 -1.89 -3.36 114.38 113.21 1ar8 h ARG 94 Ca 0.37 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 60.30 1ar8 h ARG 94 Cb 1.26 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.29 1ar8 h ARG 94 CO -0.05 0.46 -1.77 1.28 -1.07 0.00 0.00 179.97 178.82 1ar8 n LEU 95 N -3.42 0.00 0.24 3.04 4.77 0.27 -3.91 117.00 118.00 1ar8 n LEU 95 Ca 0.01 0.00 0.16 0.00 -0.03 0.00 0.00 56.01 56.14 1ar8 n LEU 95 Cb 0.61 0.16 0.84 0.00 -2.33 0.00 0.00 43.42 42.71 1ar8 n LEU 95 CO 0.39 0.16 1.13 0.77 -1.33 0.00 0.00 177.39 178.51 1ar8 h SER 96 N 0.00 0.00 -0.34 -1.43 4.64 -0.52 -2.01 113.55 113.89 1ar8 h SER 96 Ca -0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 1ar8 h SER 96 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1ar8 h SER 96 CO 0.01 0.00 0.00 1.41 -0.87 0.00 0.00 176.83 177.38 1ar8 n HIS 97 N -3.89 0.46 -1.33 4.77 8.25 -1.26 -3.23 115.22 118.99 1ar8 n HIS 97 Ca -0.00 -0.43 -0.30 0.00 -0.26 0.00 0.00 57.72 56.73 1ar8 n HIS 97 Cb 0.22 -0.02 0.10 0.00 1.12 0.00 0.00 29.99 31.42 1ar8 n HIS 97 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1ar8 s THR 98 N -1.01 3.10 0.25 1.59 -4.23 -0.75 -4.72 115.64 109.87 1ar8 s THR 98 Ca 0.25 0.36 -0.04 0.00 -1.18 0.00 0.00 61.69 61.08 1ar8 s THR 98 Cb 0.13 -2.92 0.23 0.00 1.34 0.00 0.00 72.50 71.28 1ar8 s THR 98 CO 0.18 -0.47 1.84 -0.03 -0.54 0.00 0.00 174.62 175.60 1ar8 h MET 99 N -1.23 0.90 -0.21 3.99 1.85 -1.92 0.10 114.93 118.41 1ar8 h MET 99 Ca -0.46 -0.05 0.04 0.00 -0.61 0.00 0.00 59.70 58.61 1ar8 h MET 99 Cb 1.26 -0.20 -0.04 0.00 0.43 0.00 0.00 31.60 33.05 1ar8 h MET 99 CO 0.55 0.60 -0.02 1.25 -0.40 0.00 0.00 176.91 178.88 1ar8 h LEU 100 N 0.93 -0.13 -0.68 3.39 5.85 -1.86 -1.55 115.31 121.25 1ar8 h LEU 100 Ca 0.41 0.05 0.01 0.00 0.84 0.00 0.00 57.88 59.19 1ar8 h LEU 100 Cb 0.29 0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.39 1ar8 h LEU 100 CO -0.21 -0.04 0.45 1.23 -0.34 0.00 0.00 178.44 179.52 1ar8 h GLY 101 N 0.04 0.97 0.99 3.75 0.00 -1.36 -1.12 103.07 106.34 1ar8 h GLY 101 Ca 0.10 -0.37 0.00 0.00 0.00 0.00 0.00 47.33 47.06 1ar8 h GLY 101 CO -0.19 0.36 0.19 0.83 0.00 0.00 0.00 176.54 177.73 1ar8 h GLU 102 N 0.93 0.40 -0.67 4.80 4.39 -0.60 -1.85 114.58 121.98 1ar8 h GLU 102 Ca 0.25 -0.03 -0.06 0.00 0.34 0.00 0.00 59.36 59.86 1ar8 h GLU 102 Cb -0.10 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 28.44 1ar8 h GLU 102 CO -0.05 0.28 0.18 0.82 -1.16 0.00 0.00 179.01 179.08 1ar8 h ILE 103 N 0.39 1.26 -0.01 3.13 2.04 -1.12 -2.67 117.51 120.54 1ar8 h ILE 103 Ca 0.11 -0.93 0.00 0.00 1.00 0.00 0.00 64.86 65.04 1ar8 h ILE 103 Cb -0.02 0.58 -0.00 0.00 -0.74 0.00 0.00 36.82 36.64 1ar8 h ILE 103 CO -0.02 0.35 0.01 -0.07 0.00 0.00 0.00 178.15 178.42 1ar8 h LEU 104 N 0.99 0.00 -0.20 1.44 4.07 -0.78 -1.59 115.31 119.24 1ar8 h LEU 104 Ca 0.21 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.17 1ar8 h LEU 104 Cb 0.35 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.09 1ar8 h LEU 104 CO -0.00 0.00 0.00 0.59 -1.08 0.00 0.00 178.44 177.95 1ar8 n ASN 105 N -3.78 0.29 -0.93 -0.43 3.02 -0.73 -2.36 115.26 110.34 1ar8 n ASN 105 Ca -0.03 -1.55 0.10 0.00 -0.03 0.00 0.00 54.58 53.07 1ar8 n ASN 105 Cb 0.09 -0.02 0.17 0.00 -0.61 0.00 0.00 39.78 39.40 1ar8 n ASN 105 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1ar8 n TYR 106 N -0.56 0.38 -4.13 3.10 4.01 -0.60 -3.48 117.16 115.89 1ar8 n TYR 106 Ca 0.12 -0.24 -0.15 0.00 -0.16 0.00 0.00 57.90 57.48 1ar8 n TYR 106 Cb 0.10 -0.00 -0.11 0.00 -0.31 0.00 0.00 39.34 39.01 1ar8 n TYR 106 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 1ar8 s TYR 107 N -1.32 0.94 -0.01 -0.72 2.02 -1.00 -0.25 117.35 117.02 1ar8 s TYR 107 Ca 0.31 -0.56 0.11 0.00 -0.37 0.00 0.00 57.07 56.57 1ar8 s TYR 107 Cb 0.18 -0.53 -0.19 0.00 -0.40 0.00 0.00 41.96 41.02 1ar8 s TYR 107 CO 0.26 -0.03 0.93 1.15 -1.57 0.00 0.00 175.55 176.29 1ar8 h THR 108 N 4.09 1.08 -4.28 -0.71 2.02 -0.14 -3.43 112.91 111.54 1ar8 h THR 108 Ca -0.38 -2.82 -0.53 0.00 0.77 0.00 0.00 66.41 63.46 1ar8 h THR 108 Cb 1.19 2.51 -0.29 0.00 -1.74 0.00 0.00 68.15 69.82 1ar8 h THR 108 CO 0.45 0.62 -0.83 -1.00 0.37 0.00 0.00 175.52 175.13 1ar8 s HIS 109 N -2.70 1.48 0.13 3.16 3.76 -0.54 -1.20 115.29 119.37 1ar8 s HIS 109 Ca -0.02 -0.28 0.06 0.00 -0.15 0.00 0.00 55.06 54.67 1ar8 s HIS 109 Cb 0.09 -0.95 -0.04 0.00 1.11 0.00 0.00 32.58 32.79 1ar8 s HIS 109 CO 0.82 -0.02 -0.14 1.67 -0.85 0.00 0.00 174.74 176.21 1ar8 s TRP 110 N -0.40 1.43 -0.19 1.40 1.48 -0.14 -1.29 118.94 121.23 1ar8 s TRP 110 Ca 0.06 -0.57 -0.23 0.00 -1.06 0.00 0.00 56.10 54.30 1ar8 s TRP 110 Cb -0.06 -0.74 0.06 0.00 -1.16 0.00 0.00 33.47 31.57 1ar8 s TRP 110 CO -0.01 0.16 0.62 0.00 -4.06 0.00 0.00 176.95 173.67 1ar8 s ALA 111 N -2.29 -1.56 0.00 2.67 0.00 -0.54 -0.45 121.76 119.58 1ar8 s ALA 111 Ca 0.11 1.61 0.00 0.00 0.00 0.00 0.00 51.96 53.68 1ar8 s ALA 111 Cb -0.04 -0.76 0.00 0.00 0.00 0.00 0.00 23.12 22.32 1ar8 s ALA 111 CO 0.03 -0.31 0.00 0.41 0.00 0.00 0.00 175.76 175.89 1ar8 n GLY 112 N 2.28 1.26 3.87 0.00 0.00 -1.26 -0.27 105.19 111.08 1ar8 n GLY 112 Ca -0.15 -2.04 -0.35 0.00 0.00 0.00 0.00 46.02 43.48 1ar8 n GLY 112 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ar8 s SER 113 N 0.00 6.60 0.29 1.61 0.01 -1.26 -4.21 113.70 116.74 1ar8 s SER 113 Ca 0.00 0.72 0.10 0.00 1.31 0.00 0.00 55.95 58.08 1ar8 s SER 113 Cb 0.00 -2.15 -0.05 0.00 0.21 0.00 0.00 66.02 64.03 1ar8 s SER 113 CO 0.00 0.19 -0.06 -0.76 0.41 0.00 0.00 173.24 173.02 1ar8 s LEU 114 N -1.88 2.96 -0.03 2.44 1.43 -0.79 -0.94 118.68 121.87 1ar8 s LEU 114 Ca 0.32 -0.85 -0.01 0.00 -1.03 0.00 0.00 54.13 52.56 1ar8 s LEU 114 Cb -0.14 -1.44 0.03 0.00 0.03 0.00 0.00 46.19 44.67 1ar8 s LEU 114 CO 0.18 -0.05 0.07 -1.59 0.23 0.00 0.00 176.35 175.19 1ar8 s LYS 115 N -3.64 0.01 -0.26 1.70 -2.85 -0.23 -0.28 119.74 114.19 1ar8 s LYS 115 Ca 0.32 0.23 -0.10 0.00 -1.00 0.00 0.00 55.97 55.42 1ar8 s LYS 115 Cb -0.04 -0.21 -0.05 0.00 -2.06 0.00 0.00 37.83 35.47 1ar8 s LYS 115 CO 0.18 -0.15 0.16 -0.06 0.10 0.00 0.00 175.35 175.58 1ar8 s PHE 116 N 1.01 3.21 -0.15 1.78 0.40 -0.19 -2.09 117.98 121.96 1ar8 s PHE 116 Ca -0.08 0.04 -0.02 0.00 -0.60 0.00 0.00 56.93 56.27 1ar8 s PHE 116 Cb -0.11 -2.33 -0.02 0.00 0.51 0.00 0.00 43.02 41.07 1ar8 s PHE 116 CO -0.04 -0.15 -0.09 0.99 0.70 0.00 0.00 175.22 176.64 1ar8 s THR 117 N 1.57 3.41 -0.12 0.64 2.01 0.02 -0.33 115.64 122.85 1ar8 s THR 117 Ca 0.07 -0.53 -0.03 0.00 0.31 0.00 0.00 61.69 61.51 1ar8 s THR 117 Cb -0.15 -2.47 -0.03 0.00 0.01 0.00 0.00 72.50 69.86 1ar8 s THR 117 CO 0.08 0.51 -0.01 -0.36 -0.69 0.00 0.00 174.62 174.14 1ar8 s PHE 118 N 0.43 3.10 -0.21 4.92 0.08 0.04 -0.39 117.98 125.94 1ar8 s PHE 118 Ca -0.07 -0.03 -0.05 0.00 0.12 0.00 0.00 56.93 56.90 1ar8 s PHE 118 Cb -0.15 -1.89 -0.02 0.00 -0.57 0.00 0.00 43.02 40.39 1ar8 s PHE 118 CO 0.04 0.21 -0.00 -1.17 -0.10 0.00 0.00 175.22 174.20 1ar8 s LEU 119 N -0.22 3.16 -0.25 -0.37 2.96 0.65 -1.38 118.68 123.23 1ar8 s LEU 119 Ca 0.05 -0.27 -0.24 0.00 -0.22 0.00 0.00 54.13 53.45 1ar8 s LEU 119 Cb -0.13 -1.81 -0.01 0.00 0.50 0.00 0.00 46.19 44.75 1ar8 s LEU 119 CO 0.02 0.02 0.80 0.12 -1.32 0.00 0.00 176.35 175.99 1ar8 s PHE 120 N 1.24 3.29 -0.23 5.38 5.36 -1.04 -1.24 117.98 130.74 1ar8 s PHE 120 Ca 0.03 1.05 0.14 0.00 -0.96 0.00 0.00 56.93 57.19 1ar8 s PHE 120 Cb -0.15 -3.04 0.63 0.00 -0.34 0.00 0.00 43.02 40.12 1ar8 s PHE 120 CO 0.01 -0.41 1.57 0.00 -1.46 0.00 0.00 175.22 174.92 1ar8 n GLY 122 N -0.31 -1.70 3.83 0.00 0.00 -1.25 -4.57 105.19 101.18 1ar8 n GLY 122 Ca 0.28 -1.63 -0.31 0.00 0.00 0.00 0.00 46.02 44.36 1ar8 n GLY 122 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ar8 s SER 123 N -3.68 5.55 0.51 1.61 1.04 -1.26 -4.95 113.70 112.52 1ar8 s SER 123 Ca 0.43 1.56 0.18 0.00 0.48 0.00 0.00 55.95 58.60 1ar8 s SER 123 Cb -0.02 -2.47 1.28 0.00 0.10 0.00 0.00 66.02 64.91 1ar8 s SER 123 CO 0.31 -1.33 2.09 -0.03 0.98 0.00 0.00 173.24 175.26 1ar8 h MET 124 N -0.64 0.05 0.00 4.02 4.05 -2.00 -1.24 114.93 119.17 1ar8 h MET 124 Ca -0.44 -0.00 0.00 0.00 -0.28 0.00 0.00 59.70 58.98 1ar8 h MET 124 Cb 1.21 -0.01 0.00 0.00 -0.80 0.00 0.00 31.60 32.00 1ar8 h MET 124 CO 0.58 0.03 0.00 0.52 0.23 0.00 0.00 176.91 178.27 1ar8 h MET 125 N 0.05 0.00 -6.62 0.39 2.86 -1.97 -3.44 114.93 106.21 1ar8 h MET 125 Ca 0.11 0.00 -0.51 0.00 -2.06 0.00 0.00 59.70 57.23 1ar8 h MET 125 Cb 0.36 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.01 1ar8 h MET 125 CO -0.01 0.00 0.41 0.00 1.06 0.00 0.00 176.91 178.38 1ar8 s ALA 126 N -3.39 3.31 0.35 6.32 0.00 -0.47 -4.48 121.76 123.40 1ar8 s ALA 126 Ca 0.04 0.68 0.06 0.00 0.00 0.00 0.00 51.96 52.75 1ar8 s ALA 126 Cb 0.09 -3.31 -0.07 0.00 0.00 0.00 0.00 23.12 19.84 1ar8 s ALA 126 CO 0.49 -0.09 0.01 0.95 0.00 0.00 0.00 175.76 177.13 1ar8 s THR 127 N -0.17 1.64 0.00 0.00 -4.23 -0.36 -4.89 115.64 107.62 1ar8 s THR 127 Ca 0.48 -2.03 0.00 0.00 -1.18 0.00 0.00 61.69 58.96 1ar8 s THR 127 Cb -0.26 -2.83 0.00 0.00 1.34 0.00 0.00 72.50 70.75 1ar8 s THR 127 CO 0.32 -0.05 0.00 0.61 -0.54 0.00 0.00 174.62 174.96 1ar8 n GLY 128 N -0.80 2.60 3.18 3.99 0.00 -1.26 -1.34 105.19 111.57 1ar8 n GLY 128 Ca -0.04 -0.65 -0.32 0.00 0.00 0.00 0.00 46.02 45.00 1ar8 n GLY 128 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ar8 s LYS 129 N -2.00 3.03 0.26 1.61 1.02 -1.26 -0.66 119.74 121.74 1ar8 s LYS 129 Ca 0.00 -0.86 0.11 0.00 0.02 0.00 0.00 55.97 55.24 1ar8 s LYS 129 Cb 0.00 -2.40 -0.05 0.00 -0.52 0.00 0.00 37.83 34.86 1ar8 s LYS 129 CO 0.00 0.03 -0.16 -0.51 -0.92 0.00 0.00 175.35 173.79 1ar8 s LEU 130 N 0.69 2.71 -0.15 3.17 1.43 -0.26 -0.14 118.68 126.14 1ar8 s LEU 130 Ca -0.10 -0.90 0.02 0.00 -1.03 0.00 0.00 54.13 52.11 1ar8 s LEU 130 Cb -0.16 -1.26 0.01 0.00 0.03 0.00 0.00 46.19 44.81 1ar8 s LEU 130 CO 0.01 0.05 -0.20 -0.22 0.23 0.00 0.00 176.35 176.22 1ar8 s LEU 131 N -3.38 2.04 -0.22 1.79 0.20 0.41 -0.39 118.68 119.13 1ar8 s LEU 131 Ca 0.29 -0.59 -0.05 0.00 0.69 0.00 0.00 54.13 54.47 1ar8 s LEU 131 Cb -0.06 -1.39 -0.02 0.00 -0.43 0.00 0.00 46.19 44.29 1ar8 s LEU 131 CO 0.15 0.04 0.00 -0.69 -0.29 0.00 0.00 176.35 175.57 1ar8 s VAL 132 N 1.00 3.82 0.12 1.68 1.01 -0.02 -0.78 120.40 127.24 1ar8 s VAL 132 Ca -0.03 -0.34 0.10 0.00 0.00 0.00 0.00 61.98 61.71 1ar8 s VAL 132 Cb -0.15 -2.75 -0.04 0.00 0.00 0.00 0.00 36.38 33.44 1ar8 s VAL 132 CO -0.05 0.40 -0.25 -0.55 0.00 0.00 0.00 175.10 174.64 1ar8 s SER 133 N 1.40 3.45 -0.09 3.32 0.15 0.03 -0.88 113.70 121.08 1ar8 s SER 133 Ca 0.05 -0.70 -0.01 0.00 0.70 0.00 0.00 55.95 55.99 1ar8 s SER 133 Cb -0.15 -0.30 0.03 0.00 -1.71 0.00 0.00 66.02 63.90 1ar8 s SER 133 CO 0.00 0.18 -0.03 -0.47 1.20 0.00 0.00 173.24 174.12 1ar8 s TYR 134 N -1.07 1.04 -0.34 3.44 5.04 0.13 -1.28 117.35 124.31 1ar8 s TYR 134 Ca 0.15 -0.43 -0.04 0.00 -2.44 0.00 0.00 57.07 54.31 1ar8 s TYR 134 Cb -0.10 -1.00 0.06 0.00 0.35 0.00 0.00 41.96 41.26 1ar8 s TYR 134 CO 0.07 -0.41 0.08 0.00 -1.34 0.00 0.00 175.55 173.95 1ar8 s ALA 135 N 1.85 2.98 0.45 3.97 0.00 0.08 -0.99 121.76 130.10 1ar8 s ALA 135 Ca 0.05 -1.88 -0.22 0.00 0.00 0.00 0.00 51.96 49.91 1ar8 s ALA 135 Cb -0.12 -2.18 -0.11 0.00 0.00 0.00 0.00 23.12 20.71 1ar8 s ALA 135 CO -0.07 -1.39 0.75 -2.30 0.00 0.00 0.00 175.76 172.75 1ar8 n PRO 136 N 4.71 0.87 -0.45 0.00 -0.02 -1.26 -0.91 135.00 137.94 1ar8 n PRO 136 Ca -0.11 0.32 -0.28 0.00 -2.02 0.00 0.00 63.50 61.40 1ar8 n PRO 136 Cb 0.44 -1.77 0.27 0.00 -0.02 0.00 0.00 33.50 32.42 1ar8 n PRO 136 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1ar8 n PRO 137 N 0.24 -2.76 0.00 0.52 -0.04 -1.26 -4.56 135.00 127.15 1ar8 n PRO 137 Ca 0.11 -0.78 0.00 0.00 -0.04 0.00 0.00 63.50 62.79 1ar8 n PRO 137 Cb 0.41 -2.13 0.00 0.00 -0.04 0.00 0.00 33.50 31.73 1ar8 n PRO 137 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ar8 n GLY 138 N 1.13 1.25 3.72 0.55 0.00 -1.26 -5.00 105.19 105.59 1ar8 n GLY 138 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 1ar8 n GLY 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ar8 s ALA 139 N -2.16 3.97 -0.10 4.61 0.00 -1.26 -5.09 121.76 121.73 1ar8 s ALA 139 Ca 0.00 -0.35 -0.35 0.00 0.00 0.00 0.00 51.96 51.26 1ar8 s ALA 139 Cb 0.00 0.18 -0.12 0.00 0.00 0.00 0.00 23.12 23.17 1ar8 s ALA 139 CO 0.00 -0.08 1.86 -0.25 0.00 0.00 0.00 175.76 177.29 1ar8 n ASP 140 N -1.33 3.32 -4.67 0.00 8.00 -1.26 -4.92 116.55 115.69 1ar8 n ASP 140 Ca -0.18 0.99 -0.46 0.00 0.71 0.00 0.00 54.79 55.85 1ar8 n ASP 140 Cb 0.66 -1.35 -0.04 0.00 -0.02 0.00 0.00 41.12 40.38 1ar8 n ASP 140 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 1ar8 n PRO 141 N 6.42 2.22 -1.67 -0.24 -0.04 -1.26 -4.84 135.00 135.58 1ar8 n PRO 141 Ca 0.23 0.80 -0.46 0.00 -0.04 0.00 0.00 63.50 64.04 1ar8 n PRO 141 Cb 0.28 -2.60 -0.04 0.00 -0.04 0.00 0.00 33.50 31.11 1ar8 n PRO 141 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 1ar8 n PRO 142 N 4.15 2.09 0.00 0.54 -0.02 -1.26 -4.90 135.00 135.59 1ar8 n PRO 142 Ca 0.18 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.41 1ar8 n PRO 142 Cb 0.30 -2.47 0.00 0.00 -0.02 0.00 0.00 33.50 31.31 1ar8 n PRO 142 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1ar8 n LYS 143 N 2.80 3.21 -3.91 -0.52 4.76 -1.26 -4.97 118.16 118.26 1ar8 n LYS 143 Ca 0.15 -0.22 -0.11 0.00 -2.87 0.00 0.00 58.31 55.26 1ar8 n LYS 143 Cb 0.30 -0.71 -0.12 0.00 -1.84 0.00 0.00 35.03 32.65 1ar8 n LYS 143 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1ar8 s LYS 144 N -0.52 0.18 0.34 1.97 -0.14 -1.26 -4.22 119.74 116.09 1ar8 s LYS 144 Ca 0.00 -0.27 0.14 0.00 -1.36 0.00 0.00 55.97 54.48 1ar8 s LYS 144 Cb 0.00 0.07 1.02 0.00 -1.68 0.00 0.00 37.83 37.24 1ar8 s LYS 144 CO 0.00 -0.03 1.71 -0.09 -0.76 0.00 0.00 175.35 176.17 1ar8 h ARG 145 N 5.35 0.43 -0.43 1.68 2.43 -1.57 -1.29 114.38 120.98 1ar8 h ARG 145 Ca -0.28 -0.03 0.07 0.00 -0.81 0.00 0.00 59.98 58.94 1ar8 h ARG 145 Cb 1.21 -0.10 -0.06 0.00 -0.42 0.00 0.00 29.97 30.60 1ar8 h ARG 145 CO 0.45 0.28 0.06 -0.22 -1.51 0.00 0.00 179.97 179.03 1ar8 h LYS 146 N 0.44 0.17 0.02 0.20 3.64 -1.96 0.22 116.57 119.30 1ar8 h LYS 146 Ca 0.68 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 60.05 1ar8 h LYS 146 Cb 1.50 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.28 1ar8 h LYS 146 CO -0.49 0.11 -0.01 0.93 -2.27 0.00 0.00 179.45 177.72 1ar8 h GLU 147 N 0.18 -0.03 -0.97 1.90 3.07 -1.68 -3.27 114.58 113.78 1ar8 h GLU 147 Ca 0.21 0.00 0.13 0.00 -0.50 0.00 0.00 59.36 59.21 1ar8 h GLU 147 Cb 0.28 0.01 -0.08 0.00 -0.84 0.00 0.00 28.75 28.12 1ar8 h GLU 147 CO -0.30 0.35 0.61 0.00 -1.40 0.00 0.00 179.01 178.27 1ar8 h ALA 148 N 0.54 1.63 -0.92 3.43 0.00 -0.81 -1.76 119.26 121.38 1ar8 h ALA 148 Ca -0.00 0.02 0.14 0.00 0.00 0.00 0.00 54.91 55.07 1ar8 h ALA 148 Cb 0.40 -0.17 -0.08 0.00 0.00 0.00 0.00 17.79 17.94 1ar8 h ALA 148 CO 0.01 0.12 0.59 1.98 0.00 0.00 0.00 179.25 181.94 1ar8 h MET 149 N 0.89 0.73 0.00 0.00 1.85 -0.64 -2.78 114.93 114.98 1ar8 h MET 149 Ca 0.49 -0.04 0.00 0.00 -0.61 0.00 0.00 59.70 59.53 1ar8 h MET 149 Cb 0.59 -0.16 0.00 0.00 0.43 0.00 0.00 31.60 32.45 1ar8 h MET 149 CO -0.25 0.48 0.00 1.28 -0.40 0.00 0.00 176.91 178.02 1ar8 n LEU 150 N -4.59 0.38 0.00 3.39 4.77 -0.66 -4.79 117.00 115.50 1ar8 n LEU 150 Ca 0.18 0.61 0.00 0.00 -0.03 0.00 0.00 56.01 56.77 1ar8 n LEU 150 Cb 0.46 -0.58 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 1ar8 n LEU 150 CO 0.28 -0.52 0.00 0.61 -1.33 0.00 0.00 177.39 176.43 1ar8 n GLY 151 N -0.38 3.36 3.68 -0.72 0.00 -1.05 -5.06 105.19 105.03 1ar8 n GLY 151 Ca 0.02 -2.01 -0.42 0.00 0.00 0.00 0.00 46.02 43.60 1ar8 n GLY 151 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ar8 s THR 152 N 1.88 3.73 0.24 2.61 2.01 -0.16 -4.87 115.64 121.09 1ar8 s THR 152 Ca 0.00 1.07 -0.15 0.00 0.31 0.00 0.00 61.69 62.92 1ar8 s THR 152 Cb 0.00 -3.69 0.00 0.00 0.01 0.00 0.00 72.50 68.83 1ar8 s THR 152 CO 0.00 -0.02 0.52 -1.38 -0.69 0.00 0.00 174.62 173.05 1ar8 s HIS 153 N 2.73 0.21 -0.05 4.92 -3.43 -1.26 0.18 115.29 118.60 1ar8 s HIS 153 Ca 0.64 -0.59 0.01 0.00 -0.80 0.00 0.00 55.06 54.32 1ar8 s HIS 153 Cb -0.31 0.30 0.02 0.00 -1.43 0.00 0.00 32.58 31.16 1ar8 s HIS 153 CO 0.26 -1.02 -0.05 0.08 -2.00 0.00 0.00 174.74 172.01 1ar8 s VAL 154 N -3.98 0.57 -0.44 -5.38 1.01 -0.05 -4.99 120.40 107.13 1ar8 s VAL 154 Ca 0.19 -0.13 -0.19 0.00 0.00 0.00 0.00 61.98 61.85 1ar8 s VAL 154 Cb -0.02 -0.60 0.03 0.00 0.00 0.00 0.00 36.38 35.80 1ar8 s VAL 154 CO 0.07 0.24 0.53 -0.63 0.00 0.00 0.00 175.10 175.31 1ar8 s ILE 155 N 0.98 4.97 -0.26 2.22 1.01 -1.26 -0.84 121.20 128.02 1ar8 s ILE 155 Ca -0.10 -0.25 -0.25 0.00 0.00 0.00 0.00 60.65 60.04 1ar8 s ILE 155 Cb -0.14 -4.14 -0.00 0.00 0.01 0.00 0.00 42.46 38.18 1ar8 s ILE 155 CO -0.00 -0.55 0.87 0.86 0.00 0.00 0.00 174.94 176.11 1ar8 s TRP 156 N 2.43 3.28 -0.33 3.97 -0.00 0.48 -4.95 118.94 123.82 1ar8 s TRP 156 Ca 0.16 1.12 -0.12 0.00 -0.00 0.00 0.00 56.10 57.25 1ar8 s TRP 156 Cb -0.17 -3.17 -0.02 0.00 -0.00 0.00 0.00 33.47 30.11 1ar8 s TRP 156 CO 0.15 -0.47 0.23 0.34 -0.00 0.00 0.00 176.95 177.19 1ar8 s ASP 157 N 1.41 6.03 0.09 5.86 2.15 -1.26 -1.10 116.67 129.85 1ar8 s ASP 157 Ca 0.36 -0.33 -0.31 0.00 0.43 0.00 0.00 52.55 52.71 1ar8 s ASP 157 Cb -0.15 -2.13 -0.07 0.00 -0.30 0.00 0.00 42.92 40.27 1ar8 s ASP 157 CO 0.09 -0.19 1.37 -0.63 -0.17 0.00 0.00 175.17 175.63 1ar8 s ILE 158 N 1.73 3.48 0.00 4.11 1.01 0.16 -4.93 121.20 126.76 1ar8 s ILE 158 Ca 0.06 1.03 0.00 0.00 0.00 0.00 0.00 60.65 61.75 1ar8 s ILE 158 Cb -0.17 -3.66 0.00 0.00 0.01 0.00 0.00 42.46 38.64 1ar8 s ILE 158 CO 0.10 0.07 0.00 0.61 0.00 0.00 0.00 174.94 175.72 1ar8 n GLY 159 N 3.48 2.08 0.19 6.18 0.00 -1.26 -4.46 105.19 111.40 1ar8 n GLY 159 Ca 0.11 -0.33 -0.04 0.00 0.00 0.00 0.00 46.02 45.76 1ar8 n GLY 159 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1ar8 h LEU 160 N 0.00 0.15 -8.61 0.99 3.38 -1.98 -3.32 115.31 105.92 1ar8 h LEU 160 Ca 0.00 0.05 -0.53 0.00 0.09 0.00 0.00 57.88 57.49 1ar8 h LEU 160 Cb 0.00 0.04 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 1ar8 h LEU 160 CO 0.00 0.12 1.24 -1.10 0.09 0.00 0.00 178.44 178.79 1ar8 s GLN 161 N -6.14 3.04 0.47 1.13 -1.52 -1.26 -4.83 119.66 110.55 1ar8 s GLN 161 Ca -0.13 0.74 0.15 0.00 -1.95 0.00 0.00 55.36 54.17 1ar8 s GLN 161 Cb 0.14 -4.25 1.12 0.00 -0.22 0.00 0.00 33.01 29.80 1ar8 s GLN 161 CO 0.72 -2.24 2.04 0.66 -0.25 0.00 0.00 175.29 176.22 1ar8 h SER 162 N 13.06 0.23 -2.22 5.90 4.64 -1.95 -3.45 113.55 129.74 1ar8 h SER 162 Ca -0.28 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.44 1ar8 h SER 162 Cb 1.14 -0.05 -0.14 0.00 -0.31 0.00 0.00 62.40 63.04 1ar8 h SER 162 CO 1.16 0.15 -0.75 -0.44 -0.87 0.00 0.00 176.83 176.08 1ar8 s SER 163 N -6.53 3.56 -0.01 4.97 0.01 -1.26 -2.50 113.70 111.94 1ar8 s SER 163 Ca -0.07 -1.04 0.01 0.00 1.31 0.00 0.00 55.95 56.16 1ar8 s SER 163 Cb 0.19 -0.30 0.01 0.00 0.21 0.00 0.00 66.02 66.12 1ar8 s SER 163 CO 0.72 0.01 -0.03 0.00 0.41 0.00 0.00 173.24 174.35 1ar8 s THR 165 N 0.27 3.82 -0.19 0.00 2.01 -1.26 -0.78 115.64 119.51 1ar8 s THR 165 Ca -0.03 -0.37 -0.05 0.00 0.31 0.00 0.00 61.69 61.56 1ar8 s THR 165 Cb -0.06 -2.70 -0.03 0.00 0.01 0.00 0.00 72.50 69.73 1ar8 s THR 165 CO -0.00 0.46 -0.01 -0.32 -0.69 0.00 0.00 174.62 174.05 1ar8 s MET 166 N 0.75 3.63 -0.14 4.92 1.75 0.55 -4.98 119.30 125.79 1ar8 s MET 166 Ca -0.01 -0.52 -0.18 0.00 -1.25 0.00 0.00 55.69 53.73 1ar8 s MET 166 Cb -0.14 -3.02 -0.04 0.00 2.84 0.00 0.00 34.83 34.46 1ar8 s MET 166 CO 0.02 0.09 0.47 0.08 -0.65 0.00 0.00 175.02 175.03 1ar8 s VAL 167 N 0.79 5.18 -0.57 10.11 1.01 -1.26 -1.03 120.40 134.63 1ar8 s VAL 167 Ca -0.00 0.92 -0.18 0.00 0.00 0.00 0.00 61.98 62.72 1ar8 s VAL 167 Cb -0.14 -3.81 0.10 0.00 0.00 0.00 0.00 36.38 32.53 1ar8 s VAL 167 CO 0.02 0.30 0.66 -0.69 0.00 0.00 0.00 175.10 175.39 1ar8 s VAL 168 N 0.80 4.89 0.42 2.92 1.01 0.62 -5.00 120.40 126.06 1ar8 s VAL 168 Ca 0.25 -1.02 -0.24 0.00 0.00 0.00 0.00 61.98 60.96 1ar8 s VAL 168 Cb -0.15 -4.44 -0.08 0.00 0.00 0.00 0.00 36.38 31.71 1ar8 s VAL 168 CO 0.10 -1.05 1.16 -2.16 0.00 0.00 0.00 175.10 173.15 1ar8 s PRO 169 N 2.50 3.95 -0.35 2.72 0.04 -1.26 -1.89 135.00 140.72 1ar8 s PRO 169 Ca 0.10 1.81 -0.27 0.00 0.04 0.00 0.00 61.00 62.68 1ar8 s PRO 169 Cb -0.25 -2.58 -0.06 0.00 0.04 0.00 0.00 34.50 31.66 1ar8 s PRO 169 CO 0.06 -0.40 2.31 1.87 0.04 0.00 0.00 177.00 180.89 1ar8 n TRP 170 N -0.13 1.71 -3.83 0.56 -0.00 -1.26 -4.89 117.44 109.61 1ar8 n TRP 170 Ca 0.05 -0.01 -0.30 0.00 -0.00 0.00 0.00 57.50 57.25 1ar8 n TRP 170 Cb 0.47 -2.68 -0.15 0.00 -0.00 0.00 0.00 31.31 28.95 1ar8 n TRP 170 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 177.69 178.11 1ar8 s ILE 171 N 10.03 1.23 0.01 5.87 1.01 -1.26 -5.01 121.20 133.08 1ar8 s ILE 171 Ca 1.00 -1.47 -0.06 0.00 0.00 0.00 0.00 60.65 60.12 1ar8 s ILE 171 Cb -0.28 -1.83 -0.00 0.00 0.01 0.00 0.00 42.46 40.35 1ar8 s ILE 171 CO 0.32 -0.52 0.11 -0.55 0.00 0.00 0.00 174.94 174.30 1ar8 s SER 172 N 1.46 0.07 -0.09 3.58 0.15 -1.26 -4.96 113.70 112.65 1ar8 s SER 172 Ca 0.06 -0.28 -0.27 0.00 0.70 0.00 0.00 55.95 56.16 1ar8 s SER 172 Cb -0.18 0.20 -0.23 0.00 -1.71 0.00 0.00 66.02 64.10 1ar8 s SER 172 CO -0.17 -0.38 0.94 -0.55 1.20 0.00 0.00 173.24 174.28 1ar8 h ASN 173 N 4.23 -0.01 -4.25 5.45 -1.07 -1.94 -3.46 115.58 114.52 1ar8 h ASN 173 Ca -0.31 -0.75 -0.50 0.00 0.07 0.00 0.00 56.30 54.81 1ar8 h ASN 173 Cb 1.19 0.00 0.06 0.00 -2.07 0.00 0.00 38.32 37.51 1ar8 h ASN 173 CO 0.42 0.76 0.38 0.42 0.07 0.00 0.00 177.43 179.48 1ar8 s THR 174 N -3.03 4.12 0.09 6.14 -4.23 -1.26 -4.96 115.64 112.50 1ar8 s THR 174 Ca -0.17 0.88 0.17 0.00 -1.18 0.00 0.00 61.69 61.39 1ar8 s THR 174 Cb -0.01 -3.51 0.10 0.00 1.34 0.00 0.00 72.50 70.42 1ar8 s THR 174 CO 0.66 -0.72 1.64 0.71 -0.54 0.00 0.00 174.62 176.37 1ar8 h THR 175 N 0.13 0.92 -3.95 3.99 1.35 -1.97 -3.44 112.91 109.94 1ar8 h THR 175 Ca -0.46 -1.79 -0.22 0.00 -0.55 0.00 0.00 66.41 63.40 1ar8 h THR 175 Cb 1.21 2.10 -0.22 0.00 -1.73 0.00 0.00 68.15 69.50 1ar8 h THR 175 CO 0.59 0.43 -0.72 -0.31 -0.25 0.00 0.00 175.52 175.26 1ar8 s TYR 176 N -3.40 0.37 0.22 4.73 1.51 -1.26 -4.80 117.35 114.72 1ar8 s TYR 176 Ca 0.01 -0.44 0.05 0.00 -1.01 0.00 0.00 57.07 55.68 1ar8 s TYR 176 Cb 0.10 -0.24 -0.03 0.00 -0.11 0.00 0.00 41.96 41.68 1ar8 s TYR 176 CO 0.71 -0.13 0.30 1.03 -1.11 0.00 0.00 175.55 176.35 1ar8 s ARG 177 N -1.27 3.29 0.36 -0.62 0.52 0.40 -4.90 118.95 116.74 1ar8 s ARG 177 Ca -0.11 -0.81 -0.16 0.00 -0.52 0.00 0.00 55.73 54.12 1ar8 s ARG 177 Cb -0.09 -2.81 -0.09 0.00 0.52 0.00 0.00 34.95 32.48 1ar8 s ARG 177 CO -0.00 0.44 0.80 -0.65 0.02 0.00 0.00 175.30 175.90 1ar8 s GLN 178 N -3.79 4.05 -0.09 3.54 -0.21 -1.26 -0.97 119.66 120.93 1ar8 s GLN 178 Ca 0.34 0.78 0.00 0.00 0.02 0.00 0.00 55.36 56.50 1ar8 s GLN 178 Cb -0.09 -2.36 0.11 0.00 1.00 0.00 0.00 33.01 31.67 1ar8 s GLN 178 CO 0.28 0.09 1.36 0.25 -2.12 0.00 0.00 175.29 175.14 1ar8 n THR 179 N -0.52 1.60 -4.07 -0.19 -2.24 -0.34 -4.80 114.28 103.71 1ar8 n THR 179 Ca 0.04 -0.47 -0.07 0.00 -2.27 0.00 0.00 64.05 61.28 1ar8 n THR 179 Cb 0.53 -1.04 -0.10 0.00 -2.10 0.00 0.00 70.33 67.63 1ar8 n THR 179 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 1ar8 s ILE 180 N -0.64 0.21 0.03 2.28 -4.36 -1.26 -4.25 121.20 113.22 1ar8 s ILE 180 Ca 0.10 -1.72 -0.30 0.00 -0.26 0.00 0.00 60.65 58.47 1ar8 s ILE 180 Cb 0.08 -1.43 -0.08 0.00 1.25 0.00 0.00 42.46 42.28 1ar8 s ILE 180 CO 0.01 -0.95 1.88 -1.81 0.24 0.00 0.00 174.94 174.32 1ar8 s ASP 181 N -2.82 6.49 -0.30 4.36 1.01 -1.26 -4.91 116.67 119.24 1ar8 s ASP 181 Ca 0.05 2.60 -0.08 0.00 0.71 0.00 0.00 52.55 55.84 1ar8 s ASP 181 Cb 0.07 -2.54 0.14 0.00 1.01 0.00 0.00 42.92 41.60 1ar8 s ASP 181 CO -0.09 -1.02 0.64 -0.62 0.21 0.00 0.00 175.17 174.28 1ar8 s ASP 182 N 3.95 -1.19 0.29 0.27 2.15 -1.26 -5.05 116.67 115.83 1ar8 s ASP 182 Ca 0.84 1.42 0.04 0.00 0.43 0.00 0.00 52.55 55.29 1ar8 s ASP 182 Cb -0.41 2.26 0.70 0.00 -0.30 0.00 0.00 42.92 45.17 1ar8 s ASP 182 CO 0.38 -0.23 1.77 0.28 -0.17 0.00 0.00 175.17 177.21 1ar8 h SER 183 N 8.00 0.73 -0.22 -0.34 0.02 -1.98 -1.24 113.55 118.53 1ar8 h SER 183 Ca -0.19 0.10 -0.03 0.00 -0.84 0.00 0.00 61.79 60.83 1ar8 h SER 183 Cb 1.11 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 63.60 1ar8 h SER 183 CO 0.13 0.27 0.07 0.15 -1.14 0.00 0.00 176.83 176.31 1ar8 h PHE 184 N 0.74 0.42 -0.47 3.45 3.57 -2.00 -2.75 116.94 119.90 1ar8 h PHE 184 Ca 0.56 -0.02 -0.30 0.00 3.53 0.00 0.00 57.97 61.73 1ar8 h PHE 184 Cb 0.85 -0.13 -0.20 0.00 2.79 0.00 0.00 35.95 39.26 1ar8 h PHE 184 CO -0.02 0.38 -0.25 0.25 -2.23 0.00 0.00 178.31 176.43 1ar8 n THR 185 N -4.37 2.61 -1.92 4.41 -2.24 -0.55 -4.91 114.28 107.32 1ar8 n THR 185 Ca 0.01 -3.25 -0.38 0.00 -2.27 0.00 0.00 64.05 58.16 1ar8 n THR 185 Cb 0.17 -0.61 0.03 0.00 -2.10 0.00 0.00 70.33 67.82 1ar8 n THR 185 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1ar8 s GLU 186 N -3.41 3.26 -0.00 -0.78 -1.05 -0.72 -4.67 118.70 111.32 1ar8 s GLU 186 Ca 0.47 2.08 0.12 0.00 -0.15 0.00 0.00 54.97 57.50 1ar8 s GLU 186 Cb 0.41 -2.25 -0.14 0.00 -0.44 0.00 0.00 34.13 31.71 1ar8 s GLU 186 CO -0.00 -1.05 0.46 0.41 0.95 0.00 0.00 175.26 176.03 1ar8 n GLY 187 N 0.65 -0.22 0.00 -3.83 0.00 -1.25 -4.79 105.19 95.75 1ar8 n GLY 187 Ca 0.10 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.79 1ar8 n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ar8 n GLY 188 N 1.38 -0.57 2.98 -0.02 0.00 -1.26 -4.20 105.19 103.50 1ar8 n GLY 188 Ca 0.01 -2.18 -0.26 0.00 0.00 0.00 0.00 46.02 43.58 1ar8 n GLY 188 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ar8 s TYR 189 N 0.00 1.60 -0.16 1.61 2.02 -0.08 -0.91 117.35 121.43 1ar8 s TYR 189 Ca 0.00 -0.73 -0.10 0.00 -0.37 0.00 0.00 57.07 55.87 1ar8 s TYR 189 Cb 0.00 -1.23 -0.05 0.00 -0.40 0.00 0.00 41.96 40.29 1ar8 s TYR 189 CO 0.00 -0.43 0.18 0.42 -1.57 0.00 0.00 175.55 174.15 1ar8 s ILE 190 N 1.18 5.40 0.01 2.71 1.09 0.16 -0.74 121.20 131.00 1ar8 s ILE 190 Ca -0.04 0.30 -0.15 0.00 -1.10 0.00 0.00 60.65 59.65 1ar8 s ILE 190 Cb -0.14 -3.49 0.02 0.00 -1.06 0.00 0.00 42.46 37.79 1ar8 s ILE 190 CO -0.03 0.49 0.33 -0.94 -0.10 0.00 0.00 174.94 174.69 1ar8 s SER 191 N -0.11 -0.20 -0.02 3.58 1.04 -0.41 -0.31 113.70 117.27 1ar8 s SER 191 Ca 0.13 0.02 0.06 0.00 0.48 0.00 0.00 55.95 56.63 1ar8 s SER 191 Cb -0.12 0.34 -0.01 0.00 0.10 0.00 0.00 66.02 66.33 1ar8 s SER 191 CO 0.02 -0.53 -0.20 -0.69 0.98 0.00 0.00 173.24 172.82 1ar8 s VAL 192 N -1.80 1.57 0.13 5.02 1.01 -0.90 -0.79 120.40 124.63 1ar8 s VAL 192 Ca -0.10 -0.84 0.03 0.00 0.00 0.00 0.00 61.98 61.06 1ar8 s VAL 192 Cb -0.03 -1.31 -0.04 0.00 0.00 0.00 0.00 36.38 34.99 1ar8 s VAL 192 CO 0.02 0.44 -0.07 -0.36 0.00 0.00 0.00 175.10 175.13 1ar8 s PHE 193 N -0.40 1.09 -0.26 5.22 0.40 0.04 0.27 117.98 124.33 1ar8 s PHE 193 Ca 0.06 -0.87 -0.29 0.00 -0.60 0.00 0.00 56.93 55.23 1ar8 s PHE 193 Cb -0.08 -0.59 0.01 0.00 0.51 0.00 0.00 43.02 42.86 1ar8 s PHE 193 CO -0.00 -0.06 1.09 0.71 0.70 0.00 0.00 175.22 177.65 1ar8 s TYR 194 N -3.51 3.19 -0.08 0.36 2.02 -1.26 -0.44 117.35 117.63 1ar8 s TYR 194 Ca 0.15 1.30 -0.27 0.00 -0.37 0.00 0.00 57.07 57.89 1ar8 s TYR 194 Cb 0.04 -3.47 -0.24 0.00 -0.40 0.00 0.00 41.96 37.90 1ar8 s TYR 194 CO -0.01 -0.76 0.99 0.37 -1.57 0.00 0.00 175.55 174.56 1ar8 h GLN 195 N 7.83 0.05 0.00 -0.62 5.75 -0.80 -3.45 115.11 123.87 1ar8 h GLN 195 Ca -0.21 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.25 1ar8 h GLN 195 Cb 1.07 0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.63 1ar8 h GLN 195 CO 1.00 0.83 0.00 0.25 -2.65 0.00 0.00 178.83 178.26 1ar8 n THR 196 N -4.66 0.00 -3.61 2.39 -2.24 -1.05 -5.02 114.28 100.09 1ar8 n THR 196 Ca -0.09 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 61.63 1ar8 n THR 196 Cb 0.42 -0.02 -0.02 0.00 -2.10 0.00 0.00 70.33 68.62 1ar8 n THR 196 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ar8 s ARG 197 N 0.87 0.90 0.02 -0.78 1.70 -1.26 -4.40 118.95 115.99 1ar8 s ARG 197 Ca 0.00 -0.42 -0.30 0.00 -0.47 0.00 0.00 55.73 54.54 1ar8 s ARG 197 Cb 0.00 0.36 -0.04 0.00 -0.57 0.00 0.00 34.95 34.70 1ar8 s ARG 197 CO 0.00 -0.40 1.05 0.42 -1.08 0.00 0.00 175.30 175.29 1ar8 s ILE 198 N -3.09 4.61 -0.10 4.99 -1.09 -1.26 -4.16 121.20 121.10 1ar8 s ILE 198 Ca 0.09 1.87 0.03 0.00 -2.23 0.00 0.00 60.65 60.41 1ar8 s ILE 198 Cb -0.01 -4.20 0.01 0.00 -1.58 0.00 0.00 42.46 36.68 1ar8 s ILE 198 CO -0.04 0.14 -0.19 -0.69 -1.23 0.00 0.00 174.94 172.94 1ar8 s VAL 199 N 1.03 1.71 0.18 2.92 1.01 -0.45 -4.27 120.40 122.52 1ar8 s VAL 199 Ca 0.54 -0.79 0.09 0.00 0.00 0.00 0.00 61.98 61.82 1ar8 s VAL 199 Cb -0.24 -1.52 -0.04 0.00 0.00 0.00 0.00 36.38 34.58 1ar8 s VAL 199 CO 0.28 0.48 -0.20 0.68 0.00 0.00 0.00 175.10 176.35 1ar8 s VAL 200 N 0.69 1.99 0.20 2.92 -7.23 -1.26 -1.23 120.40 116.48 1ar8 s VAL 200 Ca -0.12 -1.99 -0.03 0.00 -1.81 0.00 0.00 61.98 58.02 1ar8 s VAL 200 Cb -0.16 -1.95 0.05 0.00 0.56 0.00 0.00 36.38 34.88 1ar8 s VAL 200 CO 0.03 -0.28 0.25 -0.81 -0.31 0.00 0.00 175.10 173.98 1ar8 n PRO 201 N 0.20 -0.49 -1.70 4.82 -0.04 -1.26 -5.04 135.00 131.49 1ar8 n PRO 201 Ca -0.12 -0.39 -0.29 0.00 -0.04 0.00 0.00 63.50 62.65 1ar8 n PRO 201 Cb 0.57 -0.28 0.15 0.00 -0.04 0.00 0.00 33.50 33.90 1ar8 n PRO 201 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1ar8 s LEU 202 N 0.00 2.21 -0.58 1.53 1.43 -1.26 -3.75 118.68 118.26 1ar8 s LEU 202 Ca 0.15 0.70 0.00 0.00 -1.03 0.00 0.00 54.13 53.94 1ar8 s LEU 202 Cb -0.01 -2.93 0.00 0.00 0.03 0.00 0.00 46.19 43.28 1ar8 s LEU 202 CO 0.10 -2.57 0.00 -1.20 0.23 0.00 0.00 176.35 172.91 1ar8 n SER 203 N -3.74 -5.87 -4.43 2.29 7.64 -1.26 -4.90 113.62 103.35 1ar8 n SER 203 Ca 0.10 0.13 -0.31 0.00 1.01 0.00 0.00 58.87 59.80 1ar8 n SER 203 Cb 0.60 -3.85 -0.13 0.00 -1.01 0.00 0.00 64.21 59.82 1ar8 n SER 203 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1ar8 s THR 204 N -1.46 2.67 0.29 0.44 2.01 -1.25 -5.11 115.64 113.24 1ar8 s THR 204 Ca 0.00 -1.14 -0.30 0.00 0.31 0.00 0.00 61.69 60.56 1ar8 s THR 204 Cb 0.00 -2.09 -0.11 0.00 0.01 0.00 0.00 72.50 70.31 1ar8 s THR 204 CO 0.00 0.40 1.60 -2.84 -0.69 0.00 0.00 174.62 173.09 1ar8 s PRO 205 N -1.23 4.12 0.00 4.92 0.02 -1.26 -4.94 135.00 136.63 1ar8 s PRO 205 Ca 0.13 2.59 0.25 0.00 0.02 0.00 0.00 61.00 63.99 1ar8 s PRO 205 Cb -0.10 -3.02 0.46 0.00 0.02 0.00 0.00 34.50 31.85 1ar8 s PRO 205 CO 0.04 -0.64 1.38 0.54 -0.33 0.00 0.00 177.00 177.98 1ar8 n ARG 206 N 2.19 0.47 -4.36 5.54 1.74 -1.26 -4.87 116.66 116.11 1ar8 n ARG 206 Ca 0.08 -0.31 -0.24 0.00 -0.77 0.00 0.00 57.85 56.62 1ar8 n ARG 206 Cb 0.37 -1.49 -0.13 0.00 -1.02 0.00 0.00 32.46 30.19 1ar8 n ARG 206 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1ar8 s GLU 207 N -2.74 1.14 0.26 5.56 2.02 -1.26 -1.12 118.70 122.56 1ar8 s GLU 207 Ca 0.17 -1.08 -0.21 0.00 0.02 0.00 0.00 54.97 53.87 1ar8 s GLU 207 Cb 0.18 -1.35 0.03 0.00 0.10 0.00 0.00 34.13 33.09 1ar8 s GLU 207 CO 0.63 0.32 0.70 0.00 0.02 0.00 0.00 175.26 176.94 1ar8 s MET 208 N -1.70 1.69 0.06 1.61 0.23 -0.71 -4.99 119.30 115.50 1ar8 s MET 208 Ca 0.06 -0.89 0.04 0.00 -1.03 0.00 0.00 55.69 53.87 1ar8 s MET 208 Cb -0.10 0.60 -0.04 0.00 -1.53 0.00 0.00 34.83 33.77 1ar8 s MET 208 CO 0.03 -0.77 -0.01 -0.51 -2.03 0.00 0.00 175.02 171.74 1ar8 s ASP 209 N -2.89 5.00 0.16 -1.18 1.01 -1.26 0.11 116.67 117.62 1ar8 s ASP 209 Ca 0.09 -0.14 0.10 0.00 0.71 0.00 0.00 52.55 53.32 1ar8 s ASP 209 Cb -0.05 -1.21 -0.04 0.00 1.01 0.00 0.00 42.92 42.63 1ar8 s ASP 209 CO 0.03 0.21 -0.21 0.27 0.21 0.00 0.00 175.17 175.68 1ar8 s ILE 210 N -1.23 2.57 0.14 0.77 -4.36 -0.00 -0.80 121.20 118.28 1ar8 s ILE 210 Ca 0.24 -1.81 0.11 0.00 -0.26 0.00 0.00 60.65 58.93 1ar8 s ILE 210 Cb -0.12 -2.21 -0.04 0.00 1.25 0.00 0.00 42.46 41.34 1ar8 s ILE 210 CO 0.16 -0.03 -0.26 -0.76 0.24 0.00 0.00 174.94 174.29 1ar8 s LEU 211 N -2.46 2.35 0.05 0.37 1.43 -0.38 -1.45 118.68 118.59 1ar8 s LEU 211 Ca 0.19 -0.76 0.06 0.00 -1.03 0.00 0.00 54.13 52.60 1ar8 s LEU 211 Cb -0.09 -1.23 -0.02 0.00 0.03 0.00 0.00 46.19 44.88 1ar8 s LEU 211 CO 0.10 0.17 -0.18 -0.83 0.23 0.00 0.00 176.35 175.84 1ar8 s GLY 212 N -2.15 0.99 0.04 -3.19 0.00 -1.26 -0.25 107.32 101.49 1ar8 s GLY 212 Ca 0.15 -0.99 0.04 0.00 0.00 0.00 0.00 44.72 43.92 1ar8 s GLY 212 CO 0.07 -0.94 -0.11 -1.36 0.00 0.00 0.00 173.10 170.75 1ar8 s PHE 213 N -0.88 0.99 -0.00 1.90 0.40 0.48 -0.51 117.98 120.36 1ar8 s PHE 213 Ca 0.05 -0.36 0.06 0.00 -0.60 0.00 0.00 56.93 56.08 1ar8 s PHE 213 Cb -0.09 -0.59 -0.02 0.00 0.51 0.00 0.00 43.02 42.84 1ar8 s PHE 213 CO 0.02 0.00 -0.19 0.54 0.70 0.00 0.00 175.22 176.29 1ar8 s VAL 214 N -0.91 1.49 0.10 -0.44 0.11 -0.86 -0.80 120.40 119.09 1ar8 s VAL 214 Ca -0.01 -0.88 -0.13 0.00 -2.93 0.00 0.00 61.98 58.03 1ar8 s VAL 214 Cb -0.08 -1.25 0.02 0.00 -1.53 0.00 0.00 36.38 33.54 1ar8 s VAL 214 CO 0.01 0.36 0.29 -0.94 -3.33 0.00 0.00 175.10 171.49 1ar8 s SER 215 N -0.60 -0.06 0.28 3.54 1.04 -0.89 -2.35 113.70 114.66 1ar8 s SER 215 Ca 0.07 -0.44 -0.20 0.00 0.48 0.00 0.00 55.95 55.86 1ar8 s SER 215 Cb -0.07 0.40 -0.09 0.00 0.10 0.00 0.00 66.02 66.35 1ar8 s SER 215 CO -0.00 -0.76 0.80 0.00 0.98 0.00 0.00 173.24 174.26 1ar8 s ALA 216 N -3.61 3.31 0.69 5.32 0.00 0.13 -1.06 121.76 126.54 1ar8 s ALA 216 Ca 0.02 0.25 -0.11 0.00 0.00 0.00 0.00 51.96 52.12 1ar8 s ALA 216 Cb 0.03 -2.93 0.00 0.00 0.00 0.00 0.00 23.12 20.22 1ar8 s ALA 216 CO -0.10 0.27 1.08 0.00 0.00 0.00 0.00 175.76 177.01 1ar8 n ASN 218 N -2.96 0.00 -1.23 0.00 2.04 -1.26 -1.80 115.26 110.06 1ar8 n ASN 218 Ca 0.07 0.22 0.09 0.00 -0.44 0.00 0.00 54.58 54.52 1ar8 n ASN 218 Cb 0.56 -0.23 0.29 0.00 -2.53 0.00 0.00 39.78 37.88 1ar8 n ASN 218 CO 0.00 0.00 0.00 -0.90 -0.44 0.00 0.00 177.26 175.92 1ar8 n ASP 219 N -1.23 3.98 -4.81 0.53 5.75 -1.26 -4.98 116.55 114.54 1ar8 n ASP 219 Ca 0.00 -2.23 -0.38 0.00 -0.01 0.00 0.00 54.79 52.18 1ar8 n ASP 219 Cb 0.00 -0.46 -0.06 0.00 -1.03 0.00 0.00 41.12 39.57 1ar8 n ASP 219 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 1ar8 s PHE 220 N -1.43 3.66 0.15 2.11 2.19 -0.74 -4.29 117.98 119.63 1ar8 s PHE 220 Ca 0.43 0.93 -0.08 0.00 0.33 0.00 0.00 56.93 58.54 1ar8 s PHE 220 Cb 0.25 -2.34 -0.01 0.00 -1.31 0.00 0.00 43.02 39.62 1ar8 s PHE 220 CO 0.24 0.52 0.23 -1.54 1.83 0.00 0.00 175.22 176.51 1ar8 s SER 221 N -0.62 0.10 0.07 6.13 1.04 0.63 -4.98 113.70 116.07 1ar8 s SER 221 Ca 0.23 -0.89 0.03 0.00 0.48 0.00 0.00 55.95 55.80 1ar8 s SER 221 Cb -0.16 0.40 -0.03 0.00 0.10 0.00 0.00 66.02 66.33 1ar8 s SER 221 CO 0.12 -0.84 -0.08 0.68 0.98 0.00 0.00 173.24 174.09 1ar8 s VAL 222 N -3.96 0.70 0.28 5.02 -7.23 -1.26 -1.47 120.40 112.47 1ar8 s VAL 222 Ca 0.16 -1.43 -0.11 0.00 -1.81 0.00 0.00 61.98 58.79 1ar8 s VAL 222 Cb 0.04 -1.07 0.00 0.00 0.56 0.00 0.00 36.38 35.91 1ar8 s VAL 222 CO -0.01 -0.54 0.49 0.00 -0.31 0.00 0.00 175.10 174.73 1ar8 s ARG 223 N -2.43 1.66 -0.40 4.82 1.70 -0.41 -5.01 118.95 118.88 1ar8 s ARG 223 Ca -0.01 -1.37 -0.16 0.00 -0.47 0.00 0.00 55.73 53.72 1ar8 s ARG 223 Cb -0.05 0.47 0.02 0.00 -0.57 0.00 0.00 34.95 34.83 1ar8 s ARG 223 CO -0.01 -0.70 0.49 -0.11 -1.08 0.00 0.00 175.30 173.89 1ar8 n LEU 224 N -0.43 -6.98 -4.65 -1.89 0.00 -1.26 -1.47 117.00 100.32 1ar8 n LEU 224 Ca -0.02 0.58 -0.45 0.00 0.00 0.00 0.00 56.01 56.13 1ar8 n LEU 224 Cb 0.62 -3.06 -0.02 0.00 0.00 0.00 0.00 43.42 40.96 1ar8 n LEU 224 CO 0.24 -2.12 0.85 -0.11 0.00 0.00 0.00 177.39 176.25 1ar8 n LEU 225 N -0.05 2.73 -3.73 -1.96 7.94 -1.26 -0.56 117.00 120.11 1ar8 n LEU 225 Ca 0.06 1.17 -0.10 0.00 -1.11 0.00 0.00 56.01 56.03 1ar8 n LEU 225 Cb 0.42 -1.38 -0.05 0.00 0.53 0.00 0.00 43.42 42.93 1ar8 n LEU 225 CO 0.47 -0.80 0.08 0.00 -1.11 0.00 0.00 177.39 176.03 1ar8 s ARG 226 N -1.06 1.03 0.42 1.96 1.70 0.66 -4.84 118.95 118.82 1ar8 s ARG 226 Ca 0.63 -0.82 -0.24 0.00 -0.47 0.00 0.00 55.73 54.83 1ar8 s ARG 226 Cb -0.67 0.43 -0.08 0.00 -0.57 0.00 0.00 34.95 34.06 1ar8 s ARG 226 CO 0.56 -0.39 1.12 -0.51 -1.08 0.00 0.00 175.30 175.00 1ar8 s ASP 227 N -2.84 6.48 0.42 -2.89 1.01 -1.26 -4.39 116.67 113.20 1ar8 s ASP 227 Ca 0.05 2.21 -0.07 0.00 0.71 0.00 0.00 52.55 55.45 1ar8 s ASP 227 Cb 0.03 -2.60 -0.05 0.00 1.01 0.00 0.00 42.92 41.31 1ar8 s ASP 227 CO -0.10 -0.70 0.75 0.28 0.21 0.00 0.00 175.17 175.61 1ar8 s THR 228 N -1.56 4.87 -2.45 -1.27 -1.32 -1.23 -4.82 115.64 107.87 1ar8 s THR 228 Ca 0.60 0.36 0.26 0.00 -1.21 0.00 0.00 61.69 61.69 1ar8 s THR 228 Cb -0.27 -3.79 0.31 0.00 -1.51 0.00 0.00 72.50 67.24 1ar8 s THR 228 CO 0.33 -0.64 1.47 0.35 -2.21 0.00 0.00 174.62 173.91 1ar8 n THR 229 N -1.68 0.00 1.83 5.08 -2.24 -1.26 -4.45 114.28 111.55 1ar8 n THR 229 Ca 0.01 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.49 1ar8 n THR 229 Cb 0.54 0.90 0.01 0.00 -2.10 0.00 0.00 70.33 69.68 1ar8 n THR 229 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1ar8 n HIS 230 N 0.35 0.04 -3.57 4.78 8.25 -1.26 -4.72 115.22 119.09 1ar8 n HIS 230 Ca 0.15 -0.02 -0.17 0.00 -0.26 0.00 0.00 57.72 57.42 1ar8 n HIS 230 Cb 0.44 -0.01 -0.07 0.00 1.12 0.00 0.00 29.99 31.48 1ar8 n HIS 230 CO 0.00 0.00 0.00 -1.50 0.64 0.00 0.00 176.34 175.48 1ar8 s ILE 231 N -1.89 0.01 0.32 1.59 1.10 -1.26 -5.18 121.20 115.89 1ar8 s ILE 231 Ca 0.02 -0.10 -0.16 0.00 -0.51 0.00 0.00 60.65 59.91 1ar8 s ILE 231 Cb 0.01 -0.92 0.03 0.00 0.15 0.00 0.00 42.46 41.73 1ar8 s ILE 231 CO 0.01 -0.05 0.67 -1.83 -2.11 0.00 0.00 174.94 171.63 1ar8 s GLU 232 N -1.18 1.91 -0.33 3.50 -1.05 -1.26 -4.95 118.70 115.34 1ar8 s GLU 232 Ca -0.11 -1.28 0.17 0.00 -0.15 0.00 0.00 54.97 53.60 1ar8 s GLU 232 Cb -0.01 0.57 0.44 0.00 -0.44 0.00 0.00 34.13 34.69 1ar8 s GLU 232 CO 0.09 -0.86 0.92 0.94 0.95 0.00 0.00 175.26 177.29 1ar8 n GLN 233 N -0.48 1.13 -1.48 -4.83 7.27 -1.26 -5.06 117.38 112.67 1ar8 n GLN 233 Ca -0.05 -3.28 -0.40 0.00 0.07 0.00 0.00 57.00 53.35 1ar8 n GLN 233 Cb 0.60 -1.32 -0.15 0.00 2.41 0.00 0.00 30.24 31.78 1ar8 n GLN 233 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76 1ar8 n LYS 234 N -0.01 0.00 -0.86 3.69 4.76 -1.26 -5.38 118.16 119.10 1ar8 n LYS 234 Ca 0.12 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.56 1ar8 n LYS 234 Cb 0.79 -1.46 0.00 0.00 -1.84 0.00 0.00 35.03 32.52 1ar8 n LYS 234 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03