#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jkv n GLN 3 N 0.00 0.88 -2.83 0.00 0.00 -0.70 -4.58 117.38 110.15 2jkv n GLN 3 Ca 0.00 0.03 -0.38 0.00 0.00 0.00 0.00 57.00 56.66 2jkv n GLN 3 Cb 0.00 -1.47 -0.06 0.00 0.00 0.00 0.00 30.24 28.71 2jkv n GLN 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2jkv s ALA 4 N -2.45 3.28 -0.06 2.61 0.00 -0.15 -4.85 121.76 120.13 2jkv s ALA 4 Ca -0.16 0.49 0.13 0.00 0.00 0.00 0.00 51.96 52.42 2jkv s ALA 4 Cb 0.06 -3.13 -0.07 0.00 0.00 0.00 0.00 23.12 19.99 2jkv s ALA 4 CO 0.69 0.21 1.24 -0.44 0.00 0.00 0.00 175.76 177.46 2jkv h ASP 5 N 3.50 0.00 -4.62 0.00 3.32 -0.72 -2.07 116.42 115.83 2jkv h ASP 5 Ca -0.47 0.00 0.07 0.00 0.02 0.00 0.00 57.03 56.65 2jkv h ASP 5 Cb 1.19 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 40.58 2jkv h ASP 5 CO 0.66 0.69 0.43 -0.51 -1.72 0.00 0.00 179.24 178.79 2jkv s ILE 6 N -2.86 0.00 0.16 0.35 2.07 -1.08 -4.65 121.20 115.19 2jkv s ILE 6 Ca 0.01 0.00 0.11 0.00 -1.41 0.00 0.00 60.65 59.36 2jkv s ILE 6 Cb 0.08 -1.00 -0.04 0.00 0.13 0.00 0.00 42.46 41.63 2jkv s ILE 6 CO 0.78 0.00 -0.25 0.00 -1.91 0.00 0.00 174.94 173.57 2jkv s ALA 7 N -2.55 2.38 -0.02 1.50 0.00 -0.58 -0.39 121.76 122.10 2jkv s ALA 7 Ca 0.01 -1.53 0.00 0.00 0.00 0.00 0.00 51.96 50.45 2jkv s ALA 7 Cb -0.01 -0.34 0.02 0.00 0.00 0.00 0.00 23.12 22.79 2jkv s ALA 7 CO -0.05 0.46 -0.00 -1.17 0.00 0.00 0.00 175.76 175.00 2jkv s LEU 8 N -2.34 1.52 -0.16 0.00 0.20 -0.61 -0.53 118.68 116.75 2jkv s LEU 8 Ca 0.16 -0.02 -0.02 0.00 0.69 0.00 0.00 54.13 54.94 2jkv s LEU 8 Cb -0.09 -0.14 -0.02 0.00 -0.43 0.00 0.00 46.19 45.52 2jkv s LEU 8 CO 0.08 -0.05 -0.07 -0.63 -0.29 0.00 0.00 176.35 175.38 2jkv s ILE 9 N 0.56 3.43 0.00 6.68 1.01 0.61 -1.52 121.20 131.97 2jkv s ILE 9 Ca -0.05 -0.51 0.00 0.00 0.00 0.00 0.00 60.65 60.09 2jkv s ILE 9 Cb -0.08 -2.50 0.00 0.00 0.01 0.00 0.00 42.46 39.89 2jkv s ILE 9 CO -0.01 0.49 0.00 0.61 0.00 0.00 0.00 174.94 176.02 2jkv n GLY 10 N 3.85 2.45 2.06 6.18 0.00 -0.19 -0.94 105.19 118.60 2jkv n GLY 10 Ca -0.18 -0.96 -0.25 0.00 0.00 0.00 0.00 46.02 44.63 2jkv n GLY 10 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2jkv n LEU 11 N 0.00 5.20 0.00 0.99 4.77 -1.26 -4.01 117.00 122.70 2jkv n LEU 11 Ca 0.00 -4.72 0.00 0.00 -0.03 0.00 0.00 56.01 51.26 2jkv n LEU 11 Cb 0.00 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 40.68 2jkv n LEU 11 CO 0.00 2.05 0.00 0.00 -1.33 0.00 0.00 177.39 178.11 2jkv n ALA 12 N -0.73 0.00 -0.06 -1.18 0.00 -1.26 -4.66 120.51 112.63 2jkv n ALA 12 Ca 0.46 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.82 2jkv n ALA 12 Cb 0.93 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.37 2jkv n ALA 12 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 2jkv h VAL 13 N -0.13 0.49 -0.33 0.00 3.04 -1.96 -2.00 116.25 115.36 2jkv h VAL 13 Ca 0.00 0.00 -0.04 0.00 -1.01 0.00 0.00 66.70 65.65 2jkv h VAL 13 Cb 0.00 0.49 -0.01 0.00 -2.01 0.00 0.00 31.29 29.76 2jkv h VAL 13 CO 0.00 0.00 0.06 0.24 -1.01 0.00 0.00 177.57 176.86 2jkv h MET 14 N -0.17 0.53 0.12 4.17 2.86 -1.92 -2.48 114.93 118.04 2jkv h MET 14 Ca 0.14 -0.14 -0.01 0.00 -2.06 0.00 0.00 59.70 57.64 2jkv h MET 14 Cb 0.39 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.98 2jkv h MET 14 CO -0.36 0.61 -0.06 0.78 1.06 0.00 0.00 176.91 178.94 2jkv h GLY 15 N 0.37 -0.17 0.45 8.32 0.00 -1.65 -0.13 103.07 110.27 2jkv h GLY 15 Ca 0.10 0.06 0.06 0.00 0.00 0.00 0.00 47.33 47.55 2jkv h GLY 15 CO 0.00 -0.06 0.00 1.46 0.00 0.00 0.00 176.54 177.94 2jkv h GLN 16 N -0.46 0.09 -0.52 4.80 4.20 -1.43 -1.26 115.11 120.54 2jkv h GLN 16 Ca -0.02 -0.01 -0.10 0.00 0.06 0.00 0.00 58.65 58.59 2jkv h GLN 16 Cb 0.37 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.11 2jkv h GLN 16 CO 0.03 0.06 -0.09 -0.91 -0.67 0.00 0.00 178.83 177.25 2jkv h ASN 17 N 0.10 0.94 0.16 1.46 2.35 -1.35 -2.12 115.58 117.12 2jkv h ASN 17 Ca 0.17 -0.29 -0.12 0.00 -0.55 0.00 0.00 56.30 55.50 2jkv h ASN 17 Cb 0.23 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.33 2jkv h ASN 17 CO -0.28 1.04 -0.45 0.25 -1.65 0.00 0.00 177.43 176.34 2jkv h LEU 18 N 0.85 0.37 -0.16 1.61 5.85 -0.79 -1.13 115.31 121.91 2jkv h LEU 18 Ca 0.14 -0.17 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 2jkv h LEU 18 Cb 0.62 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.54 2jkv h LEU 18 CO 0.04 0.77 0.07 0.40 -0.34 0.00 0.00 178.44 179.39 2jkv h ILE 19 N 0.28 1.14 -0.61 4.05 2.04 -1.00 -1.34 117.51 122.08 2jkv h ILE 19 Ca 0.02 -0.43 -0.01 0.00 1.00 0.00 0.00 64.86 65.45 2jkv h ILE 19 Cb 0.91 1.13 -0.03 0.00 -0.74 0.00 0.00 36.82 38.08 2jkv h ILE 19 CO 0.08 0.14 0.36 -0.07 0.00 0.00 0.00 178.15 178.65 2jkv h LEU 20 N 0.12 0.73 -0.01 1.44 3.38 -1.17 0.39 115.31 120.19 2jkv h LEU 20 Ca 0.06 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 2jkv h LEU 20 Cb 0.15 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 2jkv h LEU 20 CO -0.01 0.57 0.00 -1.13 0.09 0.00 0.00 178.44 177.97 2jkv h ASN 21 N 0.84 0.01 -0.51 -0.43 -0.73 -0.88 -0.79 115.58 113.09 2jkv h ASN 21 Ca 0.22 -0.08 -0.06 0.00 1.87 0.00 0.00 56.30 58.25 2jkv h ASN 21 Cb -0.02 -0.00 -0.03 0.00 0.27 0.00 0.00 38.32 38.54 2jkv h ASN 21 CO -0.04 0.09 0.11 0.24 -0.37 0.00 0.00 177.43 177.46 2jkv h MET 22 N -0.07 0.88 -0.50 6.67 2.86 -0.77 -2.17 114.93 121.83 2jkv h MET 22 Ca 0.00 -0.20 0.00 0.00 -2.06 0.00 0.00 59.70 57.45 2jkv h MET 22 Cb 0.08 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.59 2jkv h MET 22 CO -0.00 0.80 0.33 -0.97 1.06 0.00 0.00 176.91 178.13 2jkv h ASN 23 N 0.84 0.58 0.14 1.22 -0.73 -0.77 -1.79 115.58 115.08 2jkv h ASN 23 Ca 0.18 -0.02 -0.01 0.00 1.87 0.00 0.00 56.30 58.32 2jkv h ASN 23 Cb 0.34 -0.14 -0.00 0.00 0.27 0.00 0.00 38.32 38.78 2jkv h ASN 23 CO 0.00 0.42 -0.04 0.44 -0.37 0.00 0.00 177.43 177.89 2jkv h ASP 24 N 0.67 0.00 -0.30 1.15 3.32 -0.52 0.20 116.42 120.94 2jkv h ASP 24 Ca 0.18 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.23 2jkv h ASP 24 Cb -0.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.48 2jkv h ASP 24 CO -0.04 0.04 0.00 1.41 -1.72 0.00 0.00 179.24 178.93 2jkv n HIS 25 N -3.69 0.40 -0.23 4.55 8.25 -0.90 -4.91 115.22 118.68 2jkv n HIS 25 Ca -0.03 -0.20 0.00 0.00 -0.26 0.00 0.00 57.72 57.24 2jkv n HIS 25 Cb 0.14 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.25 2jkv n HIS 25 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2jkv n GLY 26 N 1.19 0.69 3.77 -1.41 0.00 0.06 -5.06 105.19 104.43 2jkv n GLY 26 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 2jkv n GLY 26 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jkv s PHE 27 N -2.34 3.74 -0.17 1.61 0.08 -0.72 -5.00 117.98 115.18 2jkv s PHE 27 Ca 0.00 1.32 -0.25 0.00 0.12 0.00 0.00 56.93 58.12 2jkv s PHE 27 Cb 0.00 -2.66 -0.01 0.00 -0.57 0.00 0.00 43.02 39.78 2jkv s PHE 27 CO 0.00 0.39 0.84 0.08 -0.10 0.00 0.00 175.22 176.43 2jkv s VAL 28 N -0.41 4.87 -0.07 -0.44 1.01 -1.26 -3.85 120.40 120.24 2jkv s VAL 28 Ca 0.33 1.65 0.04 0.00 0.00 0.00 0.00 61.98 64.00 2jkv s VAL 28 Cb -0.19 -4.14 -0.01 0.00 0.00 0.00 0.00 36.38 32.03 2jkv s VAL 28 CO 0.20 0.02 -0.21 -0.69 0.00 0.00 0.00 175.10 174.42 2jkv s VAL 29 N 2.17 2.37 -0.30 2.92 1.01 -1.26 0.00 120.40 127.31 2jkv s VAL 29 Ca 0.39 -0.94 -0.11 0.00 0.00 0.00 0.00 61.98 61.31 2jkv s VAL 29 Cb -0.17 -1.90 -0.03 0.00 0.00 0.00 0.00 36.38 34.28 2jkv s VAL 29 CO 0.12 0.56 0.20 0.00 0.00 0.00 0.00 175.10 175.99 2jkv s ALA 31 N 1.72 3.61 0.09 0.00 0.00 0.90 -1.56 121.76 126.53 2jkv s ALA 31 Ca 0.06 -0.10 -0.06 0.00 0.00 0.00 0.00 51.96 51.86 2jkv s ALA 31 Cb -0.17 -2.54 -0.01 0.00 0.00 0.00 0.00 23.12 20.40 2jkv s ALA 31 CO 0.10 0.36 0.14 0.12 0.00 0.00 0.00 175.76 176.48 2jkv s PHE 32 N -0.79 0.30 -0.06 0.00 5.36 -0.58 -2.38 117.98 119.82 2jkv s PHE 32 Ca 0.26 -0.75 -0.27 0.00 -0.96 0.00 0.00 56.93 55.22 2jkv s PHE 32 Cb -0.18 -0.16 0.06 0.00 -0.34 0.00 0.00 43.02 42.40 2jkv s PHE 32 CO 0.15 -0.52 0.59 1.21 -1.46 0.00 0.00 175.22 175.20 2jkv s ASN 33 N -2.90 -0.56 0.13 6.13 2.47 -1.26 -1.02 114.94 117.94 2jkv s ASN 33 Ca 0.08 0.63 -0.30 0.00 0.42 0.00 0.00 52.86 53.69 2jkv s ASN 33 Cb 0.06 0.56 -0.07 0.00 -1.45 0.00 0.00 41.25 40.35 2jkv s ASN 33 CO -0.09 -0.54 1.57 -0.09 -3.72 0.00 0.00 177.10 174.23 2jkv h ARG 34 N 3.40 -0.46 -6.28 0.43 2.43 -2.00 -3.25 114.38 108.65 2jkv h ARG 34 Ca -0.28 0.03 -0.54 0.00 -0.81 0.00 0.00 59.98 58.39 2jkv h ARG 34 Cb 1.15 0.11 -0.07 0.00 -0.42 0.00 0.00 29.97 30.73 2jkv h ARG 34 CO 0.36 -0.31 1.13 0.99 -1.51 0.00 0.00 179.97 180.64 2jkv s THR 35 N -5.81 3.68 0.37 0.20 2.01 -1.26 -4.86 115.64 109.97 2jkv s THR 35 Ca -0.15 0.28 0.19 0.00 0.31 0.00 0.00 61.69 62.32 2jkv s THR 35 Cb 0.09 -4.78 0.18 0.00 0.01 0.00 0.00 72.50 68.01 2jkv s THR 35 CO 0.63 -1.72 1.92 0.58 -0.69 0.00 0.00 174.62 175.35 2jkv h VAL 36 N 6.23 0.94 -0.45 3.82 2.07 -1.96 -1.96 116.25 124.94 2jkv h VAL 36 Ca -0.23 -0.95 0.09 0.00 0.82 0.00 0.00 66.70 66.43 2jkv h VAL 36 Cb 1.06 1.55 -0.02 0.00 -1.52 0.00 0.00 31.29 32.36 2jkv h VAL 36 CO 1.28 0.25 0.31 0.77 0.02 0.00 0.00 177.57 180.20 2jkv h SER 37 N 0.00 0.17 0.61 0.57 4.64 -1.90 -0.98 113.55 116.66 2jkv h SER 37 Ca -0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 2jkv h SER 37 Cb 0.53 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 62.58 2jkv h SER 37 CO 0.03 0.11 -0.14 0.11 -0.87 0.00 0.00 176.83 176.07 2jkv h LYS 38 N 0.19 0.00 -0.02 4.77 1.57 -1.74 -2.22 116.57 119.13 2jkv h LYS 38 Ca 0.21 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.99 2jkv h LYS 38 Cb 0.57 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.88 2jkv h LYS 38 CO -0.03 0.14 0.01 0.28 -0.57 0.00 0.00 179.45 179.27 2jkv h VAL 39 N 0.00 1.09 -0.56 0.50 2.07 -1.32 -1.22 116.25 116.81 2jkv h VAL 39 Ca -0.00 -0.25 -0.11 0.00 0.82 0.00 0.00 66.70 67.16 2jkv h VAL 39 Cb 0.48 1.22 -0.02 0.00 -1.52 0.00 0.00 31.29 31.46 2jkv h VAL 39 CO 0.02 0.07 -0.06 0.44 0.02 0.00 0.00 177.57 178.05 2jkv h ASP 40 N -0.07 1.01 -0.84 0.57 3.32 -1.53 -1.36 116.42 117.52 2jkv h ASP 40 Ca 0.01 -0.31 0.02 0.00 0.02 0.00 0.00 57.03 56.76 2jkv h ASP 40 Cb 0.10 -0.27 -0.05 0.00 0.22 0.00 0.00 39.33 39.33 2jkv h ASP 40 CO -0.00 1.10 0.55 0.44 -1.72 0.00 0.00 179.24 179.61 2jkv h ASP 41 N 0.92 0.94 -0.18 6.45 3.32 -1.35 -1.06 116.42 125.46 2jkv h ASP 41 Ca 0.15 -0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.16 2jkv h ASP 41 Cb 0.62 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 2jkv h ASP 41 CO 0.04 0.66 0.03 0.15 -1.72 0.00 0.00 179.24 178.40 2jkv h PHE 42 N 1.10 0.33 0.00 4.55 3.57 -0.85 -1.82 116.94 123.82 2jkv h PHE 42 Ca 0.32 -0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.75 2jkv h PHE 42 Cb -0.07 -0.09 -0.00 0.00 2.79 0.00 0.00 35.95 38.58 2jkv h PHE 42 CO -0.02 0.47 -0.12 -0.07 -2.23 0.00 0.00 178.31 176.34 2jkv h LEU 43 N 0.09 0.00 0.00 0.59 3.38 -0.93 -0.52 115.31 117.92 2jkv h LEU 43 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2jkv h LEU 43 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 2jkv h LEU 43 CO 0.00 0.12 -0.77 0.00 0.09 0.00 0.00 178.44 177.89 2jkv h ALA 44 N 1.88 0.57 -3.00 1.53 0.00 -0.98 -3.19 119.26 116.07 2jkv h ALA 44 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2jkv h ALA 44 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2jkv h ALA 44 CO 0.02 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.36 2jkv n ASN 45 N -2.47 0.00 -0.13 0.00 3.02 -0.70 -4.63 115.26 110.35 2jkv n ASN 45 Ca 0.02 0.00 0.14 0.00 -0.03 0.00 0.00 54.58 54.71 2jkv n ASN 45 Cb 0.50 0.00 0.51 0.00 -0.61 0.00 0.00 39.78 40.19 2jkv n ASN 45 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 2jkv h GLU 46 N 0.00 0.38 -0.63 3.52 3.07 -1.73 -0.24 114.58 118.95 2jkv h GLU 46 Ca 0.00 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.84 2jkv h GLU 46 Cb 0.00 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 27.82 2jkv h GLU 46 CO 0.00 0.25 0.00 0.00 -1.40 0.00 0.00 179.01 177.86 2jkv n ALA 47 N -2.53 3.31 -0.13 3.43 0.00 -0.25 -4.70 120.51 119.64 2jkv n ALA 47 Ca 0.12 -1.71 0.12 0.00 0.00 0.00 0.00 53.44 51.98 2jkv n ALA 47 Cb 0.48 -1.04 0.48 0.00 0.00 0.00 0.00 19.45 19.37 2jkv n ALA 47 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 2jkv h LYS 48 N 4.05 0.45 -0.55 0.00 2.10 -1.02 -2.18 116.57 119.43 2jkv h LYS 48 Ca 0.00 -0.03 -0.33 0.00 -2.00 0.00 0.00 60.65 58.29 2jkv h LYS 48 Cb 1.61 -0.10 -0.20 0.00 -0.90 0.00 0.00 32.23 32.64 2jkv h LYS 48 CO 0.31 0.30 -0.04 0.41 -2.00 0.00 0.00 179.45 178.42 2jkv n GLY 49 N -1.51 5.26 3.83 0.07 0.00 -1.26 -5.00 105.19 106.58 2jkv n GLY 49 Ca 0.12 -1.60 -0.28 0.00 0.00 0.00 0.00 46.02 44.26 2jkv n GLY 49 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jkv s THR 50 N -3.68 1.65 -2.00 2.61 -4.23 -0.82 -5.02 115.64 104.15 2jkv s THR 50 Ca 0.49 -1.69 0.10 0.00 -1.18 0.00 0.00 61.69 59.42 2jkv s THR 50 Cb 0.43 -2.33 0.30 0.00 1.34 0.00 0.00 72.50 72.23 2jkv s THR 50 CO 0.01 0.00 1.25 0.29 -0.54 0.00 0.00 174.62 175.63 2jkv n LYS 51 N -1.50 1.77 -2.05 3.99 5.02 -1.26 -4.94 118.16 119.19 2jkv n LYS 51 Ca -0.07 -1.20 -0.41 0.00 -2.02 0.00 0.00 58.31 54.61 2jkv n LYS 51 Cb 0.65 -1.26 -0.02 0.00 -0.02 0.00 0.00 35.03 34.38 2jkv n LYS 51 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2jkv s VAL 52 N -1.55 2.66 0.17 -0.18 1.01 -1.26 -4.43 120.40 116.82 2jkv s VAL 52 Ca 0.22 0.60 0.09 0.00 0.00 0.00 0.00 61.98 62.90 2jkv s VAL 52 Cb 0.12 -3.38 -0.04 0.00 0.00 0.00 0.00 36.38 33.07 2jkv s VAL 52 CO 0.15 0.12 -0.12 0.68 0.00 0.00 0.00 175.10 175.93 2jkv s VAL 53 N -0.57 3.04 0.32 2.92 -7.23 -0.45 -4.99 120.40 113.44 2jkv s VAL 53 Ca 0.54 -1.68 0.09 0.00 -1.81 0.00 0.00 61.98 59.13 2jkv s VAL 53 Cb -0.41 -2.49 -0.05 0.00 0.56 0.00 0.00 36.38 33.99 2jkv s VAL 53 CO 0.49 -0.08 -0.01 -0.83 -0.31 0.00 0.00 175.10 174.36 2jkv s GLY 54 N -2.71 1.96 0.12 2.32 0.00 -1.26 -0.06 107.32 107.68 2jkv s GLY 54 Ca 0.23 -1.89 0.06 0.00 0.00 0.00 0.00 44.72 43.13 2jkv s GLY 54 CO 0.14 -1.87 -0.16 0.00 0.00 0.00 0.00 173.10 171.21 2jkv s ALA 55 N -2.48 1.54 -2.22 3.20 0.00 -1.01 -4.87 121.76 115.93 2jkv s ALA 55 Ca 0.34 -1.26 0.19 0.00 0.00 0.00 0.00 51.96 51.23 2jkv s ALA 55 Cb -0.02 -0.12 0.11 0.00 0.00 0.00 0.00 23.12 23.09 2jkv s ALA 55 CO 0.19 0.17 1.07 1.04 0.00 0.00 0.00 175.76 178.22 2jkv n GLN 56 N 0.72 1.65 -3.56 0.00 1.13 -1.26 -4.82 117.38 111.24 2jkv n GLN 56 Ca -0.17 -1.45 -0.11 0.00 -1.94 0.00 0.00 57.00 53.34 2jkv n GLN 56 Cb 0.56 -1.36 -0.03 0.00 0.11 0.00 0.00 30.24 29.52 2jkv n GLN 56 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 2jkv s SER 57 N -1.75 -0.41 0.19 1.08 1.04 -1.26 -5.01 113.70 107.58 2jkv s SER 57 Ca 0.21 -0.21 -0.11 0.00 0.48 0.00 0.00 55.95 56.31 2jkv s SER 57 Cb 0.16 0.58 0.18 0.00 0.10 0.00 0.00 66.02 67.04 2jkv s SER 57 CO 0.30 -1.00 1.81 -0.07 0.98 0.00 0.00 173.24 175.26 2jkv h LEU 58 N 2.11 0.51 -0.36 2.42 3.38 -1.98 -0.76 115.31 120.62 2jkv h LEU 58 Ca -0.32 0.02 0.04 0.00 0.09 0.00 0.00 57.88 57.72 2jkv h LEU 58 Cb 1.28 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.91 2jkv h LEU 58 CO 0.38 0.34 0.12 0.11 0.09 0.00 0.00 178.44 179.48 2jkv h LYS 59 N 0.64 0.26 -0.65 1.13 1.57 -1.96 0.12 116.57 117.67 2jkv h LYS 59 Ca 0.26 -0.02 -0.07 0.00 -1.87 0.00 0.00 60.65 58.95 2jkv h LYS 59 Cb 0.12 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.35 2jkv h LYS 59 CO -0.15 0.17 0.14 1.49 -0.57 0.00 0.00 179.45 180.53 2jkv h GLU 60 N 0.26 1.05 -0.24 3.15 4.81 -1.90 -2.54 114.58 119.17 2jkv h GLU 60 Ca 0.16 -0.26 -0.01 0.00 -0.13 0.00 0.00 59.36 59.12 2jkv h GLU 60 Cb 0.15 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 2jkv h GLU 60 CO -0.17 0.95 0.12 1.98 -0.73 0.00 0.00 179.01 181.16 2jkv h MET 61 N 0.97 0.34 -0.67 1.92 4.05 -0.24 -2.74 114.93 118.57 2jkv h MET 61 Ca 0.20 -0.05 -0.00 0.00 -0.28 0.00 0.00 59.70 59.57 2jkv h MET 61 Cb 0.39 -0.06 -0.03 0.00 -0.80 0.00 0.00 31.60 31.09 2jkv h MET 61 CO 0.01 0.33 0.41 0.28 0.23 0.00 0.00 176.91 178.17 2jkv h VAL 62 N 0.26 1.18 0.00 -5.77 2.07 -0.75 -2.47 116.25 110.78 2jkv h VAL 62 Ca 0.08 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 67.22 2jkv h VAL 62 Cb 0.10 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 30.10 2jkv h VAL 62 CO -0.01 0.19 0.00 0.77 0.02 0.00 0.00 177.57 178.53 2jkv h SER 63 N 0.91 0.00 0.36 0.57 4.64 -1.15 -2.47 113.55 116.41 2jkv h SER 63 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 2jkv h SER 63 Cb -0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.03 2jkv h SER 63 CO -0.05 0.00 -0.17 0.29 -0.87 0.00 0.00 176.83 176.04 2jkv n LYS 64 N -2.67 0.66 -3.49 4.77 5.02 -0.93 -3.73 118.16 117.79 2jkv n LYS 64 Ca 0.02 -0.28 -0.38 0.00 -2.02 0.00 0.00 58.31 55.64 2jkv n LYS 64 Cb 0.29 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 33.75 2jkv n LYS 64 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2jkv s LEU 65 N -2.53 4.46 0.39 -0.35 1.43 -0.93 -0.97 118.68 120.18 2jkv s LEU 65 Ca 0.26 0.95 -0.25 0.00 -1.03 0.00 0.00 54.13 54.06 2jkv s LEU 65 Cb 0.20 -2.59 -0.09 0.00 0.03 0.00 0.00 46.19 43.74 2jkv s LEU 65 CO 0.50 0.30 1.11 -0.54 0.23 0.00 0.00 176.35 177.96 2jkv s LYS 66 N -0.96 4.15 0.14 1.70 1.02 -0.78 -4.68 119.74 120.33 2jkv s LYS 66 Ca 0.24 1.70 -0.20 0.00 0.02 0.00 0.00 55.97 57.73 2jkv s LYS 66 Cb -0.17 -2.67 -0.07 0.00 -0.52 0.00 0.00 37.83 34.40 2jkv s LYS 66 CO 0.13 -0.20 0.65 0.15 -0.92 0.00 0.00 175.35 175.16 2jkv s LYS 67 N -2.30 4.25 0.16 1.68 1.02 -1.26 -2.58 119.74 120.72 2jkv s LYS 67 Ca 0.56 0.81 -0.30 0.00 0.02 0.00 0.00 55.97 57.06 2jkv s LYS 67 Cb -0.27 -3.10 -0.08 0.00 -0.52 0.00 0.00 37.83 33.86 2jkv s LYS 67 CO 0.34 0.54 1.28 -1.25 -0.92 0.00 0.00 175.35 175.34 2jkv s PRO 68 N -1.48 4.41 0.32 -1.68 0.04 -1.26 -5.09 135.00 130.26 2jkv s PRO 68 Ca 0.35 1.98 -0.29 0.00 0.04 0.00 0.00 61.00 63.08 2jkv s PRO 68 Cb -0.19 -3.23 -0.11 0.00 0.04 0.00 0.00 34.50 31.01 2jkv s PRO 68 CO 0.21 -0.24 1.44 1.03 0.04 0.00 0.00 177.00 179.47 2jkv s ARG 69 N 0.20 4.22 -0.14 4.56 0.52 -1.07 -4.80 118.95 122.44 2jkv s ARG 69 Ca 0.57 2.41 0.00 0.00 -0.52 0.00 0.00 55.73 58.19 2jkv s ARG 69 Cb -0.35 -3.04 0.02 0.00 0.52 0.00 0.00 34.95 32.11 2jkv s ARG 69 CO 0.35 -0.42 -0.14 1.03 0.02 0.00 0.00 175.30 176.15 2jkv s ARG 70 N -1.40 2.25 -0.08 3.54 0.52 -1.26 -0.24 118.95 122.28 2jkv s ARG 70 Ca 0.54 -0.54 0.03 0.00 -0.52 0.00 0.00 55.73 55.24 2jkv s ARG 70 Cb -0.44 -2.07 0.01 0.00 0.52 0.00 0.00 34.95 32.98 2jkv s ARG 70 CO 0.54 -0.23 -0.17 0.42 0.02 0.00 0.00 175.30 175.88 2jkv s ILE 71 N 1.47 1.53 -0.12 1.52 1.09 -0.49 -1.53 121.20 124.67 2jkv s ILE 71 Ca 0.04 -0.71 -0.04 0.00 -1.10 0.00 0.00 60.65 58.85 2jkv s ILE 71 Cb -0.13 -1.36 -0.03 0.00 -1.06 0.00 0.00 42.46 39.88 2jkv s ILE 71 CO -0.10 0.44 0.01 -0.63 -0.10 0.00 0.00 174.94 174.57 2jkv s ILE 72 N 0.54 4.40 -0.22 2.92 1.01 0.30 -0.03 121.20 130.13 2jkv s ILE 72 Ca -0.16 -0.20 -0.04 0.00 0.00 0.00 0.00 60.65 60.25 2jkv s ILE 72 Cb -0.17 -2.90 -0.01 0.00 0.01 0.00 0.00 42.46 39.39 2jkv s ILE 72 CO 0.06 0.56 -0.02 -0.76 0.00 0.00 0.00 174.94 174.77 2jkv s LEU 73 N -0.40 3.02 -0.54 2.97 1.43 0.93 -0.28 118.68 125.81 2jkv s LEU 73 Ca 0.08 -0.33 0.07 0.00 -1.03 0.00 0.00 54.13 52.91 2jkv s LEU 73 Cb -0.12 -1.78 0.28 0.00 0.03 0.00 0.00 46.19 44.60 2jkv s LEU 73 CO 0.02 -0.01 0.74 0.18 0.23 0.00 0.00 176.35 177.51 2jkv n LEU 74 N 4.71 2.82 -4.56 1.79 4.77 -0.12 -0.86 117.00 125.54 2jkv n LEU 74 Ca -0.18 -5.29 -0.26 0.00 -0.03 0.00 0.00 56.01 50.26 2jkv n LEU 74 Cb 0.51 -0.21 -0.11 0.00 -2.33 0.00 0.00 43.42 41.29 2jkv n LEU 74 CO 0.30 2.15 -0.35 0.68 -1.33 0.00 0.00 177.39 178.84 2jkv s VAL 75 N -2.62 2.08 -0.07 4.08 -7.23 -1.26 -4.46 120.40 110.92 2jkv s VAL 75 Ca 0.41 -2.12 -0.39 0.00 -1.81 0.00 0.00 61.98 58.07 2jkv s VAL 75 Cb 0.20 -2.76 -0.17 0.00 0.56 0.00 0.00 36.38 34.21 2jkv s VAL 75 CO -0.07 -0.13 1.48 1.17 -0.31 0.00 0.00 175.10 177.24 2jkv n LYS 76 N -0.84 1.03 -1.80 4.82 4.81 -1.26 -4.72 118.16 120.21 2jkv n LYS 76 Ca -0.05 0.37 -0.37 0.00 -0.87 0.00 0.00 58.31 57.40 2jkv n LYS 76 Cb 0.65 -2.02 0.06 0.00 0.02 0.00 0.00 35.03 33.74 2jkv n LYS 76 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2jkv s ALA 77 N 1.63 2.46 0.00 3.14 0.00 -1.26 -4.39 121.76 123.33 2jkv s ALA 77 Ca 0.91 1.20 0.00 0.00 0.00 0.00 0.00 51.96 54.06 2jkv s ALA 77 Cb -1.04 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 18.55 2jkv s ALA 77 CO 0.55 -1.49 0.00 0.41 0.00 0.00 0.00 175.76 175.23 2jkv n GLY 78 N 0.81 0.04 0.36 0.00 0.00 -1.26 -4.74 105.19 100.40 2jkv n GLY 78 Ca 0.15 -1.78 -0.01 0.00 0.00 0.00 0.00 46.02 44.38 2jkv n GLY 78 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2jkv h GLN 79 N 0.00 1.11 -0.92 1.61 5.75 -2.01 -2.49 115.11 118.16 2jkv h GLN 79 Ca 0.00 -0.07 0.16 0.00 -0.15 0.00 0.00 58.65 58.59 2jkv h GLN 79 Cb 0.00 -0.25 -0.08 0.00 1.07 0.00 0.00 27.48 28.23 2jkv h GLN 79 CO 0.00 0.74 0.59 0.00 -2.65 0.00 0.00 178.83 177.51 2jkv h ALA 80 N 1.46 1.85 -0.18 3.38 0.00 -1.85 0.33 119.26 124.25 2jkv h ALA 80 Ca 0.31 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.22 2jkv h ALA 80 Cb -0.12 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 2jkv h ALA 80 CO -0.06 -0.12 0.03 0.28 0.00 0.00 0.00 179.25 179.37 2jkv h VAL 81 N 0.67 1.22 -0.89 0.00 2.07 -1.65 -2.28 116.25 115.39 2jkv h VAL 81 Ca 0.47 -0.72 -0.01 0.00 0.82 0.00 0.00 66.70 67.26 2jkv h VAL 81 Cb 0.81 1.35 -0.04 0.00 -1.52 0.00 0.00 31.29 31.88 2jkv h VAL 81 CO -0.23 0.22 0.50 0.44 0.02 0.00 0.00 177.57 178.52 2jkv h ASP 82 N 0.09 1.10 -0.36 0.57 3.32 -1.11 -1.40 116.42 118.63 2jkv h ASP 82 Ca 0.06 -0.09 0.07 0.00 0.02 0.00 0.00 57.03 57.09 2jkv h ASP 82 Cb 0.30 -0.28 -0.07 0.00 0.22 0.00 0.00 39.33 39.51 2jkv h ASP 82 CO 0.00 0.88 -0.06 0.44 -1.72 0.00 0.00 179.24 178.78 2jkv h ASP 83 N 1.24 -0.26 -0.40 6.45 3.32 -0.25 -0.51 116.42 126.01 2jkv h ASP 83 Ca 0.31 0.10 -0.16 0.00 0.02 0.00 0.00 57.03 57.31 2jkv h ASP 83 Cb 0.01 0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 2jkv h ASP 83 CO -0.05 -0.09 -0.36 -0.26 -1.72 0.00 0.00 179.24 176.76 2jkv h PHE 84 N 0.04 1.13 -0.41 4.55 0.04 -1.10 -2.65 116.94 118.54 2jkv h PHE 84 Ca 0.18 -0.33 0.03 0.00 2.80 0.00 0.00 57.97 60.65 2jkv h PHE 84 Cb 0.26 -0.24 -0.03 0.00 2.20 0.00 0.00 35.95 38.14 2jkv h PHE 84 CO -0.30 1.16 0.21 0.82 -0.60 0.00 0.00 178.31 179.60 2jkv h ILE 85 N 0.77 0.99 -0.79 -0.55 2.04 -0.89 0.21 117.51 119.28 2jkv h ILE 85 Ca 0.07 -0.15 0.07 0.00 1.00 0.00 0.00 64.86 65.85 2jkv h ILE 85 Cb 0.95 0.52 -0.06 0.00 -0.74 0.00 0.00 36.82 37.49 2jkv h ILE 85 CO 0.09 0.08 0.46 -0.33 0.00 0.00 0.00 178.15 178.45 2jkv h GLU 86 N 0.43 0.80 -0.01 2.37 5.08 -1.00 -1.65 114.58 120.60 2jkv h GLU 86 Ca 0.17 -0.05 -0.15 0.00 -1.00 0.00 0.00 59.36 58.33 2jkv h GLU 86 Cb 0.07 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.12 2jkv h GLU 86 CO -0.11 0.53 -0.70 0.87 -1.00 0.00 0.00 179.01 178.59 2jkv h LYS 87 N 0.82 0.04 0.07 2.33 1.57 -1.10 -3.34 116.57 116.96 2jkv h LYS 87 Ca 0.36 -0.03 -0.21 0.00 -1.87 0.00 0.00 60.65 58.90 2jkv h LYS 87 Cb 0.25 0.01 0.02 0.00 0.08 0.00 0.00 32.23 32.59 2jkv h LYS 87 CO -0.20 0.72 -0.87 -0.07 -0.57 0.00 0.00 179.45 178.46 2jkv h LEU 88 N 0.02 0.64 -0.81 2.94 3.38 -0.48 -3.37 115.31 117.63 2jkv h LEU 88 Ca -0.01 -0.83 0.18 0.00 0.09 0.00 0.00 57.88 57.32 2jkv h LEU 88 Cb 1.25 -0.20 -0.12 0.00 0.09 0.00 0.00 40.66 41.68 2jkv h LEU 88 CO 0.09 1.40 0.28 0.58 0.09 0.00 0.00 178.44 180.88 2jkv h VAL 89 N -0.04 0.50 0.00 1.22 2.07 -1.44 0.24 116.25 118.81 2jkv h VAL 89 Ca -0.13 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 67.26 2jkv h VAL 89 Cb 1.60 0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 31.50 2jkv h VAL 89 CO 0.17 0.06 -0.08 -0.65 0.02 0.00 0.00 177.57 177.09 2jkv h PRO 90 N 0.34 0.00 -0.00 1.57 0.11 -1.76 -2.71 132.00 129.56 2jkv h PRO 90 Ca 0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.59 2jkv h PRO 90 Cb 0.85 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.96 2jkv h PRO 90 CO -0.51 0.08 -0.52 1.28 -0.21 0.00 0.00 178.00 178.12 2jkv n LEU 91 N -3.75 0.68 -4.98 2.35 4.77 0.80 -4.94 117.00 111.93 2jkv n LEU 91 Ca -0.02 -0.12 -0.20 0.00 -0.03 0.00 0.00 56.01 55.63 2jkv n LEU 91 Cb 0.18 -0.19 -0.01 0.00 -2.33 0.00 0.00 43.42 41.06 2jkv n LEU 91 CO 0.29 0.16 0.00 -0.76 -1.33 0.00 0.00 177.39 175.75 2jkv s LEU 92 N -2.91 4.19 0.25 2.23 1.43 -0.99 -5.00 118.68 117.89 2jkv s LEU 92 Ca 0.13 -0.00 0.08 0.00 -1.03 0.00 0.00 54.13 53.31 2jkv s LEU 92 Cb 0.18 -2.84 -0.04 0.00 0.03 0.00 0.00 46.19 43.52 2jkv s LEU 92 CO 0.69 -0.20 0.14 -1.81 0.23 0.00 0.00 176.35 175.40 2jkv s ASP 93 N -4.05 5.26 0.17 2.29 1.01 -1.26 -5.00 116.67 115.10 2jkv s ASP 93 Ca 0.38 -0.35 -0.33 0.00 0.71 0.00 0.00 52.55 52.95 2jkv s ASP 93 Cb -0.09 -1.26 -0.14 0.00 1.01 0.00 0.00 42.92 42.44 2jkv s ASP 93 CO 0.30 -0.02 1.53 0.41 0.21 0.00 0.00 175.17 177.60 2jkv n THR 94 N -1.06 0.18 -0.01 -1.27 -1.04 -1.26 -1.55 114.28 108.28 2jkv n THR 94 Ca -0.08 -0.05 0.00 0.00 -2.04 0.00 0.00 64.05 61.89 2jkv n THR 94 Cb 0.58 -1.49 0.00 0.00 -1.82 0.00 0.00 70.33 67.60 2jkv n THR 94 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2jkv n GLY 95 N 3.12 0.41 3.76 3.41 0.00 0.67 -5.01 105.19 111.55 2jkv n GLY 95 Ca 0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.87 2jkv n GLY 95 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jkv s ASP 96 N -2.32 4.33 -0.08 1.61 1.11 -0.60 -4.70 116.67 116.02 2jkv s ASP 96 Ca 0.00 1.77 0.00 0.00 0.18 0.00 0.00 52.55 54.50 2jkv s ASP 96 Cb 0.00 -2.46 0.02 0.00 1.07 0.00 0.00 42.92 41.55 2jkv s ASP 96 CO 0.00 -2.14 -0.06 -0.63 1.18 0.00 0.00 175.17 173.53 2jkv s ILE 97 N -2.91 0.76 -0.15 0.77 1.01 0.66 -0.85 121.20 120.49 2jkv s ILE 97 Ca 0.61 -0.18 -0.01 0.00 0.00 0.00 0.00 60.65 61.07 2jkv s ILE 97 Cb -0.17 -0.79 -0.01 0.00 0.01 0.00 0.00 42.46 41.49 2jkv s ILE 97 CO 0.56 0.30 -0.11 -0.63 0.00 0.00 0.00 174.94 175.06 2jkv s ILE 98 N 1.35 3.17 -0.30 2.92 1.01 -0.16 -1.39 121.20 127.79 2jkv s ILE 98 Ca -0.03 -0.61 0.01 0.00 0.00 0.00 0.00 60.65 60.02 2jkv s ILE 98 Cb -0.14 -2.36 0.07 0.00 0.01 0.00 0.00 42.46 40.04 2jkv s ILE 98 CO -0.03 0.50 -0.02 -0.63 0.00 0.00 0.00 174.94 174.77 2jkv s ILE 99 N 0.56 2.59 -0.47 2.92 1.01 0.95 -0.54 121.20 128.23 2jkv s ILE 99 Ca -0.07 -1.69 -0.26 0.00 0.00 0.00 0.00 60.65 58.64 2jkv s ILE 99 Cb -0.15 -2.59 0.03 0.00 0.01 0.00 0.00 42.46 39.75 2jkv s ILE 99 CO 0.03 -0.20 0.94 -0.62 0.00 0.00 0.00 174.94 175.09 2jkv s ASP 100 N 1.19 6.49 0.00 3.58 2.15 0.43 -0.05 116.67 130.47 2jkv s ASP 100 Ca -0.03 0.10 0.24 0.00 0.43 0.00 0.00 52.55 53.28 2jkv s ASP 100 Cb -0.20 -2.45 0.15 0.00 -0.30 0.00 0.00 42.92 40.12 2jkv s ASP 100 CO -0.04 -1.08 1.22 0.61 -0.17 0.00 0.00 175.17 175.71 2jkv n GLY 101 N 4.95 0.68 3.82 2.66 0.00 -0.05 -0.68 105.19 116.58 2jkv n GLY 101 Ca 0.06 -0.67 -0.30 0.00 0.00 0.00 0.00 46.02 45.11 2jkv n GLY 101 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jkv s GLY 102 N -2.15 1.74 -1.37 -0.02 0.00 -1.21 -4.03 107.32 100.29 2jkv s GLY 102 Ca 0.25 -1.22 -0.11 0.00 0.00 0.00 0.00 44.72 43.64 2jkv s GLY 102 CO 0.38 -0.37 2.07 0.70 0.00 0.00 0.00 173.10 175.89 2jkv n ASN 103 N -4.17 4.76 -4.87 1.64 3.02 -1.26 -4.78 115.26 109.59 2jkv n ASN 103 Ca 0.16 -2.98 -0.31 0.00 -0.03 0.00 0.00 54.58 51.42 2jkv n ASN 103 Cb 0.59 -1.55 -0.04 0.00 -0.61 0.00 0.00 39.78 38.17 2jkv n ASN 103 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2jkv s SER 104 N 1.87 6.61 0.23 6.41 0.01 -1.26 -4.72 113.70 122.85 2jkv s SER 104 Ca 0.44 1.09 -0.30 0.00 1.31 0.00 0.00 55.95 58.49 2jkv s SER 104 Cb 0.12 -2.30 -0.09 0.00 0.21 0.00 0.00 66.02 63.96 2jkv s SER 104 CO -0.04 -0.25 1.29 -1.61 0.41 0.00 0.00 173.24 173.03 2jkv s GLU 105 N -3.35 4.41 0.47 12.44 2.02 -1.26 -4.87 118.70 128.56 2jkv s GLU 105 Ca 0.51 2.06 0.14 0.00 0.02 0.00 0.00 54.97 57.70 2jkv s GLU 105 Cb -0.10 -3.17 1.11 0.00 0.10 0.00 0.00 34.13 32.07 2jkv s GLU 105 CO 0.25 -0.19 2.07 0.10 0.02 0.00 0.00 175.26 177.50 2jkv h TYR 106 N 4.83 0.24 -0.59 1.61 -0.00 -1.86 -1.11 116.97 120.10 2jkv h TYR 106 Ca -0.46 0.01 -0.10 0.00 -0.00 0.00 0.00 58.73 58.18 2jkv h TYR 106 Cb 1.22 -0.08 -0.02 0.00 -0.00 0.00 0.00 36.73 37.84 2jkv h TYR 106 CO 0.60 0.14 -0.01 0.00 -0.00 0.00 0.00 178.16 178.89 2jkv h ARG 107 N 0.25 1.04 -0.66 0.10 3.08 -1.91 0.44 114.38 116.73 2jkv h ARG 107 Ca 0.14 -0.33 0.01 0.00 0.07 0.00 0.00 59.98 59.87 2jkv h ARG 107 Cb 0.23 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.15 2jkv h ARG 107 CO -0.03 1.03 0.43 -0.44 -1.07 0.00 0.00 179.97 179.89 2jkv h ASP 108 N 0.95 0.73 -0.63 7.04 3.32 -1.61 -1.69 116.42 124.53 2jkv h ASP 108 Ca 0.17 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.14 2jkv h ASP 108 Cb 0.56 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.91 2jkv h ASP 108 CO 0.03 0.52 0.14 0.74 -1.72 0.00 0.00 179.24 178.96 2jkv h THR 109 N 0.87 1.26 -0.48 0.35 2.02 -0.87 -0.67 112.91 115.37 2jkv h THR 109 Ca 0.25 -0.94 -0.00 0.00 0.77 0.00 0.00 66.41 66.48 2jkv h THR 109 Cb -0.07 0.66 -0.02 0.00 -1.74 0.00 0.00 68.15 66.98 2jkv h THR 109 CO -0.07 0.35 0.29 0.74 0.37 0.00 0.00 175.52 177.21 2jkv h THR 110 N 0.93 1.15 0.06 3.16 2.02 -0.74 -0.07 112.91 119.42 2jkv h THR 110 Ca 0.20 -0.35 -0.00 0.00 0.77 0.00 0.00 66.41 67.02 2jkv h THR 110 Cb 0.37 0.51 0.00 0.00 -1.74 0.00 0.00 68.15 67.29 2jkv h THR 110 CO 0.00 0.16 -0.03 -0.09 0.37 0.00 0.00 175.52 175.93 2jkv h ARG 111 N 0.65 -0.07 -0.83 6.66 2.43 -1.02 -1.66 114.38 120.53 2jkv h ARG 111 Ca 0.17 0.00 0.04 0.00 -0.81 0.00 0.00 59.98 59.39 2jkv h ARG 111 Cb -0.00 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.51 2jkv h ARG 111 CO -0.03 0.05 0.52 0.00 -1.51 0.00 0.00 179.97 179.00 2jkv h ARG 112 N -0.18 0.96 -0.41 0.20 3.08 -1.01 -1.11 114.38 115.92 2jkv h ARG 112 Ca -0.01 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.98 2jkv h ARG 112 Cb 0.15 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 2jkv h ARG 112 CO 0.01 0.64 0.26 0.00 -1.07 0.00 0.00 179.97 179.81 2jkv h ARG 114 N 0.54 0.62 -0.17 0.00 3.08 -0.96 -1.84 114.38 115.65 2jkv h ARG 114 Ca 0.15 -0.26 0.00 0.00 0.07 0.00 0.00 59.98 59.94 2jkv h ARG 114 Cb -0.03 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 2jkv h ARG 114 CO -0.03 0.84 0.11 0.22 -1.07 0.00 0.00 179.97 180.04 2jkv h ASP 115 N 0.37 0.20 0.18 7.04 3.58 -1.04 -2.56 116.42 124.20 2jkv h ASP 115 Ca 0.07 -0.03 -0.13 0.00 0.42 0.00 0.00 57.03 57.36 2jkv h ASP 115 Cb 0.64 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.63 2jkv h ASP 115 CO 0.04 0.17 -0.50 -0.07 -2.88 0.00 0.00 179.24 176.01 2jkv h LEU 116 N 0.22 0.39 -0.57 2.28 3.38 -1.16 -2.77 115.31 117.08 2jkv h LEU 116 Ca 0.06 -0.19 0.02 0.00 0.09 0.00 0.00 57.88 57.86 2jkv h LEU 116 Cb -0.00 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 2jkv h LEU 116 CO -0.01 0.82 0.36 0.50 0.09 0.00 0.00 178.44 180.20 2jkv h LYS 117 N 0.29 0.69 -0.21 1.13 3.64 -1.17 0.79 116.57 121.73 2jkv h LYS 117 Ca 0.01 -0.04 0.06 0.00 -1.27 0.00 0.00 60.65 59.41 2jkv h LYS 117 Cb 0.98 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.63 2jkv h LYS 117 CO 0.08 0.46 0.20 0.00 -2.27 0.00 0.00 179.45 177.92 2jkv h ALA 118 N 1.24 1.94 -0.70 5.00 0.00 -1.19 -1.20 119.26 124.35 2jkv h ALA 118 Ca 0.22 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2jkv h ALA 118 Cb -0.01 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2jkv h ALA 118 CO -0.08 -0.30 0.00 1.63 0.00 0.00 0.00 179.25 180.50 2jkv n LYS 119 N -4.01 3.13 -0.99 0.00 5.02 0.10 -4.93 118.16 116.48 2jkv n LYS 119 Ca 0.02 -2.75 0.00 0.00 -2.02 0.00 0.00 58.31 53.56 2jkv n LYS 119 Cb 0.33 -1.69 0.00 0.00 -0.02 0.00 0.00 35.03 33.65 2jkv n LYS 119 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jkv n GLY 120 N 1.44 0.49 3.58 0.72 0.00 -0.46 -4.84 105.19 106.13 2jkv n GLY 120 Ca 0.25 -0.13 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 2jkv n GLY 120 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jkv s ILE 121 N -2.00 4.15 -0.31 -0.61 1.01 -0.22 -0.22 121.20 123.00 2jkv s ILE 121 Ca 0.00 -0.28 -0.20 0.00 0.00 0.00 0.00 60.65 60.18 2jkv s ILE 121 Cb 0.00 -2.80 -0.01 0.00 0.01 0.00 0.00 42.46 39.66 2jkv s ILE 121 CO 0.00 0.53 0.60 -0.76 0.00 0.00 0.00 174.94 175.30 2jkv s LEU 122 N -0.06 4.17 -0.17 2.97 1.43 -0.04 -3.13 118.68 123.85 2jkv s LEU 122 Ca 0.03 0.36 -0.04 0.00 -1.03 0.00 0.00 54.13 53.44 2jkv s LEU 122 Cb -0.13 -2.76 -0.03 0.00 0.03 0.00 0.00 46.19 43.31 2jkv s LEU 122 CO 0.02 -0.46 -0.02 0.12 0.23 0.00 0.00 176.35 176.25 2jkv s PHE 123 N 2.54 3.05 -0.11 0.29 5.36 -1.26 -0.98 117.98 126.86 2jkv s PHE 123 Ca 0.24 -0.32 0.03 0.00 -0.96 0.00 0.00 56.93 55.91 2jkv s PHE 123 Cb -0.15 -2.00 -0.00 0.00 -0.34 0.00 0.00 43.02 40.52 2jkv s PHE 123 CO 0.12 -0.08 -0.20 0.08 -1.46 0.00 0.00 175.22 173.67 2jkv s VAL 124 N 0.56 2.38 -0.28 3.12 1.01 0.29 -0.89 120.40 126.60 2jkv s VAL 124 Ca -0.02 -0.90 -0.05 0.00 0.00 0.00 0.00 61.98 61.00 2jkv s VAL 124 Cb -0.14 -1.94 0.01 0.00 0.00 0.00 0.00 36.38 34.31 2jkv s VAL 124 CO 0.02 0.55 0.04 -0.83 0.00 0.00 0.00 175.10 174.88 2jkv s GLY 125 N 0.33 1.74 -0.06 4.51 0.00 0.96 -0.42 107.32 114.38 2jkv s GLY 125 Ca -0.16 -1.42 0.03 0.00 0.00 0.00 0.00 44.72 43.17 2jkv s GLY 125 CO 0.08 0.60 -0.16 -0.45 0.00 0.00 0.00 173.10 173.17 2jkv s SER 126 N 1.46 2.08 0.41 1.64 0.15 0.14 -1.19 113.70 118.40 2jkv s SER 126 Ca 0.02 -0.35 -0.23 0.00 0.70 0.00 0.00 55.95 56.10 2jkv s SER 126 Cb -0.17 -0.80 -0.10 0.00 -1.71 0.00 0.00 66.02 63.24 2jkv s SER 126 CO 0.01 0.10 0.98 -0.83 1.20 0.00 0.00 173.24 174.69 2jkv s GLY 127 N 0.36 2.56 -0.08 9.45 0.00 -0.04 -4.08 107.32 115.49 2jkv s GLY 127 Ca -0.11 0.51 0.01 0.00 0.00 0.00 0.00 44.72 45.13 2jkv s GLY 127 CO 0.04 0.86 -0.10 0.14 0.00 0.00 0.00 173.10 174.04 2jkv s VAL 128 N -1.93 1.04 0.27 1.40 1.01 -1.26 -1.19 120.40 119.75 2jkv s VAL 128 Ca 0.59 -0.37 0.12 0.00 0.00 0.00 0.00 61.98 62.32 2jkv s VAL 128 Cb -0.15 -1.00 -0.05 0.00 0.00 0.00 0.00 36.38 35.18 2jkv s VAL 128 CO 0.19 0.35 -0.20 -0.55 0.00 0.00 0.00 175.10 174.89 2jkv s SER 129 N 1.13 3.49 0.00 3.32 0.15 -0.49 -4.83 113.70 116.46 2jkv s SER 129 Ca -0.06 -1.02 0.00 0.00 0.70 0.00 0.00 55.95 55.57 2jkv s SER 129 Cb -0.14 -0.28 0.00 0.00 -1.71 0.00 0.00 66.02 63.88 2jkv s SER 129 CO -0.02 0.03 0.00 0.61 1.20 0.00 0.00 173.24 175.06 2jkv n GLY 130 N -0.53 1.01 7.00 9.45 0.00 -1.07 -2.85 105.19 118.20 2jkv n GLY 130 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2jkv n GLY 130 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jkv n GLY 131 N -0.49 1.01 0.22 -0.02 0.00 -1.26 -1.08 105.19 103.57 2jkv n GLY 131 Ca 0.00 -0.66 -0.10 0.00 0.00 0.00 0.00 46.02 45.26 2jkv n GLY 131 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2jkv h GLU 132 N 0.00 -0.25 -0.53 1.61 4.81 -1.96 -0.77 114.58 117.48 2jkv h GLU 132 Ca 0.00 0.02 -0.11 0.00 -0.13 0.00 0.00 59.36 59.13 2jkv h GLU 132 Cb 0.00 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.42 2jkv h GLU 132 CO 0.00 -0.17 -0.11 1.49 -0.73 0.00 0.00 179.01 179.49 2jkv h GLU 133 N -0.26 1.01 -0.20 1.92 4.57 -1.99 -0.66 114.58 118.98 2jkv h GLU 133 Ca 0.07 -0.38 -0.02 0.00 -1.18 0.00 0.00 59.36 57.86 2jkv h GLU 133 Cb 0.37 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.88 2jkv h GLU 133 CO -0.21 1.06 0.06 0.78 -1.18 0.00 0.00 179.01 179.52 2jkv h GLY 134 N 0.94 0.33 0.86 1.92 0.00 -0.95 -1.52 103.07 104.63 2jkv h GLY 134 Ca 0.14 -0.19 0.04 0.00 0.00 0.00 0.00 47.33 47.31 2jkv h GLY 134 CO 0.05 0.18 0.53 0.00 0.00 0.00 0.00 176.54 177.29 2jkv h ALA 135 N 0.89 1.09 -0.51 3.60 0.00 -0.94 0.33 119.26 123.72 2jkv h ALA 135 Ca 0.06 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.82 2jkv h ALA 135 Cb 0.22 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2jkv h ALA 135 CO -0.00 0.34 -0.17 -0.09 0.00 0.00 0.00 179.25 179.33 2jkv h ARG 136 N 1.02 1.02 0.00 0.00 9.65 -0.86 -3.33 114.38 121.88 2jkv h ARG 136 Ca 0.33 -0.41 -0.00 0.00 -1.10 0.00 0.00 59.98 58.80 2jkv h ARG 136 Cb 0.03 -0.05 -0.00 0.00 -1.39 0.00 0.00 29.97 28.56 2jkv h ARG 136 CO -0.12 1.09 -1.00 0.66 2.80 0.00 0.00 179.97 183.40 2jkv n TYR 137 N -4.13 0.00 0.00 2.20 4.01 -0.60 -3.98 117.16 114.66 2jkv n TYR 137 Ca 0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.75 2jkv n TYR 137 Cb 0.43 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.46 2jkv n TYR 137 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2jkv n GLY 138 N 2.58 -0.25 3.92 2.72 0.00 0.96 -4.78 105.19 110.34 2jkv n GLY 138 Ca -0.00 0.69 -0.26 0.00 0.00 0.00 0.00 46.02 46.45 2jkv n GLY 138 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2jkv s PRO 139 N 0.00 3.45 0.02 1.61 0.04 0.04 -3.63 135.00 136.54 2jkv s PRO 139 Ca 0.00 -0.04 -0.30 0.00 0.04 0.00 0.00 61.00 60.70 2jkv s PRO 139 Cb 0.00 -2.48 -0.04 0.00 0.04 0.00 0.00 34.50 32.02 2jkv s PRO 139 CO 0.00 -0.12 1.16 0.45 0.04 0.00 0.00 177.00 178.52 2jkv s SER 140 N -4.10 7.13 -0.10 6.66 0.15 -0.48 -1.45 113.70 121.50 2jkv s SER 140 Ca 0.45 1.89 0.04 0.00 0.70 0.00 0.00 55.95 59.03 2jkv s SER 140 Cb -0.10 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.64 2jkv s SER 140 CO 0.41 -0.46 -0.22 -0.76 1.20 0.00 0.00 173.24 173.41 2jkv s LEU 141 N 1.36 2.03 -0.64 3.45 1.43 -0.62 -1.40 118.68 124.28 2jkv s LEU 141 Ca 0.57 -0.53 0.05 0.00 -1.03 0.00 0.00 54.13 53.18 2jkv s LEU 141 Cb -0.27 -1.33 0.16 0.00 0.03 0.00 0.00 46.19 44.78 2jkv s LEU 141 CO 0.27 0.13 0.44 -0.04 0.23 0.00 0.00 176.35 177.38 2jkv s MET 142 N 0.44 2.20 0.00 1.70 -1.94 -0.33 -4.00 119.30 117.37 2jkv s MET 142 Ca -0.17 -3.08 -0.30 0.00 -1.71 0.00 0.00 55.69 50.43 2jkv s MET 142 Cb -0.17 -3.17 -0.03 0.00 2.01 0.00 0.00 34.83 33.46 2jkv s MET 142 CO 0.07 -1.27 0.99 -1.25 -0.01 0.00 0.00 175.02 173.55 2jkv s PRO 143 N -1.09 4.56 0.24 2.03 0.05 -1.26 -0.86 135.00 138.68 2jkv s PRO 143 Ca 0.24 1.43 -0.01 0.00 0.05 0.00 0.00 61.00 62.71 2jkv s PRO 143 Cb -0.07 -3.46 -0.03 0.00 0.05 0.00 0.00 34.50 30.99 2jkv s PRO 143 CO -0.14 -0.05 0.24 0.20 0.05 0.00 0.00 177.00 177.30 2jkv s GLY 144 N 1.00 1.47 0.00 0.56 0.00 -0.33 -0.51 107.32 109.51 2jkv s GLY 144 Ca 0.52 -1.63 0.00 0.00 0.00 0.00 0.00 44.72 43.62 2jkv s GLY 144 CO 0.28 -1.26 0.00 0.61 0.00 0.00 0.00 173.10 172.73 2jkv n GLY 145 N -0.38 0.34 3.49 0.20 0.00 -0.43 -0.03 105.19 108.39 2jkv n GLY 145 Ca 0.02 -1.15 -0.43 0.00 0.00 0.00 0.00 46.02 44.46 2jkv n GLY 145 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2jkv s ASN 146 N -4.00 6.28 0.29 1.61 3.84 -0.07 -1.72 114.94 121.16 2jkv s ASN 146 Ca 0.00 -0.64 0.22 0.00 0.21 0.00 0.00 52.86 52.65 2jkv s ASN 146 Cb 0.00 -2.39 1.07 0.00 -0.55 0.00 0.00 41.25 39.38 2jkv s ASN 146 CO 0.00 -1.18 1.66 1.17 -2.79 0.00 0.00 177.10 175.96 2jkv n LYS 147 N 7.15 0.15 0.32 0.43 4.81 -1.26 -1.42 118.16 128.34 2jkv n LYS 147 Ca -0.02 0.55 0.20 0.00 -0.87 0.00 0.00 58.31 58.18 2jkv n LYS 147 Cb 0.46 -1.91 1.07 0.00 0.02 0.00 0.00 35.03 34.67 2jkv n LYS 147 CO 0.00 0.00 0.00 1.49 1.17 0.00 0.00 177.40 180.06 2jkv h GLU 148 N 0.00 0.00 0.00 1.64 4.81 -1.97 -1.46 114.58 117.60 2jkv h GLU 148 Ca 0.00 0.00 -0.18 0.00 -0.13 0.00 0.00 59.36 59.05 2jkv h GLU 148 Cb 0.13 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.49 2jkv h GLU 148 CO 0.00 0.01 -0.89 0.00 -0.73 0.00 0.00 179.01 177.40 2jkv h ALA 149 N 1.99 0.44 -0.46 2.92 0.00 -1.62 -3.40 119.26 119.13 2jkv h ALA 149 Ca -0.00 -0.81 0.09 0.00 0.00 0.00 0.00 54.91 54.19 2jkv h ALA 149 Cb 0.08 -0.12 -0.08 0.00 0.00 0.00 0.00 17.79 17.67 2jkv h ALA 149 CO 0.00 1.10 -0.01 2.35 0.00 0.00 0.00 179.25 182.68 2jkv h TRP 150 N 0.00 -0.05 -0.14 0.00 -0.00 -1.42 0.17 115.95 114.50 2jkv h TRP 150 Ca -0.02 0.03 0.04 0.00 -0.00 0.00 0.00 58.89 58.95 2jkv h TRP 150 Cb 1.68 0.09 -0.01 0.00 -0.00 0.00 0.00 29.16 30.93 2jkv h TRP 150 CO 0.00 -0.11 0.12 -1.35 -0.00 0.00 0.00 178.44 177.10 2jkv h PRO 151 N 0.10 0.00 -0.00 2.65 0.11 -1.77 0.16 132.00 133.25 2jkv h PRO 151 Ca 0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.34 2jkv h PRO 151 Cb 0.34 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.45 2jkv h PRO 151 CO -0.40 0.00 -0.23 0.72 -0.21 0.00 0.00 178.00 177.89 2jkv n HIS 152 N -4.19 0.00 0.00 0.65 8.25 0.58 -4.01 115.22 116.49 2jkv n HIS 152 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2jkv n HIS 152 Cb 0.24 -0.29 0.00 0.00 1.12 0.00 0.00 29.99 31.06 2jkv n HIS 152 CO 0.00 0.00 0.00 0.44 0.64 0.00 0.00 176.34 177.42 2jkv n ILE 153 N -1.28 0.00 -0.21 1.59 -5.35 -0.66 -4.81 119.36 108.65 2jkv n ILE 153 Ca 0.09 -0.35 0.01 0.00 -0.27 0.00 0.00 62.75 62.23 2jkv n ILE 153 Cb 0.32 0.98 0.12 0.00 -1.74 0.00 0.00 39.64 39.32 2jkv n ILE 153 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 2jkv h LYS 154 N 0.00 0.32 -0.35 6.28 3.64 -0.85 0.32 116.57 125.92 2jkv h LYS 154 Ca 0.00 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 2jkv h LYS 154 Cb 0.00 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.73 2jkv h LYS 154 CO 0.00 0.21 0.17 1.15 -2.27 0.00 0.00 179.45 178.71 2jkv h THR 155 N 0.33 1.16 -0.10 1.00 2.02 -1.85 0.51 112.91 115.98 2jkv h THR 155 Ca 0.32 -0.45 -0.05 0.00 0.77 0.00 0.00 66.41 67.01 2jkv h THR 155 Cb 0.46 0.81 -0.00 0.00 -1.74 0.00 0.00 68.15 67.68 2jkv h THR 155 CO -0.37 0.17 -0.12 0.40 0.37 0.00 0.00 175.52 175.96 2jkv h ILE 156 N 0.43 1.37 0.36 3.11 2.04 -1.80 -0.97 117.51 122.05 2jkv h ILE 156 Ca 0.12 -1.31 -0.02 0.00 1.00 0.00 0.00 64.86 64.66 2jkv h ILE 156 Cb 0.11 2.00 0.00 0.00 -0.74 0.00 0.00 36.82 38.19 2jkv h ILE 156 CO -0.02 0.37 -0.17 -0.26 0.00 0.00 0.00 178.15 178.07 2jkv h PHE 157 N -0.15 -0.45 0.00 1.37 0.05 -0.81 -1.02 116.94 115.93 2jkv h PHE 157 Ca 0.01 -0.01 -0.04 0.00 3.82 0.00 0.00 57.97 61.75 2jkv h PHE 157 Cb 0.65 0.15 -0.01 0.00 2.00 0.00 0.00 35.95 38.75 2jkv h PHE 157 CO 0.09 -0.25 -0.20 1.96 -0.18 0.00 0.00 178.31 179.73 2jkv h GLN 158 N -0.53 0.00 -0.21 1.51 4.20 -1.01 -2.20 115.11 116.88 2jkv h GLN 158 Ca -0.05 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.65 2jkv h GLN 158 Cb 0.40 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.17 2jkv h GLN 158 CO 0.08 0.20 0.10 0.78 -0.67 0.00 0.00 178.83 179.31 2jkv h GLY 159 N 1.63 0.33 0.32 3.46 0.00 -0.39 -3.17 103.07 105.26 2jkv h GLY 159 Ca -0.00 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.16 2jkv h GLY 159 CO 0.03 0.16 -0.50 0.29 0.00 0.00 0.00 176.54 176.51 2jkv n ILE 160 N -4.84 0.00 -2.24 2.60 -5.35 -0.46 -4.95 119.36 104.12 2jkv n ILE 160 Ca -0.03 -0.08 -0.35 0.00 -0.27 0.00 0.00 62.75 62.02 2jkv n ILE 160 Cb 0.11 0.56 0.00 0.00 -1.74 0.00 0.00 39.64 38.57 2jkv n ILE 160 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2jkv s ALA 161 N -2.77 2.69 0.31 -1.28 0.00 -0.84 -3.89 121.76 115.99 2jkv s ALA 161 Ca 0.16 0.80 -0.27 0.00 0.00 0.00 0.00 51.96 52.65 2jkv s ALA 161 Cb 0.18 -3.36 -0.13 0.00 0.00 0.00 0.00 23.12 19.81 2jkv s ALA 161 CO 0.65 -0.78 1.02 0.00 0.00 0.00 0.00 175.76 176.65 2jkv n ALA 162 N -1.35 -0.06 -2.64 0.00 0.00 -0.53 -4.66 120.51 111.28 2jkv n ALA 162 Ca 0.11 0.36 -0.34 0.00 0.00 0.00 0.00 53.44 53.58 2jkv n ALA 162 Cb 0.51 -2.04 -0.10 0.00 0.00 0.00 0.00 19.45 17.82 2jkv n ALA 162 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2jkv s LYS 163 N -1.64 2.81 0.24 0.00 -0.14 -1.26 -0.13 119.74 119.61 2jkv s LYS 163 Ca 0.59 -0.53 0.10 0.00 -1.36 0.00 0.00 55.97 54.77 2jkv s LYS 163 Cb -0.67 -2.66 -0.04 0.00 -1.68 0.00 0.00 37.83 32.78 2jkv s LYS 163 CO 0.60 0.66 -0.10 0.14 -0.76 0.00 0.00 175.35 175.89 2jkv s VAL 164 N -0.91 3.01 0.00 3.17 -7.23 -0.61 -4.90 120.40 112.93 2jkv s VAL 164 Ca 0.14 -2.01 0.00 0.00 -1.81 0.00 0.00 61.98 58.30 2jkv s VAL 164 Cb -0.11 -2.56 0.00 0.00 0.56 0.00 0.00 36.38 34.27 2jkv s VAL 164 CO 0.04 -0.30 0.00 0.61 -0.31 0.00 0.00 175.10 175.14 2jkv n GLY 165 N -0.50 0.34 0.00 2.32 0.00 -1.26 0.11 105.19 106.20 2jkv n GLY 165 Ca -0.07 0.35 0.08 0.00 0.00 0.00 0.00 46.02 46.37 2jkv n GLY 165 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2jkv n THR 166 N 0.00 0.00 -0.21 2.61 -2.24 -1.26 -4.82 114.28 108.37 2jkv n THR 166 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2jkv n THR 166 Cb 0.00 -0.43 0.00 0.00 -2.10 0.00 0.00 70.33 67.80 2jkv n THR 166 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jkv n GLY 167 N 0.45 0.89 3.74 3.38 0.00 0.30 -5.07 105.19 108.88 2jkv n GLY 167 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 2jkv n GLY 167 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2jkv s GLU 168 N -0.79 4.53 0.27 1.61 1.03 -1.11 -4.68 118.70 119.56 2jkv s GLU 168 Ca 0.00 1.85 -0.29 0.00 0.03 0.00 0.00 54.97 56.56 2jkv s GLU 168 Cb 0.00 -3.23 -0.09 0.00 -0.80 0.00 0.00 34.13 30.00 2jkv s GLU 168 CO 0.00 -0.02 1.00 -2.14 -1.33 0.00 0.00 175.26 172.78 2jkv s PRO 169 N -0.50 4.70 -1.42 -4.83 0.02 -1.26 -1.58 135.00 130.13 2jkv s PRO 169 Ca 0.51 1.58 -0.10 0.00 0.02 0.00 0.00 61.00 63.02 2jkv s PRO 169 Cb -0.32 -3.14 0.06 0.00 0.02 0.00 0.00 34.50 31.12 2jkv s PRO 169 CO 0.38 0.34 2.36 0.00 -0.33 0.00 0.00 177.00 179.75 2jkv s ASP 172 N 2.67 0.06 0.07 0.00 -1.08 -1.26 -4.82 116.67 112.32 2jkv s ASP 172 Ca 0.00 -0.79 -0.31 0.00 -0.52 0.00 0.00 52.55 50.94 2jkv s ASP 172 Cb -0.08 0.40 -0.09 0.00 -1.46 0.00 0.00 42.92 41.70 2jkv s ASP 172 CO -0.15 -0.84 1.72 0.86 0.52 0.00 0.00 175.17 177.28 2jkv s TRP 173 N -3.93 2.24 -0.16 -5.34 -0.11 -1.26 -4.10 118.94 106.28 2jkv s TRP 173 Ca 0.13 0.17 -0.25 0.00 1.22 0.00 0.00 56.10 57.37 2jkv s TRP 173 Cb 0.04 -4.04 -0.24 0.00 -1.50 0.00 0.00 33.47 27.74 2jkv s TRP 173 CO -0.04 -4.24 0.54 0.28 -4.62 0.00 0.00 176.95 168.87 2jkv h VAL 174 N 4.88 1.39 0.00 5.86 2.07 -1.15 -3.49 116.25 125.82 2jkv h VAL 174 Ca -0.44 -2.29 0.00 0.00 0.82 0.00 0.00 66.70 64.79 2jkv h VAL 174 Cb 1.21 2.88 0.00 0.00 -1.52 0.00 0.00 31.29 33.86 2jkv h VAL 174 CO 0.94 0.50 0.00 0.61 0.02 0.00 0.00 177.57 179.64 2jkv n GLY 175 N 1.55 -1.65 3.77 2.17 0.00 -1.26 -4.68 105.19 105.11 2jkv n GLY 175 Ca -0.20 -1.17 -0.36 0.00 0.00 0.00 0.00 46.02 44.29 2jkv n GLY 175 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jkv s ASP 176 N -3.06 6.04 1.24 1.61 -1.08 -1.26 -1.31 116.67 118.85 2jkv s ASP 176 Ca 0.00 2.22 0.00 0.00 -0.52 0.00 0.00 52.55 54.25 2jkv s ASP 176 Cb 0.00 -2.59 0.00 0.00 -1.46 0.00 0.00 42.92 38.87 2jkv s ASP 176 CO 0.00 -1.00 0.00 -0.62 0.52 0.00 0.00 175.17 174.07 2jkv n GLU 177 N -0.80 0.00 0.00 4.34 1.02 -0.70 -1.42 120.64 123.08 2jkv n GLU 177 Ca 0.09 0.00 0.07 0.00 -0.02 0.00 0.00 57.16 57.30 2jkv n GLU 177 Cb 0.49 0.00 0.43 0.00 -0.02 0.00 0.00 31.44 32.34 2jkv n GLU 177 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2jkv n GLY 178 N 0.00 -0.86 0.27 0.62 0.00 -1.26 -1.92 105.19 102.04 2jkv n GLY 178 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.93 2jkv n GLY 178 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jkv h ALA 179 N 3.23 0.99 -0.32 4.61 0.00 -1.48 -0.33 119.26 125.96 2jkv h ALA 179 Ca 0.00 0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.97 2jkv h ALA 179 Cb 0.00 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 2jkv h ALA 179 CO 0.00 0.04 0.12 0.78 0.00 0.00 0.00 179.25 180.19 2jkv h GLY 180 N 0.70 0.41 2.00 0.00 0.00 -1.75 -0.81 103.07 103.62 2jkv h GLY 180 Ca 0.34 -0.07 -0.06 0.00 0.00 0.00 0.00 47.33 47.54 2jkv h GLY 180 CO -0.22 0.04 -0.29 0.45 0.00 0.00 0.00 176.54 176.52 2jkv h HIS 181 N 0.26 0.00 0.06 5.60 3.86 -1.53 -1.50 115.15 121.90 2jkv h HIS 181 Ca 0.14 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.35 2jkv h HIS 181 Cb 0.11 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.58 2jkv h HIS 181 CO -0.13 0.29 -0.03 0.35 0.86 0.00 0.00 177.93 179.27 2jkv h PHE 182 N 0.00 -0.07 -0.82 2.45 3.04 -0.53 -0.31 116.94 120.70 2jkv h PHE 182 Ca -0.00 -0.00 0.11 0.00 3.98 0.00 0.00 57.97 62.05 2jkv h PHE 182 Cb 0.83 0.02 -0.08 0.00 2.56 0.00 0.00 35.95 39.29 2jkv h PHE 182 CO 0.00 0.38 0.46 0.28 -2.02 0.00 0.00 178.31 177.41 2jkv h VAL 183 N -0.57 0.86 -0.71 1.41 2.07 -1.06 -0.36 116.25 117.89 2jkv h VAL 183 Ca -0.01 -0.25 -0.03 0.00 0.82 0.00 0.00 66.70 67.23 2jkv h VAL 183 Cb 0.49 0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 30.29 2jkv h VAL 183 CO 0.01 0.13 0.32 0.50 0.02 0.00 0.00 177.57 178.56 2jkv h LYS 184 N 0.73 1.02 -0.07 1.57 1.63 -1.22 -0.24 116.57 120.00 2jkv h LYS 184 Ca 0.41 -0.15 -0.00 0.00 -0.85 0.00 0.00 60.65 60.06 2jkv h LYS 184 Cb 0.44 -0.18 -0.00 0.00 -0.60 0.00 0.00 32.23 31.88 2jkv h LYS 184 CO -0.28 0.80 0.04 1.98 -3.45 0.00 0.00 179.45 178.54 2jkv h MET 185 N 1.01 0.09 -0.75 1.90 4.05 0.49 -1.90 114.93 119.83 2jkv h MET 185 Ca 0.24 -0.01 0.04 0.00 -0.28 0.00 0.00 59.70 59.70 2jkv h MET 185 Cb 0.13 -0.02 -0.05 0.00 -0.80 0.00 0.00 31.60 30.86 2jkv h MET 185 CO -0.03 0.11 0.46 0.28 0.23 0.00 0.00 176.91 177.96 2jkv h VAL 186 N 0.04 1.06 -0.67 -5.77 2.07 -0.86 -0.55 116.25 111.57 2jkv h VAL 186 Ca 0.02 -0.30 0.14 0.00 0.82 0.00 0.00 66.70 67.39 2jkv h VAL 186 Cb 0.04 0.12 -0.10 0.00 -1.52 0.00 0.00 31.29 29.83 2jkv h VAL 186 CO -0.00 0.16 0.09 -0.74 0.02 0.00 0.00 177.57 177.09 2jkv h HIS 187 N 0.86 0.12 0.00 1.57 6.17 -0.69 -0.28 115.15 122.90 2jkv h HIS 187 Ca 0.31 0.04 -0.11 0.00 0.71 0.00 0.00 60.37 61.33 2jkv h HIS 187 Cb 0.10 0.05 -0.02 0.00 2.52 0.00 0.00 27.41 30.06 2jkv h HIS 187 CO -0.05 -0.12 -0.53 -0.91 0.71 0.00 0.00 177.93 177.04 2jkv h ASN 188 N 0.20 0.00 0.09 3.26 4.21 -0.45 -1.37 115.58 121.52 2jkv h ASN 188 Ca 0.36 0.00 -0.00 0.00 1.21 0.00 0.00 56.30 57.87 2jkv h ASN 188 Cb 0.60 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.80 2jkv h ASN 188 CO -0.51 0.53 -0.04 1.23 -1.29 0.00 0.00 177.43 177.35 2jkv h GLY 189 N 1.76 -0.13 0.70 2.83 0.00 0.27 0.29 103.07 108.80 2jkv h GLY 189 Ca -0.01 0.05 0.05 0.00 0.00 0.00 0.00 47.33 47.43 2jkv h GLY 189 CO 0.07 -0.05 0.37 -2.22 0.00 0.00 0.00 176.54 174.71 2jkv h ILE 190 N -0.23 0.98 0.04 2.60 2.04 -0.99 -2.07 117.51 119.88 2jkv h ILE 190 Ca -0.01 -0.23 -0.00 0.00 1.00 0.00 0.00 64.86 65.61 2jkv h ILE 190 Cb 0.19 0.23 -0.00 0.00 -0.74 0.00 0.00 36.82 36.51 2jkv h ILE 190 CO 0.02 0.12 -0.02 -0.08 0.00 0.00 0.00 178.15 178.19 2jkv h GLU 191 N 0.68 -0.06 -0.77 2.37 4.81 -0.98 -0.24 114.58 120.40 2jkv h GLU 191 Ca 0.29 0.00 0.14 0.00 -0.13 0.00 0.00 59.36 59.66 2jkv h GLU 191 Cb 0.17 0.01 -0.09 0.00 0.63 0.00 0.00 28.75 29.47 2jkv h GLU 191 CO -0.17 -0.04 0.34 1.88 -0.73 0.00 0.00 179.01 180.29 2jkv h TYR 192 N -0.06 0.59 0.05 0.92 0.99 -0.74 0.06 116.97 118.78 2jkv h TYR 192 Ca -0.00 0.03 -0.00 0.00 2.00 0.00 0.00 58.73 60.76 2jkv h TYR 192 Cb 0.05 -0.15 0.00 0.00 1.00 0.00 0.00 36.73 37.64 2jkv h TYR 192 CO -0.08 0.11 -0.02 0.78 -0.00 0.00 0.00 178.16 178.95 2jkv h GLY 193 N 0.51 -0.07 0.46 3.88 0.00 -0.89 -1.99 103.07 104.98 2jkv h GLY 193 Ca 0.42 0.02 0.07 0.00 0.00 0.00 0.00 47.33 47.84 2jkv h GLY 193 CO -0.38 -0.02 0.09 -0.55 0.00 0.00 0.00 176.54 175.68 2jkv h ASP 194 N -0.26 0.02 -0.75 0.19 3.32 -0.71 -1.22 116.42 117.01 2jkv h ASP 194 Ca -0.01 0.07 0.01 0.00 0.02 0.00 0.00 57.03 57.13 2jkv h ASP 194 Cb 0.24 0.10 -0.04 0.00 0.22 0.00 0.00 39.33 39.85 2jkv h ASP 194 CO 0.01 0.05 0.49 0.24 -1.72 0.00 0.00 179.24 178.31 2jkv h MET 195 N 0.23 0.98 -0.29 3.56 2.86 -0.90 -1.09 114.93 120.28 2jkv h MET 195 Ca 0.21 -0.06 -0.10 0.00 -2.06 0.00 0.00 59.70 57.70 2jkv h MET 195 Cb 0.26 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 31.70 2jkv h MET 195 CO -0.28 0.65 -0.21 0.37 1.06 0.00 0.00 176.91 178.51 2jkv h GLN 196 N 1.01 0.65 -0.55 1.72 5.75 -0.99 -1.17 115.11 121.53 2jkv h GLN 196 Ca 0.27 -0.31 0.09 0.00 -0.15 0.00 0.00 58.65 58.55 2jkv h GLN 196 Cb -0.11 -0.00 -0.07 0.00 1.07 0.00 0.00 27.48 28.36 2jkv h GLN 196 CO -0.06 0.91 0.17 -0.07 -2.65 0.00 0.00 178.83 177.13 2jkv h LEU 197 N 0.39 0.13 -0.72 -2.39 3.38 -1.07 -0.91 115.31 114.11 2jkv h LEU 197 Ca 0.06 0.08 0.02 0.00 0.09 0.00 0.00 57.88 58.12 2jkv h LEU 197 Cb 0.75 0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.55 2jkv h LEU 197 CO 0.06 0.09 0.47 0.40 0.09 0.00 0.00 178.44 179.54 2jkv h ILE 198 N 0.33 1.15 -0.71 1.22 2.04 -0.90 -1.14 117.51 119.49 2jkv h ILE 198 Ca 0.27 -0.32 -0.01 0.00 1.00 0.00 0.00 64.86 65.80 2jkv h ILE 198 Cb 0.34 0.13 -0.03 0.00 -0.74 0.00 0.00 36.82 36.51 2jkv h ILE 198 CO -0.30 0.17 0.40 0.00 0.00 0.00 0.00 178.15 178.42 2jkv h GLU 200 N 0.99 0.85 -0.57 0.00 5.08 -0.55 0.42 114.58 120.80 2jkv h GLU 200 Ca 0.25 -0.42 -0.00 0.00 -1.00 0.00 0.00 59.36 58.19 2jkv h GLU 200 Cb 0.00 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 2jkv h GLU 200 CO -0.04 1.06 0.35 0.00 -1.00 0.00 0.00 179.01 179.38 2jkv h ALA 201 N 0.77 0.72 -0.85 3.43 0.00 -0.95 -1.09 119.26 121.29 2jkv h ALA 201 Ca 0.07 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.92 2jkv h ALA 201 Cb 0.88 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 2jkv h ALA 201 CO 0.08 0.19 0.56 -0.92 0.00 0.00 0.00 179.25 179.16 2jkv h TYR 202 N 0.77 1.08 -0.67 0.00 3.20 -0.94 -0.38 116.97 120.03 2jkv h TYR 202 Ca 0.21 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.07 2jkv h TYR 202 Cb -0.04 -0.36 -0.03 0.00 1.54 0.00 0.00 36.73 37.84 2jkv h TYR 202 CO -0.03 0.69 0.34 1.25 -1.64 0.00 0.00 178.16 178.77 2jkv h HIS 203 N 1.16 0.96 -0.45 -3.82 2.76 -0.34 0.10 115.15 115.53 2jkv h HIS 203 Ca 0.31 -0.04 -0.03 0.00 -2.20 0.00 0.00 60.37 58.41 2jkv h HIS 203 Cb -0.12 -0.30 -0.02 0.00 1.55 0.00 0.00 27.41 28.52 2jkv h HIS 203 CO -0.01 0.71 0.18 -0.07 -1.30 0.00 0.00 177.93 177.43 2jkv h LEU 204 N 0.93 0.62 -0.82 0.26 3.38 -0.76 0.12 115.31 119.04 2jkv h LEU 204 Ca 0.23 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 2jkv h LEU 204 Cb 0.10 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 2jkv h LEU 204 CO -0.03 0.62 0.51 0.24 0.09 0.00 0.00 178.44 179.87 2jkv h MET 205 N 0.58 1.10 -0.05 1.13 2.86 -0.68 -0.02 114.93 119.85 2jkv h MET 205 Ca 0.15 -0.09 -0.09 0.00 -2.06 0.00 0.00 59.70 57.61 2jkv h MET 205 Cb 0.20 -0.24 0.01 0.00 0.06 0.00 0.00 31.60 31.63 2jkv h MET 205 CO -0.01 0.76 -0.34 -0.22 1.06 0.00 0.00 176.91 178.16 2jkv h LYS 206 N 1.12 0.31 0.00 1.72 3.64 -0.71 -1.75 116.57 120.90 2jkv h LYS 206 Ca 0.30 -0.27 -0.08 0.00 -1.27 0.00 0.00 60.65 59.33 2jkv h LYS 206 Cb -0.07 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.80 2jkv h LYS 206 CO -0.06 0.93 -1.94 -0.25 -2.27 0.00 0.00 179.45 175.86 2jkv n ASP 207 N -4.42 0.69 -0.11 4.20 9.92 0.38 -2.74 116.55 124.47 2jkv n ASP 207 Ca -0.09 0.00 -0.25 0.00 -0.53 0.00 0.00 54.79 53.93 2jkv n ASP 207 Cb 0.52 1.63 -0.11 0.00 -0.64 0.00 0.00 41.12 42.52 2jkv n ASP 207 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 2jkv n VAL 208 N -2.27 1.55 1.12 2.53 0.31 -0.07 -4.50 118.33 117.00 2jkv n VAL 208 Ca -0.10 -0.25 0.13 0.00 -0.01 0.00 0.00 64.34 64.11 2jkv n VAL 208 Cb 0.63 -1.92 0.35 0.00 -0.91 0.00 0.00 33.84 32.00 2jkv n VAL 208 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2jkv n LEU 209 N -4.21 0.62 -3.12 7.52 4.77 -0.92 -4.76 117.00 116.91 2jkv n LEU 209 Ca -0.42 -0.04 -0.23 0.00 -0.03 0.00 0.00 56.01 55.30 2jkv n LEU 209 Cb 0.81 -0.22 0.03 0.00 -2.33 0.00 0.00 43.42 41.70 2jkv n LEU 209 CO 0.15 0.13 -0.01 0.61 -1.33 0.00 0.00 177.39 176.95 2jkv n GLY 210 N 1.43 -0.51 3.82 -0.72 0.00 -0.96 -4.96 105.19 103.28 2jkv n GLY 210 Ca 0.09 0.12 -0.33 0.00 0.00 0.00 0.00 46.02 45.90 2jkv n GLY 210 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2jkv s MET 211 N -5.79 3.87 0.52 1.61 -1.94 -0.70 -5.00 119.30 111.87 2jkv s MET 211 Ca 0.33 1.13 -0.12 0.00 -1.71 0.00 0.00 55.69 55.32 2jkv s MET 211 Cb -0.16 -2.12 -0.06 0.00 2.01 0.00 0.00 34.83 34.51 2jkv s MET 211 CO 0.41 -0.34 0.93 0.00 -0.01 0.00 0.00 175.02 176.00 2jkv s ALA 212 N -2.35 3.18 0.12 3.03 0.00 -1.26 -4.69 121.76 119.78 2jkv s ALA 212 Ca 0.62 -0.07 -0.28 0.00 0.00 0.00 0.00 51.96 52.23 2jkv s ALA 212 Cb -0.12 -2.95 -0.09 0.00 0.00 0.00 0.00 23.12 19.96 2jkv s ALA 212 CO 0.25 -0.33 1.47 1.96 0.00 0.00 0.00 175.76 179.11 2jkv h GLN 213 N 0.54 -0.28 -0.04 0.00 7.50 -1.97 -0.27 115.11 120.59 2jkv h GLN 213 Ca -0.46 0.02 -0.03 0.00 0.50 0.00 0.00 58.65 58.68 2jkv h GLN 213 Cb 1.19 0.06 -0.01 0.00 0.05 0.00 0.00 27.48 28.78 2jkv h GLN 213 CO 0.62 -0.19 -0.12 -0.44 -1.50 0.00 0.00 178.83 177.20 2jkv h ASP 214 N -0.30 0.05 -0.38 1.46 3.32 -1.94 0.99 116.42 119.62 2jkv h ASP 214 Ca 0.07 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.05 2jkv h ASP 214 Cb 0.49 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.01 2jkv h ASP 214 CO -0.56 0.18 -0.00 -0.08 -1.72 0.00 0.00 179.24 177.06 2jkv h GLU 215 N 0.05 0.67 -0.42 3.56 4.81 -1.67 -0.98 114.58 120.59 2jkv h GLU 215 Ca 0.01 -0.22 -0.11 0.00 -0.13 0.00 0.00 59.36 58.91 2jkv h GLU 215 Cb 0.25 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 2jkv h GLU 215 CO 0.02 0.77 -0.18 0.52 -0.73 0.00 0.00 179.01 179.41 2jkv h MET 216 N 0.49 0.87 -0.67 1.92 2.86 0.38 -1.47 114.93 119.31 2jkv h MET 216 Ca 0.11 -0.37 0.13 0.00 -2.06 0.00 0.00 59.70 57.51 2jkv h MET 216 Cb 0.47 -0.03 -0.13 0.00 0.06 0.00 0.00 31.60 31.97 2jkv h MET 216 CO 0.02 1.01 -0.20 0.00 1.06 0.00 0.00 176.91 178.80 2jkv h ALA 217 N 0.83 0.37 -0.64 6.32 0.00 -0.75 -1.50 119.26 123.90 2jkv h ALA 217 Ca 0.10 0.25 -0.02 0.00 0.00 0.00 0.00 54.91 55.24 2jkv h ALA 217 Cb 0.74 0.57 -0.03 0.00 0.00 0.00 0.00 17.79 19.06 2jkv h ALA 217 CO 0.06 -0.46 0.33 0.37 0.00 0.00 0.00 179.25 179.55 2jkv h GLN 218 N -0.03 0.90 -0.32 0.00 5.75 -0.74 -1.07 115.11 119.61 2jkv h GLN 218 Ca 0.32 -0.12 0.06 0.00 -0.15 0.00 0.00 58.65 58.76 2jkv h GLN 218 Cb 0.51 -0.17 -0.05 0.00 1.07 0.00 0.00 27.48 28.84 2jkv h GLN 218 CO -0.70 0.70 -0.02 0.00 -2.65 0.00 0.00 178.83 176.16 2jkv h ALA 219 N 1.15 0.27 -0.60 3.38 0.00 -0.37 -0.04 119.26 123.05 2jkv h ALA 219 Ca 0.22 0.10 -0.08 0.00 0.00 0.00 0.00 54.91 55.15 2jkv h ALA 219 Cb 0.08 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 2jkv h ALA 219 CO -0.03 -0.42 0.05 0.74 0.00 0.00 0.00 179.25 179.59 2jkv h PHE 220 N 0.07 1.12 -0.98 0.00 0.04 -1.01 0.30 116.94 116.47 2jkv h PHE 220 Ca 0.16 -0.18 0.08 0.00 2.80 0.00 0.00 57.97 60.83 2jkv h PHE 220 Cb 0.22 -0.30 -0.07 0.00 2.20 0.00 0.00 35.95 38.00 2jkv h PHE 220 CO -0.25 0.97 0.62 1.49 -0.60 0.00 0.00 178.31 180.54 2jkv h GLU 221 N 0.94 1.05 -0.10 1.51 4.81 -0.75 -0.90 114.58 121.14 2jkv h GLU 221 Ca 0.18 -0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 59.29 2jkv h GLU 221 Cb 0.49 -0.24 -0.00 0.00 0.63 0.00 0.00 28.75 29.64 2jkv h GLU 221 CO 0.02 0.70 -0.14 -0.44 -0.73 0.00 0.00 179.01 178.42 2jkv h ASP 222 N 1.09 0.30 -0.62 1.04 3.32 -0.46 -3.09 116.42 117.99 2jkv h ASP 222 Ca 0.44 -0.53 0.14 0.00 0.02 0.00 0.00 57.03 57.10 2jkv h ASP 222 Cb 0.26 -0.08 -0.04 0.00 0.22 0.00 0.00 39.33 39.69 2jkv h ASP 222 CO -0.20 0.76 0.43 -0.50 -1.72 0.00 0.00 179.24 178.01 2jkv h TRP 223 N -0.16 0.29 0.00 4.55 6.55 -0.68 -0.57 115.95 125.93 2jkv h TRP 223 Ca 0.01 0.01 0.00 0.00 0.95 0.00 0.00 58.89 59.86 2jkv h TRP 223 Cb 0.70 -0.09 0.00 0.00 -0.86 0.00 0.00 29.16 28.91 2jkv h TRP 223 CO 0.10 0.12 0.00 -1.71 -1.05 0.00 0.00 178.44 175.90 2jkv n ASN 224 N -4.44 0.00 0.05 -3.49 5.15 -0.37 -2.25 115.26 109.91 2jkv n ASN 224 Ca 0.11 0.19 0.11 0.00 -0.60 0.00 0.00 54.58 54.39 2jkv n ASN 224 Cb 0.51 -0.33 0.02 0.00 -0.53 0.00 0.00 39.78 39.44 2jkv n ASN 224 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 2jkv n LYS 225 N -1.33 0.43 0.00 1.20 5.02 -0.22 -3.92 118.16 119.33 2jkv n LYS 225 Ca 0.06 0.03 0.00 0.00 -2.02 0.00 0.00 58.31 56.37 2jkv n LYS 225 Cb 0.12 -1.67 0.00 0.00 -0.02 0.00 0.00 35.03 33.45 2jkv n LYS 225 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2jkv n THR 226 N -2.24 0.00 0.24 -0.18 -2.24 -0.96 -4.88 114.28 104.02 2jkv n THR 226 Ca 0.01 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 61.86 2jkv n THR 226 Cb 0.49 0.00 0.60 0.00 -2.10 0.00 0.00 70.33 69.32 2jkv n THR 226 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2jkv h GLU 227 N 0.00 0.02 -0.04 -0.78 3.07 -1.93 -1.70 114.58 113.24 2jkv h GLU 227 Ca 0.00 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2jkv h GLU 227 Cb 0.00 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 27.90 2jkv h GLU 227 CO 0.00 0.06 0.00 1.28 -1.40 0.00 0.00 179.01 178.95 2jkv n LEU 228 N -4.49 0.35 -4.35 1.33 4.77 -1.24 -4.73 117.00 108.63 2jkv n LEU 228 Ca -0.03 -0.15 -0.55 0.00 -0.03 0.00 0.00 56.01 55.26 2jkv n LEU 228 Cb 0.12 -0.02 -0.10 0.00 -2.33 0.00 0.00 43.42 41.10 2jkv n LEU 228 CO 0.35 0.07 1.78 -0.67 -1.33 0.00 0.00 177.39 177.59 2jkv n ASP 229 N -0.55 1.43 -3.54 -1.43 -0.08 -0.64 -4.69 116.55 107.05 2jkv n ASP 229 Ca 0.14 0.52 -0.07 0.00 -1.51 0.00 0.00 54.79 53.87 2jkv n ASP 229 Cb 0.12 -1.09 -0.02 0.00 2.34 0.00 0.00 41.12 42.47 2jkv n ASP 229 CO 0.00 0.00 0.00 -0.94 0.12 0.00 0.00 177.20 176.38 2jkv s SER 230 N 6.79 -0.29 0.16 1.67 1.04 -1.26 -0.51 113.70 121.29 2jkv s SER 230 Ca 1.15 -0.02 -0.17 0.00 0.48 0.00 0.00 55.95 57.40 2jkv s SER 230 Cb -1.17 0.32 0.09 0.00 0.10 0.00 0.00 66.02 65.36 2jkv s SER 230 CO 0.57 -0.53 1.70 0.15 0.98 0.00 0.00 173.24 176.11 2jkv h PHE 231 N 2.00 -0.03 -0.50 5.02 3.57 -1.64 -1.88 116.94 123.48 2jkv h PHE 231 Ca -0.19 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.24 2jkv h PHE 231 Cb 1.22 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 40.01 2jkv h PHE 231 CO 0.27 -0.07 -0.06 -0.07 -2.23 0.00 0.00 178.31 176.14 2jkv h LEU 232 N 0.09 0.87 -0.17 0.59 3.38 -1.83 -0.95 115.31 117.28 2jkv h LEU 232 Ca 0.18 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 2jkv h LEU 232 Cb 0.25 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 2jkv h LEU 232 CO -0.31 0.97 0.06 0.40 0.09 0.00 0.00 178.44 179.65 2jkv h ILE 233 N 0.80 1.17 -0.11 1.22 1.08 -1.81 -2.06 117.51 117.79 2jkv h ILE 233 Ca 0.14 -0.52 0.04 0.00 -0.39 0.00 0.00 64.86 64.12 2jkv h ILE 233 Cb 0.57 1.20 -0.06 0.00 -3.07 0.00 0.00 36.82 35.45 2jkv h ILE 233 CO 0.03 0.16 -0.48 -0.08 -0.69 0.00 0.00 178.15 177.10 2jkv h GLU 234 N 0.11 -0.53 0.00 2.37 4.81 -1.05 -2.32 114.58 117.97 2jkv h GLU 234 Ca 0.06 0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.27 2jkv h GLU 234 Cb 0.20 0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 2jkv h GLU 234 CO -0.00 -0.35 -0.25 -0.84 -0.73 0.00 0.00 179.01 176.83 2jkv h ILE 235 N -0.55 0.95 -0.62 2.32 3.07 -1.16 -2.28 117.51 119.23 2jkv h ILE 235 Ca 0.05 -0.95 -0.06 0.00 1.55 0.00 0.00 64.86 65.45 2jkv h ILE 235 Cb 0.66 1.55 -0.03 0.00 -0.27 0.00 0.00 36.82 38.74 2jkv h ILE 235 CO -0.41 0.25 0.15 0.74 -1.05 0.00 0.00 178.15 177.83 2jkv h THR 236 N 0.00 1.25 -0.53 0.16 2.02 -1.05 0.19 112.91 114.96 2jkv h THR 236 Ca -0.00 -0.93 0.02 0.00 0.77 0.00 0.00 66.41 66.27 2jkv h THR 236 Cb 0.53 0.67 -0.04 0.00 -1.74 0.00 0.00 68.15 67.57 2jkv h THR 236 CO 0.03 0.35 0.32 0.00 0.37 0.00 0.00 175.52 176.59 2jkv h ALA 237 N 1.04 0.68 -0.25 6.16 0.00 -0.87 -0.93 119.26 125.09 2jkv h ALA 237 Ca 0.19 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 2jkv h ALA 237 Cb 0.36 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2jkv h ALA 237 CO 0.00 0.03 0.12 -0.91 0.00 0.00 0.00 179.25 178.49 2jkv h ASN 238 N 0.63 0.33 -0.70 0.00 2.35 -1.08 -2.70 115.58 114.40 2jkv h ASN 238 Ca 0.21 -0.13 0.05 0.00 -0.55 0.00 0.00 56.30 55.89 2jkv h ASN 238 Cb 0.02 -0.09 -0.05 0.00 0.05 0.00 0.00 38.32 38.25 2jkv h ASN 238 CO -0.10 0.37 0.41 0.40 -1.65 0.00 0.00 177.43 176.86 2jkv h ILE 239 N 0.27 1.01 -0.47 2.81 2.04 -0.38 -1.31 117.51 121.48 2jkv h ILE 239 Ca 0.09 -0.26 -0.03 0.00 1.00 0.00 0.00 64.86 65.65 2jkv h ILE 239 Cb 0.12 0.18 -0.02 0.00 -0.74 0.00 0.00 36.82 36.36 2jkv h ILE 239 CO -0.01 0.14 0.16 -0.07 0.00 0.00 0.00 178.15 178.37 2jkv h LEU 240 N 0.76 0.62 -0.52 1.44 3.38 -0.99 -2.48 115.31 117.53 2jkv h LEU 240 Ca 0.31 -0.08 -0.14 0.00 0.09 0.00 0.00 57.88 58.05 2jkv h LEU 240 Cb 0.15 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 2jkv h LEU 240 CO -0.16 0.59 -0.69 0.11 0.09 0.00 0.00 178.44 178.38 2jkv h LYS 241 N 0.67 0.00 -6.70 1.13 1.57 -1.10 -3.42 116.57 108.73 2jkv h LYS 241 Ca 0.16 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.41 2jkv h LYS 241 Cb 0.18 0.00 0.07 0.00 0.08 0.00 0.00 32.23 32.56 2jkv h LYS 241 CO -0.01 0.69 0.97 0.34 -0.57 0.00 0.00 179.45 180.86 2jkv n PHE 242 N -3.60 2.78 -4.82 -1.35 7.35 -0.55 -4.94 117.46 112.32 2jkv n PHE 242 Ca -0.01 0.11 -0.33 0.00 -0.76 0.00 0.00 57.45 56.47 2jkv n PHE 242 Cb 0.70 -2.65 -0.13 0.00 0.35 0.00 0.00 39.48 37.76 2jkv n PHE 242 CO 0.00 0.00 0.00 -0.65 -0.76 0.00 0.00 176.76 175.35 2jkv s GLN 243 N 0.62 2.63 0.89 -4.13 -0.21 -1.26 -2.04 119.66 116.15 2jkv s GLN 243 Ca 0.72 -0.66 -0.12 0.00 0.02 0.00 0.00 55.36 55.31 2jkv s GLN 243 Cb -0.51 -2.44 0.12 0.00 1.00 0.00 0.00 33.01 31.18 2jkv s GLN 243 CO 0.38 0.60 1.12 0.34 -2.12 0.00 0.00 175.29 175.61 2jkv s ASP 244 N -0.66 3.67 0.66 5.90 2.15 0.11 -4.81 116.67 123.69 2jkv s ASP 244 Ca 0.10 1.10 0.29 0.00 0.43 0.00 0.00 52.55 54.47 2jkv s ASP 244 Cb -0.11 -1.73 1.60 0.00 -0.30 0.00 0.00 42.92 42.37 2jkv s ASP 244 CO 0.01 -2.46 1.91 0.71 -0.17 0.00 0.00 175.17 175.16 2jkv h THR 245 N -1.43 0.03 -0.51 1.71 1.35 -2.00 0.13 112.91 112.18 2jkv h THR 245 Ca -0.50 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.36 2jkv h THR 245 Cb 1.31 0.65 0.00 0.00 -1.73 0.00 0.00 68.15 68.39 2jkv h THR 245 CO 0.60 0.00 0.00 -0.90 -0.25 0.00 0.00 175.52 174.97 2jkv n ASP 246 N -2.94 2.88 0.00 5.36 5.68 -1.26 -4.94 116.55 121.34 2jkv n ASP 246 Ca -0.01 -1.98 0.00 0.00 -0.50 0.00 0.00 54.79 52.30 2jkv n ASP 246 Cb 0.41 -0.34 0.00 0.00 -1.14 0.00 0.00 41.12 40.05 2jkv n ASP 246 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2jkv n GLY 247 N 1.37 2.90 3.84 6.12 0.00 0.45 -5.02 105.19 114.84 2jkv n GLY 247 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 2jkv n GLY 247 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jkv s LYS 248 N -0.22 4.05 0.44 1.61 1.02 -1.26 -4.72 119.74 120.66 2jkv s LYS 248 Ca 0.00 0.97 -0.25 0.00 0.02 0.00 0.00 55.97 56.71 2jkv s LYS 248 Cb 0.00 -2.19 -0.08 0.00 -0.52 0.00 0.00 37.83 35.04 2jkv s LYS 248 CO 0.00 -0.14 1.36 -1.01 -0.92 0.00 0.00 175.35 174.64 2jkv s HIS 249 N -2.40 2.61 0.03 3.18 3.76 -1.26 0.07 115.29 121.28 2jkv s HIS 249 Ca 0.59 1.34 -0.16 0.00 -0.15 0.00 0.00 55.06 56.68 2jkv s HIS 249 Cb -0.10 -3.79 -0.32 0.00 1.11 0.00 0.00 32.58 29.49 2jkv s HIS 249 CO 0.23 -2.53 1.04 1.25 -0.85 0.00 0.00 174.74 173.88 2jkv h LEU 250 N 2.40 0.81 -0.76 0.89 5.85 -1.73 -3.37 115.31 119.40 2jkv h LEU 250 Ca -0.50 -0.87 0.10 0.00 0.84 0.00 0.00 57.88 57.45 2jkv h LEU 250 Cb 1.26 -0.26 -0.08 0.00 0.37 0.00 0.00 40.66 41.95 2jkv h LEU 250 CO 0.61 1.61 0.39 0.25 -0.34 0.00 0.00 178.44 180.96 2jkv h LEU 251 N 0.14 0.51 -0.99 2.25 5.85 -1.83 0.07 115.31 121.31 2jkv h LEU 251 Ca -0.20 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.58 2jkv h LEU 251 Cb 1.95 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.95 2jkv h LEU 251 CO 0.24 0.28 0.00 -2.65 -0.34 0.00 0.00 178.44 175.96 2jkv n PRO 252 N -4.84 0.16 0.04 5.25 -0.02 -1.26 -1.49 135.00 132.84 2jkv n PRO 252 Ca 0.13 0.52 0.12 0.00 -2.02 0.00 0.00 63.50 62.25 2jkv n PRO 252 Cb 0.31 -1.89 0.28 0.00 -0.02 0.00 0.00 33.50 32.17 2jkv n PRO 252 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2jkv n LYS 253 N -2.21 0.17 -2.82 -0.52 5.02 0.01 -4.93 118.16 112.88 2jkv n LYS 253 Ca 0.00 0.07 -0.41 0.00 -2.02 0.00 0.00 58.31 55.96 2jkv n LYS 253 Cb 0.13 -1.63 -0.05 0.00 -0.02 0.00 0.00 35.03 33.47 2jkv n LYS 253 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2jkv s ILE 254 N -3.09 4.56 0.34 -0.18 1.01 -0.55 -5.00 121.20 118.29 2jkv s ILE 254 Ca 0.09 1.91 -0.29 0.00 0.00 0.00 0.00 60.65 62.37 2jkv s ILE 254 Cb 0.15 -4.25 -0.10 0.00 0.01 0.00 0.00 42.46 38.27 2jkv s ILE 254 CO 0.68 0.35 1.34 -0.60 0.00 0.00 0.00 174.94 176.70 2jkv s ARG 255 N -0.09 4.31 -0.33 2.79 3.52 -1.26 -4.90 118.95 122.99 2jkv s ARG 255 Ca 0.44 2.28 -0.00 0.00 -0.13 0.00 0.00 55.73 58.31 2jkv s ARG 255 Cb -0.22 -3.05 0.27 0.00 -1.56 0.00 0.00 34.95 30.38 2jkv s ARG 255 CO 0.27 -0.25 1.88 -3.47 -0.81 0.00 0.00 175.30 172.93 2jkv n ASP 256 N 0.77 5.77 -3.74 -2.12 2.03 -1.26 -4.79 116.55 113.22 2jkv n ASP 256 Ca 0.00 -3.07 -0.29 0.00 0.52 0.00 0.00 54.79 51.95 2jkv n ASP 256 Cb 0.41 -0.95 -0.16 0.00 -0.72 0.00 0.00 41.12 39.70 2jkv n ASP 256 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2jkv s SER 257 N -0.08 3.64 0.06 1.67 0.15 -1.26 -4.67 113.70 113.21 2jkv s SER 257 Ca 0.33 -1.33 -0.30 0.00 0.70 0.00 0.00 55.95 55.35 2jkv s SER 257 Cb 0.27 -0.78 -0.05 0.00 -1.71 0.00 0.00 66.02 63.75 2jkv s SER 257 CO 0.01 -0.37 1.13 0.00 1.20 0.00 0.00 173.24 175.21 2jkv s ALA 258 N 1.70 3.32 0.64 5.45 0.00 -1.26 -4.91 121.76 126.70 2jkv s ALA 258 Ca 0.05 0.76 -0.04 0.00 0.00 0.00 0.00 51.96 52.73 2jkv s ALA 258 Cb -0.17 -3.41 0.05 0.00 0.00 0.00 0.00 23.12 19.59 2jkv s ALA 258 CO -0.19 -0.35 0.92 0.20 0.00 0.00 0.00 175.76 176.34 2jkv s GLY 259 N 0.91 1.73 0.02 0.00 0.00 -1.26 -4.73 107.32 103.99 2jkv s GLY 259 Ca 0.56 -1.05 -0.26 0.00 0.00 0.00 0.00 44.72 43.97 2jkv s GLY 259 CO 0.29 -0.70 0.59 -0.86 0.00 0.00 0.00 173.10 172.42 2jkv s GLN 260 N -5.05 1.07 -0.04 2.90 -2.07 -1.26 -5.07 119.66 110.14 2jkv s GLN 260 Ca 0.58 -0.07 0.06 0.00 -1.82 0.00 0.00 55.36 54.11 2jkv s GLN 260 Cb -0.11 0.50 0.09 0.00 -1.09 0.00 0.00 33.01 32.40 2jkv s GLN 260 CO 0.42 -0.38 1.04 1.63 -1.32 0.00 0.00 175.29 176.69 2jkv n LYS 261 N 0.52 2.40 0.00 9.60 5.02 -1.26 -5.02 118.16 129.42 2jkv n LYS 261 Ca -0.19 -1.84 0.00 0.00 -2.02 0.00 0.00 58.31 54.27 2jkv n LYS 261 Cb 0.60 -1.16 0.00 0.00 -0.02 0.00 0.00 35.03 34.45 2jkv n LYS 261 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jkv n GLY 262 N -0.80 3.02 0.35 0.72 0.00 -1.26 -4.97 105.19 102.25 2jkv n GLY 262 Ca 0.05 -1.13 -0.02 0.00 0.00 0.00 0.00 46.02 44.92 2jkv n GLY 262 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2jkv h THR 263 N 0.00 1.21 0.07 2.61 1.35 -1.95 0.97 112.91 117.16 2jkv h THR 263 Ca 0.00 -0.41 -0.00 0.00 -0.55 0.00 0.00 66.41 65.44 2jkv h THR 263 Cb 0.00 -0.10 0.00 0.00 -1.73 0.00 0.00 68.15 66.32 2jkv h THR 263 CO 0.00 0.22 -0.03 1.23 -0.25 0.00 0.00 175.52 176.69 2jkv h GLY 264 N 1.21 -0.10 0.22 5.82 0.00 -1.88 -1.46 103.07 106.87 2jkv h GLY 264 Ca 0.34 0.04 0.12 0.00 0.00 0.00 0.00 47.33 47.83 2jkv h GLY 264 CO -0.09 -0.04 0.24 1.70 0.00 0.00 0.00 176.54 178.36 2jkv h LYS 265 N -0.24 0.38 -0.60 4.80 3.64 -1.82 -1.46 116.57 121.28 2jkv h LYS 265 Ca -0.01 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.33 2jkv h LYS 265 Cb 0.20 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.91 2jkv h LYS 265 CO 0.02 0.25 0.31 -1.49 -2.27 0.00 0.00 179.45 176.27 2jkv h TRP 266 N 0.40 0.81 -0.13 1.91 6.55 -0.42 -1.24 115.95 123.83 2jkv h TRP 266 Ca 0.36 -0.02 -0.01 0.00 0.95 0.00 0.00 58.89 60.18 2jkv h TRP 266 Cb 0.52 -0.26 -0.01 0.00 -0.86 0.00 0.00 29.16 28.56 2jkv h TRP 266 CO -0.19 0.58 0.03 1.15 -1.05 0.00 0.00 178.44 178.96 2jkv h THR 267 N 0.83 1.20 -0.63 1.49 2.02 -0.24 -0.44 112.91 117.14 2jkv h THR 267 Ca 0.21 -0.62 -0.01 0.00 0.77 0.00 0.00 66.41 66.75 2jkv h THR 267 Cb 0.05 1.38 -0.03 0.00 -1.74 0.00 0.00 68.15 67.81 2jkv h THR 267 CO -0.03 0.18 0.34 0.00 0.37 0.00 0.00 175.52 176.38 2jkv h ALA 268 N 0.82 0.81 -0.55 6.16 0.00 -1.10 -0.90 119.26 124.50 2jkv h ALA 268 Ca 0.04 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 2jkv h ALA 268 Cb 0.26 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2jkv h ALA 268 CO 0.00 0.34 0.20 0.82 0.00 0.00 0.00 179.25 180.61 2jkv h ILE 269 N 0.86 1.23 -0.66 0.00 2.04 -1.07 -1.42 117.51 118.49 2jkv h ILE 269 Ca 0.22 -0.73 0.03 0.00 1.00 0.00 0.00 64.86 65.38 2jkv h ILE 269 Cb 0.06 0.68 -0.04 0.00 -0.74 0.00 0.00 36.82 36.78 2jkv h ILE 269 CO -0.03 0.28 0.41 0.28 0.00 0.00 0.00 178.15 179.09 2jkv h SER 270 N 0.75 0.68 -0.28 1.72 0.02 -0.67 -0.13 113.55 115.64 2jkv h SER 270 Ca 0.18 0.00 0.02 0.00 -0.84 0.00 0.00 61.79 61.15 2jkv h SER 270 Cb 0.23 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.60 2jkv h SER 270 CO -0.01 0.47 0.12 0.00 -1.14 0.00 0.00 176.83 176.27 2jkv h ALA 271 N 1.28 0.33 -0.40 3.77 0.00 -0.83 -1.57 119.26 121.84 2jkv h ALA 271 Ca 0.27 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 2jkv h ALA 271 Cb 0.02 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2jkv h ALA 271 CO -0.10 -0.27 0.22 -0.07 0.00 0.00 0.00 179.25 179.02 2jkv h LEU 272 N 0.27 0.49 -1.53 0.00 3.38 -0.94 -0.30 115.31 116.67 2jkv h LEU 272 Ca 0.12 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 2jkv h LEU 272 Cb 0.05 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 2jkv h LEU 272 CO -0.09 0.44 0.08 -0.33 0.09 0.00 0.00 178.44 178.63 2jkv h GLU 273 N 0.51 0.39 -0.36 1.13 5.08 -0.58 -2.92 114.58 117.84 2jkv h GLU 273 Ca 0.14 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 2jkv h GLU 273 Cb 0.05 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.22 2jkv h GLU 273 CO -0.02 0.35 0.00 0.66 -1.00 0.00 0.00 179.01 179.00 2jkv n TYR 274 N -4.40 0.48 -3.32 4.33 4.01 -0.63 -4.99 117.16 112.64 2jkv n TYR 274 Ca 0.01 -0.48 -0.18 0.00 -0.16 0.00 0.00 57.90 57.09 2jkv n TYR 274 Cb 0.15 -0.02 0.06 0.00 -0.31 0.00 0.00 39.34 39.21 2jkv n TYR 274 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2jkv n GLY 275 N 0.59 -0.17 3.56 2.72 0.00 -0.26 -5.02 105.19 106.60 2jkv n GLY 275 Ca 0.12 0.03 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 2jkv n GLY 275 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jkv s VAL 276 N -3.24 4.51 -1.38 1.61 1.01 -0.41 -5.02 120.40 117.47 2jkv s VAL 276 Ca 0.44 -0.13 -0.13 0.00 0.00 0.00 0.00 61.98 62.16 2jkv s VAL 276 Cb -0.19 -3.05 -0.03 0.00 0.00 0.00 0.00 36.38 33.11 2jkv s VAL 276 CO 0.55 0.43 2.39 -0.81 0.00 0.00 0.00 175.10 177.65 2jkv n PRO 277 N 3.97 2.87 -2.33 2.72 -0.05 -1.26 -4.46 135.00 136.45 2jkv n PRO 277 Ca -0.16 -2.32 -0.43 0.00 -0.05 0.00 0.00 63.50 60.54 2jkv n PRO 277 Cb 0.52 -3.05 0.00 0.00 -0.05 0.00 0.00 33.50 30.92 2jkv n PRO 277 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 175.50 175.73 2jkv n VAL 278 N 4.73 4.16 0.01 0.52 0.31 -1.26 -4.79 118.33 122.00 2jkv n VAL 278 Ca 0.59 -4.19 -0.06 0.00 -0.01 0.00 0.00 64.34 60.66 2jkv n VAL 278 Cb 0.33 -2.42 0.13 0.00 -0.91 0.00 0.00 33.84 30.98 2jkv n VAL 278 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 2jkv h THR 279 N 3.99 1.30 -0.29 2.52 1.35 -1.95 -3.18 112.91 116.65 2jkv h THR 279 Ca 0.42 -1.53 -0.01 0.00 -0.55 0.00 0.00 66.41 64.74 2jkv h THR 279 Cb 0.67 1.54 -0.01 0.00 -1.73 0.00 0.00 68.15 68.62 2jkv h THR 279 CO 1.61 0.48 0.15 -0.07 -0.25 0.00 0.00 175.52 177.44 2jkv h LEU 280 N 0.43 0.36 -0.82 3.87 3.38 -1.90 -2.10 115.31 118.53 2jkv h LEU 280 Ca 0.04 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 2jkv h LEU 280 Cb 0.86 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.48 2jkv h LEU 280 CO 0.07 0.36 0.43 -0.29 0.09 0.00 0.00 178.44 179.11 2jkv h ILE 281 N 0.34 1.25 -0.24 1.22 6.09 -1.84 0.66 117.51 124.98 2jkv h ILE 281 Ca 0.10 -0.64 0.06 0.00 -1.37 0.00 0.00 64.86 63.01 2jkv h ILE 281 Cb 0.08 0.16 -0.06 0.00 0.47 0.00 0.00 36.82 37.48 2jkv h ILE 281 CO -0.01 0.28 -0.12 1.23 -3.07 0.00 0.00 178.15 176.46 2jkv h GLY 282 N 1.15 0.08 1.50 8.18 0.00 -1.49 -0.10 103.07 112.39 2jkv h GLY 282 Ca 0.29 0.15 -0.10 0.00 0.00 0.00 0.00 47.33 47.66 2jkv h GLY 282 CO -0.04 -0.14 -0.25 0.83 0.00 0.00 0.00 176.54 176.93 2jkv h GLU 283 N -0.09 0.57 -0.43 4.80 4.39 -0.92 -1.70 114.58 121.21 2jkv h GLU 283 Ca 0.13 -0.23 -0.02 0.00 0.34 0.00 0.00 59.36 59.58 2jkv h GLU 283 Cb 0.28 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.89 2jkv h GLU 283 CO -0.30 0.78 0.19 0.00 -1.16 0.00 0.00 179.01 178.52 2jkv h ALA 284 N 1.22 0.55 -0.14 3.43 0.00 -0.44 0.14 119.26 124.03 2jkv h ALA 284 Ca 0.07 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2jkv h ALA 284 Cb 0.71 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2jkv h ALA 284 CO 0.05 0.13 0.02 0.28 0.00 0.00 0.00 179.25 179.74 2jkv h VAL 285 N 0.54 1.22 -0.45 0.00 2.07 -0.85 -2.52 116.25 116.27 2jkv h VAL 285 Ca 0.14 -0.71 -0.01 0.00 0.82 0.00 0.00 66.70 66.94 2jkv h VAL 285 Cb 0.15 1.42 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 2jkv h VAL 285 CO -0.02 0.21 0.22 -0.26 0.02 0.00 0.00 177.57 177.74 2jkv h PHE 286 N 0.01 0.61 -0.76 1.57 0.04 -1.21 -2.01 116.94 115.19 2jkv h PHE 286 Ca 0.04 -0.01 0.01 0.00 2.80 0.00 0.00 57.97 60.81 2jkv h PHE 286 Cb 0.30 -0.20 -0.04 0.00 2.20 0.00 0.00 35.95 38.22 2jkv h PHE 286 CO 0.02 0.45 0.50 0.00 -0.60 0.00 0.00 178.31 178.69 2jkv h ALA 287 N 1.61 0.96 -0.49 2.45 0.00 -0.46 0.19 119.26 123.53 2jkv h ALA 287 Ca 0.16 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2jkv h ALA 287 Cb 0.07 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 2jkv h ALA 287 CO -0.02 0.38 0.32 0.00 0.00 0.00 0.00 179.25 179.93 2jkv h ARG 288 N 1.03 0.65 -0.25 0.00 3.08 -0.98 -0.74 114.38 117.17 2jkv h ARG 288 Ca 0.28 -0.04 0.04 0.00 0.07 0.00 0.00 59.98 60.33 2jkv h ARG 288 Cb -0.12 -0.14 -0.04 0.00 0.08 0.00 0.00 29.97 29.75 2jkv h ARG 288 CO -0.06 0.44 -0.02 0.00 -1.07 0.00 0.00 179.97 179.27 2jkv h LEU 290 N 0.06 0.94 -1.36 0.00 5.85 -0.37 -1.73 115.31 118.70 2jkv h LEU 290 Ca 0.12 0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.78 2jkv h LEU 290 Cb 0.16 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 2jkv h LEU 290 CO -0.22 0.60 -0.32 0.77 -0.34 0.00 0.00 178.44 178.93 2jkv h SER 291 N 1.07 0.00 0.73 1.25 4.64 -0.30 -2.42 113.55 118.52 2jkv h SER 291 Ca 0.41 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.69 2jkv h SER 291 Cb 0.21 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.30 2jkv h SER 291 CO -0.16 0.32 -0.18 0.28 -0.87 0.00 0.00 176.83 176.22 2jkv h SER 292 N 0.00 0.00 0.00 4.97 0.02 -0.68 -2.97 113.55 114.88 2jkv h SER 292 Ca -0.00 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 2jkv h SER 292 Cb 0.61 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.14 2jkv h SER 292 CO 0.04 0.18 -0.03 0.18 -1.14 0.00 0.00 176.83 176.06 2jkv n LEU 293 N -3.45 4.72 -0.15 5.07 4.77 -0.91 -4.56 117.00 122.49 2jkv n LEU 293 Ca -0.01 -2.22 -0.03 0.00 -0.03 0.00 0.00 56.01 53.72 2jkv n LEU 293 Cb 0.36 -1.03 0.06 0.00 -2.33 0.00 0.00 43.42 40.47 2jkv n LEU 293 CO 0.32 0.96 0.94 0.50 -1.33 0.00 0.00 177.39 178.77 2jkv h LYS 294 N 1.59 0.28 -0.70 3.23 1.63 -1.73 0.55 116.57 121.42 2jkv h LYS 294 Ca 0.02 -0.02 -0.01 0.00 -0.85 0.00 0.00 60.65 59.79 2jkv h LYS 294 Cb 0.94 -0.06 -0.03 0.00 -0.60 0.00 0.00 32.23 32.47 2jkv h LYS 294 CO 0.03 0.19 0.39 -0.44 -3.45 0.00 0.00 179.45 176.17 2jkv h ASP 295 N 0.29 0.87 -0.92 4.20 3.32 -1.91 -1.25 116.42 121.03 2jkv h ASP 295 Ca 0.23 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.18 2jkv h ASP 295 Cb 0.27 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 39.55 2jkv h ASP 295 CO -0.27 0.71 0.53 -0.33 -1.72 0.00 0.00 179.24 178.17 2jkv h GLU 296 N 0.96 1.26 -0.20 3.56 5.08 -1.73 -2.37 114.58 121.14 2jkv h GLU 296 Ca 0.25 -0.13 -0.14 0.00 -1.00 0.00 0.00 59.36 58.34 2jkv h GLU 296 Cb 0.03 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.01 2jkv h GLU 296 CO -0.04 0.90 -0.45 0.00 -1.00 0.00 0.00 179.01 178.42 2jkv h ARG 297 N 1.27 0.51 -0.27 2.33 3.08 -0.19 0.33 114.38 121.46 2jkv h ARG 297 Ca 0.33 -0.28 -0.00 0.00 0.07 0.00 0.00 59.98 60.09 2jkv h ARG 297 Cb -0.02 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 2jkv h ARG 297 CO -0.06 0.86 0.15 0.82 -1.07 0.00 0.00 179.97 180.68 2jkv h ILE 298 N 0.41 1.11 0.09 2.04 2.04 -1.10 -0.05 117.51 122.05 2jkv h ILE 298 Ca 0.03 -0.28 0.00 0.00 1.00 0.00 0.00 64.86 65.61 2jkv h ILE 298 Cb 0.96 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 37.84 2jkv h ILE 298 CO 0.08 0.11 -0.08 -0.61 0.00 0.00 0.00 178.15 177.66 2jkv h GLN 299 N 0.33 -0.17 -0.23 2.37 5.75 -0.88 -2.93 115.11 119.35 2jkv h GLN 299 Ca 0.10 0.01 -0.02 0.00 -0.15 0.00 0.00 58.65 58.58 2jkv h GLN 299 Cb 0.04 0.04 -0.01 0.00 1.07 0.00 0.00 27.48 28.62 2jkv h GLN 299 CO -0.02 -0.11 0.03 0.00 -2.65 0.00 0.00 178.83 176.08 2jkv h ALA 300 N 0.73 1.64 0.00 3.38 0.00 -0.18 -2.12 119.26 122.71 2jkv h ALA 300 Ca -0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 2jkv h ALA 300 Cb 0.16 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2jkv h ALA 300 CO -0.01 0.27 -0.03 0.66 0.00 0.00 0.00 179.25 180.15 2jkv h SER 301 N 0.32 0.00 0.33 0.00 4.64 -0.81 0.37 113.55 118.40 2jkv h SER 301 Ca 0.08 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.23 2jkv h SER 301 Cb 0.16 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.25 2jkv h SER 301 CO -0.00 0.03 -0.69 0.11 -0.87 0.00 0.00 176.83 175.41 2jkv h LYS 302 N 0.00 0.32 0.00 4.77 6.56 -1.40 -3.39 116.57 123.43 2jkv h LYS 302 Ca -0.00 -0.25 -0.27 0.00 -1.06 0.00 0.00 60.65 59.07 2jkv h LYS 302 Cb 0.23 0.05 -0.05 0.00 -0.57 0.00 0.00 32.23 31.89 2jkv h LYS 302 CO 0.00 0.88 -2.03 1.63 -2.06 0.00 0.00 179.45 177.87 2jkv n LYS 303 N -3.84 0.87 -3.26 3.15 5.02 -0.58 -4.95 118.16 114.57 2jkv n LYS 303 Ca -0.03 0.07 -0.40 0.00 -2.02 0.00 0.00 58.31 55.92 2jkv n LYS 303 Cb 0.68 -1.37 -0.08 0.00 -0.02 0.00 0.00 35.03 34.24 2jkv n LYS 303 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2jkv s LEU 304 N -5.73 4.16 0.28 -0.35 1.43 0.02 -5.05 118.68 113.43 2jkv s LEU 304 Ca -0.19 0.28 -0.07 0.00 -1.03 0.00 0.00 54.13 53.12 2jkv s LEU 304 Cb 0.06 -2.60 -0.06 0.00 0.03 0.00 0.00 46.19 43.62 2jkv s LEU 304 CO 0.48 -0.35 0.57 -0.54 0.23 0.00 0.00 176.35 176.74 2jkv s LYS 305 N 2.31 3.69 0.00 1.70 1.02 -1.26 -4.75 119.74 122.44 2jkv s LYS 305 Ca 0.19 0.11 0.00 0.00 0.02 0.00 0.00 55.97 56.29 2jkv s LYS 305 Cb -0.16 -2.63 0.00 0.00 -0.52 0.00 0.00 37.83 34.52 2jkv s LYS 305 CO 0.11 0.23 0.00 0.41 -0.92 0.00 0.00 175.35 175.17 2jkv n GLY 306 N -0.74 1.61 3.68 -3.33 0.00 -1.26 -5.02 105.19 100.14 2jkv n GLY 306 Ca -0.01 -2.01 -0.44 0.00 0.00 0.00 0.00 46.02 43.56 2jkv n GLY 306 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2jkv n PRO 307 N -0.22 2.59 -0.01 1.61 -0.04 -1.26 -4.90 135.00 132.77 2jkv n PRO 307 Ca 0.00 0.94 -0.17 0.00 -0.04 0.00 0.00 63.50 64.24 2jkv n PRO 307 Cb 0.00 -2.82 -0.11 0.00 -0.04 0.00 0.00 33.50 30.53 2jkv n PRO 307 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 2jkv h GLN 308 N 8.63 0.36 -2.30 0.54 4.20 -1.95 -3.39 115.11 121.21 2jkv h GLN 308 Ca -0.47 -0.37 -0.63 0.00 0.06 0.00 0.00 58.65 57.23 2jkv h GLN 308 Cb 1.24 0.10 -0.39 0.00 0.30 0.00 0.00 27.48 28.73 2jkv h GLN 308 CO 0.94 1.05 -0.32 0.36 -0.67 0.00 0.00 178.83 180.18 2jkv n LYS 309 N -4.29 3.39 -4.41 1.46 0.00 -1.26 -5.02 118.16 108.03 2jkv n LYS 309 Ca -0.10 -4.77 -0.34 0.00 -0.00 0.00 0.00 58.31 53.11 2jkv n LYS 309 Cb 0.62 -2.29 -0.13 0.00 -0.00 0.00 0.00 35.03 33.22 2jkv n LYS 309 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.40 177.52 2jkv s PHE 310 N -3.24 2.94 -0.04 5.58 5.36 -1.26 -5.09 117.98 122.23 2jkv s PHE 310 Ca 0.44 -0.56 0.01 0.00 -0.96 0.00 0.00 56.93 55.85 2jkv s PHE 310 Cb 0.21 -1.96 0.02 0.00 -0.34 0.00 0.00 43.02 40.96 2jkv s PHE 310 CO -0.08 -0.22 -0.03 -0.65 -1.46 0.00 0.00 175.22 172.78 2jkv s GLN 311 N 0.63 0.67 -0.26 10.12 1.11 -1.26 -5.09 119.66 125.59 2jkv s GLN 311 Ca -0.04 -0.05 -0.29 0.00 0.01 0.00 0.00 55.36 54.99 2jkv s GLN 311 Cb -0.15 -0.74 -0.01 0.00 -1.01 0.00 0.00 33.01 31.10 2jkv s GLN 311 CO 0.03 -0.10 1.47 0.12 0.01 0.00 0.00 175.29 176.81 2jkv s PHE 312 N 0.98 2.38 -0.59 0.91 5.36 -1.26 -4.93 117.98 120.84 2jkv s PHE 312 Ca -0.10 0.70 0.06 0.00 -0.96 0.00 0.00 56.93 56.63 2jkv s PHE 312 Cb -0.14 -3.95 0.29 0.00 -0.34 0.00 0.00 43.02 38.88 2jkv s PHE 312 CO -0.01 -2.35 0.81 -0.25 -1.46 0.00 0.00 175.22 171.96 2jkv n ASP 313 N 8.04 3.66 -2.54 6.13 10.43 -1.26 -5.05 116.55 135.97 2jkv n ASP 313 Ca 0.17 -3.47 -0.12 0.00 2.57 0.00 0.00 54.79 53.94 2jkv n ASP 313 Cb 0.46 -0.63 -0.03 0.00 1.84 0.00 0.00 41.12 42.76 2jkv n ASP 313 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2jkv n GLY 314 N 0.45 2.50 3.60 0.44 0.00 -1.26 -5.11 105.19 105.81 2jkv n GLY 314 Ca 0.30 -1.61 -0.43 0.00 0.00 0.00 0.00 46.02 44.28 2jkv n GLY 314 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jkv s ASP 315 N -2.66 6.44 0.20 1.61 2.15 -1.26 -4.92 116.67 118.23 2jkv s ASP 315 Ca 0.23 0.70 -0.11 0.00 0.43 0.00 0.00 52.55 53.80 2jkv s ASP 315 Cb -0.00 -2.54 0.25 0.00 -0.30 0.00 0.00 42.92 40.33 2jkv s ASP 315 CO 0.17 -1.37 1.72 0.11 -0.17 0.00 0.00 175.17 175.62 2jkv h LYS 316 N 10.19 0.28 -0.55 4.34 1.57 -1.99 -0.51 116.57 129.91 2jkv h LYS 316 Ca -0.26 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.48 2jkv h LYS 316 Cb 1.09 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.31 2jkv h LYS 316 CO 1.10 0.19 0.26 0.87 -0.57 0.00 0.00 179.45 181.30 2jkv h LYS 317 N 0.29 0.79 -0.65 3.15 1.79 -2.00 -0.07 116.57 119.88 2jkv h LYS 317 Ca 0.29 -0.12 -0.03 0.00 -2.18 0.00 0.00 60.65 58.62 2jkv h LYS 317 Cb 0.40 -0.14 -0.03 0.00 -1.58 0.00 0.00 32.23 30.88 2jkv h LYS 317 CO -0.35 0.66 0.31 1.03 -1.08 0.00 0.00 179.45 180.02 2jkv h SER 318 N 0.74 0.86 0.03 0.86 0.87 -1.78 -2.41 113.55 112.73 2jkv h SER 318 Ca 0.19 -0.14 -0.11 0.00 -1.23 0.00 0.00 61.79 60.50 2jkv h SER 318 Cb 0.13 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 61.85 2jkv h SER 318 CO -0.02 0.76 -0.34 0.15 -0.53 0.00 0.00 176.83 176.84 2jkv h PHE 319 N 0.91 0.50 -0.80 2.24 3.57 -0.77 -1.80 116.94 120.79 2jkv h PHE 319 Ca 0.22 -0.13 -0.00 0.00 3.53 0.00 0.00 57.97 61.60 2jkv h PHE 319 Cb 0.13 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 38.71 2jkv h PHE 319 CO 0.00 0.72 0.48 1.25 -2.23 0.00 0.00 178.31 178.54 2jkv h LEU 320 N 0.37 0.96 -0.82 0.59 5.85 -0.75 -0.43 115.31 121.08 2jkv h LEU 320 Ca 0.04 -0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.65 2jkv h LEU 320 Cb 0.78 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.54 2jkv h LEU 320 CO 0.06 0.74 0.27 -0.08 -0.34 0.00 0.00 178.44 179.09 2jkv h GLU 321 N 1.09 1.14 -0.36 1.25 4.57 -1.15 -1.80 114.58 119.32 2jkv h GLU 321 Ca 0.29 -0.22 0.05 0.00 -1.18 0.00 0.00 59.36 58.29 2jkv h GLU 321 Cb -0.04 -0.18 -0.04 0.00 -0.16 0.00 0.00 28.75 28.33 2jkv h GLU 321 CO -0.05 0.95 0.10 -0.44 -1.18 0.00 0.00 179.01 178.38 2jkv h ASP 322 N 1.10 0.07 -0.69 1.04 3.32 -0.68 -0.76 116.42 119.82 2jkv h ASP 322 Ca 0.25 0.05 0.06 0.00 0.02 0.00 0.00 57.03 57.40 2jkv h ASP 322 Cb 0.26 0.06 -0.05 0.00 0.22 0.00 0.00 39.33 39.81 2jkv h ASP 322 CO -0.01 0.08 0.39 0.40 -1.72 0.00 0.00 179.24 178.38 2jkv h ILE 323 N 0.23 0.99 -0.37 0.35 2.04 -0.73 0.74 117.51 120.77 2jkv h ILE 323 Ca 0.17 -0.25 0.02 0.00 1.00 0.00 0.00 64.86 65.80 2jkv h ILE 323 Cb 0.17 0.19 -0.03 0.00 -0.74 0.00 0.00 36.82 36.42 2jkv h ILE 323 CO -0.20 0.13 0.20 -0.09 0.00 0.00 0.00 178.15 178.19 2jkv h ARG 324 N 0.73 0.40 -0.28 2.37 2.43 -0.67 0.47 114.38 119.83 2jkv h ARG 324 Ca 0.30 -0.02 -0.13 0.00 -0.81 0.00 0.00 59.98 59.32 2jkv h ARG 324 Cb 0.16 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 2jkv h ARG 324 CO -0.17 0.26 -0.38 0.87 -1.51 0.00 0.00 179.97 179.05 2jkv h LYS 325 N 0.41 0.64 -0.61 0.20 1.57 -0.63 -1.12 116.57 117.03 2jkv h LYS 325 Ca 0.15 -0.32 -0.01 0.00 -1.87 0.00 0.00 60.65 58.61 2jkv h LYS 325 Cb 0.03 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.31 2jkv h LYS 325 CO -0.08 0.91 0.36 0.00 -0.57 0.00 0.00 179.45 180.07 2jkv h ALA 326 N 1.05 0.78 -0.33 3.86 0.00 -0.54 -1.24 119.26 122.85 2jkv h ALA 326 Ca 0.05 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 2jkv h ALA 326 Cb 0.89 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 2jkv h ALA 326 CO 0.08 0.27 0.19 1.25 0.00 0.00 0.00 179.25 181.04 2jkv h LEU 327 N 0.83 0.40 -0.19 0.00 5.85 -0.54 -1.55 115.31 120.11 2jkv h LEU 327 Ca 0.22 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.87 2jkv h LEU 327 Cb -0.01 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 2jkv h LEU 327 CO -0.04 0.35 0.12 0.22 -0.34 0.00 0.00 178.44 178.75 2jkv h TYR 328 N 0.42 0.24 -0.38 1.25 3.20 -0.91 0.67 116.97 121.46 2jkv h TYR 328 Ca 0.12 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.98 2jkv h TYR 328 Cb 0.03 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.20 2jkv h TYR 328 CO -0.04 0.17 0.18 0.00 -1.64 0.00 0.00 178.16 176.83 2jkv h ALA 329 N 1.06 0.49 -0.62 1.82 0.00 -1.12 -1.62 119.26 119.27 2jkv h ALA 329 Ca 0.07 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 2jkv h ALA 329 Cb -0.01 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2jkv h ALA 329 CO -0.01 0.06 0.07 0.77 0.00 0.00 0.00 179.25 180.13 2jkv h SER 330 N 0.48 0.99 -0.84 0.00 0.02 -1.12 -1.79 113.55 111.29 2jkv h SER 330 Ca 0.13 -0.24 0.07 0.00 -0.84 0.00 0.00 61.79 60.91 2jkv h SER 330 Cb 0.12 -0.26 -0.06 0.00 0.14 0.00 0.00 62.40 62.34 2jkv h SER 330 CO -0.02 1.01 0.51 0.50 -1.14 0.00 0.00 176.83 177.69 2jkv h LYS 331 N 0.96 0.89 -0.19 3.45 3.64 -0.53 -0.89 116.57 123.90 2jkv h LYS 331 Ca 0.19 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.51 2jkv h LYS 331 Cb 0.46 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 2jkv h LYS 331 CO 0.02 0.59 0.11 0.82 -2.27 0.00 0.00 179.45 178.72 2jkv h ILE 332 N 0.92 1.09 -0.54 2.00 2.04 -0.61 -2.35 117.51 120.06 2jkv h ILE 332 Ca 0.38 -0.24 0.09 0.00 1.00 0.00 0.00 64.86 66.09 2jkv h ILE 332 Cb 0.21 0.91 -0.07 0.00 -0.74 0.00 0.00 36.82 37.13 2jkv h ILE 332 CO -0.19 0.09 0.13 0.40 0.00 0.00 0.00 178.15 178.58 2jkv h ILE 333 N 0.21 0.71 -0.28 -0.67 1.08 -0.67 -0.47 117.51 117.42 2jkv h ILE 333 Ca 0.07 -0.09 0.07 0.00 -0.39 0.00 0.00 64.86 64.51 2jkv h ILE 333 Cb 0.05 0.41 -0.08 0.00 -3.07 0.00 0.00 36.82 34.14 2jkv h ILE 333 CO -0.01 0.05 -0.26 -1.28 -0.69 0.00 0.00 178.15 175.96 2jkv h SER 334 N 0.27 -0.83 -0.68 1.72 0.87 -0.69 0.76 113.55 114.97 2jkv h SER 334 Ca 0.28 0.15 -0.07 0.00 -1.23 0.00 0.00 61.79 60.92 2jkv h SER 334 Cb 0.37 0.40 -0.03 0.00 -0.44 0.00 0.00 62.40 62.70 2jkv h SER 334 CO -0.34 -0.29 0.17 1.88 -0.53 0.00 0.00 176.83 177.72 2jkv h TYR 335 N -0.25 1.15 -0.68 2.24 -1.99 -1.10 -1.97 116.97 114.37 2jkv h TYR 335 Ca 0.15 -0.13 0.02 0.00 2.00 0.00 0.00 58.73 60.76 2jkv h TYR 335 Cb 0.48 -0.33 -0.04 0.00 2.00 0.00 0.00 36.73 38.84 2jkv h TYR 335 CO -0.43 0.94 0.44 0.00 -0.00 0.00 0.00 178.16 179.11 2jkv h ALA 336 N 1.13 0.87 -0.16 3.88 0.00 -0.25 -1.45 119.26 123.28 2jkv h ALA 336 Ca 0.22 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 2jkv h ALA 336 Cb 0.37 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2jkv h ALA 336 CO 0.00 0.24 0.05 1.96 0.00 0.00 0.00 179.25 181.51 2jkv h GLN 337 N 0.88 0.25 -0.75 0.00 4.20 -0.72 -1.79 115.11 117.17 2jkv h GLN 337 Ca 0.26 -0.05 0.16 0.00 0.06 0.00 0.00 58.65 59.08 2jkv h GLN 337 Cb -0.05 -0.04 -0.11 0.00 0.30 0.00 0.00 27.48 27.58 2jkv h GLN 337 CO -0.08 0.35 0.18 0.78 -0.67 0.00 0.00 178.83 179.40 2jkv h GLY 338 N 0.09 1.04 2.00 3.46 0.00 -0.95 -1.21 103.07 107.50 2jkv h GLY 338 Ca 0.05 -0.04 -0.10 0.00 0.00 0.00 0.00 47.33 47.25 2jkv h GLY 338 CO -0.00 -0.21 -0.47 0.74 0.00 0.00 0.00 176.54 176.60 2jkv h PHE 339 N 0.27 0.00 -0.76 5.60 -1.00 -1.03 -2.08 116.94 117.94 2jkv h PHE 339 Ca 0.42 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 61.18 2jkv h PHE 339 Cb 0.73 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 40.25 2jkv h PHE 339 CO -0.26 0.47 0.40 0.52 -1.61 0.00 0.00 178.31 177.82 2jkv h MET 340 N 0.00 1.06 -0.47 1.51 2.86 -0.36 -0.73 114.93 118.81 2jkv h MET 340 Ca -0.00 -0.13 -0.13 0.00 -2.06 0.00 0.00 59.70 57.38 2jkv h MET 340 Cb 1.17 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 32.61 2jkv h MET 340 CO 0.06 0.80 -0.21 1.25 1.06 0.00 0.00 176.91 179.87 2jkv h LEU 341 N 1.07 0.99 -0.21 1.22 5.85 -0.88 -1.43 115.31 121.91 2jkv h LEU 341 Ca 0.27 -0.40 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 2jkv h LEU 341 Cb 0.06 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.80 2jkv h LEU 341 CO -0.04 1.17 0.08 -0.07 -0.34 0.00 0.00 178.44 179.24 2jkv h LEU 342 N 0.81 0.30 -0.55 2.25 3.38 -1.06 -0.75 115.31 119.69 2jkv h LEU 342 Ca 0.11 -0.17 0.09 0.00 0.09 0.00 0.00 57.88 57.99 2jkv h LEU 342 Cb 0.78 -0.08 -0.07 0.00 0.09 0.00 0.00 40.66 41.38 2jkv h LEU 342 CO 0.06 0.39 0.14 -0.09 0.09 0.00 0.00 178.44 179.04 2jkv h ARG 343 N 0.18 0.28 -0.71 1.13 9.65 -1.10 -1.65 114.38 122.17 2jkv h ARG 343 Ca 0.07 -0.02 0.01 0.00 -1.10 0.00 0.00 59.98 58.94 2jkv h ARG 343 Cb 0.19 -0.06 -0.04 0.00 -1.39 0.00 0.00 29.97 28.67 2jkv h ARG 343 CO -0.00 0.19 0.46 0.37 2.80 0.00 0.00 179.97 183.78 2jkv h GLN 344 N 0.29 0.91 -0.63 0.20 5.75 -0.82 -2.41 115.11 118.41 2jkv h GLN 344 Ca 0.28 -0.05 0.01 0.00 -0.15 0.00 0.00 58.65 58.74 2jkv h GLN 344 Cb 0.37 -0.21 -0.03 0.00 1.07 0.00 0.00 27.48 28.68 2jkv h GLN 344 CO -0.33 0.60 0.41 0.00 -2.65 0.00 0.00 178.83 176.86 2jkv h ALA 345 N 1.27 0.81 -0.92 3.38 0.00 -0.57 0.16 119.26 123.39 2jkv h ALA 345 Ca 0.26 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.21 2jkv h ALA 345 Cb -0.08 -0.24 -0.07 0.00 0.00 0.00 0.00 17.79 17.40 2jkv h ALA 345 CO -0.07 0.21 0.57 0.00 0.00 0.00 0.00 179.25 179.96 2jkv h ALA 346 N 1.24 1.28 -0.00 0.00 0.00 -0.88 0.88 119.26 121.79 2jkv h ALA 346 Ca 0.24 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 2jkv h ALA 346 Cb -0.06 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.48 2jkv h ALA 346 CO -0.07 0.30 -0.00 1.15 0.00 0.00 0.00 179.25 180.63 2jkv h THR 347 N 1.02 1.37 -0.96 0.00 2.02 -0.94 0.13 112.91 115.55 2jkv h THR 347 Ca 0.41 -1.10 0.01 0.00 0.77 0.00 0.00 66.41 66.50 2jkv h THR 347 Cb 0.23 2.11 -0.05 0.00 -1.74 0.00 0.00 68.15 68.70 2jkv h THR 347 CO -0.19 0.29 0.64 -0.08 0.37 0.00 0.00 175.52 176.54 2jkv h GLU 348 N -0.45 1.25 -0.00 6.66 4.57 -0.13 -3.30 114.58 123.17 2jkv h GLU 348 Ca 0.00 -0.08 0.00 0.00 -1.18 0.00 0.00 59.36 58.11 2jkv h GLU 348 Cb 0.47 -0.28 0.00 0.00 -0.16 0.00 0.00 28.75 28.78 2jkv h GLU 348 CO 0.00 0.83 -0.15 1.19 -1.18 0.00 0.00 179.01 179.70 2jkv n PHE 349 N -4.39 0.00 -0.98 0.92 3.72 0.25 -4.99 117.46 111.99 2jkv n PHE 349 Ca 0.11 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.51 2jkv n PHE 349 Cb 0.02 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.56 2jkv n PHE 349 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2jkv n GLY 350 N 0.82 0.57 3.73 1.37 0.00 0.43 -5.00 105.19 107.11 2jkv n GLY 350 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 2jkv n GLY 350 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2jkv n TRP 351 N -2.61 2.80 -3.05 1.61 8.01 -1.17 -4.92 117.44 118.11 2jkv n TRP 351 Ca 0.00 0.18 -0.44 0.00 -1.31 0.00 0.00 57.50 55.93 2jkv n TRP 351 Cb 0.05 -2.62 0.00 0.00 -2.01 0.00 0.00 31.31 26.72 2jkv n TRP 351 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.69 176.93 2jkv n THR 352 N 2.82 4.38 -2.81 -0.99 -2.24 -1.26 -4.54 114.28 109.63 2jkv n THR 352 Ca 0.11 -4.94 -0.40 0.00 -2.27 0.00 0.00 64.05 56.55 2jkv n THR 352 Cb 0.36 -2.49 -0.05 0.00 -2.10 0.00 0.00 70.33 66.04 2jkv n THR 352 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2jkv s LEU 353 N 0.54 4.56 -0.60 3.22 1.43 -1.26 -4.89 118.68 121.67 2jkv s LEU 353 Ca 0.39 1.77 -0.16 0.00 -1.03 0.00 0.00 54.13 55.09 2jkv s LEU 353 Cb -0.04 -3.49 0.14 0.00 0.03 0.00 0.00 46.19 42.82 2jkv s LEU 353 CO -0.02 0.06 0.59 0.21 0.23 0.00 0.00 176.35 177.42 2jkv s ASN 354 N -0.57 6.28 0.11 2.29 2.47 -1.26 -4.95 114.94 119.30 2jkv s ASN 354 Ca 0.42 -1.86 -0.18 0.00 0.42 0.00 0.00 52.86 51.67 2jkv s ASN 354 Cb -0.24 -2.23 -0.05 0.00 -1.45 0.00 0.00 41.25 37.28 2jkv s ASN 354 CO 0.29 -0.87 1.62 1.88 -3.72 0.00 0.00 177.10 176.30 2jkv h TYR 355 N 8.79 0.50 -0.96 0.43 0.05 -1.95 0.11 116.97 123.94 2jkv h TYR 355 Ca -0.23 -0.05 0.02 0.00 0.05 0.00 0.00 58.73 58.52 2jkv h TYR 355 Cb 1.09 -0.14 -0.05 0.00 1.01 0.00 0.00 36.73 38.63 2jkv h TYR 355 CO 0.80 0.52 0.63 0.78 -1.05 0.00 0.00 178.16 179.84 2jkv h GLY 356 N 0.34 1.37 1.02 3.88 0.00 -1.86 -1.44 103.07 106.37 2jkv h GLY 356 Ca 0.10 -0.49 -0.05 0.00 0.00 0.00 0.00 47.33 46.89 2jkv h GLY 356 CO -0.00 0.45 0.21 -1.33 0.00 0.00 0.00 176.54 175.87 2jkv h GLY 357 N 1.26 1.09 0.99 4.60 0.00 -1.78 -1.33 103.07 107.89 2jkv h GLY 357 Ca 0.37 -0.64 -0.02 0.00 0.00 0.00 0.00 47.33 47.04 2jkv h GLY 357 CO -0.10 0.60 0.29 -2.22 0.00 0.00 0.00 176.54 175.11 2jkv h ILE 358 N 0.95 1.20 -0.85 2.60 2.04 -0.33 -1.44 117.51 121.67 2jkv h ILE 358 Ca 0.21 -0.53 0.05 0.00 1.00 0.00 0.00 64.86 65.60 2jkv h ILE 358 Cb 0.29 0.50 -0.06 0.00 -0.74 0.00 0.00 36.82 36.81 2jkv h ILE 358 CO -0.01 0.22 0.53 0.00 0.00 0.00 0.00 178.15 178.89 2jkv h ALA 359 N 1.13 1.15 -0.51 1.87 0.00 -0.95 -2.44 119.26 119.51 2jkv h ALA 359 Ca 0.20 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 2jkv h ALA 359 Cb 0.08 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2jkv h ALA 359 CO -0.03 0.30 0.05 -0.07 0.00 0.00 0.00 179.25 179.51 2jkv h LEU 360 N 0.99 0.77 -2.42 0.00 3.38 -0.75 -2.39 115.31 114.89 2jkv h LEU 360 Ca 0.36 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.17 2jkv h LEU 360 Cb 0.12 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.66 2jkv h LEU 360 CO -0.15 0.80 0.00 0.24 0.09 0.00 0.00 178.44 179.42 2jkv h MET 361 N 0.77 0.00 -0.16 1.13 2.86 -0.78 -2.68 114.93 116.08 2jkv h MET 361 Ca 0.16 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.80 2jkv h MET 361 Cb 0.39 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.05 2jkv h MET 361 CO 0.01 0.00 0.00 0.91 1.06 0.00 0.00 176.91 178.89 2jkv n TRP 362 N -2.88 0.19 0.35 -0.22 8.01 -0.90 -4.31 117.44 117.69 2jkv n TRP 362 Ca -0.02 -0.09 0.14 0.00 -1.31 0.00 0.00 57.50 56.21 2jkv n TRP 362 Cb 0.09 0.00 0.44 0.00 -2.01 0.00 0.00 31.31 29.83 2jkv n TRP 362 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2jkv h ARG 363 N 3.20 0.00 -3.93 -0.99 3.08 -1.58 -3.29 114.38 110.87 2jkv h ARG 363 Ca 0.00 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.93 2jkv h ARG 363 Cb 0.69 0.00 -0.16 0.00 0.08 0.00 0.00 29.97 30.58 2jkv h ARG 363 CO 0.00 0.00 -0.54 0.20 -1.07 0.00 0.00 179.97 178.56 2jkv s GLY 364 N -3.95 0.24 -1.64 0.04 0.00 -1.26 -4.86 107.32 95.90 2jkv s GLY 364 Ca 0.05 -0.74 -0.18 0.00 0.00 0.00 0.00 44.72 43.85 2jkv s GLY 364 CO 0.56 -0.88 0.74 0.61 0.00 0.00 0.00 173.10 174.14 2jkv n GLY 365 N 0.47 -0.45 2.95 0.20 0.00 -1.25 -3.85 105.19 103.25 2jkv n GLY 365 Ca -0.17 0.12 -0.13 0.00 0.00 0.00 0.00 46.02 45.85 2jkv n GLY 365 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jkv h ILE 367 N 5.35 1.00 -0.66 0.00 1.08 -1.90 -2.53 117.51 119.85 2jkv h ILE 367 Ca -0.31 -1.13 -0.32 0.00 -0.39 0.00 0.00 64.86 62.72 2jkv h ILE 367 Cb 1.18 1.65 -0.19 0.00 -3.07 0.00 0.00 36.82 36.39 2jkv h ILE 367 CO 0.44 0.30 0.27 2.30 -0.69 0.00 0.00 178.15 180.77 2jkv n ILE 368 N -3.86 2.86 -1.68 -0.67 -5.35 -1.26 -4.15 119.36 105.25 2jkv n ILE 368 Ca -0.01 -2.23 -0.46 0.00 -0.27 0.00 0.00 62.75 59.77 2jkv n ILE 368 Cb 0.38 -0.38 -0.04 0.00 -1.74 0.00 0.00 39.64 37.86 2jkv n ILE 368 CO 0.00 0.00 0.00 -1.14 -1.76 0.00 0.00 176.55 173.65 2jkv n ARG 369 N -0.99 2.35 -4.03 6.28 0.63 -0.95 -4.95 116.66 115.00 2jkv n ARG 369 Ca 0.45 0.85 -0.11 0.00 -0.92 0.00 0.00 57.85 58.12 2jkv n ARG 369 Cb 1.34 -2.70 -0.11 0.00 0.45 0.00 0.00 32.46 31.44 2jkv n ARG 369 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 2jkv s SER 370 N 2.88 0.57 0.60 6.15 0.15 -1.26 -1.95 113.70 120.84 2jkv s SER 370 Ca 0.86 -0.54 0.34 0.00 0.70 0.00 0.00 55.95 57.31 2jkv s SER 370 Cb -0.63 0.07 1.91 0.00 -1.71 0.00 0.00 66.02 65.66 2jkv s SER 370 CO 0.44 -0.26 2.24 1.62 1.20 0.00 0.00 173.24 178.47 2jkv h VAL 371 N 4.51 0.33 -0.39 4.45 3.04 -1.09 -2.80 116.25 124.31 2jkv h VAL 371 Ca -0.34 -0.16 0.00 0.00 -1.01 0.00 0.00 66.70 65.19 2jkv h VAL 371 Cb 1.20 1.11 0.00 0.00 -2.01 0.00 0.00 31.29 31.60 2jkv h VAL 371 CO 0.42 0.03 0.00 2.22 -1.01 0.00 0.00 177.57 179.23 2jkv n PHE 372 N -3.50 0.51 -0.01 3.17 1.16 -1.26 -4.19 117.46 113.33 2jkv n PHE 372 Ca -0.02 -0.25 0.10 0.00 -1.87 0.00 0.00 57.45 55.41 2jkv n PHE 372 Cb 0.13 0.00 0.52 0.00 -1.61 0.00 0.00 39.48 38.52 2jkv n PHE 372 CO 0.00 0.00 0.00 -0.07 -1.87 0.00 0.00 176.76 174.82 2jkv h LEU 373 N 3.59 0.30 -1.14 5.98 3.38 -1.84 0.12 115.31 125.70 2jkv h LEU 373 Ca 0.00 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 2jkv h LEU 373 Cb 0.80 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.47 2jkv h LEU 373 CO 0.00 0.19 -0.05 1.23 0.09 0.00 0.00 178.44 179.90 2jkv h GLY 374 N 0.34 0.58 1.31 0.83 0.00 -1.83 -2.15 103.07 102.15 2jkv h GLY 374 Ca 0.21 -0.37 -0.08 0.00 0.00 0.00 0.00 47.33 47.08 2jkv h GLY 374 CO -0.05 0.34 -0.03 0.50 0.00 0.00 0.00 176.54 177.31 2jkv h LYS 375 N 0.51 0.84 -0.34 4.80 1.79 -1.05 -1.04 116.57 122.08 2jkv h LYS 375 Ca 0.10 -0.24 -0.02 0.00 -2.18 0.00 0.00 60.65 58.31 2jkv h LYS 375 Cb 0.41 -0.09 -0.02 0.00 -1.58 0.00 0.00 32.23 30.96 2jkv h LYS 375 CO 0.02 0.86 0.14 0.82 -1.08 0.00 0.00 179.45 180.21 2jkv h ILE 376 N 0.77 1.18 -0.42 1.86 2.04 -0.93 -0.55 117.51 121.47 2jkv h ILE 376 Ca 0.14 -0.54 0.05 0.00 1.00 0.00 0.00 64.86 65.51 2jkv h ILE 376 Cb 0.50 0.91 -0.04 0.00 -0.74 0.00 0.00 36.82 37.45 2jkv h ILE 376 CO 0.03 0.19 0.16 0.50 0.00 0.00 0.00 178.15 179.03 2jkv h LYS 377 N 0.40 0.33 -0.68 2.37 1.63 -1.19 -1.97 116.57 117.47 2jkv h LYS 377 Ca 0.11 -0.02 0.03 0.00 -0.85 0.00 0.00 60.65 59.92 2jkv h LYS 377 Cb 0.17 -0.07 -0.04 0.00 -0.60 0.00 0.00 32.23 31.68 2jkv h LYS 377 CO -0.01 0.22 0.42 -0.44 -3.45 0.00 0.00 179.45 176.19 2jkv h ASP 378 N 0.34 0.69 -0.23 4.20 3.32 -0.86 -0.07 116.42 123.81 2jkv h ASP 378 Ca 0.19 0.00 0.03 0.00 0.02 0.00 0.00 57.03 57.27 2jkv h ASP 378 Cb 0.16 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.53 2jkv h ASP 378 CO -0.18 0.48 0.05 0.00 -1.72 0.00 0.00 179.24 177.86 2jkv h ALA 379 N 1.29 0.23 0.00 3.45 0.00 -0.68 -0.11 119.26 123.45 2jkv h ALA 379 Ca 0.27 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.17 2jkv h ALA 379 Cb 0.02 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2jkv h ALA 379 CO -0.11 -0.38 -0.27 0.74 0.00 0.00 0.00 179.25 179.24 2jkv h PHE 380 N 0.14 0.00 -0.06 0.00 0.04 -1.09 -1.98 116.94 113.99 2jkv h PHE 380 Ca 0.10 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.87 2jkv h PHE 380 Cb 0.10 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.25 2jkv h PHE 380 CO -0.15 0.27 0.01 -0.44 -0.60 0.00 0.00 178.31 177.40 2jkv h ASP 381 N 0.00 0.09 0.18 2.17 3.32 -0.39 -1.62 116.42 120.17 2jkv h ASP 381 Ca -0.00 -0.25 -0.03 0.00 0.02 0.00 0.00 57.03 56.77 2jkv h ASP 381 Cb 0.82 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 40.34 2jkv h ASP 381 CO 0.04 0.31 -0.15 0.03 -1.72 0.00 0.00 179.24 177.75 2jkv h ARG 382 N -0.14 0.00 -1.15 3.56 3.08 -0.82 -3.39 114.38 115.52 2jkv h ARG 382 Ca 0.02 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 59.93 2jkv h ARG 382 Cb 0.26 0.00 -0.20 0.00 0.08 0.00 0.00 29.97 30.11 2jkv h ARG 382 CO 0.00 0.15 -0.51 1.21 -1.07 0.00 0.00 179.97 179.75 2jkv s ASN 383 N -6.84 -1.12 0.65 7.04 2.47 -0.76 -5.00 114.94 111.37 2jkv s ASN 383 Ca -0.04 -1.23 0.43 0.00 0.42 0.00 0.00 52.86 52.44 2jkv s ASN 383 Cb 0.15 1.71 2.34 0.00 -1.45 0.00 0.00 41.25 44.01 2jkv s ASN 383 CO 0.67 -0.14 2.33 -0.65 -3.72 0.00 0.00 177.10 175.59 2jkv h PRO 384 N 6.37 0.00 -0.15 0.43 0.11 -1.51 0.19 132.00 137.44 2jkv h PRO 384 Ca 0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.17 2jkv h PRO 384 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2jkv h PRO 384 CO 0.09 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.27 2jkv n GLU 385 N -3.04 2.22 -1.51 1.05 -0.58 -1.26 -4.97 120.64 112.56 2jkv n GLU 385 Ca -0.03 -1.80 -0.59 0.00 -0.42 0.00 0.00 57.16 54.32 2jkv n GLU 385 Cb 0.08 -1.47 -0.09 0.00 -0.57 0.00 0.00 31.44 29.39 2jkv n GLU 385 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 2jkv n LEU 386 N 1.11 1.01 0.13 -4.62 7.94 0.65 -4.82 117.00 118.41 2jkv n LEU 386 Ca 0.17 1.03 0.08 0.00 -1.11 0.00 0.00 56.01 56.17 2jkv n LEU 386 Cb 0.54 -0.76 0.04 0.00 0.53 0.00 0.00 43.42 43.77 2jkv n LEU 386 CO 0.15 -0.75 0.29 1.56 -1.11 0.00 0.00 177.39 177.53 2jkv h GLN 387 N 4.27 0.00 -1.97 1.96 4.20 -1.93 -3.46 115.11 118.18 2jkv h GLN 387 Ca -0.38 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.29 2jkv h GLN 387 Cb 1.19 0.00 -0.21 0.00 0.30 0.00 0.00 27.48 28.75 2jkv h GLN 387 CO 0.84 0.15 0.16 1.21 -0.67 0.00 0.00 178.83 180.52 2jkv s ASN 388 N -5.90 -0.72 0.46 1.46 2.47 -1.26 -4.88 114.94 106.56 2jkv s ASN 388 Ca 0.02 1.36 0.12 0.00 0.42 0.00 0.00 52.86 54.78 2jkv s ASN 388 Cb 0.08 1.37 1.05 0.00 -1.45 0.00 0.00 41.25 42.29 2jkv s ASN 388 CO 0.75 -0.26 2.07 -0.07 -3.72 0.00 0.00 177.10 175.86 2jkv h LEU 389 N 4.81 0.28 -2.12 3.21 3.38 -1.90 -1.27 115.31 121.70 2jkv h LEU 389 Ca -0.29 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.68 2jkv h LEU 389 Cb 1.16 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.85 2jkv h LEU 389 CO 0.08 0.19 0.00 -0.07 0.09 0.00 0.00 178.44 178.73 2jkv h LEU 390 N 0.32 0.00 -0.25 1.67 3.38 -1.95 -1.31 115.31 117.18 2jkv h LEU 390 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2jkv h LEU 390 Cb 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2jkv h LEU 390 CO -0.03 0.00 0.00 -0.07 0.09 0.00 0.00 178.44 178.43 2jkv h LEU 391 N 0.00 0.00 -9.85 1.67 3.38 -1.62 -3.26 115.31 105.63 2jkv h LEU 391 Ca 0.00 0.00 -0.50 0.00 0.09 0.00 0.00 57.88 57.47 2jkv h LEU 391 Cb 0.26 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.03 2jkv h LEU 391 CO 0.00 0.00 0.44 -0.62 0.09 0.00 0.00 178.44 178.35 2jkv s ASP 392 N -5.86 7.15 0.17 -0.43 2.15 -0.49 -4.86 116.67 114.49 2jkv s ASP 392 Ca 0.06 2.17 -0.14 0.00 0.43 0.00 0.00 52.55 55.08 2jkv s ASP 392 Cb 0.07 -2.61 0.13 0.00 -0.30 0.00 0.00 42.92 40.20 2jkv s ASP 392 CO 0.63 -0.22 1.74 0.44 -0.17 0.00 0.00 175.17 177.59 2jkv h ASP 393 N 3.44 0.10 -0.52 -0.34 5.19 -1.86 0.16 116.42 122.60 2jkv h ASP 393 Ca -0.47 0.06 0.09 0.00 -0.62 0.00 0.00 57.03 56.09 2jkv h ASP 393 Cb 1.21 0.06 -0.08 0.00 0.18 0.00 0.00 39.33 40.71 2jkv h ASP 393 CO 0.66 0.09 0.08 0.15 -3.12 0.00 0.00 179.24 177.10 2jkv h PHE 394 N 0.28 0.13 0.13 4.55 3.57 -1.92 0.04 116.94 123.72 2jkv h PHE 394 Ca 0.21 0.03 -0.28 0.00 3.53 0.00 0.00 57.97 61.47 2jkv h PHE 394 Cb 0.23 0.02 0.01 0.00 2.79 0.00 0.00 35.95 39.00 2jkv h PHE 394 CO -0.17 -0.03 -1.23 0.74 -2.23 0.00 0.00 178.31 175.38 2jkv h PHE 395 N 0.21 0.57 -0.26 0.41 0.04 -1.68 -2.24 116.94 113.99 2jkv h PHE 395 Ca 0.26 -0.40 0.03 0.00 2.80 0.00 0.00 57.97 60.67 2jkv h PHE 395 Cb 0.37 -0.03 -0.03 0.00 2.20 0.00 0.00 35.95 38.47 2jkv h PHE 395 CO -0.25 1.30 0.08 -0.22 -0.60 0.00 0.00 178.31 178.61 2jkv h LYS 396 N 0.10 0.18 -0.31 1.51 3.64 -0.50 -1.99 116.57 119.19 2jkv h LYS 396 Ca -0.14 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.20 2jkv h LYS 396 Cb 1.95 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 33.71 2jkv h LYS 396 CO 0.21 0.12 0.08 0.77 -2.27 0.00 0.00 179.45 178.36 2jkv h SER 397 N 0.19 0.47 -0.28 4.20 0.02 -1.02 -0.91 113.55 116.23 2jkv h SER 397 Ca 0.12 -0.23 0.04 0.00 -0.84 0.00 0.00 61.79 60.87 2jkv h SER 397 Cb 0.10 -0.12 -0.04 0.00 0.14 0.00 0.00 62.40 62.47 2jkv h SER 397 CO -0.13 0.58 0.06 0.00 -1.14 0.00 0.00 176.83 176.20 2jkv h ALA 398 N 0.91 0.29 -0.48 3.77 0.00 -1.30 -0.23 119.26 122.23 2jkv h ALA 398 Ca 0.10 0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.95 2jkv h ALA 398 Cb 0.29 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2jkv h ALA 398 CO 0.00 -0.35 -0.15 0.28 0.00 0.00 0.00 179.25 179.03 2jkv h VAL 399 N 0.16 1.27 -0.82 0.00 2.07 -1.25 -1.72 116.25 115.96 2jkv h VAL 399 Ca 0.13 -1.28 0.03 0.00 0.82 0.00 0.00 66.70 66.39 2jkv h VAL 399 Cb 0.13 1.06 -0.05 0.00 -1.52 0.00 0.00 31.29 30.91 2jkv h VAL 399 CO -0.17 0.44 0.53 -0.08 0.02 0.00 0.00 177.57 178.32 2jkv h GLU 400 N 0.81 1.01 0.00 1.57 4.57 -0.70 -1.20 114.58 120.64 2jkv h GLU 400 Ca 0.12 -0.06 -0.02 0.00 -1.18 0.00 0.00 59.36 58.22 2jkv h GLU 400 Cb 0.69 -0.23 -0.00 0.00 -0.16 0.00 0.00 28.75 29.05 2jkv h GLU 400 CO 0.05 0.67 -0.11 -0.91 -1.18 0.00 0.00 179.01 177.53 2jkv h ASN 401 N 1.04 0.00 0.66 1.04 2.35 -0.57 -3.10 115.58 116.99 2jkv h ASN 401 Ca 0.33 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.08 2jkv h ASN 401 Cb -0.01 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.36 2jkv h ASN 401 CO -0.11 0.11 -0.86 0.00 -1.65 0.00 0.00 177.43 174.92 2jkv h GLN 403 N 0.00 -0.23 -0.25 0.00 4.15 -1.16 0.19 115.11 117.81 2jkv h GLN 403 Ca 0.00 0.02 0.05 0.00 0.77 0.00 0.00 58.65 59.49 2jkv h GLN 403 Cb 0.76 0.05 -0.05 0.00 0.21 0.00 0.00 27.48 28.45 2jkv h GLN 403 CO 0.00 -0.16 -0.06 -0.44 -1.93 0.00 0.00 178.83 176.24 2jkv h ASP 404 N -0.24 -0.23 -0.55 -0.69 5.19 -1.82 -0.83 116.42 117.25 2jkv h ASP 404 Ca 0.14 0.08 -0.09 0.00 -0.62 0.00 0.00 57.03 56.54 2jkv h ASP 404 Cb 0.46 0.16 -0.02 0.00 0.18 0.00 0.00 39.33 40.11 2jkv h ASP 404 CO -0.40 -0.08 0.01 0.28 -3.12 0.00 0.00 179.24 175.93 2jkv h SER 405 N 0.00 0.96 0.05 6.45 0.02 -1.60 -1.56 113.55 117.87 2jkv h SER 405 Ca 0.12 -0.26 0.03 0.00 -0.84 0.00 0.00 61.79 60.84 2jkv h SER 405 Cb 0.18 -0.26 -0.04 0.00 0.14 0.00 0.00 62.40 62.43 2jkv h SER 405 CO -0.26 1.01 -0.27 -0.25 -1.14 0.00 0.00 176.83 175.92 2jkv h TRP 406 N 0.91 -0.72 -0.20 3.45 7.01 -0.17 0.13 115.95 126.36 2jkv h TRP 406 Ca 0.17 0.02 -0.08 0.00 2.11 0.00 0.00 58.89 61.11 2jkv h TRP 406 Cb 0.51 0.31 -0.01 0.00 -2.10 0.00 0.00 29.16 27.87 2jkv h TRP 406 CO 0.03 -0.36 -0.21 0.00 -2.79 0.00 0.00 178.44 175.11 2jkv h ARG 407 N -0.44 0.35 -0.29 2.65 3.08 -0.99 -1.91 114.38 116.83 2jkv h ARG 407 Ca 0.05 -0.11 -0.03 0.00 0.07 0.00 0.00 59.98 59.96 2jkv h ARG 407 Cb 0.50 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.51 2jkv h ARG 407 CO -0.20 0.55 0.07 -0.09 -1.07 0.00 0.00 179.97 179.23 2jkv h ARG 408 N 0.32 0.46 -0.06 0.04 2.43 -0.82 -0.70 114.38 116.05 2jkv h ARG 408 Ca 0.05 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2jkv h ARG 408 Cb 0.56 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 30.04 2jkv h ARG 408 CO 0.04 0.55 0.04 0.00 -1.51 0.00 0.00 179.97 179.09 2jkv h ALA 409 N 0.89 0.07 -0.30 2.80 0.00 -0.44 -1.23 119.26 121.06 2jkv h ALA 409 Ca 0.09 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 2jkv h ALA 409 Cb 0.30 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2jkv h ALA 409 CO 0.00 -0.43 0.04 0.28 0.00 0.00 0.00 179.25 179.15 2jkv h VAL 410 N 0.07 1.24 -0.89 0.00 2.07 -1.33 0.07 116.25 117.48 2jkv h VAL 410 Ca 0.02 -0.83 -0.02 0.00 0.82 0.00 0.00 66.70 66.70 2jkv h VAL 410 Cb 0.00 1.19 -0.04 0.00 -1.52 0.00 0.00 31.29 30.92 2jkv h VAL 410 CO -0.00 0.27 0.48 -1.28 0.02 0.00 0.00 177.57 177.05 2jkv h SER 411 N 0.32 1.12 -0.26 0.57 0.87 -1.03 0.12 113.55 115.25 2jkv h SER 411 Ca 0.09 -0.11 -0.06 0.00 -1.23 0.00 0.00 61.79 60.49 2jkv h SER 411 Cb 0.36 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 62.02 2jkv h SER 411 CO 0.01 0.90 -0.05 0.74 -0.53 0.00 0.00 176.83 177.89 2jkv h THR 412 N 1.24 1.28 -0.71 2.23 2.02 -1.10 -2.15 112.91 115.71 2jkv h THR 412 Ca 0.31 -1.05 0.07 0.00 0.77 0.00 0.00 66.41 66.50 2jkv h THR 412 Cb 0.04 1.43 -0.06 0.00 -1.74 0.00 0.00 68.15 67.82 2jkv h THR 412 CO -0.05 0.33 0.40 1.23 0.37 0.00 0.00 175.52 177.80 2jkv h GLY 413 N 0.26 1.06 0.99 2.16 0.00 -0.36 0.50 103.07 107.69 2jkv h GLY 413 Ca 0.07 -0.28 -0.00 0.00 0.00 0.00 0.00 47.33 47.12 2jkv h GLY 413 CO 0.02 0.16 0.30 -2.08 0.00 0.00 0.00 176.54 174.94 2jkv h VAL 414 N 0.72 1.15 -0.14 4.60 2.07 -0.64 -0.85 116.25 123.15 2jkv h VAL 414 Ca 0.33 -0.32 -0.11 0.00 0.82 0.00 0.00 66.70 67.42 2jkv h VAL 414 Cb 0.23 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.45 2jkv h VAL 414 CO -0.20 0.15 -0.38 1.56 0.02 0.00 0.00 177.57 178.72 2jkv h GLN 415 N 0.66 0.31 0.00 1.57 4.20 -0.67 -2.61 115.11 118.57 2jkv h GLN 415 Ca 0.18 -0.14 0.00 0.00 0.06 0.00 0.00 58.65 58.75 2jkv h GLN 415 Cb -0.02 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.75 2jkv h GLN 415 CO -0.03 0.65 0.00 0.00 -0.67 0.00 0.00 178.83 178.77 2jkv n ALA 416 N -2.48 2.22 -0.97 3.87 0.00 0.09 -4.78 120.51 118.46 2jkv n ALA 416 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.41 2jkv n ALA 416 Cb 0.47 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.45 2jkv n ALA 416 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jkv n GLY 417 N 1.18 0.64 3.66 0.00 0.00 -0.45 -4.74 105.19 105.49 2jkv n GLY 417 Ca 0.05 -0.75 -0.40 0.00 0.00 0.00 0.00 46.02 44.93 2jkv n GLY 417 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jkv s ILE 418 N -2.00 5.03 -0.02 -0.61 -1.09 -0.46 -4.98 121.20 117.07 2jkv s ILE 418 Ca 0.00 1.17 -0.30 0.00 -2.23 0.00 0.00 60.65 59.30 2jkv s ILE 418 Cb 0.00 -3.94 -0.08 0.00 -1.58 0.00 0.00 42.46 36.87 2jkv s ILE 418 CO 0.00 0.12 1.95 -2.84 -1.23 0.00 0.00 174.94 172.94 2jkv s PRO 419 N 1.82 4.00 -0.47 2.79 0.02 -1.26 -4.56 135.00 137.34 2jkv s PRO 419 Ca 0.29 2.44 0.09 0.00 0.02 0.00 0.00 61.00 63.84 2jkv s PRO 419 Cb -0.16 -4.16 0.35 0.00 0.02 0.00 0.00 34.50 30.55 2jkv s PRO 419 CO 0.11 -1.10 0.85 -1.33 -0.33 0.00 0.00 177.00 175.19 2jkv n MET 420 N 7.65 2.13 -0.35 5.54 2.81 -1.26 -4.90 117.12 128.75 2jkv n MET 420 Ca 0.21 -4.12 0.04 0.00 -1.81 0.00 0.00 57.70 52.02 2jkv n MET 420 Cb 0.42 -1.97 0.20 0.00 -0.71 0.00 0.00 33.22 31.16 2jkv n MET 420 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 2jkv h PRO 421 N 2.98 0.99 0.21 0.03 0.13 -1.95 -1.53 132.00 132.86 2jkv h PRO 421 Ca 0.11 -0.06 -0.29 0.00 -0.87 0.00 0.00 66.00 64.89 2jkv h PRO 421 Cb 0.75 -0.22 0.03 0.00 0.13 0.00 0.00 31.00 31.69 2jkv h PRO 421 CO 0.66 0.66 -1.31 0.00 -0.23 0.00 0.00 178.00 177.78 2jkv h PHE 423 N -0.03 0.44 -0.12 0.00 0.04 -1.91 -1.20 116.94 114.16 2jkv h PHE 423 Ca -0.23 0.02 -0.20 0.00 2.80 0.00 0.00 57.97 60.35 2jkv h PHE 423 Cb 2.00 -0.12 0.00 0.00 2.20 0.00 0.00 35.95 40.03 2jkv h PHE 423 CO 0.15 0.21 -0.75 1.79 -0.60 0.00 0.00 178.31 179.11 2jkv h THR 424 N 0.47 1.33 -0.29 -1.55 1.35 -1.37 -1.81 112.91 111.04 2jkv h THR 424 Ca 0.22 -2.05 -0.11 0.00 -0.55 0.00 0.00 66.41 63.92 2jkv h THR 424 Cb 0.14 2.04 -0.01 0.00 -1.73 0.00 0.00 68.15 68.58 2jkv h THR 424 CO -0.16 0.63 -0.28 0.00 -0.25 0.00 0.00 175.52 175.46 2jkv h THR 425 N 0.41 1.28 -0.33 6.82 1.03 -1.28 0.64 112.91 121.47 2jkv h THR 425 Ca -0.04 -1.37 -0.02 0.00 -0.01 0.00 0.00 66.41 64.97 2jkv h THR 425 Cb 1.35 1.36 -0.01 0.00 -1.07 0.00 0.00 68.15 69.78 2jkv h THR 425 CO 0.14 0.44 0.12 0.00 -0.01 0.00 0.00 175.52 176.21 2jkv h ALA 426 N 1.19 0.44 -0.28 0.00 0.00 -1.05 -0.01 119.26 119.54 2jkv h ALA 426 Ca 0.07 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 2jkv h ALA 426 Cb 0.75 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 2jkv h ALA 426 CO 0.06 0.06 -0.25 1.25 0.00 0.00 0.00 179.25 180.37 2jkv h LEU 427 N 0.39 0.72 -0.65 0.00 5.85 -1.18 -1.31 115.31 119.13 2jkv h LEU 427 Ca 0.11 -0.46 0.10 0.00 0.84 0.00 0.00 57.88 58.47 2jkv h LEU 427 Cb 0.22 -0.20 -0.07 0.00 0.37 0.00 0.00 40.66 40.98 2jkv h LEU 427 CO -0.01 1.03 0.27 0.28 -0.34 0.00 0.00 178.44 179.67 2jkv h SER 428 N 0.41 0.30 -0.33 1.25 0.02 -0.76 -0.11 113.55 114.33 2jkv h SER 428 Ca 0.05 0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 61.05 2jkv h SER 428 Cb 0.81 0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.38 2jkv h SER 428 CO 0.06 0.17 0.11 0.15 -1.14 0.00 0.00 176.83 176.18 2jkv h PHE 429 N 0.47 0.52 -0.34 3.45 3.57 -0.84 0.14 116.94 123.90 2jkv h PHE 429 Ca 0.33 -0.05 0.05 0.00 3.53 0.00 0.00 57.97 61.83 2jkv h PHE 429 Cb 0.39 -0.15 -0.05 0.00 2.79 0.00 0.00 35.95 38.94 2jkv h PHE 429 CO -0.15 0.51 0.06 -0.92 -2.23 0.00 0.00 178.31 175.59 2jkv h TYR 430 N 0.37 0.10 -0.18 0.41 3.20 -0.69 0.48 116.97 120.66 2jkv h TYR 430 Ca 0.11 0.02 -0.09 0.00 3.14 0.00 0.00 58.73 61.91 2jkv h TYR 430 Cb 0.23 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.50 2jkv h TYR 430 CO 0.00 0.01 -0.27 -0.44 -1.64 0.00 0.00 178.16 175.83 2jkv h ASP 431 N 0.18 0.34 -0.10 -2.11 3.32 -0.82 -2.33 116.42 114.90 2jkv h ASP 431 Ca 0.16 -0.11 -0.05 0.00 0.02 0.00 0.00 57.03 57.05 2jkv h ASP 431 Cb 0.19 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 39.64 2jkv h ASP 431 CO -0.22 0.61 -0.12 1.23 -1.72 0.00 0.00 179.24 179.02 2jkv h GLY 432 N 1.02 0.29 2.00 2.75 0.00 -0.38 -3.22 103.07 105.53 2jkv h GLY 432 Ca 0.05 -0.31 -0.08 0.00 0.00 0.00 0.00 47.33 46.99 2jkv h GLY 432 CO 0.05 0.28 -0.37 -1.82 0.00 0.00 0.00 176.54 174.67 2jkv h TYR 433 N -0.15 0.00 -0.00 5.60 3.20 -0.77 -2.57 116.97 122.28 2jkv h TYR 433 Ca 0.01 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.88 2jkv h TYR 433 Cb 0.66 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.93 2jkv h TYR 433 CO 0.09 0.37 -0.24 2.89 -1.64 0.00 0.00 178.16 179.64 2jkv n ARG 434 N -4.00 0.21 -3.01 1.82 1.85 -0.89 -4.82 116.66 107.82 2jkv n ARG 434 Ca -0.02 -0.09 -0.41 0.00 -1.00 0.00 0.00 57.85 56.34 2jkv n ARG 434 Cb 0.42 -1.50 -0.05 0.00 -1.05 0.00 0.00 32.46 30.28 2jkv n ARG 434 CO 0.00 0.00 0.00 -1.01 -0.01 0.00 0.00 177.63 176.61 2jkv s HIS 435 N -2.84 3.35 0.18 2.89 3.76 -0.97 -4.95 115.29 116.70 2jkv s HIS 435 Ca 0.17 1.03 -0.08 0.00 -0.15 0.00 0.00 55.06 56.03 2jkv s HIS 435 Cb 0.19 -2.92 0.08 0.00 1.11 0.00 0.00 32.58 31.04 2jkv s HIS 435 CO 0.58 -0.28 1.58 1.49 -0.85 0.00 0.00 174.74 177.27 2jkv h GLU 436 N 7.59 0.91 -5.31 1.40 4.81 -1.88 -3.42 114.58 118.69 2jkv h GLU 436 Ca -0.28 -0.38 -0.65 0.00 -0.13 0.00 0.00 59.36 57.92 2jkv h GLU 436 Cb 1.12 -0.04 -0.25 0.00 0.63 0.00 0.00 28.75 30.22 2jkv h GLU 436 CO 0.81 1.04 -0.73 -1.64 -0.73 0.00 0.00 179.01 177.76 2jkv s MET 437 N -4.65 3.48 0.23 1.92 -1.94 -1.26 -5.12 119.30 111.97 2jkv s MET 437 Ca -0.10 -0.63 0.11 0.00 -1.71 0.00 0.00 55.69 53.35 2jkv s MET 437 Cb 0.13 -2.73 -0.05 0.00 2.01 0.00 0.00 34.83 34.19 2jkv s MET 437 CO 0.86 0.23 -0.19 -0.51 -0.01 0.00 0.00 175.02 175.39 2jkv s LEU 438 N 0.35 2.53 0.00 -0.03 1.43 -1.26 -5.03 118.68 116.67 2jkv s LEU 438 Ca -0.09 -0.97 0.06 0.00 -1.03 0.00 0.00 54.13 52.11 2jkv s LEU 438 Cb -0.15 -0.99 0.38 0.00 0.03 0.00 0.00 46.19 45.46 2jkv s LEU 438 CO 0.05 0.00 0.82 -2.65 0.23 0.00 0.00 176.35 174.80 2jkv n PRO 439 N -0.26 0.45 0.28 1.29 -0.02 -1.26 -3.66 135.00 131.81 2jkv n PRO 439 Ca -0.08 0.00 0.16 0.00 -2.02 0.00 0.00 63.50 61.56 2jkv n PRO 439 Cb 0.59 -1.22 0.92 0.00 -0.02 0.00 0.00 33.50 33.76 2jkv n PRO 439 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2jkv h ALA 440 N 2.34 1.56 -0.86 3.55 0.00 -2.00 0.38 119.26 124.22 2jkv h ALA 440 Ca 0.00 -0.00 0.10 0.00 0.00 0.00 0.00 54.91 55.01 2jkv h ALA 440 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.73 2jkv h ALA 440 CO 0.00 -0.09 0.56 0.66 0.00 0.00 0.00 179.25 180.38 2jkv h SER 441 N 0.00 0.75 -0.39 0.00 4.64 -2.00 -0.39 113.55 116.16 2jkv h SER 441 Ca 0.02 0.02 -0.08 0.00 -0.47 0.00 0.00 61.79 61.28 2jkv h SER 441 Cb 0.15 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 62.08 2jkv h SER 441 CO -0.00 0.44 -0.03 0.25 -0.87 0.00 0.00 176.83 176.62 2jkv h LEU 442 N 0.83 0.77 -0.63 5.97 5.85 -1.23 -0.48 115.31 126.39 2jkv h LEU 442 Ca 0.40 -0.20 -0.03 0.00 0.84 0.00 0.00 57.88 58.89 2jkv h LEU 442 Cb 0.43 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.23 2jkv h LEU 442 CO -0.17 0.86 0.29 0.40 -0.34 0.00 0.00 178.44 179.49 2jkv h ILE 443 N 0.74 1.22 -0.84 4.05 2.04 -1.16 -0.36 117.51 123.20 2jkv h ILE 443 Ca 0.14 -0.65 -0.01 0.00 1.00 0.00 0.00 64.86 65.34 2jkv h ILE 443 Cb 0.50 0.48 -0.04 0.00 -0.74 0.00 0.00 36.82 37.01 2jkv h ILE 443 CO 0.03 0.26 0.48 1.56 0.00 0.00 0.00 178.15 180.48 2jkv h GLN 444 N 0.88 1.15 -0.46 2.37 1.08 -0.75 -0.87 115.11 118.51 2jkv h GLN 444 Ca 0.22 -0.12 -0.04 0.00 -1.45 0.00 0.00 58.65 57.25 2jkv h GLN 444 Cb 0.14 -0.23 -0.02 0.00 -0.05 0.00 0.00 27.48 27.32 2jkv h GLN 444 CO -0.02 0.83 0.12 0.00 -0.95 0.00 0.00 178.83 178.80 2jkv h ALA 445 N 1.26 0.61 -0.25 3.87 0.00 -0.58 -1.90 119.26 122.26 2jkv h ALA 445 Ca 0.30 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2jkv h ALA 445 Cb -0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2jkv h ALA 445 CO -0.05 0.29 0.09 1.96 0.00 0.00 0.00 179.25 181.54 2jkv h GLN 446 N 0.61 0.39 -0.62 0.00 4.20 -0.81 -0.08 115.11 118.81 2jkv h GLN 446 Ca 0.14 -0.08 0.05 0.00 0.06 0.00 0.00 58.65 58.82 2jkv h GLN 446 Cb 0.32 -0.06 -0.05 0.00 0.30 0.00 0.00 27.48 27.99 2jkv h GLN 446 CO 0.00 0.44 0.35 0.00 -0.67 0.00 0.00 178.83 178.95 2jkv h ARG 447 N 0.25 0.64 -0.17 1.46 3.08 -1.08 -0.55 114.38 118.01 2jkv h ARG 447 Ca 0.08 -0.04 -0.11 0.00 0.07 0.00 0.00 59.98 59.99 2jkv h ARG 447 Cb 0.21 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 2jkv h ARG 447 CO -0.00 0.43 -0.37 0.22 -1.07 0.00 0.00 179.97 179.17 2jkv h ASP 448 N 0.66 0.37 -0.02 7.04 3.58 -1.12 0.38 116.42 127.32 2jkv h ASP 448 Ca 0.27 -0.15 -0.01 0.00 0.42 0.00 0.00 57.03 57.56 2jkv h ASP 448 Cb 0.12 -0.10 -0.00 0.00 1.72 0.00 0.00 39.33 41.07 2jkv h ASP 448 CO -0.15 0.72 -0.01 0.22 -2.88 0.00 0.00 179.24 177.14 2jkv h TYR 449 N 0.31 0.05 0.00 0.28 3.20 -0.08 -1.82 116.97 118.90 2jkv h TYR 449 Ca 0.03 -0.01 -0.26 0.00 3.14 0.00 0.00 58.73 61.63 2jkv h TYR 449 Cb 0.80 -0.01 -0.05 0.00 1.54 0.00 0.00 36.73 39.01 2jkv h TYR 449 CO 0.02 0.43 -1.72 1.97 -1.64 0.00 0.00 178.16 177.21 2jkv n PHE 450 N -4.87 0.85 -0.06 -3.82 1.16 -0.30 -4.53 117.46 105.89 2jkv n PHE 450 Ca -0.08 0.30 0.00 0.00 -1.87 0.00 0.00 57.45 55.80 2jkv n PHE 450 Cb 0.22 -1.12 0.00 0.00 -1.61 0.00 0.00 39.48 36.96 2jkv n PHE 450 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2jkv n GLY 451 N 1.53 -0.68 3.73 4.97 0.00 0.09 -5.01 105.19 109.82 2jkv n GLY 451 Ca -0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.58 2jkv n GLY 451 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jkv n ALA 452 N -0.08 -1.27 0.85 4.61 0.00 -0.68 -4.33 120.51 119.61 2jkv n ALA 452 Ca 0.00 0.29 0.13 0.00 0.00 0.00 0.00 53.44 53.85 2jkv n ALA 452 Cb 0.06 -4.85 0.54 0.00 0.00 0.00 0.00 19.45 15.20 2jkv n ALA 452 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2jkv n HIS 453 N -4.79 0.15 -0.52 0.00 8.25 -1.19 -1.38 115.22 115.73 2jkv n HIS 453 Ca 0.02 0.04 0.06 0.00 -0.26 0.00 0.00 57.72 57.59 2jkv n HIS 453 Cb 0.54 -0.57 -0.03 0.00 1.12 0.00 0.00 29.99 31.05 2jkv n HIS 453 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2jkv n THR 454 N -1.62 -0.36 -4.03 1.59 -2.24 -1.26 -4.45 114.28 101.90 2jkv n THR 454 Ca 0.06 0.35 -0.11 0.00 -2.27 0.00 0.00 64.05 62.08 2jkv n THR 454 Cb 0.32 -0.53 -0.05 0.00 -2.10 0.00 0.00 70.33 67.97 2jkv n THR 454 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 2jkv s TYR 455 N -3.50 0.62 0.22 4.78 -0.85 -0.05 -4.74 117.35 113.83 2jkv s TYR 455 Ca 0.00 -0.94 0.10 0.00 -0.52 0.00 0.00 57.07 55.71 2jkv s TYR 455 Cb 0.00 0.08 -0.04 0.00 0.38 0.00 0.00 41.96 42.38 2jkv s TYR 455 CO 0.00 -1.03 -0.13 -1.21 -1.52 0.00 0.00 175.55 171.66 2jkv s GLU 456 N -3.68 1.91 0.15 -3.49 2.02 -1.26 -0.07 118.70 114.29 2jkv s GLU 456 Ca 0.26 -1.47 -0.16 0.00 0.02 0.00 0.00 54.97 53.62 2jkv s GLU 456 Cb -0.00 -2.00 -0.07 0.00 0.10 0.00 0.00 34.13 32.15 2jkv s GLU 456 CO 0.12 0.39 0.58 -0.51 0.02 0.00 0.00 175.26 175.87 2jkv s LEU 457 N -3.14 4.35 0.25 1.80 1.43 -1.26 -4.98 118.68 117.13 2jkv s LEU 457 Ca 0.27 1.15 -0.03 0.00 -1.03 0.00 0.00 54.13 54.48 2jkv s LEU 457 Cb -0.07 -3.30 0.50 0.00 0.03 0.00 0.00 46.19 43.35 2jkv s LEU 457 CO 0.15 0.10 1.70 -0.07 0.23 0.00 0.00 176.35 178.46 2jkv h LEU 458 N 3.60 0.12 -1.62 1.79 3.38 -2.00 -1.93 115.31 118.65 2jkv h LEU 458 Ca -0.49 0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.62 2jkv h LEU 458 Cb 1.19 0.16 0.00 0.00 0.09 0.00 0.00 40.66 42.11 2jkv h LEU 458 CO 0.65 -0.00 0.00 0.00 0.09 0.00 0.00 178.44 179.18 2jkv h ALA 459 N 1.61 1.00 -1.54 1.53 0.00 -2.03 -3.35 119.26 116.49 2jkv h ALA 459 Ca 0.44 0.00 -0.43 0.00 0.00 0.00 0.00 54.91 54.92 2jkv h ALA 459 Cb 0.74 0.00 -0.30 0.00 0.00 0.00 0.00 17.79 18.24 2jkv h ALA 459 CO -0.49 0.00 -0.83 1.17 0.00 0.00 0.00 179.25 179.10 2jkv n LYS 460 N -2.89 0.53 -1.89 0.00 4.81 -0.73 -5.13 118.16 112.85 2jkv n LYS 460 Ca 0.00 -2.70 -0.37 0.00 -0.87 0.00 0.00 58.31 54.37 2jkv n LYS 460 Cb 0.23 -1.45 0.04 0.00 0.02 0.00 0.00 35.03 33.87 2jkv n LYS 460 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 2jkv s PRO 461 N -0.05 3.00 0.00 1.64 0.02 -1.17 -3.16 135.00 135.28 2jkv s PRO 461 Ca 0.33 2.02 0.00 0.00 0.02 0.00 0.00 61.00 63.37 2jkv s PRO 461 Cb 0.11 -2.06 0.00 0.00 0.02 0.00 0.00 34.50 32.57 2jkv s PRO 461 CO -0.15 -1.23 0.00 0.41 -0.33 0.00 0.00 177.00 175.69 2jkv n GLY 462 N 0.68 3.42 3.49 0.52 0.00 -1.26 -5.02 105.19 107.02 2jkv n GLY 462 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 2jkv n GLY 462 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2jkv s GLN 463 N -0.85 3.33 0.00 1.61 0.74 -1.19 -5.07 119.66 118.23 2jkv s GLN 463 Ca 0.00 -0.76 -0.15 0.00 0.05 0.00 0.00 55.36 54.50 2jkv s GLN 463 Cb 0.00 -3.80 -0.06 0.00 1.10 0.00 0.00 33.01 30.25 2jkv s GLN 463 CO 0.00 -0.52 0.43 -0.06 -0.55 0.00 0.00 175.29 174.59 2jkv s PHE 464 N 1.69 3.73 0.07 1.67 0.40 -1.26 -4.39 117.98 119.89 2jkv s PHE 464 Ca 0.05 1.02 0.08 0.00 -0.60 0.00 0.00 56.93 57.48 2jkv s PHE 464 Cb -0.18 -2.32 -0.03 0.00 0.51 0.00 0.00 43.02 41.00 2jkv s PHE 464 CO 0.10 0.62 -0.21 0.42 0.70 0.00 0.00 175.22 176.85 2jkv s ILE 465 N -1.02 1.68 -0.10 0.64 1.01 0.91 -4.87 121.20 119.44 2jkv s ILE 465 Ca 0.24 -1.33 0.02 0.00 0.00 0.00 0.00 60.65 59.59 2jkv s ILE 465 Cb -0.17 -1.49 -0.01 0.00 0.01 0.00 0.00 42.46 40.80 2jkv s ILE 465 CO 0.14 0.10 -0.18 -2.28 0.00 0.00 0.00 174.94 172.72 2jkv s HIS 466 N -0.94 2.68 -0.06 3.97 5.65 -1.26 -0.87 115.29 124.46 2jkv s HIS 466 Ca 0.07 -0.74 0.00 0.00 0.25 0.00 0.00 55.06 54.64 2jkv s HIS 466 Cb -0.09 -1.75 -0.03 0.00 -1.18 0.00 0.00 32.58 29.52 2jkv s HIS 466 CO 0.03 -0.24 -0.04 0.99 -0.65 0.00 0.00 174.74 174.82 2jkv s THR 467 N 0.19 3.91 -1.38 0.89 2.01 -1.26 -5.03 115.64 114.96 2jkv s THR 467 Ca -0.11 -0.45 -0.14 0.00 0.31 0.00 0.00 61.69 61.31 2jkv s THR 467 Cb -0.16 -2.63 0.08 0.00 0.01 0.00 0.00 72.50 69.80 2jkv s THR 467 CO 0.06 0.57 2.03 -3.20 -0.69 0.00 0.00 174.62 173.39 2jkv n ASN 468 N 2.08 4.36 -0.17 3.53 5.15 -1.26 -4.82 115.26 124.13 2jkv n ASN 468 Ca -0.18 -2.91 -0.02 0.00 -0.60 0.00 0.00 54.58 50.87 2jkv n ASN 468 Cb 0.53 -1.64 0.08 0.00 -0.53 0.00 0.00 39.78 38.22 2jkv n ASN 468 CO 0.00 0.00 0.00 -0.50 1.40 0.00 0.00 177.26 178.16 2jkv h TRP 469 N 6.32 0.30 0.00 1.20 4.06 -1.92 -1.94 115.95 123.97 2jkv h TRP 469 Ca 0.50 0.03 -0.03 0.00 2.06 0.00 0.00 58.89 61.45 2jkv h TRP 469 Cb 0.70 -0.05 -0.00 0.00 -1.00 0.00 0.00 29.16 28.80 2jkv h TRP 469 CO 1.40 0.07 -0.14 1.79 -3.56 0.00 0.00 178.44 178.00 2jkv h THR 470 N 0.34 0.27 0.00 1.49 1.35 -1.92 -3.47 112.91 110.98 2jkv h THR 470 Ca 0.26 -1.22 0.00 0.00 -0.55 0.00 0.00 66.41 64.90 2jkv h THR 470 Cb 0.31 1.99 0.00 0.00 -1.73 0.00 0.00 68.15 68.73 2jkv h THR 470 CO -0.28 0.14 0.00 0.61 -0.25 0.00 0.00 175.52 175.74 2jkv n GLY 471 N 0.84 1.20 0.00 5.82 0.00 -0.73 -4.83 105.19 107.48 2jkv n GLY 471 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2jkv n GLY 471 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2jkv n HIS 472 N -2.00 0.00 -2.05 1.61 8.25 -1.26 -5.08 115.22 114.69 2jkv n HIS 472 Ca 0.00 -0.19 -0.29 0.00 -0.26 0.00 0.00 57.72 56.99 2jkv n HIS 472 Cb 0.00 -0.02 0.17 0.00 1.12 0.00 0.00 29.99 31.26 2jkv n HIS 472 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2jkv s GLY 473 N -0.37 1.77 0.33 -1.41 0.00 -1.26 -5.09 107.32 101.28 2jkv s GLY 473 Ca 0.00 -1.28 -0.02 0.00 0.00 0.00 0.00 44.72 43.42 2jkv s GLY 473 CO 0.00 -0.55 0.45 0.61 0.00 0.00 0.00 173.10 173.61 2jkv n GLY 474 N -3.59 0.02 0.04 0.20 0.00 -1.26 -5.04 105.19 95.56 2jkv n GLY 474 Ca 0.15 -1.88 0.02 0.00 0.00 0.00 0.00 46.02 44.31 2jkv n GLY 474 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2jkv n THR 475 N -2.24 0.47 -2.16 2.61 -2.24 -1.26 -4.89 114.28 104.57 2jkv n THR 475 Ca 0.07 -0.53 -0.43 0.00 -2.27 0.00 0.00 64.05 60.89 2jkv n THR 475 Cb 0.23 -0.18 -0.02 0.00 -2.10 0.00 0.00 70.33 68.26 2jkv n THR 475 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2jkv s VAL 476 N -2.90 3.79 0.44 2.28 1.01 -1.26 -5.00 120.40 118.76 2jkv s VAL 476 Ca -0.07 0.92 0.06 0.00 0.00 0.00 0.00 61.98 62.88 2jkv s VAL 476 Cb 0.09 -3.73 0.06 0.00 0.00 0.00 0.00 36.38 32.79 2jkv s VAL 476 CO 0.72 -0.24 0.47 -1.54 0.00 0.00 0.00 175.10 174.51 2jkv n SER 477 N 7.83 2.00 -4.91 3.32 3.41 -1.26 -5.04 113.62 118.97 2jkv n SER 477 Ca 0.17 -2.33 -0.28 0.00 -0.26 0.00 0.00 58.87 56.18 2jkv n SER 477 Cb 0.45 -0.18 0.07 0.00 -0.26 0.00 0.00 64.21 64.29 2jkv n SER 477 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2jkv s SER 478 N -3.64 4.76 0.54 4.04 0.15 -0.48 -5.07 113.70 114.00 2jkv s SER 478 Ca 0.36 0.68 -0.07 0.00 0.70 0.00 0.00 55.95 57.61 2jkv s SER 478 Cb -0.03 -1.28 -0.03 0.00 -1.71 0.00 0.00 66.02 62.97 2jkv s SER 478 CO 0.23 -1.70 0.88 -0.94 1.20 0.00 0.00 173.24 172.91 2jkv s SER 479 N -4.52 6.17 -0.41 5.45 1.04 -1.26 -4.79 113.70 115.37 2jkv s SER 479 Ca 0.61 1.06 -0.17 0.00 0.48 0.00 0.00 55.95 57.92 2jkv s SER 479 Cb -0.11 -2.25 0.02 0.00 0.10 0.00 0.00 66.02 63.78 2jkv s SER 479 CO 0.47 -0.73 0.43 -0.44 0.98 0.00 0.00 173.24 173.95 2jkv s SER 480 N -4.15 6.19 0.05 7.02 0.01 -1.26 -4.89 113.70 116.67 2jkv s SER 480 Ca 0.50 -0.62 -0.26 0.00 1.31 0.00 0.00 55.95 56.88 2jkv s SER 480 Cb -0.11 -2.22 0.06 0.00 0.21 0.00 0.00 66.02 63.97 2jkv s SER 480 CO 0.48 -0.55 0.60 -0.72 0.41 0.00 0.00 173.24 173.46 2jkv s TYR 481 N 2.11 -0.54 0.21 2.43 -0.85 -1.26 -5.17 117.35 114.27 2jkv s TYR 481 Ca 0.12 0.67 0.08 0.00 -0.52 0.00 0.00 57.07 57.41 2jkv s TYR 481 Cb -0.17 0.43 -0.04 0.00 0.38 0.00 0.00 41.96 42.56 2jkv s TYR 481 CO 0.13 -0.69 0.04 -0.80 -1.52 0.00 0.00 175.55 172.71 2jkv s ASN 482 N -1.92 4.91 0.00 -0.18 0.01 -1.26 -5.20 114.94 111.31 2jkv s ASN 482 Ca -0.06 -0.41 0.00 0.00 -0.71 0.00 0.00 52.86 51.69 2jkv s ASN 482 Cb -0.01 -1.08 0.00 0.00 0.41 0.00 0.00 41.25 40.58 2jkv s ASN 482 CO -0.01 0.04 0.00 0.00 -1.51 0.00 0.00 177.10 175.63