#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nx5 n ASN 2 N 0.00 -7.40 -4.13 1.69 4.13 -1.26 -3.98 115.26 104.30 2nx5 n ASN 2 Ca 0.00 0.96 -0.33 0.00 1.68 0.00 0.00 54.58 56.89 2nx5 n ASN 2 Cb 0.00 -3.77 -0.16 0.00 -1.54 0.00 0.00 39.78 34.31 2nx5 n ASN 2 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2nx5 s ILE 3 N -1.42 2.22 -0.11 2.41 1.01 -1.26 -2.26 121.20 121.79 2nx5 s ILE 3 Ca 0.02 -1.03 -0.02 0.00 0.00 0.00 0.00 60.65 59.62 2nx5 s ILE 3 Cb -0.00 -2.02 -0.03 0.00 0.01 0.00 0.00 42.46 40.42 2nx5 s ILE 3 CO 0.48 0.41 -0.03 -0.62 0.00 0.00 0.00 174.94 175.18 2nx5 s ASP 4 N 1.27 4.89 -0.16 3.58 2.15 0.17 -4.55 116.67 124.02 2nx5 s ASP 4 Ca 0.02 -0.02 -0.27 0.00 0.43 0.00 0.00 52.55 52.71 2nx5 s ASP 4 Cb -0.14 -1.54 0.07 0.00 -0.30 0.00 0.00 42.92 41.01 2nx5 s ASP 4 CO -0.10 0.28 0.68 0.00 -0.17 0.00 0.00 175.17 175.85 2nx5 s GLN 5 N -0.28 0.92 0.51 4.34 -2.07 -1.26 -1.40 119.66 120.42 2nx5 s GLN 5 Ca 0.05 0.62 -0.22 0.00 -1.82 0.00 0.00 55.36 53.99 2nx5 s GLN 5 Cb -0.13 0.44 -0.07 0.00 -1.09 0.00 0.00 33.01 32.16 2nx5 s GLN 5 CO 0.02 -0.20 1.16 -2.30 -1.32 0.00 0.00 175.29 172.65 2nx5 n PRO 7 N 1.86 1.45 -0.03 9.60 -0.02 -1.26 -4.81 135.00 141.79 2nx5 n PRO 7 Ca -0.16 0.53 -0.15 0.00 -2.02 0.00 0.00 63.50 61.70 2nx5 n PRO 7 Cb 0.56 -2.32 -0.11 0.00 -0.02 0.00 0.00 33.50 31.62 2nx5 n PRO 7 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 2nx5 h THR 8 N 1.31 1.51 -3.39 3.45 2.02 -1.95 -3.36 112.91 112.51 2nx5 h THR 8 Ca -0.48 -1.83 -0.20 0.00 0.77 0.00 0.00 66.41 64.66 2nx5 h THR 8 Cb 1.33 2.63 -0.28 0.00 -1.74 0.00 0.00 68.15 70.09 2nx5 h THR 8 CO 0.56 0.50 -0.57 -0.70 0.37 0.00 0.00 175.52 175.68 2nx5 s GLU 9 N -3.32 0.14 0.05 6.66 2.12 -1.26 -0.70 118.70 122.39 2nx5 s GLU 9 Ca -0.16 0.22 0.03 0.00 0.36 0.00 0.00 54.97 55.42 2nx5 s GLU 9 Cb 0.01 0.02 -0.02 0.00 0.26 0.00 0.00 34.13 34.40 2nx5 s GLU 9 CO 0.74 -0.05 -0.09 -1.64 -0.54 0.00 0.00 175.26 173.68 2nx5 s MET 10 N 0.28 0.60 -0.05 4.30 -1.94 0.08 -4.95 119.30 117.64 2nx5 s MET 10 Ca -0.02 -0.79 0.05 0.00 -1.71 0.00 0.00 55.69 53.22 2nx5 s MET 10 Cb -0.03 -0.44 -0.01 0.00 2.01 0.00 0.00 34.83 36.37 2nx5 s MET 10 CO -0.01 0.09 -0.20 0.99 -0.01 0.00 0.00 175.02 175.88 2nx5 s THR 11 N -1.31 1.66 0.04 2.05 2.01 -1.26 -2.08 115.64 116.75 2nx5 s THR 11 Ca -0.08 -0.85 -0.18 0.00 0.31 0.00 0.00 61.69 60.89 2nx5 s THR 11 Cb -0.10 -1.42 0.04 0.00 0.01 0.00 0.00 72.50 71.03 2nx5 s THR 11 CO 0.01 0.47 0.42 0.00 -0.69 0.00 0.00 174.62 174.83 2nx5 s ALA 12 N -0.06 -1.02 0.59 7.40 0.00 -1.04 -5.01 121.76 122.62 2nx5 s ALA 12 Ca -0.03 0.33 -0.04 0.00 0.00 0.00 0.00 51.96 52.23 2nx5 s ALA 12 Cb -0.12 0.33 0.02 0.00 0.00 0.00 0.00 23.12 23.35 2nx5 s ALA 12 CO 0.03 -0.45 0.87 0.99 0.00 0.00 0.00 175.76 177.19 2nx5 s THR 13 N -2.41 3.19 0.29 0.00 2.01 -1.26 -0.94 115.64 116.52 2nx5 s THR 13 Ca -0.06 -0.28 -0.29 0.00 0.31 0.00 0.00 61.69 61.37 2nx5 s THR 13 Cb -0.01 -3.26 -0.10 0.00 0.01 0.00 0.00 72.50 69.14 2nx5 s THR 13 CO -0.02 -0.24 1.18 -1.83 -0.69 0.00 0.00 174.62 173.02 2nx5 s GLU 14 N -4.94 4.53 0.00 4.92 -1.05 -0.81 -3.06 118.70 118.30 2nx5 s GLU 14 Ca 0.55 1.95 0.00 0.00 -0.15 0.00 0.00 54.97 57.33 2nx5 s GLU 14 Cb -0.10 -3.15 0.00 0.00 -0.44 0.00 0.00 34.13 30.44 2nx5 s GLU 14 CO 0.42 0.06 0.00 0.41 0.95 0.00 0.00 175.26 177.10 2nx5 n GLY 15 N 1.09 2.12 2.27 -3.83 0.00 -0.45 -4.87 105.19 101.52 2nx5 n GLY 15 Ca -0.01 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 2nx5 n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nx5 n ALA 16 N -1.62 -1.19 -3.84 4.61 0.00 -1.17 -4.05 120.51 113.24 2nx5 n ALA 16 Ca 0.00 -1.03 -0.30 0.00 0.00 0.00 0.00 53.44 52.11 2nx5 n ALA 16 Cb 0.00 -0.06 -0.15 0.00 0.00 0.00 0.00 19.45 19.24 2nx5 n ALA 16 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2nx5 s ILE 17 N -2.62 1.29 0.00 0.00 1.09 -1.26 -2.55 121.20 117.15 2nx5 s ILE 17 Ca 0.45 -1.46 0.02 0.00 -1.10 0.00 0.00 60.65 58.55 2nx5 s ILE 17 Cb -0.02 -1.84 -0.04 0.00 -1.06 0.00 0.00 42.46 39.50 2nx5 s ILE 17 CO 0.32 -0.47 -0.01 0.54 -0.10 0.00 0.00 174.94 175.22 2nx5 s VAL 18 N 1.44 4.05 -0.29 2.92 0.11 -0.68 -4.98 120.40 122.97 2nx5 s VAL 18 Ca 0.05 -0.64 0.01 0.00 -2.93 0.00 0.00 61.98 58.47 2nx5 s VAL 18 Cb -0.18 -2.80 0.08 0.00 -1.53 0.00 0.00 36.38 31.96 2nx5 s VAL 18 CO -0.15 0.37 0.02 -1.58 -3.33 0.00 0.00 175.10 170.44 2nx5 s GLN 19 N -1.54 1.30 -0.32 1.54 0.74 -1.26 -0.84 119.66 119.28 2nx5 s GLN 19 Ca 0.19 -1.28 -0.21 0.00 0.05 0.00 0.00 55.36 54.11 2nx5 s GLN 19 Cb -0.11 -2.60 -0.00 0.00 1.10 0.00 0.00 33.01 31.39 2nx5 s GLN 19 CO 0.10 -0.82 0.67 0.42 -0.55 0.00 0.00 175.29 175.11 2nx5 s ILE 20 N 1.31 4.89 0.47 -2.34 1.01 -0.20 -4.91 121.20 121.43 2nx5 s ILE 20 Ca 0.04 0.83 -0.13 0.00 0.00 0.00 0.00 60.65 61.39 2nx5 s ILE 20 Cb -0.18 -4.06 -0.07 0.00 0.01 0.00 0.00 42.46 38.16 2nx5 s ILE 20 CO -0.12 -0.23 0.89 0.20 0.00 0.00 0.00 174.94 175.68 2nx5 s ASN 21 N 1.70 6.55 -0.19 3.58 0.02 -1.26 -0.41 114.94 124.92 2nx5 s ASN 21 Ca 0.26 1.36 -0.05 0.00 -1.02 0.00 0.00 52.86 53.41 2nx5 s ASN 21 Cb -0.15 -2.42 0.10 0.00 0.02 0.00 0.00 41.25 38.80 2nx5 s ASN 21 CO 0.13 -0.52 0.37 0.00 0.02 0.00 0.00 177.10 177.10 2nx5 s THR 23 N 2.54 2.76 -0.02 0.00 -4.23 -0.49 -0.58 115.64 115.63 2nx5 s THR 23 Ca 0.03 -0.84 0.03 0.00 -1.18 0.00 0.00 61.69 59.73 2nx5 s THR 23 Cb -0.13 -2.05 -0.00 0.00 1.34 0.00 0.00 72.50 71.66 2nx5 s THR 23 CO -0.13 0.58 -0.09 -0.72 -0.54 0.00 0.00 174.62 173.73 2nx5 s TYR 24 N -0.62 0.83 -1.04 3.99 -0.85 -0.43 -0.66 117.35 118.58 2nx5 s TYR 24 Ca 0.09 -0.18 -0.10 0.00 -0.52 0.00 0.00 57.07 56.37 2nx5 s TYR 24 Cb -0.11 -0.57 0.26 0.00 0.38 0.00 0.00 41.96 41.92 2nx5 s TYR 24 CO 0.01 -0.05 1.01 -1.14 -1.52 0.00 0.00 175.55 173.86 2nx5 s GLN 25 N -0.00 4.01 -0.00 -3.49 0.74 -0.96 -4.39 119.66 115.56 2nx5 s GLN 25 Ca 0.00 -3.06 0.01 0.00 0.05 0.00 0.00 55.36 52.36 2nx5 s GLN 25 Cb -0.06 -4.48 -0.00 0.00 1.10 0.00 0.00 33.01 29.57 2nx5 s GLN 25 CO -0.00 -1.25 -0.04 -0.08 -0.55 0.00 0.00 175.29 173.37 2nx5 s THR 26 N -0.97 0.34 0.36 -0.34 -1.32 -1.26 -4.65 115.64 107.80 2nx5 s THR 26 Ca 0.28 -0.18 0.07 0.00 -1.21 0.00 0.00 61.69 60.65 2nx5 s THR 26 Cb -0.10 -0.30 -0.01 0.00 -1.51 0.00 0.00 72.50 70.59 2nx5 s THR 26 CO -0.08 0.10 0.48 -0.94 -2.21 0.00 0.00 174.62 171.96 2nx5 s SER 27 N -0.08 5.76 -1.17 8.08 1.04 -1.26 -4.63 113.70 121.44 2nx5 s SER 27 Ca 0.01 -0.32 0.00 0.00 0.48 0.00 0.00 55.95 56.13 2nx5 s SER 27 Cb -0.02 -1.00 0.00 0.00 0.10 0.00 0.00 66.02 65.10 2nx5 s SER 27 CO -0.00 -0.53 0.00 0.61 0.98 0.00 0.00 173.24 174.29 2nx5 n GLY 28 N -1.67 1.23 3.75 7.32 0.00 -1.26 -4.49 105.19 110.06 2nx5 n GLY 28 Ca 0.02 -0.49 -0.41 0.00 0.00 0.00 0.00 46.02 45.14 2nx5 n GLY 28 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2nx5 s PHE 29 N -2.40 2.94 -0.15 1.61 5.36 -1.26 -0.86 117.98 123.22 2nx5 s PHE 29 Ca 0.00 1.01 0.22 0.00 -0.96 0.00 0.00 56.93 57.20 2nx5 s PHE 29 Cb 0.00 -3.88 0.44 0.00 -0.34 0.00 0.00 43.02 39.24 2nx5 s PHE 29 CO 0.00 -2.83 1.16 -1.71 -1.46 0.00 0.00 175.22 170.38 2nx5 n ASN 30 N 2.09 0.95 0.00 6.13 4.05 0.59 -4.94 115.26 124.14 2nx5 n ASN 30 Ca 0.06 -2.03 0.00 0.00 0.45 0.00 0.00 54.58 53.07 2nx5 n ASN 30 Cb 0.40 -0.27 0.00 0.00 1.23 0.00 0.00 39.78 41.13 2nx5 n ASN 30 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2nx5 n GLY 31 N -0.19 3.94 2.96 8.20 0.00 -1.23 -4.75 105.19 114.11 2nx5 n GLY 31 Ca 0.03 -1.54 -0.22 0.00 0.00 0.00 0.00 46.02 44.28 2nx5 n GLY 31 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2nx5 s LEU 32 N 0.00 1.50 0.06 0.99 2.96 0.60 -1.30 118.68 123.49 2nx5 s LEU 32 Ca 0.00 -0.20 0.06 0.00 -0.22 0.00 0.00 54.13 53.76 2nx5 s LEU 32 Cb 0.00 -0.61 -0.04 0.00 0.50 0.00 0.00 46.19 46.04 2nx5 s LEU 32 CO 0.00 -0.01 -0.10 -0.36 -1.32 0.00 0.00 176.35 174.56 2nx5 s PHE 33 N 0.74 2.76 -0.03 5.38 0.08 0.13 -0.31 117.98 126.73 2nx5 s PHE 33 Ca -0.12 -0.13 0.05 0.00 0.12 0.00 0.00 56.93 56.84 2nx5 s PHE 33 Cb -0.15 -1.50 -0.03 0.00 -0.57 0.00 0.00 43.02 40.78 2nx5 s PHE 33 CO 0.02 0.38 -0.17 -1.58 -0.10 0.00 0.00 175.22 173.76 2nx5 s TRP 34 N -1.09 2.60 0.06 0.36 0.52 -0.19 -0.49 118.94 120.72 2nx5 s TRP 34 Ca 0.19 -0.23 0.05 0.00 0.02 0.00 0.00 56.10 56.13 2nx5 s TRP 34 Cb -0.11 -1.58 -0.03 0.00 -1.15 0.00 0.00 33.47 30.60 2nx5 s TRP 34 CO 0.10 0.14 -0.15 0.71 0.02 0.00 0.00 176.95 177.77 2nx5 s TYR 35 N -0.72 1.29 -0.21 -1.98 2.02 0.55 -1.78 117.35 116.52 2nx5 s TYR 35 Ca 0.11 -0.42 -0.08 0.00 -0.37 0.00 0.00 57.07 56.32 2nx5 s TYR 35 Cb -0.10 -0.74 -0.04 0.00 -0.40 0.00 0.00 41.96 40.68 2nx5 s TYR 35 CO 0.01 0.07 0.07 -1.14 -1.57 0.00 0.00 175.55 172.99 2nx5 s GLN 36 N -1.57 3.86 -0.22 -0.62 0.74 -0.39 -1.02 119.66 120.46 2nx5 s GLN 36 Ca 0.00 -0.39 -0.00 0.00 0.05 0.00 0.00 55.36 55.02 2nx5 s GLN 36 Cb -0.09 -3.28 0.06 0.00 1.10 0.00 0.00 33.01 30.80 2nx5 s GLN 36 CO 0.02 0.09 -0.03 -1.14 -0.55 0.00 0.00 175.29 173.68 2nx5 s GLN 37 N 0.88 1.35 0.48 1.67 0.74 0.47 -0.08 119.66 125.17 2nx5 s GLN 37 Ca 0.04 -0.79 -0.22 0.00 0.05 0.00 0.00 55.36 54.44 2nx5 s GLN 37 Cb -0.14 -2.40 -0.07 0.00 1.10 0.00 0.00 33.01 31.50 2nx5 s GLN 37 CO 0.03 -0.59 1.13 -1.01 -0.55 0.00 0.00 175.29 174.29 2nx5 s HIS 38 N 1.54 2.87 0.22 1.67 3.76 -1.26 0.16 115.29 124.25 2nx5 s HIS 38 Ca -0.04 1.56 -0.31 0.00 -0.15 0.00 0.00 55.06 56.11 2nx5 s HIS 38 Cb -0.18 -3.28 -0.14 0.00 1.11 0.00 0.00 32.58 30.08 2nx5 s HIS 38 CO -0.07 -1.34 1.24 0.00 -0.85 0.00 0.00 174.74 173.72 2nx5 n ALA 39 N -0.75 0.09 0.00 -1.40 0.00 -1.26 -1.96 120.51 115.23 2nx5 n ALA 39 Ca 0.09 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.96 2nx5 n ALA 39 Cb 0.50 -2.13 0.00 0.00 0.00 0.00 0.00 19.45 17.82 2nx5 n ALA 39 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nx5 n GLY 40 N 1.91 2.38 3.98 0.00 0.00 -1.26 -4.95 105.19 107.25 2nx5 n GLY 40 Ca 0.13 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.95 2nx5 n GLY 40 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2nx5 s GLU 41 N 0.00 2.59 0.43 1.61 -1.05 -0.83 -5.09 118.70 116.36 2nx5 s GLU 41 Ca 0.00 -1.47 -0.24 0.00 -0.15 0.00 0.00 54.97 53.12 2nx5 s GLU 41 Cb 0.00 -2.60 -0.08 0.00 -0.44 0.00 0.00 34.13 31.01 2nx5 s GLU 41 CO 0.00 -0.43 1.14 0.00 0.95 0.00 0.00 175.26 176.91 2nx5 s ALA 42 N -2.49 3.03 0.28 -0.84 0.00 -1.26 -4.55 121.76 115.93 2nx5 s ALA 42 Ca 0.54 0.88 -0.29 0.00 0.00 0.00 0.00 51.96 53.09 2nx5 s ALA 42 Cb -0.07 -3.35 -0.09 0.00 0.00 0.00 0.00 23.12 19.60 2nx5 s ALA 42 CO 0.33 -0.52 1.02 -1.25 0.00 0.00 0.00 175.76 175.33 2nx5 s PRO 43 N -2.58 4.68 0.10 0.00 0.04 -1.26 -4.51 135.00 131.47 2nx5 s PRO 43 Ca 0.61 1.61 0.10 0.00 0.04 0.00 0.00 61.00 63.36 2nx5 s PRO 43 Cb -0.27 -3.13 -0.04 0.00 0.04 0.00 0.00 34.50 31.11 2nx5 s PRO 43 CO 0.33 0.31 -0.25 0.95 0.04 0.00 0.00 177.00 178.38 2nx5 s THR 44 N -1.26 2.10 0.23 1.26 -4.23 0.88 -4.93 115.64 109.69 2nx5 s THR 44 Ca 0.45 -1.59 -0.30 0.00 -1.18 0.00 0.00 61.69 59.07 2nx5 s THR 44 Cb -0.27 -1.85 -0.10 0.00 1.34 0.00 0.00 72.50 71.62 2nx5 s THR 44 CO 0.35 0.15 1.49 0.12 -0.54 0.00 0.00 174.62 176.19 2nx5 s PHE 45 N -0.99 3.00 -0.02 3.99 5.36 -1.26 -1.26 117.98 126.81 2nx5 s PHE 45 Ca 0.12 0.89 -0.03 0.00 -0.96 0.00 0.00 56.93 56.95 2nx5 s PHE 45 Cb -0.10 -3.88 -0.01 0.00 -0.34 0.00 0.00 43.02 38.69 2nx5 s PHE 45 CO 0.04 -2.98 -0.06 1.28 -1.46 0.00 0.00 175.22 172.05 2nx5 n LEU 46 N 2.76 0.48 -4.00 6.12 4.77 -0.73 -4.86 117.00 121.54 2nx5 n LEU 46 Ca 0.09 0.07 -0.09 0.00 -0.03 0.00 0.00 56.01 56.06 2nx5 n LEU 46 Cb 0.39 -0.36 -0.10 0.00 -2.33 0.00 0.00 43.42 41.02 2nx5 n LEU 46 CO 0.61 -0.50 -0.32 -0.94 -1.33 0.00 0.00 177.39 174.92 2nx5 s SER 47 N -4.90 0.29 -0.06 -1.43 1.04 -1.19 -5.00 113.70 102.45 2nx5 s SER 47 Ca -0.05 -0.65 0.05 0.00 0.48 0.00 0.00 55.95 55.78 2nx5 s SER 47 Cb 0.01 0.17 -0.00 0.00 0.10 0.00 0.00 66.02 66.29 2nx5 s SER 47 CO 0.07 -0.45 -0.22 -0.47 0.98 0.00 0.00 173.24 173.16 2nx5 s TYR 48 N -2.49 2.20 -0.08 5.02 5.04 -1.26 -1.02 117.35 124.75 2nx5 s TYR 48 Ca -0.06 -0.72 -0.00 0.00 -2.44 0.00 0.00 57.07 53.84 2nx5 s TYR 48 Cb -0.02 -1.46 0.02 0.00 0.35 0.00 0.00 41.96 40.85 2nx5 s TYR 48 CO -0.05 -0.26 -0.05 -0.80 -1.34 0.00 0.00 175.55 173.05 2nx5 s ASN 49 N 0.07 1.77 0.00 4.32 0.01 0.57 -4.98 114.94 116.71 2nx5 s ASN 49 Ca -0.08 -0.21 0.00 0.00 -0.71 0.00 0.00 52.86 51.86 2nx5 s ASN 49 Cb -0.14 -0.66 0.00 0.00 0.41 0.00 0.00 41.25 40.85 2nx5 s ASN 49 CO 0.05 -0.11 0.00 0.55 -1.51 0.00 0.00 177.10 176.07 2nx5 n VAL 50 N 4.73 0.00 -3.95 1.60 3.14 -1.26 -0.29 118.33 122.30 2nx5 n VAL 50 Ca -0.14 0.00 -0.25 0.00 -2.96 0.00 0.00 64.34 60.99 2nx5 n VAL 50 Cb 0.50 -0.52 -0.03 0.00 -1.06 0.00 0.00 33.84 32.73 2nx5 n VAL 50 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 2nx5 s LEU 51 N -2.67 4.33 0.59 6.55 1.43 -1.26 -4.86 118.68 122.78 2nx5 s LEU 51 Ca 0.00 0.14 -0.19 0.00 -1.03 0.00 0.00 54.13 53.05 2nx5 s LEU 51 Cb 0.00 -2.89 -0.03 0.00 0.03 0.00 0.00 46.19 43.30 2nx5 s LEU 51 CO 0.00 0.02 1.25 -1.81 0.23 0.00 0.00 176.35 176.04 2nx5 s ASP 52 N -3.41 5.09 0.00 2.29 1.01 -1.26 -4.68 116.67 115.71 2nx5 s ASP 52 Ca 0.34 2.50 0.00 0.00 0.71 0.00 0.00 52.55 56.11 2nx5 s ASP 52 Cb -0.11 -2.61 0.00 0.00 1.01 0.00 0.00 42.92 41.21 2nx5 s ASP 52 CO 0.29 -1.67 0.00 0.61 0.21 0.00 0.00 175.17 174.61 2nx5 n GLY 53 N 0.65 0.60 3.00 0.21 0.00 -1.11 -4.95 105.19 103.59 2nx5 n GLY 53 Ca 0.13 -2.13 -0.31 0.00 0.00 0.00 0.00 46.02 43.72 2nx5 n GLY 53 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2nx5 s LEU 54 N 0.00 4.52 0.11 0.99 2.96 -1.26 -1.86 118.68 124.14 2nx5 s LEU 54 Ca 0.00 -2.09 -0.30 0.00 -0.22 0.00 0.00 54.13 51.52 2nx5 s LEU 54 Cb 0.00 -1.57 -0.06 0.00 0.50 0.00 0.00 46.19 45.07 2nx5 s LEU 54 CO 0.00 -0.38 0.99 -0.70 -1.32 0.00 0.00 176.35 174.94 2nx5 s GLU 55 N 0.96 4.67 -0.13 1.98 2.12 -0.13 -4.91 118.70 123.26 2nx5 s GLU 55 Ca 0.10 1.49 -0.01 0.00 0.36 0.00 0.00 54.97 56.91 2nx5 s GLU 55 Cb -0.19 -3.37 -0.02 0.00 0.26 0.00 0.00 34.13 30.81 2nx5 s GLU 55 CO -0.09 0.16 -0.09 -1.21 -0.54 0.00 0.00 175.26 173.49 2nx5 s GLU 56 N 0.07 3.38 -0.39 4.30 2.02 -1.26 -0.67 118.70 126.15 2nx5 s GLU 56 Ca 0.48 -0.60 0.09 0.00 0.02 0.00 0.00 54.97 54.96 2nx5 s GLU 56 Cb -0.24 -2.73 0.29 0.00 0.10 0.00 0.00 34.13 31.56 2nx5 s GLU 56 CO 0.30 0.30 0.66 1.17 0.02 0.00 0.00 175.26 177.71 2nx5 n LYS 57 N 3.30 0.84 0.00 1.61 4.81 -0.55 -5.03 118.16 123.14 2nx5 n LYS 57 Ca -0.18 -3.15 0.00 0.00 -0.87 0.00 0.00 58.31 54.12 2nx5 n LYS 57 Cb 0.53 -1.43 0.00 0.00 0.02 0.00 0.00 35.03 34.15 2nx5 n LYS 57 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2nx5 n GLY 58 N 0.90 1.91 0.03 3.14 0.00 -1.26 -3.40 105.19 106.51 2nx5 n GLY 58 Ca 0.21 -0.63 0.13 0.00 0.00 0.00 0.00 46.02 45.74 2nx5 n GLY 58 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nx5 n ARG 61 N 9.12 0.08 -4.54 1.61 1.74 -1.26 -4.81 116.66 118.60 2nx5 n ARG 61 Ca 0.00 0.05 -0.33 0.00 -0.77 0.00 0.00 57.85 56.80 2nx5 n ARG 61 Cb 0.00 -1.58 -0.14 0.00 -1.02 0.00 0.00 32.46 29.72 2nx5 n ARG 61 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2nx5 s PHE 62 N -3.04 2.83 0.11 -1.55 0.08 -1.22 -1.16 117.98 114.05 2nx5 s PHE 62 Ca 0.12 -0.81 0.06 0.00 0.12 0.00 0.00 56.93 56.42 2nx5 s PHE 62 Cb 0.17 -1.90 -0.04 0.00 -0.57 0.00 0.00 43.02 40.67 2nx5 s PHE 62 CO 0.59 -0.35 -0.01 -1.12 -0.10 0.00 0.00 175.22 174.23 2nx5 s SER 63 N 0.68 4.88 -0.07 1.36 0.01 0.27 -1.48 113.70 119.36 2nx5 s SER 63 Ca -0.06 -0.26 0.01 0.00 1.31 0.00 0.00 55.95 56.95 2nx5 s SER 63 Cb -0.15 -1.10 0.02 0.00 0.21 0.00 0.00 66.02 64.99 2nx5 s SER 63 CO 0.02 0.15 -0.07 -0.55 0.41 0.00 0.00 173.24 173.20 2nx5 s SER 64 N -2.47 1.61 -0.03 2.44 0.15 0.16 -0.17 113.70 115.39 2nx5 s SER 64 Ca 0.26 -0.23 0.07 0.00 0.70 0.00 0.00 55.95 56.75 2nx5 s SER 64 Cb -0.11 -0.68 -0.02 0.00 -1.71 0.00 0.00 66.02 63.50 2nx5 s SER 64 CO 0.18 -0.06 -0.22 0.12 1.20 0.00 0.00 173.24 174.46 2nx5 s PHE 65 N 1.15 2.45 0.02 3.44 5.36 -0.69 -0.95 117.98 128.75 2nx5 s PHE 65 Ca -0.06 -0.35 0.05 0.00 -0.96 0.00 0.00 56.93 55.60 2nx5 s PHE 65 Cb -0.14 -1.54 -0.02 0.00 -0.34 0.00 0.00 43.02 40.98 2nx5 s PHE 65 CO -0.01 0.04 -0.14 -1.17 -1.46 0.00 0.00 175.22 172.47 2nx5 s LEU 66 N -0.67 2.11 -0.36 6.12 2.96 -0.78 -2.51 118.68 125.55 2nx5 s LEU 66 Ca 0.11 -0.36 0.01 0.00 -0.22 0.00 0.00 54.13 53.66 2nx5 s LEU 66 Cb -0.10 -0.66 0.15 0.00 0.50 0.00 0.00 46.19 46.08 2nx5 s LEU 66 CO -0.00 0.10 0.25 -0.55 -1.32 0.00 0.00 176.35 174.82 2nx5 s SER 67 N -0.77 2.52 0.21 3.68 0.15 0.73 -2.76 113.70 117.46 2nx5 s SER 67 Ca 0.03 -2.24 -0.10 0.00 0.70 0.00 0.00 55.95 54.35 2nx5 s SER 67 Cb -0.07 -0.27 0.24 0.00 -1.71 0.00 0.00 66.02 64.21 2nx5 s SER 67 CO 0.00 -0.28 1.80 0.03 1.20 0.00 0.00 173.24 175.99 2nx5 h ARG 68 N 6.82 0.63 -0.42 5.44 3.08 -1.93 -1.91 114.38 126.07 2nx5 h ARG 68 Ca 0.09 -0.04 0.10 0.00 0.07 0.00 0.00 59.98 60.20 2nx5 h ARG 68 Cb 0.97 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.86 2nx5 h ARG 68 CO 0.27 0.41 0.29 0.77 -1.07 0.00 0.00 179.97 180.64 2nx5 h SER 69 N 0.64 0.13 -0.08 7.04 0.02 -1.95 -2.76 113.55 116.59 2nx5 h SER 69 Ca 0.29 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.25 2nx5 h SER 69 Cb 0.20 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.72 2nx5 h SER 69 CO -0.19 0.08 0.00 0.29 -1.14 0.00 0.00 176.83 175.87 2nx5 n LYS 70 N -4.45 2.72 -3.84 3.45 5.02 -1.02 -5.00 118.16 115.04 2nx5 n LYS 70 Ca 0.07 -1.83 -0.37 0.00 -2.02 0.00 0.00 58.31 54.16 2nx5 n LYS 70 Cb 0.39 -1.16 0.03 0.00 -0.02 0.00 0.00 35.03 34.27 2nx5 n LYS 70 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2nx5 n GLY 71 N -0.45 -0.91 2.99 0.72 0.00 -0.81 -4.80 105.19 101.94 2nx5 n GLY 71 Ca 0.06 0.40 -0.15 0.00 0.00 0.00 0.00 46.02 46.33 2nx5 n GLY 71 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2nx5 s TYR 72 N -3.51 0.54 0.09 1.61 5.04 -0.78 -1.32 117.35 119.02 2nx5 s TYR 72 Ca 0.47 -0.21 -0.22 0.00 -2.44 0.00 0.00 57.07 54.67 2nx5 s TYR 72 Cb -0.20 -0.34 0.06 0.00 0.35 0.00 0.00 41.96 41.82 2nx5 s TYR 72 CO 0.90 -0.03 0.53 0.45 -1.34 0.00 0.00 175.55 176.07 2nx5 s SER 73 N -0.54 -0.46 -0.05 4.32 0.15 0.26 -0.19 113.70 117.18 2nx5 s SER 73 Ca -0.01 0.07 -0.21 0.00 0.70 0.00 0.00 55.95 56.50 2nx5 s SER 73 Cb -0.04 0.53 0.04 0.00 -1.71 0.00 0.00 66.02 64.84 2nx5 s SER 73 CO -0.00 -0.81 0.47 -0.72 1.20 0.00 0.00 173.24 173.38 2nx5 s TYR 74 N -3.01 -0.41 -0.21 3.44 -0.85 -1.05 0.48 117.35 115.74 2nx5 s TYR 74 Ca -0.02 0.74 -0.08 0.00 -0.52 0.00 0.00 57.07 57.19 2nx5 s TYR 74 Cb -0.00 0.22 -0.04 0.00 0.38 0.00 0.00 41.96 42.52 2nx5 s TYR 74 CO -0.06 -0.45 0.07 -1.17 -1.52 0.00 0.00 175.55 172.42 2nx5 s LEU 75 N -1.03 3.70 -0.33 -3.49 2.96 0.45 -1.70 118.68 119.24 2nx5 s LEU 75 Ca -0.11 -0.02 -0.11 0.00 -0.22 0.00 0.00 54.13 53.67 2nx5 s LEU 75 Cb -0.03 -1.96 -0.01 0.00 0.50 0.00 0.00 46.19 44.69 2nx5 s LEU 75 CO 0.06 0.09 0.19 -0.22 -1.32 0.00 0.00 176.35 175.15 2nx5 s LEU 76 N 0.87 4.33 -0.19 -0.68 2.96 0.76 -1.03 118.68 125.71 2nx5 s LEU 76 Ca 0.04 -0.54 -0.09 0.00 -0.22 0.00 0.00 54.13 53.32 2nx5 s LEU 76 Cb -0.14 -2.06 -0.04 0.00 0.50 0.00 0.00 46.19 44.45 2nx5 s LEU 76 CO 0.03 -0.23 0.10 -0.76 -1.32 0.00 0.00 176.35 174.16 2nx5 s LEU 77 N 1.65 4.03 0.07 -0.68 1.43 -0.02 -0.56 118.68 124.59 2nx5 s LEU 77 Ca 0.05 0.17 0.09 0.00 -1.03 0.00 0.00 54.13 53.41 2nx5 s LEU 77 Cb -0.17 -2.03 -0.03 0.00 0.03 0.00 0.00 46.19 43.99 2nx5 s LEU 77 CO 0.08 0.19 -0.24 -0.54 0.23 0.00 0.00 176.35 176.07 2nx5 s LYS 78 N 0.26 1.54 -1.10 1.70 1.02 -0.31 -1.68 119.74 121.18 2nx5 s LYS 78 Ca 0.06 -1.12 -0.05 0.00 0.02 0.00 0.00 55.97 54.89 2nx5 s LYS 78 Cb -0.12 -1.77 -0.05 0.00 -0.52 0.00 0.00 37.83 35.37 2nx5 s LYS 78 CO -0.01 0.45 0.93 0.39 -0.92 0.00 0.00 175.35 176.19 2nx5 n GLU 79 N 1.56 -3.33 -1.69 1.68 1.02 -1.06 -4.81 120.64 114.01 2nx5 n GLU 79 Ca -0.17 0.84 -0.54 0.00 -0.02 0.00 0.00 57.16 57.27 2nx5 n GLU 79 Cb 0.53 -5.76 -0.06 0.00 -0.02 0.00 0.00 31.44 26.13 2nx5 n GLU 79 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2nx5 n LEU 80 N -3.51 2.80 -4.98 -4.62 4.32 -1.18 -4.59 117.00 105.24 2nx5 n LEU 80 Ca -0.13 1.01 -0.20 0.00 -0.02 0.00 0.00 56.01 56.67 2nx5 n LEU 80 Cb 0.63 -1.23 0.02 0.00 -1.62 0.00 0.00 43.42 41.22 2nx5 n LEU 80 CO 0.60 -0.29 0.27 -1.10 -1.22 0.00 0.00 177.39 175.65 2nx5 s GLN 81 N 3.88 2.71 0.25 3.23 1.11 -1.26 -1.34 119.66 128.25 2nx5 s GLN 81 Ca 0.97 -0.92 0.08 0.00 0.01 0.00 0.00 55.36 55.50 2nx5 s GLN 81 Cb -0.92 -2.60 0.30 0.00 -1.01 0.00 0.00 33.01 28.78 2nx5 s GLN 81 CO 0.60 -0.49 1.58 0.52 0.01 0.00 0.00 175.29 177.52 2nx5 h MET 82 N 0.33 0.10 0.00 2.91 2.86 -1.93 -2.96 114.93 116.24 2nx5 h MET 82 Ca -0.42 -0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.15 2nx5 h MET 82 Cb 1.29 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.96 2nx5 h MET 82 CO 0.50 0.69 0.00 0.36 1.06 0.00 0.00 176.91 179.52 2nx5 n LYS 83 N -3.83 0.12 0.01 1.72 2.85 -1.26 -2.45 118.16 115.33 2nx5 n LYS 83 Ca -0.02 0.16 0.13 0.00 -1.05 0.00 0.00 58.31 57.54 2nx5 n LYS 83 Cb 0.62 -1.50 0.47 0.00 -0.65 0.00 0.00 35.03 33.97 2nx5 n LYS 83 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2nx5 n ASP 84 N -1.39 0.26 -4.55 -5.58 8.00 -1.12 -4.76 116.55 107.41 2nx5 n ASP 84 Ca 0.06 0.26 -0.42 0.00 0.71 0.00 0.00 54.79 55.40 2nx5 n ASP 84 Cb 0.17 -0.26 -0.04 0.00 -0.02 0.00 0.00 41.12 40.97 2nx5 n ASP 84 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2nx5 n SER 85 N -1.60 2.58 -2.39 -2.24 7.64 -1.03 -4.82 113.62 111.77 2nx5 n SER 85 Ca 0.06 0.02 -0.04 0.00 1.01 0.00 0.00 58.87 59.93 2nx5 n SER 85 Cb 0.35 -1.47 0.02 0.00 -1.01 0.00 0.00 64.21 62.09 2nx5 n SER 85 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2nx5 n ALA 86 N 12.60 -1.54 -2.75 -0.43 0.00 -1.09 -4.82 120.51 122.47 2nx5 n ALA 86 Ca 0.36 -0.75 -0.35 0.00 0.00 0.00 0.00 53.44 52.70 2nx5 n ALA 86 Cb 0.41 0.50 -0.08 0.00 0.00 0.00 0.00 19.45 20.28 2nx5 n ALA 86 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2nx5 s SER 87 N -2.52 5.60 -0.24 0.00 0.15 0.12 -0.91 113.70 115.90 2nx5 s SER 87 Ca 0.13 0.22 0.01 0.00 0.70 0.00 0.00 55.95 57.01 2nx5 s SER 87 Cb -0.02 -1.65 0.04 0.00 -1.71 0.00 0.00 66.02 62.68 2nx5 s SER 87 CO 0.05 0.37 -0.10 -0.31 1.20 0.00 0.00 173.24 174.45 2nx5 s TYR 88 N -0.98 3.11 -0.14 3.44 2.02 0.13 -0.39 117.35 124.54 2nx5 s TYR 88 Ca 0.15 -1.89 -0.08 0.00 -0.37 0.00 0.00 57.07 54.88 2nx5 s TYR 88 Cb -0.12 -1.99 -0.04 0.00 -0.40 0.00 0.00 41.96 39.41 2nx5 s TYR 88 CO 0.05 -0.81 0.15 -0.51 -1.57 0.00 0.00 175.55 172.86 2nx5 s LEU 89 N 1.23 4.34 -0.19 -1.29 1.43 -0.19 -1.70 118.68 122.30 2nx5 s LEU 89 Ca -0.03 0.42 -0.02 0.00 -1.03 0.00 0.00 54.13 53.47 2nx5 s LEU 89 Cb -0.17 -2.11 -0.01 0.00 0.03 0.00 0.00 46.19 43.93 2nx5 s LEU 89 CO -0.06 0.33 -0.08 0.00 0.23 0.00 0.00 176.35 176.77 2nx5 s ALA 91 N 1.18 1.92 -0.07 0.00 0.00 0.35 -0.47 121.76 124.67 2nx5 s ALA 91 Ca 0.02 -1.15 0.04 0.00 0.00 0.00 0.00 51.96 50.87 2nx5 s ALA 91 Cb -0.14 -0.37 0.00 0.00 0.00 0.00 0.00 23.12 22.61 2nx5 s ALA 91 CO -0.03 0.43 -0.18 0.08 0.00 0.00 0.00 175.76 176.07 2nx5 s VAL 92 N -0.84 1.55 -0.22 0.00 1.01 0.47 0.19 120.40 122.56 2nx5 s VAL 92 Ca 0.09 -0.74 -0.13 0.00 0.00 0.00 0.00 61.98 61.20 2nx5 s VAL 92 Cb -0.09 -1.35 -0.05 0.00 0.00 0.00 0.00 36.38 34.89 2nx5 s VAL 92 CO 0.02 0.44 0.25 -1.10 0.00 0.00 0.00 175.10 174.72 2nx5 s GLN 93 N 0.36 4.12 0.10 2.72 -0.21 -0.42 -1.41 119.66 124.91 2nx5 s GLN 93 Ca -0.13 -0.08 -0.10 0.00 0.02 0.00 0.00 55.36 55.07 2nx5 s GLN 93 Cb -0.15 -3.53 0.01 0.00 1.00 0.00 0.00 33.01 30.33 2nx5 s GLN 93 CO 0.05 0.04 0.24 0.00 -2.12 0.00 0.00 175.29 173.49 2nx5 s ALA 94 N 1.11 -0.39 0.19 6.09 0.00 -1.26 -0.30 121.76 127.21 2nx5 s ALA 94 Ca 0.12 -0.48 -0.09 0.00 0.00 0.00 0.00 51.96 51.51 2nx5 s ALA 94 Cb -0.14 0.53 0.11 0.00 0.00 0.00 0.00 23.12 23.62 2nx5 s ALA 94 CO 0.05 -0.54 1.72 0.77 0.00 0.00 0.00 175.76 177.76 2nx5 h SER 95 N 2.67 1.04 0.00 0.00 0.02 -1.23 -2.23 113.55 113.82 2nx5 h SER 95 Ca -0.34 -0.22 0.00 0.00 -0.84 0.00 0.00 61.79 60.39 2nx5 h SER 95 Cb 1.21 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 63.48 2nx5 h SER 95 CO 0.54 0.99 0.00 0.61 -1.14 0.00 0.00 176.83 177.83 2nx5 n GLY 96 N -0.69 -2.07 0.00 -3.77 0.00 -1.26 -3.45 105.19 93.94 2nx5 n GLY 96 Ca 0.05 0.43 0.00 0.00 0.00 0.00 0.00 46.02 46.50 2nx5 n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nx5 n GLY 97 N -0.85 -0.36 3.53 -0.02 0.00 -1.26 -5.06 105.19 101.17 2nx5 n GLY 97 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 2nx5 n GLY 97 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2nx5 s SER 98 N -1.51 -0.39 0.00 1.61 0.15 -1.20 -5.02 113.70 107.33 2nx5 s SER 98 Ca 0.00 0.18 0.00 0.00 0.70 0.00 0.00 55.95 56.83 2nx5 s SER 98 Cb 0.00 0.37 0.00 0.00 -1.71 0.00 0.00 66.02 64.68 2nx5 s SER 98 CO 0.00 -0.54 0.00 -1.22 1.20 0.00 0.00 173.24 172.68 2nx5 n TYR 102 N 0.14 0.00 -2.87 3.44 4.02 -0.84 -4.44 117.16 116.60 2nx5 n TYR 102 Ca -0.10 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.37 2nx5 n TYR 102 Cb 0.60 -0.03 -0.04 0.00 -0.02 0.00 0.00 39.34 39.85 2nx5 n TYR 102 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 2nx5 s ILE 103 N -0.02 4.87 -0.32 -0.72 1.09 -1.26 -4.71 121.20 120.12 2nx5 s ILE 103 Ca 0.00 1.66 -0.38 0.00 -1.10 0.00 0.00 60.65 60.84 2nx5 s ILE 103 Cb 0.00 -4.15 -0.14 0.00 -1.06 0.00 0.00 42.46 37.11 2nx5 s ILE 103 CO 0.00 0.02 2.02 -2.65 -0.10 0.00 0.00 174.94 174.23 2nx5 n PRO 104 N 5.24 1.07 -3.80 2.79 -0.02 -1.26 -4.73 135.00 134.28 2nx5 n PRO 104 Ca 0.05 0.34 -0.35 0.00 -2.02 0.00 0.00 63.50 61.51 2nx5 n PRO 104 Cb 0.49 -2.26 -0.08 0.00 -0.02 0.00 0.00 33.50 31.63 2nx5 n PRO 104 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2nx5 s THR 105 N 5.75 5.36 0.11 3.45 2.01 -0.50 -4.88 115.64 126.93 2nx5 s THR 105 Ca 1.06 0.17 0.01 0.00 0.31 0.00 0.00 61.69 63.23 2nx5 s THR 105 Cb -0.98 -3.41 -0.04 0.00 0.01 0.00 0.00 72.50 68.08 2nx5 s THR 105 CO 0.56 0.49 0.26 -0.36 -0.69 0.00 0.00 174.62 174.88 2nx5 s PHE 106 N 0.02 3.50 0.87 4.92 0.08 -1.26 -0.39 117.98 125.72 2nx5 s PHE 106 Ca 0.09 0.22 -0.10 0.00 0.12 0.00 0.00 56.93 57.27 2nx5 s PHE 106 Cb -0.11 -1.75 0.17 0.00 -0.57 0.00 0.00 43.02 40.76 2nx5 s PHE 106 CO -0.00 0.54 1.20 0.20 -0.10 0.00 0.00 175.22 177.05 2nx5 s GLY 107 N -2.83 1.77 0.35 4.36 0.00 0.38 -4.92 107.32 106.43 2nx5 s GLY 107 Ca 0.35 -1.43 0.27 0.00 0.00 0.00 0.00 44.72 43.91 2nx5 s GLY 107 CO 0.28 -0.74 1.79 3.21 0.00 0.00 0.00 173.10 177.65 2nx5 h ARG 108 N -1.21 0.00 0.00 2.90 3.08 -1.88 -3.45 114.38 113.82 2nx5 h ARG 108 Ca -0.41 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.64 2nx5 h ARG 108 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.30 2nx5 h ARG 108 CO 0.38 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.69 2nx5 n GLY 109 N 0.27 0.39 2.89 0.04 0.00 -1.26 -5.01 105.19 102.50 2nx5 n GLY 109 Ca 0.02 -1.71 -0.27 0.00 0.00 0.00 0.00 46.02 44.06 2nx5 n GLY 109 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2nx5 s THR 110 N -2.97 1.00 -0.17 2.61 2.01 -0.69 -4.46 115.64 112.97 2nx5 s THR 110 Ca 0.00 -0.36 -0.26 0.00 0.31 0.00 0.00 61.69 61.38 2nx5 s THR 110 Cb 0.00 -1.08 -0.01 0.00 0.01 0.00 0.00 72.50 71.42 2nx5 s THR 110 CO 0.00 0.28 0.84 -0.55 -0.69 0.00 0.00 174.62 174.51 2nx5 s SER 111 N 1.71 6.97 -0.29 3.53 0.15 0.12 0.20 113.70 126.09 2nx5 s SER 111 Ca 0.04 1.19 -0.06 0.00 0.70 0.00 0.00 55.95 57.81 2nx5 s SER 111 Cb -0.13 -2.46 0.01 0.00 -1.71 0.00 0.00 66.02 61.73 2nx5 s SER 111 CO -0.08 -0.41 0.07 -0.22 1.20 0.00 0.00 173.24 173.79 2nx5 s LEU 112 N 2.20 3.79 -0.29 3.45 2.96 -0.09 -0.74 118.68 129.97 2nx5 s LEU 112 Ca 0.39 -0.74 -0.18 0.00 -0.22 0.00 0.00 54.13 53.38 2nx5 s LEU 112 Cb -0.16 -1.86 -0.02 0.00 0.50 0.00 0.00 46.19 44.65 2nx5 s LEU 112 CO 0.12 -0.19 0.53 -0.63 -1.32 0.00 0.00 176.35 174.86 2nx5 s ILE 113 N 1.48 5.04 -0.54 6.68 1.01 -0.88 -2.68 121.20 131.31 2nx5 s ILE 113 Ca 0.02 0.71 -0.19 0.00 0.00 0.00 0.00 60.65 61.19 2nx5 s ILE 113 Cb -0.17 -3.89 0.07 0.00 0.01 0.00 0.00 42.46 38.48 2nx5 s ILE 113 CO 0.02 -0.03 0.65 -0.69 0.00 0.00 0.00 174.94 174.89 2nx5 s VAL 114 N 2.37 4.85 0.43 2.92 1.01 -1.26 -2.49 120.40 128.23 2nx5 s VAL 114 Ca 0.21 -0.66 -0.25 0.00 0.00 0.00 0.00 61.98 61.28 2nx5 s VAL 114 Cb -0.15 -4.37 -0.08 0.00 0.00 0.00 0.00 36.38 31.78 2nx5 s VAL 114 CO 0.11 -0.92 1.22 -1.00 0.00 0.00 0.00 175.10 174.51 2nx5 s HIS 115 N 2.66 2.89 0.71 5.22 3.76 -0.12 -4.88 115.29 125.53 2nx5 s HIS 115 Ca 0.14 1.50 -0.11 0.00 -0.15 0.00 0.00 55.06 56.43 2nx5 s HIS 115 Cb -0.21 -3.50 0.02 0.00 1.11 0.00 0.00 32.58 30.00 2nx5 s HIS 115 CO 0.10 -1.69 1.08 -1.25 -0.85 0.00 0.00 174.74 172.12 2nx5 s PRO 116 N -2.42 2.82 -0.44 8.40 0.04 -1.26 -1.92 135.00 140.22 2nx5 s PRO 116 Ca 0.60 0.65 -0.23 0.00 0.04 0.00 0.00 61.00 62.05 2nx5 s PRO 116 Cb -0.33 -2.00 0.02 0.00 0.04 0.00 0.00 34.50 32.23 2nx5 s PRO 116 CO 0.41 -1.10 0.78 -0.47 0.04 0.00 0.00 177.00 176.66 2nx5 s TYR 117 N -3.22 3.00 -0.68 0.56 5.04 -1.26 -4.59 117.35 116.21 2nx5 s TYR 117 Ca 0.58 0.20 -0.20 0.00 -2.44 0.00 0.00 57.07 55.21 2nx5 s TYR 117 Cb -0.12 -3.63 0.10 0.00 0.35 0.00 0.00 41.96 38.65 2nx5 s TYR 117 CO 0.53 -0.96 0.86 0.42 -1.34 0.00 0.00 175.55 175.06 2nx5 s ILE 118 N 3.27 4.67 0.07 3.14 -1.09 -1.26 -4.91 121.20 125.09 2nx5 s ILE 118 Ca 0.30 -0.94 -0.34 0.00 -2.23 0.00 0.00 60.65 57.44 2nx5 s ILE 118 Cb -0.12 -4.60 -0.19 0.00 -1.58 0.00 0.00 42.46 35.97 2nx5 s ILE 118 CO 0.22 -1.29 1.62 -0.61 -1.23 0.00 0.00 174.94 173.64 2nx5 h GLN 119 N 9.20 -0.95 -3.14 2.79 4.15 -1.94 -3.38 115.11 121.84 2nx5 h GLN 119 Ca -0.21 0.06 -0.62 0.00 0.77 0.00 0.00 58.65 58.65 2nx5 h GLN 119 Cb 1.07 0.22 -0.41 0.00 0.21 0.00 0.00 27.48 28.57 2nx5 h GLN 119 CO 1.11 -0.63 -0.65 -0.80 -1.93 0.00 0.00 178.83 175.93 2nx5 s ASN 120 N -4.33 4.19 0.34 -0.69 0.01 -1.26 -5.10 114.94 108.10 2nx5 s ASN 120 Ca -0.18 -3.25 -0.29 0.00 -0.71 0.00 0.00 52.86 48.43 2nx5 s ASN 120 Cb 0.03 -1.45 -0.11 0.00 0.41 0.00 0.00 41.25 40.13 2nx5 s ASN 120 CO 0.62 -0.18 1.52 -2.65 -1.51 0.00 0.00 177.10 174.89 2nx5 n PRO 121 N 2.76 2.65 -3.19 -0.60 -0.02 -1.26 -4.98 135.00 130.36 2nx5 n PRO 121 Ca 0.13 0.93 -0.20 0.00 -2.02 0.00 0.00 63.50 62.34 2nx5 n PRO 121 Cb 0.35 -2.67 -0.04 0.00 -0.02 0.00 0.00 33.50 31.11 2nx5 n PRO 121 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2nx5 n ASP 122 N 1.16 0.78 -4.65 2.55 -0.08 0.14 -5.01 116.55 111.43 2nx5 n ASP 122 Ca 0.04 -2.94 -0.45 0.00 -1.51 0.00 0.00 54.79 49.93 2nx5 n ASP 122 Cb 0.38 -0.62 -0.04 0.00 2.34 0.00 0.00 41.12 43.17 2nx5 n ASP 122 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 2nx5 n PRO 123 N 0.61 2.39 -3.94 -0.67 -0.02 -1.23 -4.56 135.00 127.57 2nx5 n PRO 123 Ca 0.24 0.84 -0.10 0.00 -2.02 0.00 0.00 63.50 62.47 2nx5 n PRO 123 Cb 0.61 -2.89 -0.10 0.00 -0.02 0.00 0.00 33.50 31.10 2nx5 n PRO 123 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2nx5 s ALA 124 N 5.08 -0.04 -0.18 3.55 0.00 -0.74 -5.00 121.76 124.43 2nx5 s ALA 124 Ca 0.93 -0.50 0.01 0.00 0.00 0.00 0.00 51.96 52.40 2nx5 s ALA 124 Cb -0.54 0.19 0.03 0.00 0.00 0.00 0.00 23.12 22.80 2nx5 s ALA 124 CO 0.45 -0.25 -0.14 0.08 0.00 0.00 0.00 175.76 175.90 2nx5 s VAL 125 N -2.04 1.79 0.02 0.00 1.01 -1.26 -1.13 120.40 118.79 2nx5 s VAL 125 Ca -0.10 -0.94 0.05 0.00 0.00 0.00 0.00 61.98 61.00 2nx5 s VAL 125 Cb -0.05 -1.74 -0.03 0.00 0.00 0.00 0.00 36.38 34.56 2nx5 s VAL 125 CO -0.02 0.35 -0.13 -0.31 0.00 0.00 0.00 175.10 174.98 2nx5 s TYR 126 N 1.36 2.70 -0.21 5.22 2.02 -0.59 -4.93 117.35 122.93 2nx5 s TYR 126 Ca 0.02 -0.16 -0.13 0.00 -0.37 0.00 0.00 57.07 56.42 2nx5 s TYR 126 Cb -0.15 -1.54 -0.04 0.00 -0.40 0.00 0.00 41.96 39.83 2nx5 s TYR 126 CO -0.10 0.29 0.29 -1.14 -1.57 0.00 0.00 175.55 173.32 2nx5 s GLN 127 N -1.37 4.14 -0.18 -0.62 0.74 -1.26 0.01 119.66 121.13 2nx5 s GLN 127 Ca 0.15 0.00 0.00 0.00 0.05 0.00 0.00 55.36 55.57 2nx5 s GLN 127 Cb -0.11 -3.53 0.01 0.00 1.10 0.00 0.00 33.01 30.49 2nx5 s GLN 127 CO 0.06 0.03 -0.17 -0.51 -0.55 0.00 0.00 175.29 174.14 2nx5 s LEU 128 N 1.13 2.28 0.21 3.68 1.02 0.83 -5.00 118.68 122.84 2nx5 s LEU 128 Ca 0.14 -0.58 -0.04 0.00 0.02 0.00 0.00 54.13 53.67 2nx5 s LEU 128 Cb -0.14 -1.52 -0.05 0.00 0.02 0.00 0.00 46.19 44.50 2nx5 s LEU 128 CO 0.06 0.02 0.45 -0.13 0.02 0.00 0.00 176.35 176.77 2nx5 s ARG 129 N 1.19 3.61 0.50 1.70 0.52 -1.26 -0.98 118.95 124.22 2nx5 s ARG 129 Ca 0.02 -0.09 -0.20 0.00 -0.52 0.00 0.00 55.73 54.94 2nx5 s ARG 129 Cb -0.14 -2.76 -0.11 0.00 0.52 0.00 0.00 34.95 32.46 2nx5 s ARG 129 CO -0.08 0.36 0.43 -3.47 0.02 0.00 0.00 175.30 172.56 2nx5 n ASP 130 N -0.46 -1.38 0.01 0.23 2.03 -1.10 -4.97 116.55 110.91 2nx5 n ASP 130 Ca -0.03 0.79 -0.02 0.00 0.52 0.00 0.00 54.79 56.06 2nx5 n ASP 130 Cb 0.53 -1.10 -0.01 0.00 -0.72 0.00 0.00 41.12 39.82 2nx5 n ASP 130 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 2nx5 n SER 131 N 1.11 0.48 -4.25 1.67 2.88 -1.26 -5.11 113.62 109.14 2nx5 n SER 131 Ca 0.11 0.07 -0.23 0.00 -1.33 0.00 0.00 58.87 57.48 2nx5 n SER 131 Cb 0.44 -0.16 -0.13 0.00 -0.75 0.00 0.00 64.21 63.62 2nx5 n SER 131 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 2nx5 s LYS 132 N -2.04 1.12 -0.33 -1.46 1.02 -1.26 -4.87 119.74 111.91 2nx5 s LYS 132 Ca -0.02 -1.06 0.00 0.00 0.02 0.00 0.00 55.97 54.90 2nx5 s LYS 132 Cb 0.01 -1.30 0.00 0.00 -0.52 0.00 0.00 37.83 36.02 2nx5 s LYS 132 CO 0.03 0.31 0.00 0.43 -0.92 0.00 0.00 175.35 175.20 2nx5 n SER 133 N 1.31 -1.95 -1.37 2.83 7.64 -1.26 -4.92 113.62 115.90 2nx5 n SER 133 Ca -0.19 -0.00 0.18 0.00 1.01 0.00 0.00 58.87 59.87 2nx5 n SER 133 Cb 0.54 -1.31 -0.05 0.00 -1.01 0.00 0.00 64.21 62.38 2nx5 n SER 133 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2nx5 n SER 134 N 1.27 -8.14 0.00 6.43 7.64 -1.26 -5.08 113.62 114.48 2nx5 n SER 134 Ca -0.05 0.63 0.00 0.00 1.01 0.00 0.00 58.87 60.46 2nx5 n SER 134 Cb 0.52 -4.19 0.00 0.00 -1.01 0.00 0.00 64.21 59.53 2nx5 n SER 134 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2nx5 n ASP 135 N -4.10 0.00 0.00 6.43 8.00 -1.26 -4.98 116.55 120.64 2nx5 n ASP 135 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2nx5 n ASP 135 Cb 0.63 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.73 2nx5 n ASP 135 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2nx5 n LYS 136 N -0.93 0.00 -3.34 -1.24 4.76 -1.26 -4.64 118.16 111.51 2nx5 n LYS 136 Ca 0.00 0.00 -0.10 0.00 -2.87 0.00 0.00 58.31 55.34 2nx5 n LYS 136 Cb 0.00 0.00 -0.00 0.00 -1.84 0.00 0.00 35.03 33.19 2nx5 n LYS 136 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 2nx5 n SER 137 N 0.00 -1.38 -3.79 4.39 3.41 -1.26 -2.73 113.62 112.26 2nx5 n SER 137 Ca 0.00 -2.39 -0.13 0.00 -0.26 0.00 0.00 58.87 56.09 2nx5 n SER 137 Cb 0.00 2.43 -0.13 0.00 -0.26 0.00 0.00 64.21 66.25 2nx5 n SER 137 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2nx5 s VAL 138 N -2.55 -0.02 0.05 -3.33 1.01 -0.16 -4.62 120.40 110.78 2nx5 s VAL 138 Ca 0.18 0.07 -0.12 0.00 0.00 0.00 0.00 61.98 62.12 2nx5 s VAL 138 Cb -0.02 -0.22 -0.06 0.00 0.00 0.00 0.00 36.38 36.08 2nx5 s VAL 138 CO 0.13 0.03 0.40 0.00 0.00 0.00 0.00 175.10 175.66 2nx5 s LEU 140 N -1.59 3.35 -0.35 0.00 2.96 0.10 -1.47 118.68 121.68 2nx5 s LEU 140 Ca 0.29 -1.36 -0.24 0.00 -0.22 0.00 0.00 54.13 52.60 2nx5 s LEU 140 Cb -0.15 -1.53 0.01 0.00 0.50 0.00 0.00 46.19 45.02 2nx5 s LEU 140 CO 0.16 -0.19 0.83 0.12 -1.32 0.00 0.00 176.35 175.95 2nx5 s PHE 141 N 1.12 3.12 0.16 5.38 5.36 -0.42 -1.54 117.98 131.16 2nx5 s PHE 141 Ca -0.08 0.68 -0.02 0.00 -0.96 0.00 0.00 56.93 56.55 2nx5 s PHE 141 Cb -0.20 -3.44 -0.04 0.00 -0.34 0.00 0.00 43.02 39.01 2nx5 s PHE 141 CO -0.05 -0.73 0.11 -0.08 -1.46 0.00 0.00 175.22 173.01 2nx5 s THR 142 N 3.19 0.06 -0.70 0.12 -1.32 -0.28 -0.06 115.64 116.65 2nx5 s THR 142 Ca 0.34 -1.89 0.00 0.00 -1.21 0.00 0.00 61.69 58.92 2nx5 s THR 142 Cb -0.13 -2.19 0.00 0.00 -1.51 0.00 0.00 72.50 68.67 2nx5 s THR 142 CO 0.16 -0.28 0.00 0.47 -2.21 0.00 0.00 174.62 172.77 2nx5 n ASP 143 N -0.17 -4.71 -4.86 8.08 8.00 -0.79 -1.80 116.55 120.30 2nx5 n ASP 143 Ca -0.03 0.16 -0.30 0.00 0.71 0.00 0.00 54.79 55.33 2nx5 n ASP 143 Cb 0.64 -2.79 0.05 0.00 -0.02 0.00 0.00 41.12 39.00 2nx5 n ASP 143 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2nx5 s PHE 144 N -1.94 3.27 0.45 1.24 -0.12 -1.26 0.24 117.98 119.86 2nx5 s PHE 144 Ca 0.00 1.13 -0.14 0.00 -0.05 0.00 0.00 56.93 57.87 2nx5 s PHE 144 Cb 0.00 -3.01 -0.08 0.00 -0.63 0.00 0.00 43.02 39.30 2nx5 s PHE 144 CO 0.00 -1.22 0.87 0.16 -0.05 0.00 0.00 175.22 174.99 2nx5 s ASP 145 N -4.20 6.61 0.63 1.98 -4.77 -1.26 -4.31 116.67 111.35 2nx5 s ASP 145 Ca 0.58 1.37 0.28 0.00 -3.30 0.00 0.00 52.55 51.49 2nx5 s ASP 145 Cb -0.12 -2.42 1.51 0.00 -1.09 0.00 0.00 42.92 40.80 2nx5 s ASP 145 CO 0.53 -0.46 1.88 0.28 0.70 0.00 0.00 175.17 178.10 2nx5 h SER 146 N 1.23 0.00 1.12 2.11 0.02 -1.92 -0.17 113.55 115.94 2nx5 h SER 146 Ca -0.47 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.48 2nx5 h SER 146 Cb 1.18 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.72 2nx5 h SER 146 CO 0.63 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 176.32 2nx5 n GLN 147 N -3.27 0.07 -2.20 3.45 1.13 -1.26 -4.83 117.38 110.46 2nx5 n GLN 147 Ca 0.03 0.05 -0.41 0.00 -1.94 0.00 0.00 57.00 54.74 2nx5 n GLN 147 Cb 0.53 -1.58 -0.03 0.00 0.11 0.00 0.00 30.24 29.28 2nx5 n GLN 147 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 2nx5 s THR 148 N -3.03 2.94 -0.16 5.09 2.01 -0.08 -5.03 115.64 117.39 2nx5 s THR 148 Ca 0.13 0.92 -0.02 0.00 0.31 0.00 0.00 61.69 63.03 2nx5 s THR 148 Cb 0.17 -3.58 -0.02 0.00 0.01 0.00 0.00 72.50 69.08 2nx5 s THR 148 CO 0.55 0.21 -0.08 0.20 -0.69 0.00 0.00 174.62 174.80 2nx5 s ASN 149 N -0.43 4.30 -0.37 3.53 0.01 -1.26 -5.03 114.94 115.71 2nx5 s ASN 149 Ca 0.49 -0.29 -0.22 0.00 -0.71 0.00 0.00 52.86 52.14 2nx5 s ASN 149 Cb -0.38 -1.69 0.01 0.00 0.41 0.00 0.00 41.25 39.60 2nx5 s ASN 149 CO 0.48 0.12 0.70 -0.69 -1.51 0.00 0.00 177.10 176.20 2nx5 s VAL 150 N 0.62 4.82 0.40 1.60 1.01 -1.26 -5.03 120.40 122.56 2nx5 s VAL 150 Ca -0.05 0.67 -0.26 0.00 0.00 0.00 0.00 61.98 62.34 2nx5 s VAL 150 Cb -0.15 -4.14 -0.09 0.00 0.00 0.00 0.00 36.38 32.00 2nx5 s VAL 150 CO 0.03 -0.38 1.30 -0.44 0.00 0.00 0.00 175.10 175.60 2nx5 s SER 151 N 1.83 6.38 0.85 3.32 0.01 -1.26 -4.93 113.70 119.89 2nx5 s SER 151 Ca 0.27 2.65 -0.12 0.00 1.31 0.00 0.00 55.95 60.05 2nx5 s SER 151 Cb -0.14 -2.64 0.11 0.00 0.21 0.00 0.00 66.02 63.56 2nx5 s SER 151 CO 0.16 -0.80 1.18 -1.10 0.41 0.00 0.00 173.24 173.09 2nx5 s GLN 152 N -2.19 1.60 0.14 12.44 -1.52 -1.26 -4.93 119.66 123.94 2nx5 s GLN 152 Ca 0.56 0.11 -0.22 0.00 -1.95 0.00 0.00 55.36 53.86 2nx5 s GLN 152 Cb -0.38 -1.91 -0.08 0.00 -0.22 0.00 0.00 33.01 30.43 2nx5 s GLN 152 CO 0.49 -1.85 0.69 -1.54 -0.25 0.00 0.00 175.29 172.83 2nx5 s SER 153 N -4.46 7.21 0.55 5.90 1.04 -1.26 -5.04 113.70 117.65 2nx5 s SER 153 Ca 0.64 1.46 0.04 0.00 0.48 0.00 0.00 55.95 58.57 2nx5 s SER 153 Cb -0.11 -2.43 0.06 0.00 0.10 0.00 0.00 66.02 63.63 2nx5 s SER 153 CO 0.51 0.21 0.77 -0.54 0.98 0.00 0.00 173.24 175.16 2nx5 s LYS 154 N -1.27 2.41 0.00 4.02 1.02 -1.26 -4.64 119.74 120.02 2nx5 s LYS 154 Ca 0.34 -1.12 0.00 0.00 0.02 0.00 0.00 55.97 55.21 2nx5 s LYS 154 Cb -0.21 -2.56 0.00 0.00 -0.52 0.00 0.00 37.83 34.55 2nx5 s LYS 154 CO 0.23 -0.77 0.00 -0.40 -0.92 0.00 0.00 175.35 173.49 2nx5 n ASP 155 N -2.29 0.00 0.00 2.83 5.68 -1.26 -4.22 116.55 117.28 2nx5 n ASP 155 Ca 0.11 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.40 2nx5 n ASP 155 Cb 0.60 -1.78 0.00 0.00 -1.14 0.00 0.00 41.12 38.81 2nx5 n ASP 155 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 2nx5 n SER 156 N 0.00 0.00 -0.09 -1.12 7.64 -1.26 -4.60 113.62 114.19 2nx5 n SER 156 Ca 0.00 0.00 -0.16 0.00 1.01 0.00 0.00 58.87 59.72 2nx5 n SER 156 Cb 0.00 -2.14 -0.14 0.00 -1.01 0.00 0.00 64.21 60.92 2nx5 n SER 156 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2nx5 n ASP 157 N 0.00 1.37 -4.71 6.43 10.43 -1.26 -4.86 116.55 123.95 2nx5 n ASP 157 Ca 0.00 0.02 -0.41 0.00 2.57 0.00 0.00 54.79 56.96 2nx5 n ASP 157 Cb 0.00 -0.08 -0.03 0.00 1.84 0.00 0.00 41.12 42.85 2nx5 n ASP 157 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 2nx5 s VAL 158 N -2.53 4.92 -0.17 2.53 1.01 -1.26 -4.10 120.40 120.81 2nx5 s VAL 158 Ca -0.23 1.88 -0.02 0.00 0.00 0.00 0.00 61.98 63.61 2nx5 s VAL 158 Cb 0.08 -4.24 -0.02 0.00 0.00 0.00 0.00 36.38 32.20 2nx5 s VAL 158 CO 0.71 0.18 -0.08 -0.31 0.00 0.00 0.00 175.10 175.61 2nx5 s TYR 159 N 0.96 2.91 -0.10 5.22 2.02 0.91 -4.73 117.35 124.54 2nx5 s TYR 159 Ca 0.48 -0.67 0.02 0.00 -0.37 0.00 0.00 57.07 56.53 2nx5 s TYR 159 Cb -0.20 -1.96 0.01 0.00 -0.40 0.00 0.00 41.96 39.41 2nx5 s TYR 159 CO 0.25 -0.29 -0.17 0.42 -1.57 0.00 0.00 175.55 174.19 2nx5 s ILE 160 N 0.74 1.63 0.63 2.71 1.01 -1.26 -1.66 121.20 125.00 2nx5 s ILE 160 Ca -0.04 -0.74 -0.09 0.00 0.00 0.00 0.00 60.65 59.79 2nx5 s ILE 160 Cb -0.15 -1.46 -0.00 0.00 0.01 0.00 0.00 42.46 40.86 2nx5 s ILE 160 CO 0.02 0.46 0.98 0.42 0.00 0.00 0.00 174.94 176.83 2nx5 s THR 161 N 0.77 3.88 0.62 2.92 -4.23 -0.39 -4.79 115.64 114.41 2nx5 s THR 161 Ca -0.11 0.34 -0.15 0.00 -1.18 0.00 0.00 61.69 60.59 2nx5 s THR 161 Cb -0.16 -3.57 -0.02 0.00 1.34 0.00 0.00 72.50 70.09 2nx5 s THR 161 CO 0.02 -0.67 1.07 -0.62 -0.54 0.00 0.00 174.62 173.88 2nx5 s ASP 162 N -4.29 5.57 0.37 3.99 -1.08 -1.26 -4.52 116.67 115.46 2nx5 s ASP 162 Ca 0.55 1.86 -0.28 0.00 -0.52 0.00 0.00 52.55 54.16 2nx5 s ASP 162 Cb -0.11 -2.54 -0.11 0.00 -1.46 0.00 0.00 42.92 38.71 2nx5 s ASP 162 CO 0.49 -1.31 1.43 -1.59 0.52 0.00 0.00 175.17 174.71 2nx5 s LYS 163 N -4.11 4.14 0.05 4.34 -2.85 -1.26 -4.72 119.74 115.31 2nx5 s LYS 163 Ca 0.64 2.46 0.01 0.00 -1.00 0.00 0.00 55.97 58.08 2nx5 s LYS 163 Cb -0.17 -2.96 -0.03 0.00 -2.06 0.00 0.00 37.83 32.61 2nx5 s LYS 163 CO 0.39 -0.46 -0.05 0.00 0.10 0.00 0.00 175.35 175.32 2nx5 s VAL 165 N -2.28 3.47 0.09 0.00 1.01 -1.26 -2.01 120.40 119.42 2nx5 s VAL 165 Ca -0.05 -0.49 0.04 0.00 0.00 0.00 0.00 61.98 61.48 2nx5 s VAL 165 Cb -0.04 -2.53 -0.04 0.00 0.00 0.00 0.00 36.38 33.77 2nx5 s VAL 165 CO -0.03 0.47 0.02 -1.48 0.00 0.00 0.00 175.10 174.08 2nx5 s LEU 166 N 0.80 3.54 -0.21 3.92 0.05 -0.88 -4.98 118.68 120.92 2nx5 s LEU 166 Ca -0.02 -0.14 0.02 0.00 0.05 0.00 0.00 54.13 54.03 2nx5 s LEU 166 Cb -0.15 -2.26 0.04 0.00 -2.05 0.00 0.00 46.19 41.78 2nx5 s LEU 166 CO 0.02 0.17 -0.14 -0.62 -0.55 0.00 0.00 176.35 175.23 2nx5 s ASP 167 N -2.34 3.68 -0.80 1.48 2.15 -1.26 -2.26 116.67 117.33 2nx5 s ASP 167 Ca 0.27 -0.99 -0.21 0.00 0.43 0.00 0.00 52.55 52.05 2nx5 s ASP 167 Cb -0.12 -1.44 0.09 0.00 -0.30 0.00 0.00 42.92 41.16 2nx5 s ASP 167 CO 0.19 -0.11 1.07 -0.04 -0.17 0.00 0.00 175.17 176.12 2nx5 s MET 168 N 1.25 3.34 0.25 4.34 -1.94 0.94 -4.92 119.30 122.57 2nx5 s MET 168 Ca -0.02 -1.21 -0.04 0.00 -1.71 0.00 0.00 55.69 52.71 2nx5 s MET 168 Cb -0.16 -4.59 0.30 0.00 2.01 0.00 0.00 34.83 32.38 2nx5 s MET 168 CO -0.09 -1.84 1.83 0.00 -0.01 0.00 0.00 175.02 174.91 2nx5 h ARG 169 N 9.31 1.03 -0.25 2.03 3.08 -1.97 -1.50 114.38 126.11 2nx5 h ARG 169 Ca -0.07 -0.18 -0.03 0.00 0.07 0.00 0.00 59.98 59.77 2nx5 h ARG 169 Cb 1.05 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.91 2nx5 h ARG 169 CO 1.18 0.84 0.05 0.66 -1.07 0.00 0.00 179.97 181.63 2nx5 h SER 170 N 1.01 0.39 -0.22 7.04 4.64 -1.96 -3.09 113.55 121.36 2nx5 h SER 170 Ca 0.23 -0.24 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2nx5 h SER 170 Cb 0.20 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 2nx5 h SER 170 CO -0.02 0.53 0.00 0.23 -0.87 0.00 0.00 176.83 176.70 2nx5 n MET 171 N -4.70 1.73 -3.78 4.77 2.81 -1.14 -4.93 117.12 111.87 2nx5 n MET 171 Ca -0.03 -1.11 -0.27 0.00 -1.81 0.00 0.00 57.70 54.48 2nx5 n MET 171 Cb 0.19 -1.34 0.02 0.00 -0.71 0.00 0.00 33.22 31.37 2nx5 n MET 171 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2nx5 n ASP 172 N 0.35 -2.72 -4.19 7.83 2.03 -0.92 -4.98 116.55 113.94 2nx5 n ASP 172 Ca 0.14 -0.98 -0.27 0.00 0.52 0.00 0.00 54.79 54.21 2nx5 n ASP 172 Cb 0.31 -3.40 -0.16 0.00 -0.72 0.00 0.00 41.12 37.15 2nx5 n ASP 172 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 2nx5 s PHE 173 N -3.69 1.82 -0.01 -0.67 5.36 -0.61 -5.02 117.98 115.17 2nx5 s PHE 173 Ca 0.22 -0.41 0.02 0.00 -0.96 0.00 0.00 56.93 55.79 2nx5 s PHE 173 Cb -0.08 -1.19 0.00 0.00 -0.34 0.00 0.00 43.02 41.41 2nx5 s PHE 173 CO 0.86 -0.08 -0.06 0.15 -1.46 0.00 0.00 175.22 174.63 2nx5 s LYS 174 N -0.31 0.59 -0.01 10.12 1.02 -1.26 -0.04 119.74 129.85 2nx5 s LYS 174 Ca 0.04 -0.20 -0.10 0.00 0.02 0.00 0.00 55.97 55.73 2nx5 s LYS 174 Cb -0.09 -0.58 0.01 0.00 -0.52 0.00 0.00 37.83 36.64 2nx5 s LYS 174 CO 0.00 0.09 0.20 -1.54 -0.92 0.00 0.00 175.35 173.19 2nx5 s SER 175 N 0.10 -0.07 0.20 2.83 1.04 -0.96 -4.94 113.70 111.91 2nx5 s SER 175 Ca -0.01 -0.04 -0.06 0.00 0.48 0.00 0.00 55.95 56.32 2nx5 s SER 175 Cb -0.05 0.27 -0.06 0.00 0.10 0.00 0.00 66.02 66.28 2nx5 s SER 175 CO -0.00 -0.37 0.46 0.20 0.98 0.00 0.00 173.24 174.51 2nx5 s ASN 176 N -1.22 6.51 -0.29 7.02 0.01 -1.26 -2.06 114.94 123.65 2nx5 s ASN 176 Ca -0.13 0.68 -0.15 0.00 -0.71 0.00 0.00 52.86 52.56 2nx5 s ASN 176 Cb -0.06 -2.13 0.10 0.00 0.41 0.00 0.00 41.25 39.57 2nx5 s ASN 176 CO 0.02 -0.04 0.73 -0.94 -1.51 0.00 0.00 177.10 175.36 2nx5 s SER 177 N -2.64 -0.92 0.21 -1.22 1.04 -0.85 -1.89 113.70 107.43 2nx5 s SER 177 Ca 0.43 1.41 0.10 0.00 0.48 0.00 0.00 55.95 58.37 2nx5 s SER 177 Cb -0.11 1.56 -0.04 0.00 0.10 0.00 0.00 66.02 67.52 2nx5 s SER 177 CO 0.25 -0.22 -0.12 0.00 0.98 0.00 0.00 173.24 174.13 2nx5 s ALA 178 N 1.88 2.88 -0.08 5.32 0.00 0.91 -2.66 121.76 130.01 2nx5 s ALA 178 Ca -0.09 -1.58 0.03 0.00 0.00 0.00 0.00 51.96 50.32 2nx5 s ALA 178 Cb -0.06 -0.61 0.01 0.00 0.00 0.00 0.00 23.12 22.46 2nx5 s ALA 178 CO -0.19 0.41 -0.16 0.08 0.00 0.00 0.00 175.76 175.90 2nx5 s VAL 179 N -1.89 1.43 -0.06 0.00 1.01 -1.26 -1.30 120.40 118.33 2nx5 s VAL 179 Ca 0.26 -0.64 0.02 0.00 0.00 0.00 0.00 61.98 61.61 2nx5 s VAL 179 Cb -0.08 -1.28 0.01 0.00 0.00 0.00 0.00 36.38 35.04 2nx5 s VAL 179 CO 0.15 0.42 -0.11 0.00 0.00 0.00 0.00 175.10 175.56 2nx5 s ALA 180 N 0.62 1.12 0.04 5.51 0.00 -0.54 -1.27 121.76 127.25 2nx5 s ALA 180 Ca -0.15 -0.34 -0.11 0.00 0.00 0.00 0.00 51.96 51.37 2nx5 s ALA 180 Cb -0.16 -0.52 0.01 0.00 0.00 0.00 0.00 23.12 22.45 2nx5 s ALA 180 CO 0.04 0.10 0.23 1.67 0.00 0.00 0.00 175.76 177.80 2nx5 s TRP 181 N 0.67 0.00 0.24 0.00 -2.14 -0.66 -0.58 118.94 116.47 2nx5 s TRP 181 Ca -0.13 -0.20 -0.05 0.00 2.66 0.00 0.00 56.10 58.38 2nx5 s TRP 181 Cb -0.15 0.01 -0.02 0.00 -3.10 0.00 0.00 33.47 30.21 2nx5 s TRP 181 CO 0.03 -0.46 0.30 0.45 -2.66 0.00 0.00 176.95 174.60 2nx5 s SER 182 N -2.10 0.22 -0.13 -2.66 0.15 -1.26 -0.06 113.70 107.85 2nx5 s SER 182 Ca -0.05 -1.25 0.13 0.00 0.70 0.00 0.00 55.95 55.48 2nx5 s SER 182 Cb -0.01 0.49 -0.24 0.00 -1.71 0.00 0.00 66.02 64.56 2nx5 s SER 182 CO -0.04 -1.00 0.32 0.59 1.20 0.00 0.00 173.24 174.31 2nx5 n ASN 183 N -0.49 0.66 -4.59 5.45 5.03 -1.26 -4.88 115.26 115.18 2nx5 n ASN 183 Ca 0.01 0.18 -0.51 0.00 0.87 0.00 0.00 54.58 55.13 2nx5 n ASN 183 Cb 0.64 0.32 -0.05 0.00 -1.02 0.00 0.00 39.78 39.67 2nx5 n ASN 183 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.26 176.60 2nx5 n LYS 184 N -2.96 1.17 0.00 3.52 4.81 -1.26 -4.87 118.16 118.56 2nx5 n LYS 184 Ca -0.27 0.42 0.12 0.00 -0.87 0.00 0.00 58.31 57.70 2nx5 n LYS 184 Cb 1.09 -2.03 0.56 0.00 0.02 0.00 0.00 35.03 34.68 2nx5 n LYS 184 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 2nx5 n SER 185 N 2.41 0.00 -2.24 3.14 3.41 -1.26 -3.29 113.62 115.79 2nx5 n SER 185 Ca 0.17 0.13 -0.30 0.00 -0.26 0.00 0.00 58.87 58.61 2nx5 n SER 185 Cb 0.21 -0.36 0.08 0.00 -0.26 0.00 0.00 64.21 63.88 2nx5 n SER 185 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2nx5 n ASP 186 N -1.36 7.02 -4.31 4.04 10.43 -1.26 -4.95 116.55 126.16 2nx5 n ASP 186 Ca 0.09 -3.64 -0.35 0.00 2.57 0.00 0.00 54.79 53.46 2nx5 n ASP 186 Cb 0.22 -0.97 -0.14 0.00 1.84 0.00 0.00 41.12 42.07 2nx5 n ASP 186 CO 0.00 0.00 0.00 0.12 -1.07 0.00 0.00 177.20 176.25 2nx5 s PHE 187 N -3.41 3.00 0.53 1.24 5.99 -1.21 -5.10 117.98 119.03 2nx5 s PHE 187 Ca 0.58 -0.97 0.03 0.00 0.00 0.00 0.00 56.93 56.56 2nx5 s PHE 187 Cb 0.46 -2.12 0.02 0.00 0.00 0.00 0.00 43.02 41.37 2nx5 s PHE 187 CO 0.00 -0.56 0.18 0.00 -0.00 0.00 0.00 175.22 174.85 2nx5 s ALA 188 N 1.47 4.32 -0.10 11.12 0.00 -1.26 -5.09 121.76 132.23 2nx5 s ALA 188 Ca 0.05 -0.66 0.12 0.00 0.00 0.00 0.00 51.96 51.47 2nx5 s ALA 188 Cb -0.15 -0.32 -0.17 0.00 0.00 0.00 0.00 23.12 22.49 2nx5 s ALA 188 CO -0.02 -0.21 0.11 0.00 0.00 0.00 0.00 175.76 175.63 2nx5 h ALA 190 N 0.77 1.54 0.00 0.00 0.00 -1.98 -1.97 119.26 117.62 2nx5 h ALA 190 Ca -0.25 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2nx5 h ALA 190 Cb 1.47 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.27 2nx5 h ALA 190 CO 0.01 -0.09 -0.14 0.27 0.00 0.00 0.00 179.25 179.31 2nx5 n ASN 191 N -3.74 1.59 0.10 0.00 6.94 -1.26 -4.78 115.26 114.12 2nx5 n ASN 191 Ca -0.02 -2.66 -0.02 0.00 -0.02 0.00 0.00 54.58 51.87 2nx5 n ASN 191 Cb 0.15 -0.33 0.23 0.00 -2.36 0.00 0.00 39.78 37.47 2nx5 n ASN 191 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2nx5 h ALA 192 N 0.00 1.12 -1.50 -2.53 0.00 -1.46 -3.33 119.26 111.57 2nx5 h ALA 192 Ca 0.00 -0.42 -0.75 0.00 0.00 0.00 0.00 54.91 53.74 2nx5 h ALA 192 Cb 1.08 -0.09 -0.31 0.00 0.00 0.00 0.00 17.79 18.48 2nx5 h ALA 192 CO 0.00 0.59 0.60 1.19 0.00 0.00 0.00 179.25 181.63 2nx5 n PHE 193 N -4.02 3.11 -0.06 0.00 3.01 -1.26 -5.08 117.46 113.17 2nx5 n PHE 193 Ca -0.02 -2.91 0.00 0.00 1.01 0.00 0.00 57.45 55.54 2nx5 n PHE 193 Cb 0.48 -1.01 0.00 0.00 -0.01 0.00 0.00 39.48 38.95 2nx5 n PHE 193 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86