#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2byp n LYS -1 N 0.00 0.00 0.19 -1.24 5.02 -1.26 -4.35 118.16 116.52 2byp n LYS -1 Ca 0.00 0.00 0.04 0.00 -2.02 0.00 0.00 58.31 56.33 2byp n LYS -1 Cb 0.00 -0.20 0.39 0.00 -0.02 0.00 0.00 35.03 35.19 2byp n LYS -1 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2byp h LEU 0 N 0.00 0.00 -0.23 -0.35 5.85 -2.04 -0.20 115.31 118.34 2byp h LEU 0 Ca 0.00 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.57 2byp h LEU 0 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 2byp h LEU 0 CO 0.00 0.36 -0.44 0.45 -0.34 0.00 0.00 178.44 178.47 2byp h HIS 1 N 0.00 0.89 -0.52 1.25 3.86 -1.97 0.70 115.15 119.36 2byp h HIS 1 Ca -0.00 -0.32 -0.03 0.00 -1.16 0.00 0.00 60.37 58.85 2byp h HIS 1 Cb 0.73 -0.17 -0.02 0.00 1.06 0.00 0.00 27.41 29.01 2byp h HIS 1 CO 0.00 1.10 0.20 0.66 0.86 0.00 0.00 177.93 180.75 2byp h SER 2 N 0.43 0.74 -0.82 2.45 4.64 -1.74 0.35 113.55 119.60 2byp h SER 2 Ca 0.01 -0.18 -0.04 0.00 -0.47 0.00 0.00 61.79 61.11 2byp h SER 2 Cb 1.05 -0.19 -0.04 0.00 -0.31 0.00 0.00 62.40 62.91 2byp h SER 2 CO 0.10 0.72 0.37 -0.61 -0.87 0.00 0.00 176.83 176.54 2byp h GLN 3 N 0.71 1.19 -0.37 4.77 4.15 -0.99 -1.53 115.11 123.04 2byp h GLN 3 Ca 0.17 -0.19 -0.03 0.00 0.77 0.00 0.00 58.65 59.37 2byp h GLN 3 Cb 0.22 -0.21 -0.02 0.00 0.21 0.00 0.00 27.48 27.69 2byp h GLN 3 CO -0.01 0.93 0.11 0.00 -1.93 0.00 0.00 178.83 177.93 2byp h ALA 4 N 1.20 0.49 -0.81 3.38 0.00 0.73 -1.81 119.26 122.43 2byp h ALA 4 Ca 0.28 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 55.05 2byp h ALA 4 Cb 0.15 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 2byp h ALA 4 CO -0.03 0.14 0.52 -0.91 0.00 0.00 0.00 179.25 178.97 2byp h ASN 5 N 0.46 0.86 -0.29 0.00 2.35 -0.05 -0.39 115.58 118.52 2byp h ASN 5 Ca 0.12 -0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.80 2byp h ASN 5 Cb 0.27 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.44 2byp h ASN 5 CO -0.00 0.59 -0.09 0.25 -1.65 0.00 0.00 177.43 176.53 2byp h LEU 6 N 1.01 0.57 -0.97 1.61 5.85 -1.23 -1.17 115.31 120.98 2byp h LEU 6 Ca 0.33 -0.38 0.05 0.00 0.84 0.00 0.00 57.88 58.72 2byp h LEU 6 Cb 0.02 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 40.83 2byp h LEU 6 CO -0.12 0.82 0.63 0.24 -0.34 0.00 0.00 178.44 179.67 2byp h MET 7 N 0.32 1.15 -0.35 1.25 2.86 -0.97 -1.05 114.93 118.13 2byp h MET 7 Ca 0.07 -0.07 -0.07 0.00 -2.06 0.00 0.00 59.70 57.57 2byp h MET 7 Cb 0.58 -0.26 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 2byp h MET 7 CO 0.03 0.76 -0.05 -0.09 1.06 0.00 0.00 176.91 178.62 2byp h ARG 8 N 1.19 0.65 0.09 1.72 2.43 -0.95 -1.47 114.38 118.04 2byp h ARG 8 Ca 0.40 -0.23 0.01 0.00 -0.81 0.00 0.00 59.98 59.34 2byp h ARG 8 Cb 0.06 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.55 2byp h ARG 8 CO -0.14 0.80 -0.15 1.25 -1.51 0.00 0.00 179.97 180.22 2byp h LEU 9 N 0.45 -0.41 -0.60 3.80 5.85 -0.93 0.45 115.31 123.91 2byp h LEU 9 Ca 0.09 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.84 2byp h LEU 9 Cb 0.54 0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.70 2byp h LEU 9 CO 0.03 -0.22 0.31 0.11 -0.34 0.00 0.00 178.44 178.33 2byp h LYS 10 N -0.30 0.85 -0.20 1.25 1.57 -1.16 -0.47 116.57 118.11 2byp h LYS 10 Ca 0.02 -0.11 0.04 0.00 -1.87 0.00 0.00 60.65 58.73 2byp h LYS 10 Cb 0.31 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.43 2byp h LYS 10 CO -0.08 0.67 -0.02 1.03 -0.57 0.00 0.00 179.45 180.48 2byp h SER 11 N 0.82 -0.12 -0.90 0.86 0.87 -1.14 0.08 113.55 114.01 2byp h SER 11 Ca 0.21 0.05 0.03 0.00 -1.23 0.00 0.00 61.79 60.85 2byp h SER 11 Cb 0.08 0.10 -0.05 0.00 -0.44 0.00 0.00 62.40 62.08 2byp h SER 11 CO -0.03 -0.03 0.59 0.44 -0.53 0.00 0.00 176.83 177.27 2byp h ASP 12 N 0.04 0.98 0.23 6.23 3.32 -0.34 0.55 116.42 127.43 2byp h ASP 12 Ca 0.10 -0.01 -0.30 0.00 0.02 0.00 0.00 57.03 56.83 2byp h ASP 12 Cb 0.13 -0.23 0.03 0.00 0.22 0.00 0.00 39.33 39.48 2byp h ASP 12 CO -0.18 0.68 -1.27 -0.07 -1.72 0.00 0.00 179.24 176.67 2byp h LEU 13 N 1.14 0.80 0.05 1.55 3.38 -0.88 -3.32 115.31 118.03 2byp h LEU 13 Ca 0.36 -0.76 -0.37 0.00 0.09 0.00 0.00 57.88 57.19 2byp h LEU 13 Cb 0.00 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.46 2byp h LEU 13 CO -0.10 1.58 -2.13 0.49 0.09 0.00 0.00 178.44 178.36 2byp n PHE 14 N -3.74 0.65 -0.11 1.13 0.99 -0.01 -4.50 117.46 111.87 2byp n PHE 14 Ca -0.13 0.17 -0.19 0.00 -0.00 0.00 0.00 57.45 57.29 2byp n PHE 14 Cb 1.01 -1.08 -0.12 0.00 -1.00 0.00 0.00 39.48 38.28 2byp n PHE 14 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.76 176.85 2byp n ASN 15 N -3.64 2.00 0.00 4.37 3.02 0.19 -4.05 115.26 117.14 2byp n ASN 15 Ca -0.40 -0.06 0.01 0.00 -0.03 0.00 0.00 54.58 54.10 2byp n ASN 15 Cb 0.96 -0.50 0.08 0.00 -0.61 0.00 0.00 39.78 39.71 2byp n ASN 15 CO 0.00 0.00 0.00 -2.11 -2.62 0.00 0.00 177.26 172.53 2byp n ARG 16 N -3.36 0.90 -4.22 3.52 1.85 -0.70 -4.79 116.66 109.85 2byp n ARG 16 Ca -0.45 0.00 -0.19 0.00 -1.00 0.00 0.00 57.85 56.21 2byp n ARG 16 Cb 0.99 -1.04 -0.16 0.00 -1.05 0.00 0.00 32.46 31.20 2byp n ARG 16 CO 0.00 0.00 0.00 -1.12 -0.01 0.00 0.00 177.63 176.50 2byp s SER 17 N -1.18 0.90 0.73 2.89 0.01 -1.26 -5.03 113.70 110.76 2byp s SER 17 Ca 0.04 -0.13 -0.12 0.00 1.31 0.00 0.00 55.95 57.05 2byp s SER 17 Cb 0.02 -0.30 0.03 0.00 0.21 0.00 0.00 66.02 65.98 2byp s SER 17 CO 0.03 0.01 1.09 -2.16 0.41 0.00 0.00 173.24 172.62 2byp s PRO 18 N 0.43 2.55 0.20 12.44 0.04 -1.26 -4.87 135.00 144.54 2byp s PRO 18 Ca -0.06 1.16 -0.31 0.00 0.04 0.00 0.00 61.00 61.84 2byp s PRO 18 Cb -0.10 -1.93 -0.10 0.00 0.04 0.00 0.00 34.50 32.42 2byp s PRO 18 CO 0.00 -1.41 1.45 -1.64 0.04 0.00 0.00 177.00 175.44 2byp s MET 19 N -4.76 4.27 -0.12 4.56 -1.94 -1.26 -4.92 119.30 115.14 2byp s MET 19 Ca 0.61 2.26 -0.29 0.00 -1.71 0.00 0.00 55.69 56.56 2byp s MET 19 Cb -0.17 -3.15 -0.05 0.00 2.01 0.00 0.00 34.83 33.47 2byp s MET 19 CO 0.52 -0.45 1.86 -0.47 -0.01 0.00 0.00 175.02 176.47 2byp s TYR 20 N 0.45 1.64 -2.00 -0.03 5.04 -1.26 -4.85 117.35 116.34 2byp s TYR 20 Ca 0.62 0.19 0.02 0.00 -2.44 0.00 0.00 57.07 55.46 2byp s TYR 20 Cb -0.41 -4.04 0.04 0.00 0.35 0.00 0.00 41.96 37.90 2byp s TYR 20 CO 0.38 -4.11 1.04 -0.35 -1.34 0.00 0.00 175.55 171.16 2byp n PRO 21 N 7.78 1.12 0.00 4.97 -0.04 -1.26 -4.92 135.00 142.65 2byp n PRO 21 Ca 0.21 -0.18 0.00 0.00 -0.04 0.00 0.00 63.50 63.49 2byp n PRO 21 Cb 0.44 -1.04 0.00 0.00 -0.04 0.00 0.00 33.50 32.86 2byp n PRO 21 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2byp n GLY 22 N 0.58 -0.61 3.81 0.55 0.00 -1.26 -5.01 105.19 103.24 2byp n GLY 22 Ca 0.02 -1.72 -0.31 0.00 0.00 0.00 0.00 46.02 44.01 2byp n GLY 22 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2byp s PRO 23 N -1.77 2.80 0.25 1.61 0.04 -1.26 -5.06 135.00 131.61 2byp s PRO 23 Ca 0.00 0.94 -0.01 0.00 0.04 0.00 0.00 61.00 61.97 2byp s PRO 23 Cb 0.00 -1.98 -0.03 0.00 0.04 0.00 0.00 34.50 32.54 2byp s PRO 23 CO 0.00 -1.19 0.25 0.95 0.04 0.00 0.00 177.00 177.04 2byp s THR 24 N -3.05 0.00 0.28 1.26 -4.23 -0.79 -4.98 115.64 104.13 2byp s THR 24 Ca 0.59 -1.88 -0.01 0.00 -1.18 0.00 0.00 61.69 59.21 2byp s THR 24 Cb -0.14 -2.47 0.28 0.00 1.34 0.00 0.00 72.50 71.50 2byp s THR 24 CO 0.55 0.00 1.89 0.11 -0.54 0.00 0.00 174.62 176.63 2byp h LYS 25 N 2.41 1.09 0.00 3.99 1.57 -1.91 -0.29 116.57 123.42 2byp h LYS 25 Ca -0.31 -0.07 -0.07 0.00 -1.87 0.00 0.00 60.65 58.33 2byp h LYS 25 Cb 1.24 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 33.30 2byp h LYS 25 CO 0.45 0.72 -0.35 -0.44 -0.57 0.00 0.00 179.45 179.27 2byp h ASP 26 N 1.12 0.00 -1.99 0.86 3.45 -1.96 -3.37 116.42 114.53 2byp h ASP 26 Ca 0.43 0.00 -0.54 0.00 0.43 0.00 0.00 57.03 57.35 2byp h ASP 26 Cb 0.21 0.00 -0.39 0.00 -0.56 0.00 0.00 39.33 38.59 2byp h ASP 26 CO -0.17 0.35 -1.13 -0.67 -1.57 0.00 0.00 179.24 176.05 2byp n ASP 27 N -3.45 0.31 -4.85 6.45 2.03 -0.72 -5.13 116.55 111.20 2byp n ASP 27 Ca 0.00 -2.77 -0.30 0.00 0.52 0.00 0.00 54.79 52.24 2byp n ASP 27 Cb 0.52 -0.62 0.08 0.00 -0.72 0.00 0.00 41.12 40.38 2byp n ASP 27 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2byp s PRO 28 N -1.47 2.22 -0.02 -0.67 0.04 -0.20 -1.89 135.00 133.00 2byp s PRO 28 Ca 0.36 0.44 0.01 0.00 0.04 0.00 0.00 61.00 61.85 2byp s PRO 28 Cb 0.21 -1.95 0.02 0.00 0.04 0.00 0.00 34.50 32.82 2byp s PRO 28 CO -0.10 -1.48 -0.01 -1.17 0.04 0.00 0.00 177.00 174.27 2byp s LEU 29 N -5.63 1.41 -0.06 -3.56 2.96 -0.38 -4.92 118.68 108.50 2byp s LEU 29 Ca 0.60 -0.04 -0.18 0.00 -0.22 0.00 0.00 54.13 54.29 2byp s LEU 29 Cb -0.13 -0.23 -0.05 0.00 0.50 0.00 0.00 46.19 46.29 2byp s LEU 29 CO 0.52 -0.06 0.50 -0.89 -1.32 0.00 0.00 176.35 175.11 2byp s THR 30 N 0.71 5.07 -0.15 3.68 2.01 -1.26 -0.98 115.64 124.73 2byp s THR 30 Ca -0.07 1.03 0.02 0.00 0.31 0.00 0.00 61.69 62.97 2byp s THR 30 Cb -0.10 -3.83 0.01 0.00 0.01 0.00 0.00 72.50 68.58 2byp s THR 30 CO -0.01 0.40 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.42 2byp s VAL 31 N 0.05 2.07 -0.19 3.82 1.01 0.37 -4.38 120.40 123.15 2byp s VAL 31 Ca 0.27 -0.97 -0.08 0.00 0.00 0.00 0.00 61.98 61.20 2byp s VAL 31 Cb -0.16 -1.83 -0.04 0.00 0.00 0.00 0.00 36.38 34.34 2byp s VAL 31 CO 0.13 0.55 0.08 -0.89 0.00 0.00 0.00 175.10 174.97 2byp s THR 32 N 0.89 4.93 0.01 3.92 2.01 0.27 -1.56 115.64 126.11 2byp s THR 32 Ca -0.05 0.02 0.05 0.00 0.31 0.00 0.00 61.69 62.01 2byp s THR 32 Cb -0.15 -3.23 -0.03 0.00 0.01 0.00 0.00 72.50 69.10 2byp s THR 32 CO -0.04 0.45 -0.12 -0.76 -0.69 0.00 0.00 174.62 173.46 2byp s LEU 33 N 0.44 2.88 -0.09 4.42 1.43 0.20 -1.49 118.68 126.47 2byp s LEU 33 Ca 0.04 -0.26 -0.07 0.00 -1.03 0.00 0.00 54.13 52.82 2byp s LEU 33 Cb -0.12 -1.65 0.03 0.00 0.03 0.00 0.00 46.19 44.47 2byp s LEU 33 CO 0.00 0.29 0.23 -0.83 0.23 0.00 0.00 176.35 176.26 2byp s GLY 34 N -1.28 -0.16 -0.16 -3.19 0.00 -0.74 -0.90 107.32 100.89 2byp s GLY 34 Ca 0.15 0.71 -0.08 0.00 0.00 0.00 0.00 44.72 45.51 2byp s GLY 34 CO 0.05 0.71 0.10 -1.36 0.00 0.00 0.00 173.10 172.60 2byp s PHE 35 N 0.39 3.39 -0.40 1.90 0.08 -1.26 -0.40 117.98 121.68 2byp s PHE 35 Ca -0.02 0.30 -0.08 0.00 0.12 0.00 0.00 56.93 57.24 2byp s PHE 35 Cb -0.04 -2.03 0.07 0.00 -0.57 0.00 0.00 43.02 40.45 2byp s PHE 35 CO -0.02 0.40 0.22 0.99 -0.10 0.00 0.00 175.22 176.71 2byp s THR 36 N -0.17 4.08 -0.25 0.64 2.01 -0.36 -1.32 115.64 120.26 2byp s THR 36 Ca 0.09 -1.37 -0.25 0.00 0.31 0.00 0.00 61.69 60.47 2byp s THR 36 Cb -0.12 -3.47 -0.00 0.00 0.01 0.00 0.00 72.50 68.92 2byp s THR 36 CO 0.01 -0.44 0.84 -0.22 -0.69 0.00 0.00 174.62 174.11 2byp s LEU 37 N 1.40 4.08 -0.19 4.42 2.96 -0.40 -0.85 118.68 130.10 2byp s LEU 37 Ca 0.02 1.01 -0.03 0.00 -0.22 0.00 0.00 54.13 54.92 2byp s LEU 37 Cb -0.22 -3.20 -0.21 0.00 0.50 0.00 0.00 46.19 43.06 2byp s LEU 37 CO 0.02 -0.54 0.05 0.00 -1.32 0.00 0.00 176.35 174.56 2byp n GLN 38 N 6.06 0.70 -3.60 1.98 6.02 -0.02 -3.68 117.38 124.85 2byp n GLN 38 Ca 0.06 0.21 -0.11 0.00 -0.01 0.00 0.00 57.00 57.15 2byp n GLN 38 Cb 0.47 -1.61 -0.06 0.00 1.02 0.00 0.00 30.24 30.06 2byp n GLN 38 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 2byp s ASP 39 N -6.78 -0.45 -0.49 1.08 2.15 -0.83 -0.26 116.67 111.08 2byp s ASP 39 Ca -0.29 0.68 -0.18 0.00 0.43 0.00 0.00 52.55 53.19 2byp s ASP 39 Cb 0.08 0.63 0.06 0.00 -0.30 0.00 0.00 42.92 43.39 2byp s ASP 39 CO 0.68 -0.29 0.55 -0.63 -0.17 0.00 0.00 175.17 175.32 2byp s ILE 40 N -0.48 4.98 -0.01 4.11 1.01 -1.26 -0.91 121.20 128.63 2byp s ILE 40 Ca -0.01 -0.62 -0.02 0.00 0.00 0.00 0.00 60.65 60.00 2byp s ILE 40 Cb -0.03 -4.24 -0.27 0.00 0.01 0.00 0.00 42.46 37.94 2byp s ILE 40 CO -0.01 -0.72 0.79 -0.37 0.00 0.00 0.00 174.94 174.63 2byp h VAL 41 N 5.83 1.07 -3.10 2.92 -1.51 -1.39 -3.42 116.25 116.65 2byp h VAL 41 Ca -0.28 -2.73 -0.15 0.00 -1.23 0.00 0.00 66.70 62.30 2byp h VAL 41 Cb 1.10 2.71 -0.25 0.00 -2.13 0.00 0.00 31.29 32.72 2byp h VAL 41 CO 0.93 0.80 -0.40 -0.75 -1.23 0.00 0.00 177.57 176.93 2byp s LYS 42 N -2.61 0.35 -0.19 5.19 2.20 -1.20 -4.97 119.74 118.51 2byp s LYS 42 Ca -0.10 0.30 -0.02 0.00 -0.36 0.00 0.00 55.97 55.79 2byp s LYS 42 Cb 0.07 0.17 0.05 0.00 -1.51 0.00 0.00 37.83 36.61 2byp s LYS 42 CO 0.84 -0.05 0.01 0.00 -0.36 0.00 0.00 175.35 175.79 2byp s ALA 43 N -0.03 1.19 -0.40 3.13 0.00 -1.26 -0.77 121.76 123.62 2byp s ALA 43 Ca -0.02 -0.77 -0.05 0.00 0.00 0.00 0.00 51.96 51.13 2byp s ALA 43 Cb -0.02 -1.17 0.09 0.00 0.00 0.00 0.00 23.12 22.01 2byp s ALA 43 CO 0.01 -1.06 0.19 0.34 0.00 0.00 0.00 175.76 175.24 2byp s ASP 44 N 1.77 5.33 0.00 0.00 -1.08 0.32 -4.95 116.67 118.06 2byp s ASP 44 Ca -0.01 -1.74 0.30 0.00 -0.52 0.00 0.00 52.55 50.59 2byp s ASP 44 Cb -0.17 -1.87 1.58 0.00 -1.46 0.00 0.00 42.92 41.01 2byp s ASP 44 CO -0.07 -0.50 2.06 -1.54 0.52 0.00 0.00 175.17 175.64 2byp n SER 45 N 4.71 0.17 0.16 -0.34 3.41 -1.26 -0.12 113.62 120.34 2byp n SER 45 Ca -0.07 -0.61 0.08 0.00 -0.26 0.00 0.00 58.87 58.02 2byp n SER 45 Cb 0.42 -0.12 0.07 0.00 -0.26 0.00 0.00 64.21 64.32 2byp n SER 45 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2byp h SER 46 N 0.23 0.00 0.00 4.04 4.64 -1.96 -3.38 113.55 117.13 2byp h SER 46 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2byp h SER 46 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 2byp h SER 46 CO 0.00 0.17 0.00 0.35 -0.87 0.00 0.00 176.83 176.48 2byp n THR 47 N -3.02 0.00 -3.63 2.95 -2.24 -1.15 -5.04 114.28 102.15 2byp n THR 47 Ca 0.01 -0.29 -0.24 0.00 -2.27 0.00 0.00 64.05 61.27 2byp n THR 47 Cb 0.61 1.30 0.04 0.00 -2.10 0.00 0.00 70.33 70.19 2byp n THR 47 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2byp n ASN 48 N -0.16 -3.35 -4.20 3.42 3.02 0.82 -4.92 115.26 109.90 2byp n ASN 48 Ca 0.00 -0.88 -0.28 0.00 -0.03 0.00 0.00 54.58 53.39 2byp n ASN 48 Cb 0.08 -3.97 -0.16 0.00 -0.61 0.00 0.00 39.78 35.11 2byp n ASN 48 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2byp s GLU 49 N -5.75 2.01 0.01 3.52 2.02 -1.02 -0.98 118.70 118.51 2byp s GLU 49 Ca 0.23 -0.74 0.08 0.00 0.02 0.00 0.00 54.97 54.56 2byp s GLU 49 Cb -0.06 -1.77 -0.02 0.00 0.10 0.00 0.00 34.13 32.37 2byp s GLU 49 CO 0.82 0.33 -0.23 0.08 0.02 0.00 0.00 175.26 176.28 2byp s VAL 50 N -0.15 1.85 -0.19 2.63 1.01 -0.57 -0.52 120.40 124.47 2byp s VAL 50 Ca -0.01 -1.14 -0.04 0.00 0.00 0.00 0.00 61.98 60.79 2byp s VAL 50 Cb -0.11 -1.57 -0.02 0.00 0.00 0.00 0.00 36.38 34.68 2byp s VAL 50 CO 0.02 0.40 -0.03 -1.81 0.00 0.00 0.00 175.10 173.68 2byp s ASP 51 N -0.88 4.61 0.11 3.32 1.11 0.05 -1.55 116.67 123.45 2byp s ASP 51 Ca 0.09 -0.25 0.09 0.00 0.18 0.00 0.00 52.55 52.67 2byp s ASP 51 Cb -0.09 -1.78 -0.04 0.00 1.07 0.00 0.00 42.92 42.09 2byp s ASP 51 CO 0.01 0.07 -0.21 -0.76 1.18 0.00 0.00 175.17 175.46 2byp s LEU 52 N 0.93 2.58 -0.12 1.23 1.43 -0.05 -0.93 118.68 123.76 2byp s LEU 52 Ca 0.00 -0.59 0.03 0.00 -1.03 0.00 0.00 54.13 52.55 2byp s LEU 52 Cb -0.14 -1.45 0.00 0.00 0.03 0.00 0.00 46.19 44.63 2byp s LEU 52 CO 0.01 0.19 -0.23 -0.69 0.23 0.00 0.00 176.35 175.87 2byp s VAL 53 N -1.08 2.01 0.14 -1.59 1.01 -0.09 -1.01 120.40 119.79 2byp s VAL 53 Ca 0.16 -0.98 -0.14 0.00 0.00 0.00 0.00 61.98 61.03 2byp s VAL 53 Cb -0.10 -1.76 0.02 0.00 0.00 0.00 0.00 36.38 34.54 2byp s VAL 53 CO 0.08 0.55 0.38 -0.72 0.00 0.00 0.00 175.10 175.39 2byp s TYR 54 N 0.56 -0.05 -0.18 5.22 -0.85 -0.89 -0.84 117.35 120.32 2byp s TYR 54 Ca -0.14 -0.30 -0.08 0.00 -0.52 0.00 0.00 57.07 56.03 2byp s TYR 54 Cb -0.17 0.20 -0.04 0.00 0.38 0.00 0.00 41.96 42.32 2byp s TYR 54 CO 0.04 -0.73 0.10 0.71 -1.52 0.00 0.00 175.55 174.16 2byp s TYR 55 N -3.85 3.37 -0.38 -3.49 4.12 -0.03 -1.33 117.35 115.76 2byp s TYR 55 Ca 0.07 0.25 -0.08 0.00 0.02 0.00 0.00 57.07 57.33 2byp s TYR 55 Cb 0.02 -2.09 0.06 0.00 -1.52 0.00 0.00 41.96 38.43 2byp s TYR 55 CO -0.08 0.30 0.19 -2.00 0.02 0.00 0.00 175.55 173.98 2byp s GLU 56 N 0.15 2.59 -0.21 -0.62 2.12 -0.14 -1.22 118.70 121.37 2byp s GLU 56 Ca 0.07 -1.34 -0.27 0.00 0.36 0.00 0.00 54.97 53.78 2byp s GLU 56 Cb -0.12 -3.64 0.00 0.00 0.26 0.00 0.00 34.13 30.63 2byp s GLU 56 CO -0.00 -0.83 0.95 -0.65 -0.54 0.00 0.00 175.26 174.19 2byp s GLN 57 N 1.41 4.26 -0.15 4.30 -0.21 0.47 -3.23 119.66 126.51 2byp s GLN 57 Ca 0.01 1.21 0.01 0.00 0.02 0.00 0.00 55.36 56.61 2byp s GLN 57 Cb -0.21 -3.62 -0.00 0.00 1.00 0.00 0.00 33.01 30.17 2byp s GLN 57 CO 0.02 -0.52 -0.16 -0.65 -2.12 0.00 0.00 175.29 171.86 2byp s GLN 58 N 2.82 3.21 -0.04 2.91 -0.21 0.33 -1.78 119.66 126.89 2byp s GLN 58 Ca 0.41 -0.76 0.02 0.00 0.02 0.00 0.00 55.36 55.05 2byp s GLN 58 Cb -0.16 -2.58 0.01 0.00 1.00 0.00 0.00 33.01 31.28 2byp s GLN 58 CO 0.09 0.05 -0.09 0.50 -2.12 0.00 0.00 175.29 173.72 2byp s ARG 59 N 0.71 1.16 0.27 2.91 3.52 -0.55 -0.75 118.95 126.22 2byp s ARG 59 Ca -0.07 -0.27 -0.12 0.00 -0.13 0.00 0.00 55.73 55.13 2byp s ARG 59 Cb -0.16 -1.05 0.00 0.00 -1.56 0.00 0.00 34.95 32.19 2byp s ARG 59 CO 0.01 0.02 0.51 1.67 -0.81 0.00 0.00 175.30 176.70 2byp s TRP 60 N 0.59 0.41 -0.04 5.12 -2.14 -0.92 -0.56 118.94 121.40 2byp s TRP 60 Ca -0.10 -0.78 -0.00 0.00 2.66 0.00 0.00 56.10 57.88 2byp s TRP 60 Cb -0.13 0.22 0.03 0.00 -3.10 0.00 0.00 33.47 30.48 2byp s TRP 60 CO 0.02 -1.06 0.01 0.21 -2.66 0.00 0.00 176.95 173.47 2byp s LYS 61 N -3.79 0.24 -0.09 3.25 2.20 -1.26 -0.09 119.74 120.20 2byp s LYS 61 Ca 0.23 0.15 0.02 0.00 -0.36 0.00 0.00 55.97 56.01 2byp s LYS 61 Cb -0.01 -0.53 -0.02 0.00 -1.51 0.00 0.00 37.83 35.76 2byp s LYS 61 CO 0.11 -0.20 -0.16 -0.51 -0.36 0.00 0.00 175.35 174.23 2byp s LEU 62 N 1.37 2.58 0.29 5.43 1.43 -0.48 -4.91 118.68 124.39 2byp s LEU 62 Ca -0.05 -0.33 0.02 0.00 -1.03 0.00 0.00 54.13 52.74 2byp s LEU 62 Cb -0.13 -1.54 0.57 0.00 0.03 0.00 0.00 46.19 45.12 2byp s LEU 62 CO -0.03 0.23 1.86 0.78 0.23 0.00 0.00 176.35 179.42 2byp h ASN 63 N 6.18 0.91 0.35 2.29 4.21 -1.88 -2.34 115.58 125.30 2byp h ASN 63 Ca -0.33 0.04 0.00 0.00 1.21 0.00 0.00 56.30 57.22 2byp h ASN 63 Cb 1.19 -0.15 0.00 0.00 -1.12 0.00 0.00 38.32 38.24 2byp h ASN 63 CO 0.52 0.50 0.00 -1.54 -1.29 0.00 0.00 177.43 175.63 2byp n SER 64 N -4.58 0.00 -0.92 5.81 3.41 -1.26 -2.21 113.62 113.88 2byp n SER 64 Ca 0.18 0.15 0.09 0.00 -0.26 0.00 0.00 58.87 59.02 2byp n SER 64 Cb 0.33 -0.33 0.18 0.00 -0.26 0.00 0.00 64.21 64.13 2byp n SER 64 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2byp n LEU 65 N -1.33 3.13 -4.85 1.04 4.77 -0.88 -4.99 117.00 113.89 2byp n LEU 65 Ca 0.07 -1.64 -0.32 0.00 -0.03 0.00 0.00 56.01 54.09 2byp n LEU 65 Cb 0.14 -0.24 -0.05 0.00 -2.33 0.00 0.00 43.42 40.95 2byp n LEU 65 CO 0.13 0.72 0.54 0.00 -1.33 0.00 0.00 177.39 177.44 2byp s MET 66 N -1.18 3.96 0.19 3.23 0.23 -0.94 -3.96 119.30 120.83 2byp s MET 66 Ca 0.31 0.77 -0.10 0.00 -1.03 0.00 0.00 55.69 55.65 2byp s MET 66 Cb 0.18 -2.29 -0.01 0.00 -1.53 0.00 0.00 34.83 31.18 2byp s MET 66 CO 0.24 -0.05 0.33 1.67 -2.03 0.00 0.00 175.02 175.18 2byp s TRP 67 N -2.32 0.44 -0.43 3.16 -2.14 -0.47 -4.93 118.94 112.25 2byp s TRP 67 Ca 0.56 -0.79 -0.17 0.00 2.66 0.00 0.00 56.10 58.36 2byp s TRP 67 Cb -0.10 -0.02 0.03 0.00 -3.10 0.00 0.00 33.47 30.28 2byp s TRP 67 CO 0.25 -0.79 0.43 0.34 -2.66 0.00 0.00 176.95 174.52 2byp s ASP 68 N -2.99 6.18 0.56 -2.66 3.68 -1.26 -4.70 116.67 115.47 2byp s ASP 68 Ca 0.20 -0.79 0.33 0.00 2.13 0.00 0.00 52.55 54.43 2byp s ASP 68 Cb 0.02 -2.22 1.48 0.00 -1.45 0.00 0.00 42.92 40.76 2byp s ASP 68 CO 0.03 -0.60 1.81 -0.65 0.13 0.00 0.00 175.17 175.90 2byp h PRO 69 N 8.74 0.00 -0.71 4.34 0.11 -1.94 0.48 132.00 143.02 2byp h PRO 69 Ca -0.27 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.81 2byp h PRO 69 Cb 1.11 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.19 2byp h PRO 69 CO 0.81 0.00 0.32 -0.91 -0.21 0.00 0.00 178.00 178.01 2byp h ASN 70 N 0.00 0.93 0.55 -2.05 -0.26 -1.92 0.40 115.58 113.23 2byp h ASN 70 Ca 0.45 -0.11 0.00 0.00 -0.56 0.00 0.00 56.30 56.07 2byp h ASN 70 Cb 1.94 -0.24 0.00 0.00 -1.06 0.00 0.00 38.32 38.96 2byp h ASN 70 CO -0.00 0.81 0.00 -0.62 -1.06 0.00 0.00 177.43 176.55 2byp n GLU 71 N -4.32 0.13 -2.63 0.81 1.02 0.16 -4.14 120.64 111.67 2byp n GLU 71 Ca 0.07 0.41 -0.11 0.00 -0.02 0.00 0.00 57.16 57.50 2byp n GLU 71 Cb 0.15 -1.77 0.03 0.00 -0.02 0.00 0.00 31.44 29.83 2byp n GLU 71 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2byp n TYR 72 N -2.02 1.63 -2.56 -0.32 4.01 -0.79 -4.97 117.16 112.14 2byp n TYR 72 Ca 0.02 -2.69 -0.21 0.00 -0.16 0.00 0.00 57.90 54.87 2byp n TYR 72 Cb 0.18 -0.30 0.00 0.00 -0.31 0.00 0.00 39.34 38.91 2byp n TYR 72 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2byp n GLY 73 N -0.27 -0.51 2.40 2.72 0.00 -1.19 -2.25 105.19 106.09 2byp n GLY 73 Ca 0.15 0.03 -0.13 0.00 0.00 0.00 0.00 46.02 46.08 2byp n GLY 73 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2byp n ASN 74 N -2.13 -4.64 -4.70 1.61 3.02 0.13 -5.00 115.26 103.56 2byp n ASN 74 Ca -0.21 0.33 -0.42 0.00 -0.03 0.00 0.00 54.58 54.25 2byp n ASN 74 Cb 0.67 -3.30 -0.03 0.00 -0.61 0.00 0.00 39.78 36.51 2byp n ASN 74 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2byp s ILE 75 N -2.47 2.83 -0.14 2.41 1.01 -0.96 -4.91 121.20 118.97 2byp s ILE 75 Ca 0.00 0.46 0.08 0.00 0.00 0.00 0.00 60.65 61.19 2byp s ILE 75 Cb 0.00 -3.29 -0.11 0.00 0.01 0.00 0.00 42.46 39.07 2byp s ILE 75 CO 0.00 0.02 0.23 0.35 0.00 0.00 0.00 174.94 175.54 2byp n THR 76 N 4.37 0.00 -3.49 2.92 -2.24 -1.26 -4.25 114.28 110.33 2byp n THR 76 Ca 0.15 -0.23 -0.12 0.00 -2.27 0.00 0.00 64.05 61.57 2byp n THR 76 Cb 0.39 0.57 -0.03 0.00 -2.10 0.00 0.00 70.33 69.16 2byp n THR 76 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2byp s ASP 77 N -2.49 -0.49 0.13 3.42 -4.77 -1.26 -1.23 116.67 109.98 2byp s ASP 77 Ca -0.01 -0.01 -0.15 0.00 -3.30 0.00 0.00 52.55 49.09 2byp s ASP 77 Cb 0.05 0.56 0.03 0.00 -1.09 0.00 0.00 42.92 42.47 2byp s ASP 77 CO 0.33 -0.90 0.37 0.72 0.70 0.00 0.00 175.17 176.39 2byp s PHE 78 N -3.47 -0.12 -0.08 2.11 -0.12 0.35 -5.00 117.98 111.65 2byp s PHE 78 Ca 0.00 -0.22 -0.01 0.00 -0.05 0.00 0.00 56.93 56.65 2byp s PHE 78 Cb -0.00 0.20 -0.03 0.00 -0.63 0.00 0.00 43.02 42.56 2byp s PHE 78 CO -0.10 -0.69 -0.02 1.03 -0.05 0.00 0.00 175.22 175.39 2byp s ARG 79 N -3.82 2.93 0.03 1.99 3.00 -1.26 -0.57 118.95 121.25 2byp s ARG 79 Ca 0.04 -0.45 -0.19 0.00 0.00 0.00 0.00 55.73 55.13 2byp s ARG 79 Cb 0.02 -2.73 0.04 0.00 0.00 0.00 0.00 34.95 32.28 2byp s ARG 79 CO -0.11 0.68 0.43 -0.08 0.00 0.00 0.00 175.30 176.21 2byp s THR 80 N -0.82 0.05 0.19 0.02 -1.32 -0.49 -5.00 115.64 108.28 2byp s THR 80 Ca 0.12 -0.41 -0.33 0.00 -1.21 0.00 0.00 61.69 59.86 2byp s THR 80 Cb -0.11 -0.93 -0.14 0.00 -1.51 0.00 0.00 72.50 69.81 2byp s THR 80 CO 0.02 -0.23 1.38 -0.24 -2.21 0.00 0.00 174.62 173.34 2byp n SER 81 N 0.58 2.36 0.27 8.08 2.88 -1.26 -0.73 113.62 125.79 2byp n SER 81 Ca -0.19 1.13 0.14 0.00 -1.33 0.00 0.00 58.87 58.62 2byp n SER 81 Cb 0.59 -1.35 0.77 0.00 -0.75 0.00 0.00 64.21 63.48 2byp n SER 81 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2byp h ALA 82 N 4.44 1.16 0.00 -1.46 0.00 -1.13 -1.60 119.26 120.67 2byp h ALA 82 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2byp h ALA 82 Cb 1.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2byp h ALA 82 CO 0.78 -0.16 0.00 0.00 0.00 0.00 0.00 179.25 179.86 2byp h ALA 83 N 1.59 1.00 0.00 0.00 0.00 -1.89 -3.08 119.26 116.87 2byp h ALA 83 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2byp h ALA 83 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2byp h ALA 83 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 179.00 2byp n ASP 84 N -3.00 0.75 -4.29 0.00 8.00 -0.60 -4.88 116.55 112.53 2byp n ASP 84 Ca 0.04 0.63 -0.16 0.00 0.71 0.00 0.00 54.79 56.01 2byp n ASP 84 Cb 0.51 -0.81 -0.10 0.00 -0.02 0.00 0.00 41.12 40.70 2byp n ASP 84 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 2byp s ILE 85 N -3.23 1.31 0.32 0.53 -4.36 -1.17 -4.99 121.20 109.62 2byp s ILE 85 Ca 0.07 -2.10 -0.29 0.00 -0.26 0.00 0.00 60.65 58.08 2byp s ILE 85 Cb 0.11 -2.00 -0.10 0.00 1.25 0.00 0.00 42.46 41.71 2byp s ILE 85 CO 0.49 -0.62 1.35 0.86 0.24 0.00 0.00 174.94 177.26 2byp s TRP 86 N -3.24 2.98 0.06 1.37 -0.00 -1.26 -4.96 118.94 113.88 2byp s TRP 86 Ca 0.21 1.32 0.04 0.00 -0.00 0.00 0.00 56.10 57.67 2byp s TRP 86 Cb 0.02 -3.75 -0.03 0.00 -0.00 0.00 0.00 33.47 29.71 2byp s TRP 86 CO 0.04 -2.15 -0.12 0.95 -0.00 0.00 0.00 176.95 175.68 2byp s THR 87 N -0.96 0.90 0.62 5.86 -4.23 -1.26 -5.10 115.64 111.47 2byp s THR 87 Ca 0.51 -1.24 -0.14 0.00 -1.18 0.00 0.00 61.69 59.63 2byp s THR 87 Cb -0.41 -0.92 -0.03 0.00 1.34 0.00 0.00 72.50 72.48 2byp s THR 87 CO 0.53 -0.30 1.06 -2.16 -0.54 0.00 0.00 174.62 173.21 2byp s PRO 88 N -1.74 3.23 -0.56 3.99 0.04 -1.26 -4.95 135.00 133.75 2byp s PRO 88 Ca -0.04 1.13 -0.02 0.00 0.04 0.00 0.00 61.00 62.10 2byp s PRO 88 Cb -0.10 -2.02 0.25 0.00 0.04 0.00 0.00 34.50 32.67 2byp s PRO 88 CO 0.01 -0.87 2.27 -0.40 0.04 0.00 0.00 177.00 178.05 2byp n ASP 89 N -2.31 7.00 -4.68 6.66 5.75 -1.26 -4.96 116.55 122.74 2byp n ASP 89 Ca 0.08 -3.45 -0.42 0.00 -0.01 0.00 0.00 54.79 50.99 2byp n ASP 89 Cb 0.53 -1.10 -0.03 0.00 -1.03 0.00 0.00 41.12 39.49 2byp n ASP 89 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2byp s ILE 90 N -3.49 4.10 0.01 2.12 -1.09 -1.26 -3.19 121.20 118.40 2byp s ILE 90 Ca 0.52 1.42 0.04 0.00 -2.23 0.00 0.00 60.65 60.41 2byp s ILE 90 Cb 0.39 -3.92 -0.01 0.00 -1.58 0.00 0.00 42.46 37.34 2byp s ILE 90 CO -0.17 -0.03 -0.12 -0.89 -1.23 0.00 0.00 174.94 172.50 2byp s THR 91 N 2.53 0.97 0.10 2.92 2.01 0.66 -4.91 115.64 119.92 2byp s THR 91 Ca 0.58 -0.68 -0.31 0.00 0.31 0.00 0.00 61.69 61.59 2byp s THR 91 Cb -0.26 -0.85 -0.07 0.00 0.01 0.00 0.00 72.50 71.33 2byp s THR 91 CO 0.22 0.16 1.38 0.00 -0.69 0.00 0.00 174.62 175.69 2byp s ALA 92 N -0.50 3.57 -0.67 7.40 0.00 -1.26 -1.29 121.76 129.01 2byp s ALA 92 Ca 0.03 1.07 0.25 0.00 0.00 0.00 0.00 51.96 53.31 2byp s ALA 92 Cb -0.06 -3.54 0.58 0.00 0.00 0.00 0.00 23.12 20.10 2byp s ALA 92 CO 0.00 -0.63 1.56 1.88 0.00 0.00 0.00 175.76 178.57 2byp h TYR 93 N 6.93 0.00 -0.12 0.00 -1.99 -1.20 -3.34 116.97 117.24 2byp h TYR 93 Ca -0.42 0.00 -0.14 0.00 2.00 0.00 0.00 58.73 60.17 2byp h TYR 93 Cb 1.21 0.00 -0.21 0.00 2.00 0.00 0.00 36.73 39.73 2byp h TYR 93 CO 0.67 0.00 -0.77 -1.13 -0.00 0.00 0.00 178.16 176.94 2byp n SER 94 N -2.24 1.83 -4.74 3.88 3.41 -1.26 -5.04 113.62 109.46 2byp n SER 94 Ca 0.04 -3.11 -0.36 0.00 -0.26 0.00 0.00 58.87 55.19 2byp n SER 94 Cb 0.44 -0.43 0.05 0.00 -0.26 0.00 0.00 64.21 64.02 2byp n SER 94 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2byp s SER 95 N -2.92 4.86 0.00 4.04 1.04 -1.26 -1.95 113.70 117.52 2byp s SER 95 Ca 0.37 2.47 0.06 0.00 0.48 0.00 0.00 55.95 59.34 2byp s SER 95 Cb 0.38 -2.61 -0.05 0.00 0.10 0.00 0.00 66.02 63.84 2byp s SER 95 CO -0.09 -1.82 0.31 0.35 0.98 0.00 0.00 173.24 172.97 2byp n THR 96 N -1.83 0.00 -4.04 2.02 -2.24 -0.26 -4.84 114.28 103.09 2byp n THR 96 Ca 0.14 -0.37 -0.08 0.00 -2.27 0.00 0.00 64.05 61.48 2byp n THR 96 Cb 0.49 1.02 -0.10 0.00 -2.10 0.00 0.00 70.33 69.64 2byp n THR 96 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2byp s ARG 97 N -1.46 0.60 0.28 -0.78 0.52 -1.25 -5.04 118.95 111.81 2byp s ARG 97 Ca 0.03 -1.09 -0.30 0.00 -0.52 0.00 0.00 55.73 53.85 2byp s ARG 97 Cb 0.05 0.22 -0.12 0.00 0.52 0.00 0.00 34.95 35.61 2byp s ARG 97 CO 0.23 -0.12 1.56 -2.30 0.02 0.00 0.00 175.30 174.69 2byp n PRO 98 N 0.30 2.56 -1.76 3.54 -0.02 -1.26 -4.67 135.00 133.70 2byp n PRO 98 Ca -0.16 0.91 -0.41 0.00 -2.02 0.00 0.00 63.50 61.82 2byp n PRO 98 Cb 0.60 -2.67 -0.01 0.00 -0.02 0.00 0.00 33.50 31.41 2byp n PRO 98 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2byp n VAL 99 N 2.17 1.66 -4.00 -1.45 0.31 -1.26 -4.89 118.33 110.87 2byp n VAL 99 Ca 0.10 -0.41 -0.35 0.00 -0.01 0.00 0.00 64.34 63.66 2byp n VAL 99 Cb 0.35 -1.94 -0.10 0.00 -0.91 0.00 0.00 33.84 31.24 2byp n VAL 99 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 2byp s GLN 100 N -1.54 3.97 -0.09 5.55 -0.21 -0.67 -4.98 119.66 121.69 2byp s GLN 100 Ca 0.57 -0.35 -0.20 0.00 0.02 0.00 0.00 55.36 55.40 2byp s GLN 100 Cb -0.49 -3.22 -0.04 0.00 1.00 0.00 0.00 33.01 30.26 2byp s GLN 100 CO 0.58 0.26 0.56 0.08 -2.12 0.00 0.00 175.29 174.66 2byp s VAL 101 N 0.41 5.11 -0.63 1.09 1.01 -1.26 -1.05 120.40 125.08 2byp s VAL 101 Ca 0.03 1.15 0.15 0.00 0.00 0.00 0.00 61.98 63.31 2byp s VAL 101 Cb -0.12 -3.90 -0.17 0.00 0.00 0.00 0.00 36.38 32.18 2byp s VAL 101 CO 0.00 0.31 0.60 0.18 0.00 0.00 0.00 175.10 176.20 2byp n LEU 102 N 3.58 0.63 -4.29 3.92 4.77 0.08 -4.97 117.00 120.72 2byp n LEU 102 Ca -0.05 -0.45 -0.16 0.00 -0.03 0.00 0.00 56.01 55.32 2byp n LEU 102 Cb 0.51 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.50 2byp n LEU 102 CO 0.44 0.16 -0.42 -0.94 -1.33 0.00 0.00 177.39 175.30 2byp s SER 103 N -2.55 2.12 0.40 -1.43 1.04 -1.25 -4.95 113.70 107.07 2byp s SER 103 Ca 0.04 -1.00 -0.26 0.00 0.48 0.00 0.00 55.95 55.21 2byp s SER 103 Cb 0.11 -0.06 -0.11 0.00 0.10 0.00 0.00 66.02 66.06 2byp s SER 103 CO 0.62 -0.26 1.21 -2.65 0.98 0.00 0.00 173.24 173.15 2byp n PRO 104 N -0.23 1.83 -3.06 4.02 -0.02 -1.26 -4.84 135.00 131.44 2byp n PRO 104 Ca -0.10 0.65 -0.44 0.00 -2.02 0.00 0.00 63.50 61.59 2byp n PRO 104 Cb 0.60 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 2byp n PRO 104 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2byp n GLN 105 N 0.19 3.62 -4.37 -0.52 1.13 -1.26 -4.92 117.38 111.26 2byp n GLN 105 Ca 0.07 -4.17 -0.20 0.00 -1.94 0.00 0.00 57.00 50.75 2byp n GLN 105 Cb 0.38 -2.75 -0.15 0.00 0.11 0.00 0.00 30.24 27.83 2byp n GLN 105 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2byp s ILE 106 N -0.37 0.75 0.20 5.09 1.01 -1.26 -0.53 121.20 126.09 2byp s ILE 106 Ca 0.36 -0.35 0.08 0.00 0.00 0.00 0.00 60.65 60.74 2byp s ILE 106 Cb -0.04 -0.67 -0.04 0.00 0.01 0.00 0.00 42.46 41.73 2byp s ILE 106 CO -0.02 0.23 0.01 0.00 0.00 0.00 0.00 174.94 175.16 2byp s ALA 107 N 0.16 3.20 -0.17 9.38 0.00 0.09 -4.58 121.76 129.83 2byp s ALA 107 Ca -0.02 -1.45 -0.05 0.00 0.00 0.00 0.00 51.96 50.44 2byp s ALA 107 Cb -0.08 -0.94 -0.03 0.00 0.00 0.00 0.00 23.12 22.07 2byp s ALA 107 CO 0.00 0.41 -0.01 0.08 0.00 0.00 0.00 175.76 176.25 2byp s VAL 108 N -1.90 4.11 -0.11 0.00 1.01 -0.68 -1.39 120.40 121.42 2byp s VAL 108 Ca 0.29 -0.28 0.00 0.00 0.00 0.00 0.00 61.98 61.99 2byp s VAL 108 Cb -0.08 -2.83 -0.02 0.00 0.00 0.00 0.00 36.38 33.45 2byp s VAL 108 CO 0.19 0.47 -0.11 -0.69 0.00 0.00 0.00 175.10 174.96 2byp s VAL 109 N 0.51 3.25 0.26 2.92 1.01 0.26 -1.41 120.40 127.20 2byp s VAL 109 Ca -0.01 -0.61 0.09 0.00 0.00 0.00 0.00 61.98 61.45 2byp s VAL 109 Cb -0.14 -2.36 -0.04 0.00 0.00 0.00 0.00 36.38 33.84 2byp s VAL 109 CO 0.02 0.54 0.05 0.42 0.00 0.00 0.00 175.10 176.13 2byp s THR 110 N 0.04 3.76 0.03 3.92 -4.23 -0.33 -0.50 115.64 118.33 2byp s THR 110 Ca -0.04 -1.73 0.30 0.00 -1.18 0.00 0.00 61.69 59.04 2byp s THR 110 Cb -0.14 -3.01 0.30 0.00 1.34 0.00 0.00 72.50 70.99 2byp s THR 110 CO 0.04 -0.35 1.90 1.12 -0.54 0.00 0.00 174.62 176.79 2byp h HIS 111 N 1.83 0.00 -0.03 3.99 2.07 -1.48 0.08 115.15 121.61 2byp h HIS 111 Ca -0.46 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.06 2byp h HIS 111 Cb 1.24 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.22 2byp h HIS 111 CO 0.64 0.00 0.00 -0.40 -3.07 0.00 0.00 177.93 175.10 2byp n ASP 112 N -2.57 0.51 0.00 3.10 5.75 -1.26 -1.36 116.55 120.71 2byp n ASP 112 Ca -0.01 -1.31 0.00 0.00 -0.01 0.00 0.00 54.79 53.46 2byp n ASP 112 Cb 0.10 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.18 2byp n ASP 112 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2byp n GLY 113 N 0.99 0.72 3.74 6.12 0.00 0.01 -4.65 105.19 112.12 2byp n GLY 113 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 2byp n GLY 113 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2byp s SER 114 N -2.74 7.39 -0.07 1.61 0.01 -1.22 -1.39 113.70 117.30 2byp s SER 114 Ca 0.00 2.02 0.05 0.00 1.31 0.00 0.00 55.95 59.33 2byp s SER 114 Cb 0.00 -2.60 -0.01 0.00 0.21 0.00 0.00 66.02 63.61 2byp s SER 114 CO 0.00 -0.11 -0.23 -0.69 0.41 0.00 0.00 173.24 172.62 2byp s VAL 115 N -0.47 2.20 -0.15 3.43 1.01 0.87 -1.19 120.40 126.10 2byp s VAL 115 Ca 0.47 -1.01 0.02 0.00 0.00 0.00 0.00 61.98 61.46 2byp s VAL 115 Cb -0.28 -1.82 0.01 0.00 0.00 0.00 0.00 36.38 34.30 2byp s VAL 115 CO 0.34 0.57 -0.21 -0.32 0.00 0.00 0.00 175.10 175.48 2byp s MET 116 N -0.11 2.93 -0.06 2.72 0.00 -0.50 -2.16 119.30 122.12 2byp s MET 116 Ca -0.05 -0.82 0.02 0.00 0.00 0.00 0.00 55.69 54.84 2byp s MET 116 Cb -0.14 -2.42 0.02 0.00 0.00 0.00 0.00 34.83 32.28 2byp s MET 116 CO 0.04 -0.08 -0.10 0.12 0.00 0.00 0.00 175.02 175.00 2byp s PHE 117 N 0.99 1.20 -0.57 4.11 5.36 0.07 -1.69 117.98 127.46 2byp s PHE 117 Ca -0.03 -0.42 0.05 0.00 -0.96 0.00 0.00 56.93 55.57 2byp s PHE 117 Cb -0.15 -0.92 0.17 0.00 -0.34 0.00 0.00 43.02 41.78 2byp s PHE 117 CO -0.05 -0.24 0.43 -0.89 -1.46 0.00 0.00 175.22 173.01 2byp n ILE 118 N 3.88 0.32 -2.27 3.12 5.41 -1.26 -0.52 119.36 128.05 2byp n ILE 118 Ca -0.24 -4.21 -0.42 0.00 1.00 0.00 0.00 62.75 58.88 2byp n ILE 118 Cb 0.51 -1.94 -0.03 0.00 -0.71 0.00 0.00 39.64 37.48 2byp n ILE 118 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 2byp s PRO 119 N -0.81 4.33 0.06 0.38 0.04 -1.20 -4.79 135.00 133.02 2byp s PRO 119 Ca 0.29 1.94 -0.23 0.00 0.04 0.00 0.00 61.00 63.04 2byp s PRO 119 Cb 0.01 -3.43 -0.06 0.00 0.04 0.00 0.00 34.50 31.06 2byp s PRO 119 CO -0.18 -0.46 0.70 0.00 0.04 0.00 0.00 177.00 177.10 2byp s ALA 120 N 1.71 3.44 0.01 8.56 0.00 -1.26 -0.97 121.76 133.26 2byp s ALA 120 Ca 0.62 0.20 -0.01 0.00 0.00 0.00 0.00 51.96 52.77 2byp s ALA 120 Cb -0.32 -2.88 -0.01 0.00 0.00 0.00 0.00 23.12 19.91 2byp s ALA 120 CO 0.28 0.18 -0.00 -0.65 0.00 0.00 0.00 175.76 175.56 2byp s GLN 121 N -0.42 0.26 -0.21 0.00 -0.21 -0.44 -0.74 119.66 117.90 2byp s GLN 121 Ca 0.35 -0.44 -0.05 0.00 0.02 0.00 0.00 55.36 55.23 2byp s GLN 121 Cb -0.20 0.10 -0.02 0.00 1.00 0.00 0.00 33.01 33.88 2byp s GLN 121 CO 0.21 -0.04 0.01 0.50 -2.12 0.00 0.00 175.29 173.85 2byp s ARG 122 N -1.11 3.62 -0.11 2.91 3.52 -0.21 -2.09 118.95 125.48 2byp s ARG 122 Ca -0.12 -0.52 0.03 0.00 -0.13 0.00 0.00 55.73 54.99 2byp s ARG 122 Cb -0.07 -3.10 0.01 0.00 -1.56 0.00 0.00 34.95 30.22 2byp s ARG 122 CO -0.01 -0.01 -0.21 -1.17 -0.81 0.00 0.00 175.30 173.09 2byp s LEU 123 N 1.07 1.99 -0.22 -0.88 2.96 -0.18 -1.67 118.68 121.75 2byp s LEU 123 Ca 0.02 -0.52 -0.10 0.00 -0.22 0.00 0.00 54.13 53.31 2byp s LEU 123 Cb -0.14 -1.31 -0.05 0.00 0.50 0.00 0.00 46.19 45.19 2byp s LEU 123 CO 0.02 0.10 0.13 -0.44 -1.32 0.00 0.00 176.35 174.84 2byp s SER 124 N 0.60 6.02 0.12 3.68 0.01 -1.26 -0.87 113.70 122.00 2byp s SER 124 Ca -0.14 0.13 -0.00 0.00 1.31 0.00 0.00 55.95 57.25 2byp s SER 124 Cb -0.17 -2.07 -0.04 0.00 0.21 0.00 0.00 66.02 63.96 2byp s SER 124 CO 0.04 0.12 0.02 0.72 0.41 0.00 0.00 173.24 174.55 2byp s PHE 125 N 0.73 0.88 -0.12 2.43 -0.12 -0.59 -1.10 117.98 120.09 2byp s PHE 125 Ca 0.07 -1.13 -0.29 0.00 -0.05 0.00 0.00 56.93 55.52 2byp s PHE 125 Cb -0.13 -0.52 -0.05 0.00 -0.63 0.00 0.00 43.02 41.70 2byp s PHE 125 CO 0.02 -0.40 1.70 -1.64 -0.05 0.00 0.00 175.22 174.85 2byp s MET 126 N -3.98 3.98 -0.29 1.99 -1.94 -0.82 -1.51 119.30 116.72 2byp s MET 126 Ca 0.20 2.03 -0.14 0.00 -1.71 0.00 0.00 55.69 56.07 2byp s MET 126 Cb 0.07 -4.04 0.12 0.00 2.01 0.00 0.00 34.83 32.99 2byp s MET 126 CO -0.00 -1.09 0.77 0.00 -0.01 0.00 0.00 175.02 174.69 2byp s ASP 128 N 2.09 6.36 0.00 0.00 -1.08 -1.26 -2.96 116.67 119.82 2byp s ASP 128 Ca -0.08 -0.29 0.02 0.00 -0.52 0.00 0.00 52.55 51.68 2byp s ASP 128 Cb -0.07 -2.44 0.11 0.00 -1.46 0.00 0.00 42.92 39.06 2byp s ASP 128 CO -0.18 -1.20 1.00 -0.81 0.52 0.00 0.00 175.17 174.50 2byp n PRO 129 N 7.40 0.93 -1.56 4.34 -0.04 -1.26 -4.68 135.00 140.13 2byp n PRO 129 Ca 0.02 0.00 -0.53 0.00 -0.04 0.00 0.00 63.50 62.95 2byp n PRO 129 Cb 0.48 -1.03 -0.06 0.00 -0.04 0.00 0.00 33.50 32.85 2byp n PRO 129 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2byp n THR 130 N -0.53 0.24 -0.51 0.52 -1.04 -1.26 -1.34 114.28 110.35 2byp n THR 130 Ca 0.01 -0.06 0.00 0.00 -2.04 0.00 0.00 64.05 61.96 2byp n THR 130 Cb 0.01 -0.61 0.00 0.00 -1.82 0.00 0.00 70.33 67.91 2byp n THR 130 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2byp n GLY 131 N 2.17 0.75 0.29 3.41 0.00 -1.26 -4.39 105.19 106.16 2byp n GLY 131 Ca 0.18 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.32 2byp n GLY 131 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2byp h VAL 132 N 0.00 0.91 -1.80 1.61 3.04 -1.39 -2.07 116.25 116.55 2byp h VAL 132 Ca 0.00 0.00 -0.71 0.00 -1.01 0.00 0.00 66.70 64.98 2byp h VAL 132 Cb 0.00 0.93 -0.25 0.00 -2.01 0.00 0.00 31.29 29.96 2byp h VAL 132 CO 0.00 0.00 0.93 -0.67 -1.01 0.00 0.00 177.57 176.82 2byp n ASP 133 N -4.47 7.31 -3.90 3.17 2.03 -1.26 -1.08 116.55 118.36 2byp n ASP 133 Ca 0.00 -3.71 -0.13 0.00 0.52 0.00 0.00 54.79 51.47 2byp n ASP 133 Cb 0.23 -1.10 -0.08 0.00 -0.72 0.00 0.00 41.12 39.44 2byp n ASP 133 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 2byp s SER 134 N -0.78 0.50 0.28 1.67 1.04 -0.78 -5.04 113.70 110.58 2byp s SER 134 Ca 0.53 -1.40 0.00 0.00 0.48 0.00 0.00 55.95 55.57 2byp s SER 134 Cb 0.43 0.48 0.40 0.00 0.10 0.00 0.00 66.02 67.43 2byp s SER 134 CO -0.38 -0.98 1.76 -0.08 0.98 0.00 0.00 173.24 174.55 2byp h GLU 135 N 2.41 0.65 0.00 4.02 4.81 -1.91 -3.00 114.58 121.56 2byp h GLU 135 Ca -0.31 -0.19 -0.00 0.00 -0.13 0.00 0.00 59.36 58.72 2byp h GLU 135 Cb 1.25 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.56 2byp h GLU 135 CO 0.45 0.73 -0.44 1.05 -0.73 0.00 0.00 179.01 180.07 2byp h GLU 136 N 0.60 0.00 0.00 1.92 4.11 -1.96 -3.50 114.58 115.74 2byp h GLU 136 Ca 0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.54 2byp h GLU 136 Cb 0.51 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.76 2byp h GLU 136 CO 0.03 0.01 0.00 0.41 0.07 0.00 0.00 179.01 179.53 2byp n GLY 137 N 1.14 -1.88 3.73 1.06 0.00 -1.14 -4.80 105.19 103.30 2byp n GLY 137 Ca 0.02 -1.42 -0.22 0.00 0.00 0.00 0.00 46.02 44.40 2byp n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2byp s ALA 138 N -1.05 3.38 -0.09 4.61 0.00 0.13 -4.26 121.76 124.48 2byp s ALA 138 Ca 0.00 -1.58 -0.01 0.00 0.00 0.00 0.00 51.96 50.37 2byp s ALA 138 Cb 0.00 -0.98 0.03 0.00 0.00 0.00 0.00 23.12 22.16 2byp s ALA 138 CO 0.00 0.23 -0.03 0.99 0.00 0.00 0.00 175.76 176.94 2byp s THR 139 N -2.26 0.66 0.24 0.00 2.01 -1.26 -1.30 115.64 113.72 2byp s THR 139 Ca 0.33 -0.06 0.11 0.00 0.31 0.00 0.00 61.69 62.37 2byp s THR 139 Cb -0.07 -0.75 -0.05 0.00 0.01 0.00 0.00 72.50 71.65 2byp s THR 139 CO 0.22 0.30 -0.20 0.00 -0.69 0.00 0.00 174.62 174.26 2byp s ALA 141 N -2.35 -0.09 -0.06 0.00 0.00 -1.26 -0.43 121.76 117.56 2byp s ALA 141 Ca 0.25 0.00 -0.03 0.00 0.00 0.00 0.00 51.96 52.19 2byp s ALA 141 Cb -0.05 -0.03 0.03 0.00 0.00 0.00 0.00 23.12 23.07 2byp s ALA 141 CO 0.12 -0.06 0.13 0.54 0.00 0.00 0.00 175.76 176.49 2byp s VAL 142 N -0.29 -0.05 0.01 0.00 0.11 -0.26 -4.91 120.40 115.01 2byp s VAL 142 Ca -0.03 0.17 -0.17 0.00 -2.93 0.00 0.00 61.98 59.02 2byp s VAL 142 Cb -0.02 -0.21 -0.06 0.00 -1.53 0.00 0.00 36.38 34.56 2byp s VAL 142 CO -0.00 0.07 0.47 -0.54 -3.33 0.00 0.00 175.10 171.77 2byp s LYS 143 N 1.06 4.08 0.04 1.54 1.02 -1.26 -1.00 119.74 125.22 2byp s LYS 143 Ca -0.08 0.53 0.06 0.00 0.02 0.00 0.00 55.97 56.50 2byp s LYS 143 Cb -0.11 -3.26 -0.03 0.00 -0.52 0.00 0.00 37.83 33.91 2byp s LYS 143 CO -0.05 0.60 -0.14 -0.06 -0.92 0.00 0.00 175.35 174.78 2byp s PHE 144 N -0.84 2.67 -0.00 3.18 0.08 -0.06 -0.56 117.98 122.43 2byp s PHE 144 Ca 0.26 -0.19 -0.29 0.00 0.12 0.00 0.00 56.93 56.84 2byp s PHE 144 Cb -0.17 -1.49 0.10 0.00 -0.57 0.00 0.00 43.02 40.89 2byp s PHE 144 CO 0.15 0.31 1.27 0.20 -0.10 0.00 0.00 175.22 177.05 2byp s GLY 145 N -1.56 -0.19 0.68 4.36 0.00 -0.41 -1.08 107.32 109.11 2byp s GLY 145 Ca 0.16 0.20 -0.15 0.00 0.00 0.00 0.00 44.72 44.94 2byp s GLY 145 CO 0.07 3.83 1.12 -0.45 0.00 0.00 0.00 173.10 177.68 2byp s SER 146 N -3.54 4.92 -0.05 1.64 0.15 -1.26 -0.24 113.70 115.30 2byp s SER 146 Ca 0.25 2.04 0.10 0.00 0.70 0.00 0.00 55.95 59.04 2byp s SER 146 Cb 0.01 -2.56 -0.23 0.00 -1.71 0.00 0.00 66.02 61.53 2byp s SER 146 CO -0.01 -1.76 0.62 1.87 1.20 0.00 0.00 173.24 175.16 2byp n TRP 147 N -2.54 1.02 -0.07 3.44 -0.00 -1.19 -4.61 117.44 113.49 2byp n TRP 147 Ca 0.11 0.35 0.00 0.00 -0.00 0.00 0.00 57.50 57.95 2byp n TRP 147 Cb 0.52 -1.18 0.00 0.00 -0.00 0.00 0.00 31.31 30.65 2byp n TRP 147 CO 0.00 0.00 0.00 1.33 -0.00 0.00 0.00 177.69 179.02 2byp n VAL 148 N -3.09 0.00 -4.39 5.87 0.24 -1.26 -5.07 118.33 110.63 2byp n VAL 148 Ca -0.19 -0.36 -0.34 0.00 -2.04 0.00 0.00 64.34 61.41 2byp n VAL 148 Cb 1.05 1.07 -0.12 0.00 -1.47 0.00 0.00 33.84 34.37 2byp n VAL 148 CO 0.00 0.00 0.00 -0.31 -2.14 0.00 0.00 176.83 174.38 2byp s TYR 149 N -0.55 3.05 1.01 6.34 2.02 -1.26 -5.11 117.35 122.84 2byp s TYR 149 Ca 0.00 -0.21 -0.16 0.00 -0.37 0.00 0.00 57.07 56.32 2byp s TYR 149 Cb 0.00 -1.94 0.21 0.00 -0.40 0.00 0.00 41.96 39.83 2byp s TYR 149 CO 0.00 0.04 1.25 -1.54 -1.57 0.00 0.00 175.55 173.73 2byp s SER 150 N 0.19 2.68 0.07 2.29 1.04 -1.26 -4.69 113.70 114.02 2byp s SER 150 Ca -0.01 0.44 0.22 0.00 0.48 0.00 0.00 55.95 57.07 2byp s SER 150 Cb -0.14 -0.59 0.89 0.00 0.10 0.00 0.00 66.02 66.28 2byp s SER 150 CO 0.03 -3.02 1.68 0.61 0.98 0.00 0.00 173.24 173.52 2byp n GLY 151 N -2.93 -1.28 0.25 7.32 0.00 0.62 -0.94 105.19 108.23 2byp n GLY 151 Ca 0.14 -0.04 0.15 0.00 0.00 0.00 0.00 46.02 46.27 2byp n GLY 151 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2byp n PHE 152 N -1.73 0.00 -0.01 1.61 3.72 -1.26 -3.89 117.46 115.89 2byp n PHE 152 Ca 0.05 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.41 2byp n PHE 152 Cb 0.26 -0.04 -0.01 0.00 -0.94 0.00 0.00 39.48 38.75 2byp n PHE 152 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2byp n GLU 153 N -0.45 0.07 -4.05 -1.08 1.02 -0.40 -4.12 120.64 111.64 2byp n GLU 153 Ca 0.19 0.03 -0.32 0.00 -0.02 0.00 0.00 57.16 57.05 2byp n GLU 153 Cb 0.26 -0.62 -0.15 0.00 -0.02 0.00 0.00 31.44 30.91 2byp n GLU 153 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2byp s ILE 154 N -2.06 1.97 -0.12 -3.67 1.01 -0.11 -1.24 121.20 116.98 2byp s ILE 154 Ca -0.05 -1.36 -0.23 0.00 0.00 0.00 0.00 60.65 59.01 2byp s ILE 154 Cb 0.02 -2.05 -0.03 0.00 0.01 0.00 0.00 42.46 40.41 2byp s ILE 154 CO 0.06 0.09 0.72 -0.62 0.00 0.00 0.00 174.94 175.19 2byp s ASP 155 N 1.22 6.93 -0.10 3.58 2.15 -0.15 -3.97 116.67 126.33 2byp s ASP 155 Ca -0.05 1.12 -0.05 0.00 0.43 0.00 0.00 52.55 54.00 2byp s ASP 155 Cb -0.18 -2.41 -0.04 0.00 -0.30 0.00 0.00 42.92 39.99 2byp s ASP 155 CO -0.07 -0.22 0.09 -0.76 -0.17 0.00 0.00 175.17 174.04 2byp s LEU 156 N 1.35 4.09 0.20 -1.34 1.43 -1.26 -0.48 118.68 122.67 2byp s LEU 156 Ca 0.36 0.35 0.01 0.00 -1.03 0.00 0.00 54.13 53.82 2byp s LEU 156 Cb -0.17 -1.99 -0.05 0.00 0.03 0.00 0.00 46.19 44.02 2byp s LEU 156 CO 0.15 0.40 0.04 -0.54 0.23 0.00 0.00 176.35 176.63 2byp s LYS 157 N -1.00 1.20 0.12 1.70 1.02 -0.60 -4.96 119.74 117.23 2byp s LYS 157 Ca 0.15 -1.61 0.08 0.00 0.02 0.00 0.00 55.97 54.60 2byp s LYS 157 Cb -0.12 -0.21 -0.04 0.00 -0.52 0.00 0.00 37.83 36.95 2byp s LYS 157 CO 0.04 -0.21 -0.10 0.95 -0.92 0.00 0.00 175.35 175.11 2byp s THR 158 N -3.74 3.33 -1.35 2.17 -4.23 -1.26 -0.63 115.64 109.93 2byp s THR 158 Ca 0.29 -1.37 -0.16 0.00 -1.18 0.00 0.00 61.69 59.28 2byp s THR 158 Cb 0.07 -2.58 0.07 0.00 1.34 0.00 0.00 72.50 71.40 2byp s THR 158 CO 0.07 0.05 1.90 -0.67 -0.54 0.00 0.00 174.62 175.44 2byp n ASP 159 N 0.52 4.58 -0.69 3.99 2.03 -0.08 -4.81 116.55 122.09 2byp n ASP 159 Ca -0.13 -2.90 0.09 0.00 0.52 0.00 0.00 54.79 52.37 2byp n ASP 159 Cb 0.53 -1.69 -0.04 0.00 -0.72 0.00 0.00 41.12 39.20 2byp n ASP 159 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 2byp n THR 160 N 5.68 -0.22 1.37 5.18 -2.24 -1.26 -4.69 114.28 118.10 2byp n THR 160 Ca 0.49 0.34 0.13 0.00 -2.27 0.00 0.00 64.05 62.74 2byp n THR 160 Cb 0.43 -0.58 0.46 0.00 -2.10 0.00 0.00 70.33 68.54 2byp n THR 160 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2byp n ASP 161 N -3.26 1.62 -4.58 3.42 5.75 -1.26 -4.78 116.55 113.46 2byp n ASP 161 Ca -0.03 -1.60 -0.39 0.00 -0.01 0.00 0.00 54.79 52.77 2byp n ASP 161 Cb 0.33 -0.04 -0.11 0.00 -1.03 0.00 0.00 41.12 40.27 2byp n ASP 161 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 2byp s GLN 162 N -1.91 3.88 0.43 0.11 -1.52 -1.26 -0.63 119.66 118.76 2byp s GLN 162 Ca 0.36 -0.33 -0.26 0.00 -1.95 0.00 0.00 55.36 53.18 2byp s GLN 162 Cb 0.20 -3.69 -0.09 0.00 -0.22 0.00 0.00 33.01 29.21 2byp s GLN 162 CO 0.31 -0.24 1.40 0.08 -0.25 0.00 0.00 175.29 176.58 2byp s VAL 163 N 1.80 2.22 -0.30 1.09 1.01 -0.90 -4.85 120.40 120.46 2byp s VAL 163 Ca 0.08 0.20 -0.29 0.00 0.00 0.00 0.00 61.98 61.97 2byp s VAL 163 Cb -0.16 -3.12 0.01 0.00 0.00 0.00 0.00 36.38 33.11 2byp s VAL 163 CO 0.11 0.03 1.24 -0.62 0.00 0.00 0.00 175.10 175.85 2byp s ASP 164 N -0.53 6.75 0.00 3.32 -1.08 -0.44 -4.88 116.67 119.82 2byp s ASP 164 Ca 0.59 1.17 0.14 0.00 -0.52 0.00 0.00 52.55 53.93 2byp s ASP 164 Cb -0.42 -2.54 0.33 0.00 -1.46 0.00 0.00 42.92 38.83 2byp s ASP 164 CO 0.55 -1.02 1.25 0.18 0.52 0.00 0.00 175.17 176.65 2byp n LEU 165 N 7.38 2.97 0.29 -1.34 4.77 -1.26 -1.28 117.00 128.53 2byp n LEU 165 Ca 0.14 -1.77 0.17 0.00 -0.03 0.00 0.00 56.01 54.51 2byp n LEU 165 Cb 0.47 -0.23 0.87 0.00 -2.33 0.00 0.00 43.42 42.19 2byp n LEU 165 CO 0.62 0.71 1.05 0.77 -1.33 0.00 0.00 177.39 179.21 2byp h SER 166 N 2.67 0.00 -0.26 -1.43 4.64 -1.90 -1.98 113.55 115.29 2byp h SER 166 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2byp h SER 166 Cb 0.75 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 2byp h SER 166 CO 0.00 0.05 0.00 -1.20 -0.87 0.00 0.00 176.83 174.81 2byp n SER 167 N -3.36 3.72 -4.73 4.97 7.64 -1.26 -5.03 113.62 115.56 2byp n SER 167 Ca -0.02 -2.88 -0.42 0.00 1.01 0.00 0.00 58.87 56.57 2byp n SER 167 Cb 0.20 -0.50 -0.03 0.00 -1.01 0.00 0.00 64.21 62.87 2byp n SER 167 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 2byp s TYR 168 N -2.58 3.27 -0.03 1.43 5.04 -0.75 -4.63 117.35 119.11 2byp s TYR 168 Ca 0.39 1.16 -0.31 0.00 -2.44 0.00 0.00 57.07 55.88 2byp s TYR 168 Cb 0.31 -3.61 -0.09 0.00 0.35 0.00 0.00 41.96 38.92 2byp s TYR 168 CO 0.10 -1.95 2.00 0.98 -1.34 0.00 0.00 175.55 175.33 2byp n TYR 169 N 3.07 2.39 0.32 4.97 9.36 0.64 -4.84 117.16 133.07 2byp n TYR 169 Ca 0.08 -0.27 0.13 0.00 3.32 0.00 0.00 57.90 61.16 2byp n TYR 169 Cb 0.43 -2.77 0.60 0.00 -0.63 0.00 0.00 39.34 36.97 2byp n TYR 169 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2byp h ALA 170 N 11.04 1.00 0.00 2.98 0.00 -1.90 -2.66 119.26 129.72 2byp h ALA 170 Ca -0.48 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 2byp h ALA 170 Cb 1.25 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.02 2byp h ALA 170 CO 0.95 0.00 -0.29 0.43 0.00 0.00 0.00 179.25 180.34 2byp n SER 171 N -2.43 1.89 -4.58 0.00 7.64 -1.26 -5.06 113.62 109.82 2byp n SER 171 Ca 0.01 -3.32 -0.36 0.00 1.01 0.00 0.00 58.87 56.20 2byp n SER 171 Cb 0.18 -0.45 0.08 0.00 -1.01 0.00 0.00 64.21 63.01 2byp n SER 171 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2byp n SER 172 N -1.13 0.09 0.30 6.43 2.88 -1.01 -4.90 113.62 116.28 2byp n SER 172 Ca 0.16 0.66 0.18 0.00 -1.33 0.00 0.00 58.87 58.54 2byp n SER 172 Cb 0.69 -1.36 0.93 0.00 -0.75 0.00 0.00 64.21 63.72 2byp n SER 172 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2byp h LYS 173 N -0.23 0.00 -5.46 -1.46 1.79 -1.92 -3.43 116.57 105.85 2byp h LYS 173 Ca -0.47 0.00 -0.62 0.00 -2.18 0.00 0.00 60.65 57.39 2byp h LYS 173 Cb 1.34 0.00 -0.32 0.00 -1.58 0.00 0.00 32.23 31.67 2byp h LYS 173 CO 0.46 0.03 -0.86 0.71 -1.08 0.00 0.00 179.45 178.72 2byp s TYR 174 N -4.08 2.04 0.02 -1.35 2.02 -1.26 -0.84 117.35 113.89 2byp s TYR 174 Ca -0.03 -0.65 -0.07 0.00 -0.37 0.00 0.00 57.07 55.95 2byp s TYR 174 Cb 0.12 -1.37 -0.05 0.00 -0.40 0.00 0.00 41.96 40.27 2byp s TYR 174 CO 0.50 -0.23 0.29 -1.83 -1.57 0.00 0.00 175.55 172.71 2byp s GLU 175 N 0.07 3.61 -0.20 -0.62 -1.05 0.20 -4.82 118.70 115.89 2byp s GLU 175 Ca -0.07 -0.02 -0.20 0.00 -0.15 0.00 0.00 54.97 54.52 2byp s GLU 175 Cb -0.14 -3.07 -0.03 0.00 -0.44 0.00 0.00 34.13 30.46 2byp s GLU 175 CO 0.04 0.64 0.62 0.42 0.95 0.00 0.00 175.26 177.92 2byp s ILE 176 N -1.30 5.03 -0.08 1.83 -1.09 -1.26 -2.08 121.20 122.25 2byp s ILE 176 Ca 0.28 1.16 -0.09 0.00 -2.23 0.00 0.00 60.65 59.77 2byp s ILE 176 Cb -0.13 -3.93 -0.29 0.00 -1.58 0.00 0.00 42.46 36.53 2byp s ILE 176 CO 0.16 0.12 0.53 -0.07 -1.23 0.00 0.00 174.94 174.45 2byp h LEU 177 N 8.18 0.53 -7.00 2.97 3.38 -1.23 -3.49 115.31 118.66 2byp h LEU 177 Ca -0.32 -0.95 -0.05 0.00 0.09 0.00 0.00 57.88 56.66 2byp h LEU 177 Cb 1.14 -0.17 -0.19 0.00 0.09 0.00 0.00 40.66 41.54 2byp h LEU 177 CO 0.77 1.82 0.22 -0.94 0.09 0.00 0.00 178.44 180.40 2byp s SER 178 N -7.18 -0.63 -0.09 -0.43 1.04 -1.07 -4.99 113.70 100.34 2byp s SER 178 Ca -0.19 0.62 -0.03 0.00 0.48 0.00 0.00 55.95 56.83 2byp s SER 178 Cb 0.06 0.53 0.05 0.00 0.10 0.00 0.00 66.02 66.76 2byp s SER 178 CO 0.82 -0.63 0.16 0.00 0.98 0.00 0.00 173.24 174.57 2byp s ALA 179 N -1.44 -0.14 0.15 5.32 0.00 -1.26 -0.96 121.76 123.43 2byp s ALA 179 Ca -0.09 0.51 0.08 0.00 0.00 0.00 0.00 51.96 52.46 2byp s ALA 179 Cb -0.00 -0.85 -0.04 0.00 0.00 0.00 0.00 23.12 22.23 2byp s ALA 179 CO 0.07 -0.61 -0.18 0.95 0.00 0.00 0.00 175.76 175.99 2byp s THR 180 N 2.29 1.75 -0.23 0.00 -4.23 0.06 -2.13 115.64 113.15 2byp s THR 180 Ca 0.03 -1.84 -0.03 0.00 -1.18 0.00 0.00 61.69 58.68 2byp s THR 180 Cb -0.12 -1.76 0.07 0.00 1.34 0.00 0.00 72.50 72.02 2byp s THR 180 CO -0.06 -0.29 0.06 0.00 -0.54 0.00 0.00 174.62 173.79 2byp s GLN 181 N -2.65 0.61 -0.11 3.99 -2.07 0.20 -1.09 119.66 118.54 2byp s GLN 181 Ca 0.14 -0.57 0.00 0.00 -1.82 0.00 0.00 55.36 53.11 2byp s GLN 181 Cb -0.06 -1.98 0.02 0.00 -1.09 0.00 0.00 33.01 29.90 2byp s GLN 181 CO 0.06 -0.76 -0.11 0.99 -1.32 0.00 0.00 175.29 174.15 2byp s THR 182 N 1.83 1.21 0.16 3.63 2.01 -0.57 -4.16 115.64 119.74 2byp s THR 182 Ca 0.02 -0.43 -0.31 0.00 0.31 0.00 0.00 61.69 61.28 2byp s THR 182 Cb -0.17 -1.16 -0.10 0.00 0.01 0.00 0.00 72.50 71.08 2byp s THR 182 CO -0.15 0.39 1.62 -0.60 -0.69 0.00 0.00 174.62 175.20 2byp s ARG 183 N 1.38 4.19 0.06 4.92 3.52 -1.26 -0.69 118.95 131.07 2byp s ARG 183 Ca -0.00 2.41 0.07 0.00 -0.13 0.00 0.00 55.73 58.08 2byp s ARG 183 Cb -0.13 -3.24 -0.03 0.00 -1.56 0.00 0.00 34.95 29.99 2byp s ARG 183 CO -0.06 -0.67 -0.20 -0.65 -0.81 0.00 0.00 175.30 172.92 2byp s GLN 184 N 1.48 1.25 0.01 5.12 -0.21 0.11 -4.95 119.66 122.47 2byp s GLN 184 Ca 0.72 -0.97 0.03 0.00 0.02 0.00 0.00 55.36 55.17 2byp s GLN 184 Cb -0.44 -1.38 -0.01 0.00 1.00 0.00 0.00 33.01 32.17 2byp s GLN 184 CO 0.32 0.34 -0.10 0.54 -2.12 0.00 0.00 175.29 174.27 2byp s VAL 185 N -0.90 0.79 0.01 1.09 0.11 -1.26 -1.49 120.40 118.75 2byp s VAL 185 Ca 0.06 -0.60 0.00 0.00 -2.93 0.00 0.00 61.98 58.52 2byp s VAL 185 Cb -0.09 -0.69 -0.01 0.00 -1.53 0.00 0.00 36.38 34.06 2byp s VAL 185 CO 0.02 0.10 -0.02 -1.58 -3.33 0.00 0.00 175.10 170.30 2byp s GLN 186 N -0.56 0.16 0.02 1.54 0.74 -0.40 -4.99 119.66 116.17 2byp s GLN 186 Ca 0.02 -0.27 0.05 0.00 0.05 0.00 0.00 55.36 55.21 2byp s GLN 186 Cb -0.05 0.01 -0.02 0.00 1.10 0.00 0.00 33.01 34.05 2byp s GLN 186 CO 0.00 -0.01 -0.15 -1.01 -0.55 0.00 0.00 175.29 173.57 2byp s HIS 187 N -0.62 1.31 0.05 1.67 3.76 -1.26 -1.23 115.29 118.96 2byp s HIS 187 Ca -0.06 -0.32 0.02 0.00 -0.15 0.00 0.00 55.06 54.55 2byp s HIS 187 Cb -0.04 -0.79 -0.04 0.00 1.11 0.00 0.00 32.58 32.81 2byp s HIS 187 CO -0.00 0.03 0.05 0.71 -0.85 0.00 0.00 174.74 174.68 2byp s TYR 188 N -0.69 3.16 0.48 1.40 4.12 -1.26 -5.02 117.35 119.54 2byp s TYR 188 Ca 0.03 0.09 0.18 0.00 0.02 0.00 0.00 57.07 57.40 2byp s TYR 188 Cb -0.07 -1.65 1.20 0.00 -1.52 0.00 0.00 41.96 39.92 2byp s TYR 188 CO 0.01 0.51 2.01 0.66 0.02 0.00 0.00 175.55 178.76 2byp h SER 189 N 3.70 0.18 0.13 2.29 4.64 -2.01 -2.50 113.55 119.97 2byp h SER 189 Ca -0.48 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.82 2byp h SER 189 Cb 1.17 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 63.22 2byp h SER 189 CO 0.63 0.11 -0.12 0.00 -0.87 0.00 0.00 176.83 176.57 2byp h PRO 192 N 4.86 0.70 -6.96 0.00 0.14 -1.92 -3.39 132.00 125.43 2byp h PRO 192 Ca -0.28 -0.37 -0.55 0.00 0.14 0.00 0.00 66.00 64.93 2byp h PRO 192 Cb 1.19 0.02 0.12 0.00 0.14 0.00 0.00 31.00 32.47 2byp h PRO 192 CO 0.38 0.99 0.66 0.39 0.14 0.00 0.00 178.00 180.56 2byp n GLU 193 N -4.03 2.16 -2.56 0.86 4.71 -1.26 -4.98 120.64 115.54 2byp n GLU 193 Ca -0.02 0.77 -0.37 0.00 -0.01 0.00 0.00 57.16 57.53 2byp n GLU 193 Cb 0.54 -2.58 -0.04 0.00 -1.01 0.00 0.00 31.44 28.35 2byp n GLU 193 CO 0.00 0.00 0.00 -1.25 0.09 0.00 0.00 177.13 175.97 2byp s PRO 194 N -2.43 4.24 -0.24 3.49 0.04 -1.26 -4.63 135.00 134.21 2byp s PRO 194 Ca 0.62 1.52 -0.05 0.00 0.04 0.00 0.00 61.00 63.12 2byp s PRO 194 Cb -0.46 -2.61 -0.01 0.00 0.04 0.00 0.00 34.50 31.46 2byp s PRO 194 CO 0.57 -0.08 0.01 0.71 0.04 0.00 0.00 177.00 178.25 2byp s TYR 195 N -1.62 3.03 -0.14 0.56 2.02 -0.37 -0.27 117.35 120.56 2byp s TYR 195 Ca 0.56 -0.74 0.01 0.00 -0.37 0.00 0.00 57.07 56.53 2byp s TYR 195 Cb -0.22 -2.17 -0.00 0.00 -0.40 0.00 0.00 41.96 39.16 2byp s TYR 195 CO 0.28 -0.48 -0.17 0.42 -1.57 0.00 0.00 175.55 174.03 2byp s ILE 196 N 1.53 2.58 0.24 2.71 1.01 -1.26 -1.27 121.20 126.74 2byp s ILE 196 Ca 0.06 -0.81 0.12 0.00 0.00 0.00 0.00 60.65 60.01 2byp s ILE 196 Cb -0.15 -2.07 -0.05 0.00 0.01 0.00 0.00 42.46 40.21 2byp s ILE 196 CO -0.00 0.53 -0.22 -1.81 0.00 0.00 0.00 174.94 173.44 2byp s ASP 197 N 0.60 3.52 -0.29 3.58 -0.00 -0.55 -4.69 116.67 118.84 2byp s ASP 197 Ca -0.10 -0.95 -0.06 0.00 -0.00 0.00 0.00 52.55 51.44 2byp s ASP 197 Cb -0.16 -0.28 0.01 0.00 -0.00 0.00 0.00 42.92 42.49 2byp s ASP 197 CO 0.03 0.08 0.06 -0.69 -0.00 0.00 0.00 175.17 174.65 2byp s VAL 198 N -2.10 3.84 -0.38 -1.27 1.01 -0.24 0.08 120.40 121.34 2byp s VAL 198 Ca 0.26 -0.71 -0.20 0.00 0.00 0.00 0.00 61.98 61.32 2byp s VAL 198 Cb -0.06 -2.97 0.01 0.00 0.00 0.00 0.00 36.38 33.35 2byp s VAL 198 CO 0.13 0.10 0.63 0.21 0.00 0.00 0.00 175.10 176.17 2byp s ASN 199 N 1.48 6.39 -0.32 3.32 2.47 0.14 -0.89 114.94 127.53 2byp s ASN 199 Ca 0.02 -0.01 -0.18 0.00 0.42 0.00 0.00 52.86 53.12 2byp s ASN 199 Cb -0.17 -2.32 -0.01 0.00 -1.45 0.00 0.00 41.25 37.30 2byp s ASN 199 CO 0.02 -0.64 0.53 -0.22 -3.72 0.00 0.00 177.10 173.06 2byp s LEU 200 N 2.72 4.23 -0.15 3.21 2.96 -0.17 -1.51 118.68 129.97 2byp s LEU 200 Ca 0.23 0.17 0.02 0.00 -0.22 0.00 0.00 54.13 54.33 2byp s LEU 200 Cb -0.14 -2.63 0.01 0.00 0.50 0.00 0.00 46.19 43.92 2byp s LEU 200 CO 0.16 -0.43 -0.20 -0.69 -1.32 0.00 0.00 176.35 173.87 2byp s VAL 201 N 2.40 2.19 -0.12 1.68 1.01 -0.25 -1.10 120.40 126.20 2byp s VAL 201 Ca 0.20 -0.93 0.02 0.00 0.00 0.00 0.00 61.98 61.27 2byp s VAL 201 Cb -0.15 -1.89 0.01 0.00 0.00 0.00 0.00 36.38 34.35 2byp s VAL 201 CO 0.12 0.54 -0.17 -0.69 0.00 0.00 0.00 175.10 174.90 2byp s VAL 202 N 0.94 1.70 -0.15 2.92 1.01 0.42 -0.76 120.40 126.48 2byp s VAL 202 Ca -0.04 -0.76 -0.02 0.00 0.00 0.00 0.00 61.98 61.16 2byp s VAL 202 Cb -0.15 -1.54 -0.02 0.00 0.00 0.00 0.00 36.38 34.67 2byp s VAL 202 CO -0.04 0.48 -0.07 -0.54 0.00 0.00 0.00 175.10 174.92 2byp s LYS 203 N 0.99 3.52 0.15 2.72 1.02 -0.13 -0.53 119.74 127.47 2byp s LYS 203 Ca -0.05 -0.60 -0.16 0.00 0.02 0.00 0.00 55.97 55.18 2byp s LYS 203 Cb -0.15 -2.82 0.03 0.00 -0.52 0.00 0.00 37.83 34.38 2byp s LYS 203 CO -0.03 0.17 0.43 -0.59 -0.92 0.00 0.00 175.35 174.41 2byp s PHE 204 N 0.52 -0.16 0.10 3.18 -0.12 -0.42 -0.62 117.98 120.47 2byp s PHE 204 Ca -0.05 -0.17 -0.10 0.00 -0.05 0.00 0.00 56.93 56.56 2byp s PHE 204 Cb -0.15 0.28 0.00 0.00 -0.63 0.00 0.00 43.02 42.53 2byp s PHE 204 CO 0.03 -0.76 0.23 -0.98 -0.05 0.00 0.00 175.22 173.69 2byp s ARG 205 N -3.83 0.90 0.16 1.99 1.70 -0.88 0.18 118.95 119.17 2byp s ARG 205 Ca 0.05 -0.93 -0.32 0.00 -0.47 0.00 0.00 55.73 54.06 2byp s ARG 205 Cb 0.01 0.36 -0.12 0.00 -0.57 0.00 0.00 34.95 34.63 2byp s ARG 205 CO -0.09 -0.30 1.72 0.39 -1.08 0.00 0.00 175.30 175.94 2byp n GLU 206 N -0.10 2.57 -2.49 3.89 1.02 -0.24 -0.63 120.64 124.66 2byp n GLU 206 Ca -0.15 0.93 -0.43 0.00 -0.02 0.00 0.00 57.16 57.49 2byp n GLU 206 Cb 0.63 -2.77 -0.02 0.00 -0.02 0.00 0.00 31.44 29.26 2byp n GLU 206 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 2byp s ARG 207 N 1.64 3.88 0.00 3.49 3.52 -0.02 -4.74 118.95 126.71 2byp s ARG 207 Ca 0.79 1.06 0.00 0.00 -0.13 0.00 0.00 55.73 57.44 2byp s ARG 207 Cb -0.56 -3.87 0.00 0.00 -1.56 0.00 0.00 34.95 28.96 2byp s ARG 207 CO 0.36 -1.17 0.10 2.89 -0.81 0.00 0.00 175.30 176.67