#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jti n SER 2 N 0.00 0.00 0.27 1.61 3.41 -1.26 -4.96 113.62 112.69 1jti n SER 2 Ca 0.00 0.00 0.15 0.00 -0.26 0.00 0.00 58.87 58.76 1jti n SER 2 Cb 0.00 0.00 0.86 0.00 -0.26 0.00 0.00 64.21 64.81 1jti n SER 2 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 1jti h ILE 3 N 1.15 0.58 0.65 -1.33 6.09 -1.93 -1.42 117.51 121.29 1jti h ILE 3 Ca 0.00 0.00 -0.03 0.00 -1.37 0.00 0.00 64.86 63.46 1jti h ILE 3 Cb 0.00 0.96 0.01 0.00 0.47 0.00 0.00 36.82 38.26 1jti h ILE 3 CO 0.00 0.00 -0.31 1.23 -3.07 0.00 0.00 178.15 176.00 1jti h GLY 4 N 0.00 -0.91 0.82 8.18 0.00 -1.86 -0.35 103.07 108.96 1jti h GLY 4 Ca 0.02 0.34 0.10 0.00 0.00 0.00 0.00 47.33 47.79 1jti h GLY 4 CO -0.00 -0.33 0.51 0.00 0.00 0.00 0.00 176.54 176.72 1jti h ALA 5 N -1.38 1.82 -0.22 3.60 0.00 -1.72 -1.84 119.26 119.51 1jti h ALA 5 Ca -0.09 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 1jti h ALA 5 Cb 0.67 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1jti h ALA 5 CO 0.15 0.01 -0.02 0.00 0.00 0.00 0.00 179.25 179.39 1jti h ALA 6 N 1.61 0.31 -0.35 0.00 0.00 -1.22 -2.09 119.26 117.53 1jti h ALA 6 Ca 0.36 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1jti h ALA 6 Cb 0.50 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1jti h ALA 6 CO -0.14 0.05 0.15 0.66 0.00 0.00 0.00 179.25 179.98 1jti h SER 7 N 0.16 0.43 0.38 0.00 4.64 -0.44 -2.21 113.55 116.51 1jti h SER 7 Ca 0.06 -0.04 -0.02 0.00 -0.47 0.00 0.00 61.79 61.33 1jti h SER 7 Cb 0.44 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 1jti h SER 7 CO 0.02 0.39 -0.18 0.24 -0.87 0.00 0.00 176.83 176.42 1jti h MET 8 N 0.48 -0.49 -0.76 4.77 2.86 -1.10 -1.51 114.93 119.19 1jti h MET 8 Ca 0.12 0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.76 1jti h MET 8 Cb 0.08 0.11 -0.03 0.00 0.06 0.00 0.00 31.60 31.82 1jti h MET 8 CO -0.01 -0.18 0.32 0.93 1.06 0.00 0.00 176.91 179.02 1jti h GLU 9 N -0.80 1.12 -0.74 1.72 5.08 -1.34 -1.76 114.58 117.86 1jti h GLU 9 Ca -0.05 -0.19 -0.05 0.00 -1.00 0.00 0.00 59.36 58.07 1jti h GLU 9 Cb 0.53 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.56 1jti h GLU 9 CO 0.08 0.90 0.26 0.35 -1.00 0.00 0.00 179.01 179.60 1jti h PHE 10 N 1.10 1.16 0.09 4.33 3.57 -1.43 0.12 116.94 125.88 1jti h PHE 10 Ca 0.26 -0.10 0.01 0.00 3.53 0.00 0.00 57.97 61.66 1jti h PHE 10 Cb 0.18 -0.34 -0.01 0.00 2.79 0.00 0.00 35.95 38.57 1jti h PHE 10 CO 0.02 0.91 -0.11 0.00 -2.23 0.00 0.00 178.31 176.89 1jti h PHE 12 N -0.24 0.92 -0.52 0.00 0.04 -1.12 -1.19 116.94 114.83 1jti h PHE 12 Ca 0.01 -0.18 -0.06 0.00 2.80 0.00 0.00 57.97 60.54 1jti h PHE 12 Cb 0.24 -0.23 -0.02 0.00 2.20 0.00 0.00 35.95 38.13 1jti h PHE 12 CO -0.13 0.90 0.08 -0.44 -0.60 0.00 0.00 178.31 178.12 1jti h ASP 13 N 0.74 0.77 -0.37 2.17 3.32 -0.60 -1.52 116.42 120.94 1jti h ASP 13 Ca 0.12 -0.16 -0.09 0.00 0.02 0.00 0.00 57.03 56.92 1jti h ASP 13 Cb 0.63 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.97 1jti h ASP 13 CO 0.04 0.79 -0.13 0.58 -1.72 0.00 0.00 179.24 178.80 1jti h VAL 14 N 0.78 1.28 -0.08 -1.35 2.07 -0.74 -3.19 116.25 115.03 1jti h VAL 14 Ca 0.16 -1.24 0.02 0.00 0.82 0.00 0.00 66.70 66.47 1jti h VAL 14 Cb 0.36 1.30 -0.02 0.00 -1.52 0.00 0.00 31.29 31.41 1jti h VAL 14 CO 0.01 0.41 -0.06 0.15 0.02 0.00 0.00 177.57 178.10 1jti h PHE 15 N 0.55 -0.14 0.00 1.57 3.57 -0.85 -0.40 116.94 121.24 1jti h PHE 15 Ca 0.09 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.60 1jti h PHE 15 Cb 0.66 0.07 0.00 0.00 2.79 0.00 0.00 35.95 39.48 1jti h PHE 15 CO 0.05 -0.09 0.18 0.87 -2.23 0.00 0.00 178.31 177.09 1jti h LYS 16 N -0.06 0.00 0.00 1.11 6.56 -1.29 0.40 116.57 123.29 1jti h LYS 16 Ca 0.05 0.00 -0.36 0.00 -1.06 0.00 0.00 60.65 59.28 1jti h LYS 16 Cb 0.14 0.00 -0.07 0.00 -0.57 0.00 0.00 32.23 31.73 1jti h LYS 16 CO -0.12 0.00 -2.36 -1.91 -2.06 0.00 0.00 179.45 173.00 1jti n GLU 17 N -2.41 0.76 0.00 3.15 4.07 -0.54 -4.50 120.64 121.17 1jti n GLU 17 Ca -0.02 0.04 -0.17 0.00 -0.06 0.00 0.00 57.16 56.95 1jti n GLU 17 Cb 0.21 -1.50 -0.11 0.00 -0.06 0.00 0.00 31.44 29.99 1jti n GLU 17 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 1jti h LEU 18 N 0.00 0.56 -2.20 4.31 3.38 0.52 -3.29 115.31 118.59 1jti h LEU 18 Ca -0.54 -0.74 0.06 0.00 0.09 0.00 0.00 57.88 56.75 1jti h LEU 18 Cb 2.08 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 42.65 1jti h LEU 18 CO -0.01 1.22 0.24 0.07 0.09 0.00 0.00 178.44 180.05 1jti h LYS 19 N -0.06 0.00 0.00 1.13 2.10 -1.24 -0.05 116.57 118.46 1jti h LYS 19 Ca -0.07 0.00 -0.11 0.00 -2.00 0.00 0.00 60.65 58.47 1jti h LYS 19 Cb 1.30 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.61 1jti h LYS 19 CO 0.12 0.00 -0.54 0.28 -2.00 0.00 0.00 179.45 177.31 1jti h VAL 20 N 0.00 1.25 -0.02 0.07 2.07 -1.79 -2.93 116.25 114.91 1jti h VAL 20 Ca 0.10 -1.93 0.00 0.00 0.82 0.00 0.00 66.70 65.68 1jti h VAL 20 Cb 0.58 2.08 0.00 0.00 -1.52 0.00 0.00 31.29 32.43 1jti h VAL 20 CO -0.00 0.53 -0.33 1.41 0.02 0.00 0.00 177.57 179.20 1jti n HIS 21 N -3.70 0.00 -2.81 1.57 8.25 -0.12 -4.50 115.22 113.91 1jti n HIS 21 Ca -0.01 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.31 1jti n HIS 21 Cb 0.58 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.70 1jti n HIS 21 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1jti n HIS 22 N 0.19 1.21 -2.30 4.41 8.25 -0.68 -5.09 115.22 121.20 1jti n HIS 22 Ca 0.09 -3.16 -0.37 0.00 -0.26 0.00 0.00 57.72 54.01 1jti n HIS 22 Cb 0.43 -0.37 -0.02 0.00 1.12 0.00 0.00 29.99 31.16 1jti n HIS 22 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1jti s ALA 23 N -2.98 3.06 -1.92 -1.41 0.00 -1.11 -2.89 121.76 114.50 1jti s ALA 23 Ca 0.34 0.92 0.00 0.00 0.00 0.00 0.00 51.96 53.22 1jti s ALA 23 Cb 0.42 -3.37 0.00 0.00 0.00 0.00 0.00 23.12 20.17 1jti s ALA 23 CO -0.02 -0.56 0.00 0.09 0.00 0.00 0.00 175.76 175.27 1jti n ASN 24 N -0.22 -5.05 -4.47 0.00 4.13 -1.26 -4.96 115.26 103.43 1jti n ASN 24 Ca 0.06 0.45 -0.23 0.00 1.68 0.00 0.00 54.58 56.53 1jti n ASN 24 Cb 0.48 -4.42 -0.10 0.00 -1.54 0.00 0.00 39.78 34.20 1jti n ASN 24 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 1jti s GLU 25 N -3.52 1.65 0.64 3.52 2.02 -1.14 -4.98 118.70 116.89 1jti s GLU 25 Ca 0.00 -1.79 -0.14 0.00 0.02 0.00 0.00 54.97 53.06 1jti s GLU 25 Cb 0.00 -1.60 -0.01 0.00 0.10 0.00 0.00 34.13 32.62 1jti s GLU 25 CO 0.00 0.23 1.07 -0.80 0.02 0.00 0.00 175.26 175.78 1jti s ASN 26 N -3.50 5.42 -0.02 -0.19 0.01 -1.26 -4.69 114.94 110.70 1jti s ASN 26 Ca 0.30 1.83 0.00 0.00 -0.71 0.00 0.00 52.86 54.28 1jti s ASN 26 Cb -0.01 -2.53 0.02 0.00 0.41 0.00 0.00 41.25 39.14 1jti s ASN 26 CO 0.14 -1.42 0.01 -0.63 -1.51 0.00 0.00 177.10 173.69 1jti s ILE 27 N -2.56 0.08 -0.20 0.60 1.01 -0.79 -4.95 121.20 114.38 1jti s ILE 27 Ca 0.63 0.11 -0.09 0.00 0.00 0.00 0.00 60.65 61.30 1jti s ILE 27 Cb -0.17 -0.17 0.08 0.00 0.01 0.00 0.00 42.46 42.20 1jti s ILE 27 CO 0.43 0.11 0.46 0.12 0.00 0.00 0.00 174.94 176.05 1jti s PHE 28 N 0.86 -0.78 0.22 3.97 5.36 -1.26 0.48 117.98 126.83 1jti s PHE 28 Ca -0.08 1.54 -0.14 0.00 -0.96 0.00 0.00 56.93 57.29 1jti s PHE 28 Cb -0.11 0.36 0.01 0.00 -0.34 0.00 0.00 43.02 42.93 1jti s PHE 28 CO -0.02 -0.44 0.49 1.52 -1.46 0.00 0.00 175.22 175.31 1jti s TYR 29 N 1.99 0.17 -0.49 10.12 1.13 -0.80 -4.71 117.35 124.76 1jti s TYR 29 Ca -0.06 -0.54 -0.02 0.00 -1.41 0.00 0.00 57.07 55.04 1jti s TYR 29 Cb -0.10 0.27 0.13 0.00 -1.10 0.00 0.00 41.96 41.16 1jti s TYR 29 CO -0.14 -0.96 0.28 0.00 -2.51 0.00 0.00 175.55 172.22 1jti h PRO 31 N 7.56 0.39 -0.65 0.00 0.11 -1.80 -2.43 132.00 135.18 1jti h PRO 31 Ca -0.08 -0.02 0.05 0.00 0.11 0.00 0.00 66.00 66.06 1jti h PRO 31 Cb 1.00 -0.09 -0.05 0.00 0.11 0.00 0.00 31.00 31.97 1jti h PRO 31 CO 0.69 0.26 0.37 0.82 -0.21 0.00 0.00 178.00 179.93 1jti h ILE 32 N 0.40 0.99 0.00 4.15 1.08 -1.72 -0.82 117.51 121.59 1jti h ILE 32 Ca 0.40 -0.24 -0.08 0.00 -0.39 0.00 0.00 64.86 64.56 1jti h ILE 32 Cb 0.62 0.24 -0.01 0.00 -3.07 0.00 0.00 36.82 34.60 1jti h ILE 32 CO -0.42 0.13 -0.37 0.00 -0.69 0.00 0.00 178.15 176.80 1jti h ALA 33 N 1.33 1.15 0.10 1.87 0.00 -1.76 -2.28 119.26 119.67 1jti h ALA 33 Ca 0.29 -0.34 -0.29 0.00 0.00 0.00 0.00 54.91 54.57 1jti h ALA 33 Cb 0.15 -0.06 0.03 0.00 0.00 0.00 0.00 17.79 17.91 1jti h ALA 33 CO -0.17 0.46 -1.21 0.82 0.00 0.00 0.00 179.25 179.16 1jti h ILE 34 N 0.00 1.30 -0.12 0.00 2.04 -1.07 -2.79 117.51 116.86 1jti h ILE 34 Ca -0.00 -2.46 -0.10 0.00 1.00 0.00 0.00 64.86 63.29 1jti h ILE 34 Cb 0.77 2.65 -0.01 0.00 -0.74 0.00 0.00 36.82 39.49 1jti h ILE 34 CO 0.05 0.75 -0.38 0.24 0.00 0.00 0.00 178.15 178.81 1jti h MET 35 N 0.28 0.26 0.15 2.37 2.86 -1.12 -1.70 114.93 118.03 1jti h MET 35 Ca -0.17 -0.11 -0.01 0.00 -2.06 0.00 0.00 59.70 57.34 1jti h MET 35 Cb 1.88 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 33.53 1jti h MET 35 CO 0.23 0.60 -0.07 1.03 1.06 0.00 0.00 176.91 179.76 1jti h SER 36 N 0.22 -0.17 -0.77 1.22 0.87 -1.40 0.29 113.55 113.80 1jti h SER 36 Ca 0.02 -0.09 -0.04 0.00 -1.23 0.00 0.00 61.79 60.46 1jti h SER 36 Cb 0.77 0.04 -0.03 0.00 -0.44 0.00 0.00 62.40 62.74 1jti h SER 36 CO 0.06 -0.01 0.35 0.00 -0.53 0.00 0.00 176.83 176.69 1jti h ALA 37 N 0.52 1.00 -0.15 6.23 0.00 -1.40 -2.15 119.26 123.32 1jti h ALA 37 Ca -0.02 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.66 1jti h ALA 37 Cb 0.25 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1jti h ALA 37 CO 0.03 0.59 -0.17 1.25 0.00 0.00 0.00 179.25 180.96 1jti h LEU 38 N 1.10 0.23 -0.51 0.00 5.85 -1.05 -2.57 115.31 118.36 1jti h LEU 38 Ca 0.26 -0.05 -0.08 0.00 0.84 0.00 0.00 57.88 58.85 1jti h LEU 38 Cb 0.16 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 1jti h LEU 38 CO -0.03 0.42 0.02 0.00 -0.34 0.00 0.00 178.44 178.51 1jti h ALA 39 N 1.61 0.68 0.00 1.25 0.00 0.20 -1.32 119.26 121.68 1jti h ALA 39 Ca 0.04 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.63 1jti h ALA 39 Cb 0.43 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1jti h ALA 39 CO 0.03 0.48 -0.23 0.52 0.00 0.00 0.00 179.25 180.05 1jti h MET 40 N 0.75 0.00 -0.00 0.00 2.86 -1.06 -1.51 114.93 115.98 1jti h MET 40 Ca 0.15 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.70 1jti h MET 40 Cb 0.49 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.16 1jti h MET 40 CO 0.02 0.23 -0.35 0.28 1.06 0.00 0.00 176.91 178.16 1jti h VAL 41 N 0.00 1.52 -0.72 -2.22 2.07 -1.19 -3.27 116.25 112.43 1jti h VAL 41 Ca -0.00 -1.99 0.15 0.00 0.82 0.00 0.00 66.70 65.68 1jti h VAL 41 Cb 0.44 2.73 -0.05 0.00 -1.52 0.00 0.00 31.29 32.89 1jti h VAL 41 CO 0.03 0.55 0.49 0.22 0.02 0.00 0.00 177.57 178.88 1jti h TYR 42 N -0.40 0.41 -0.68 1.57 3.20 -0.93 -1.48 116.97 118.66 1jti h TYR 42 Ca -0.04 0.01 0.08 0.00 3.14 0.00 0.00 58.73 61.92 1jti h TYR 42 Cb 1.09 -0.13 -0.04 0.00 1.54 0.00 0.00 36.73 39.19 1jti h TYR 42 CO 0.17 0.15 0.45 1.25 -1.64 0.00 0.00 178.16 178.54 1jti h LEU 43 N 0.35 0.55 -3.44 2.82 6.46 -1.33 -2.67 115.31 118.05 1jti h LEU 43 Ca 0.35 0.01 -0.19 0.00 -0.12 0.00 0.00 57.88 57.93 1jti h LEU 43 Cb 0.89 -0.11 -0.12 0.00 -0.73 0.00 0.00 40.66 40.59 1jti h LEU 43 CO -0.10 0.35 0.05 0.61 -0.62 0.00 0.00 178.44 178.73 1jti n GLY 44 N -1.47 4.63 3.51 3.75 0.00 -0.56 -4.84 105.19 110.22 1jti n GLY 44 Ca 0.10 -1.16 -0.30 0.00 0.00 0.00 0.00 46.02 44.66 1jti n GLY 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jti s ALA 45 N -3.17 2.76 0.31 4.61 0.00 -1.01 -2.08 121.76 123.18 1jti s ALA 45 Ca 0.46 -1.25 0.03 0.00 0.00 0.00 0.00 51.96 51.20 1jti s ALA 45 Cb 0.41 -0.78 -0.04 0.00 0.00 0.00 0.00 23.12 22.71 1jti s ALA 45 CO 0.04 0.60 0.14 0.15 0.00 0.00 0.00 175.76 176.69 1jti s LYS 46 N -1.89 1.59 3.32 0.00 1.02 -0.95 -4.58 119.74 118.25 1jti s LYS 46 Ca 0.18 -1.91 0.00 0.00 0.02 0.00 0.00 55.97 54.26 1jti s LYS 46 Cb -0.11 -0.19 0.00 0.00 -0.52 0.00 0.00 37.83 37.02 1jti s LYS 46 CO 0.09 -0.42 0.00 -3.47 -0.92 0.00 0.00 175.35 170.63 1jti n ASP 47 N -0.88 0.00 -0.29 2.83 -0.08 -1.26 -2.43 116.55 114.45 1jti n ASP 47 Ca 0.00 0.00 0.06 0.00 -1.51 0.00 0.00 54.79 53.34 1jti n ASP 47 Cb 0.65 0.00 0.28 0.00 2.34 0.00 0.00 41.12 44.39 1jti n ASP 47 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 1jti h SER 48 N 7.42 0.83 -0.12 1.67 4.64 -1.97 -0.57 113.55 125.45 1jti h SER 48 Ca 0.00 0.02 0.04 0.00 -0.47 0.00 0.00 61.79 61.38 1jti h SER 48 Cb 0.00 -0.16 -0.06 0.00 -0.31 0.00 0.00 62.40 61.87 1jti h SER 48 CO 0.00 0.51 -0.41 0.74 -0.87 0.00 0.00 176.83 176.80 1jti h THR 49 N 0.93 0.16 0.39 2.95 2.02 -1.86 0.40 112.91 117.90 1jti h THR 49 Ca 0.40 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.56 1jti h THR 49 Cb 0.32 0.16 0.00 0.00 -1.74 0.00 0.00 68.15 66.89 1jti h THR 49 CO -0.16 0.00 -0.19 -0.09 0.37 0.00 0.00 175.52 175.45 1jti h ARG 50 N -0.49 -0.50 -0.83 6.66 2.43 -1.05 -2.76 114.38 117.84 1jti h ARG 50 Ca 0.07 0.03 0.06 0.00 -0.81 0.00 0.00 59.98 59.34 1jti h ARG 50 Cb 0.62 0.11 -0.05 0.00 -0.42 0.00 0.00 29.97 30.24 1jti h ARG 50 CO -0.39 -0.34 0.54 0.00 -1.51 0.00 0.00 179.97 178.28 1jti h THR 51 N -0.52 1.07 -0.48 0.20 1.03 -0.84 -2.07 112.91 111.29 1jti h THR 51 Ca -0.05 -0.32 -0.06 0.00 -0.01 0.00 0.00 66.41 65.96 1jti h THR 51 Cb 0.40 0.05 -0.02 0.00 -1.07 0.00 0.00 68.15 67.51 1jti h THR 51 CO 0.09 0.17 0.05 -0.61 -0.01 0.00 0.00 175.52 175.21 1jti h GLN 52 N 0.94 0.77 0.04 0.00 4.15 -0.05 -2.32 115.11 118.63 1jti h GLN 52 Ca 0.35 -0.18 -0.00 0.00 0.77 0.00 0.00 58.65 59.59 1jti h GLN 52 Cb 0.18 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 27.77 1jti h GLN 52 CO -0.12 0.75 -0.02 0.82 -1.93 0.00 0.00 178.83 178.33 1jti h ILE 53 N 0.73 1.15 0.00 2.39 2.04 -1.09 -3.09 117.51 119.64 1jti h ILE 53 Ca 0.15 -0.60 -0.02 0.00 1.00 0.00 0.00 64.86 65.39 1jti h ILE 53 Cb 0.37 1.54 -0.00 0.00 -0.74 0.00 0.00 36.82 38.00 1jti h ILE 53 CO 0.01 0.15 -0.09 -1.13 0.00 0.00 0.00 178.15 177.09 1jti h ASN 54 N -0.32 0.00 0.93 1.72 -0.00 -1.39 -1.70 115.58 114.83 1jti h ASN 54 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.29 1jti h ASN 54 Cb 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.61 1jti h ASN 54 CO 0.01 0.09 0.00 1.17 -0.00 0.00 0.00 177.43 178.70 1jti n LYS 55 N -4.24 0.22 -0.07 6.67 4.81 -0.88 -0.18 118.16 124.49 1jti n LYS 55 Ca -0.03 0.38 -0.08 0.00 -0.87 0.00 0.00 58.31 57.71 1jti n LYS 55 Cb 0.17 -1.87 -0.09 0.00 0.02 0.00 0.00 35.03 33.26 1jti n LYS 55 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 1jti n VAL 56 N -2.28 0.88 -0.01 3.15 0.31 -0.81 -4.60 118.33 114.97 1jti n VAL 56 Ca 0.03 -0.45 -0.04 0.00 -0.01 0.00 0.00 64.34 63.87 1jti n VAL 56 Cb 0.28 -0.85 -0.12 0.00 -0.91 0.00 0.00 33.84 32.25 1jti n VAL 56 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 1jti n VAL 57 N -2.69 1.33 -3.80 2.52 0.31 -0.70 -4.88 118.33 110.43 1jti n VAL 57 Ca -0.24 -0.74 -0.27 0.00 -0.01 0.00 0.00 64.34 63.08 1jti n VAL 57 Cb 0.86 -0.80 0.04 0.00 -0.91 0.00 0.00 33.84 33.02 1jti n VAL 57 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1jti n ARG 58 N -2.91 -5.73 -0.02 5.55 1.74 0.75 -4.76 116.66 111.27 1jti n ARG 58 Ca -0.15 0.64 0.05 0.00 -0.77 0.00 0.00 57.85 57.63 1jti n ARG 58 Cb 0.95 -5.47 0.06 0.00 -1.02 0.00 0.00 32.46 26.98 1jti n ARG 58 CO 0.00 0.00 0.00 1.97 -1.52 0.00 0.00 177.63 178.08 1jti n PHE 59 N -4.60 0.06 -3.90 -1.55 -0.00 -1.26 -4.79 117.46 101.42 1jti n PHE 59 Ca -0.07 -0.07 -0.35 0.00 -0.00 0.00 0.00 57.45 56.97 1jti n PHE 59 Cb 0.58 -0.00 -0.13 0.00 -0.00 0.00 0.00 39.48 39.92 1jti n PHE 59 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.76 177.10 1jti s ASP 60 N -0.92 4.93 -0.08 5.98 2.15 -1.26 -3.70 116.67 123.77 1jti s ASP 60 Ca 0.14 -1.50 -0.29 0.00 0.43 0.00 0.00 52.55 51.32 1jti s ASP 60 Cb 0.09 -1.72 -0.07 0.00 -0.30 0.00 0.00 42.92 40.93 1jti s ASP 60 CO 0.14 -0.32 1.96 -0.75 -0.17 0.00 0.00 175.17 176.02 1jti s LYS 61 N 1.19 3.82 0.55 4.34 2.20 -1.26 -4.91 119.74 125.67 1jti s LYS 61 Ca -0.01 2.28 -0.16 0.00 -0.36 0.00 0.00 55.97 57.72 1jti s LYS 61 Cb -0.20 -4.19 -0.06 0.00 -1.51 0.00 0.00 37.83 31.87 1jti s LYS 61 CO -0.02 -1.31 1.01 -0.51 -0.36 0.00 0.00 175.35 174.15 1jti s LEU 62 N 5.59 3.55 0.87 5.43 1.43 -1.26 -4.48 118.68 129.81 1jti s LEU 62 Ca 0.88 1.62 -0.12 0.00 -1.03 0.00 0.00 54.13 55.48 1jti s LEU 62 Cb -0.37 -4.51 0.12 0.00 0.03 0.00 0.00 46.19 41.46 1jti s LEU 62 CO 0.37 -0.77 1.12 -2.16 0.23 0.00 0.00 176.35 175.14 1jti s PRO 63 N -4.18 1.45 -0.02 1.29 0.04 -1.26 -5.16 135.00 127.17 1jti s PRO 63 Ca 0.60 0.46 -0.01 0.00 0.04 0.00 0.00 61.00 62.09 1jti s PRO 63 Cb -0.12 -1.86 -0.04 0.00 0.04 0.00 0.00 34.50 32.53 1jti s PRO 63 CO 0.35 -2.02 0.06 0.20 0.04 0.00 0.00 177.00 175.63 1jti s GLY 64 N -3.92 1.98 -0.38 0.56 0.00 -1.26 -5.02 107.32 99.28 1jti s GLY 64 Ca 0.63 -0.86 0.03 0.00 0.00 0.00 0.00 44.72 44.52 1jti s GLY 64 CO 0.54 -0.71 1.78 0.69 0.00 0.00 0.00 173.10 175.40 1jti n PHE 65 N 1.40 2.54 0.00 1.90 0.99 -1.26 -4.99 117.46 118.04 1jti n PHE 65 Ca -0.14 -1.69 0.00 0.00 -0.00 0.00 0.00 57.45 55.61 1jti n PHE 65 Cb 0.53 -0.86 0.00 0.00 -1.00 0.00 0.00 39.48 38.15 1jti n PHE 65 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1jti n GLY 66 N -0.83 3.09 0.07 1.37 0.00 -1.26 -4.81 105.19 102.82 1jti n GLY 66 Ca 0.50 -1.65 0.10 0.00 0.00 0.00 0.00 46.02 44.97 1jti n GLY 66 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1jti n ASP 67 N 0.00 0.21 -4.71 1.61 8.00 -1.26 -4.19 116.55 116.21 1jti n ASP 67 Ca 0.00 -1.40 -0.42 0.00 0.71 0.00 0.00 54.79 53.67 1jti n ASP 67 Cb 0.00 -0.01 -0.03 0.00 -0.02 0.00 0.00 41.12 41.06 1jti n ASP 67 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1jti s SER 68 N -1.63 6.54 0.37 -2.24 0.15 -1.26 -4.87 113.70 110.76 1jti s SER 68 Ca 0.31 2.64 0.08 0.00 0.70 0.00 0.00 55.95 59.67 1jti s SER 68 Cb 0.14 -2.58 0.80 0.00 -1.71 0.00 0.00 66.02 62.67 1jti s SER 68 CO 0.24 -0.88 1.93 0.40 1.20 0.00 0.00 173.24 176.13 1jti h ILE 69 N 4.25 0.95 -0.42 6.45 2.04 -1.88 0.13 117.51 129.03 1jti h ILE 69 Ca -0.43 -0.24 -0.10 0.00 1.00 0.00 0.00 64.86 65.09 1jti h ILE 69 Cb 1.20 0.20 -0.02 0.00 -0.74 0.00 0.00 36.82 37.46 1jti h ILE 69 CO 0.93 0.13 -0.16 -0.33 0.00 0.00 0.00 178.15 178.71 1jti h GLU 70 N 0.69 0.80 0.17 2.37 3.07 -1.93 -1.40 114.58 118.35 1jti h GLU 70 Ca 0.35 -0.29 -0.01 0.00 -0.50 0.00 0.00 59.36 58.91 1jti h GLU 70 Cb 0.44 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.30 1jti h GLU 70 CO -0.13 0.91 -0.08 0.00 -1.40 0.00 0.00 179.01 178.31 1jti h ALA 71 N 1.11 -0.89 -0.80 3.43 0.00 -1.16 0.10 119.26 121.04 1jti h ALA 71 Ca 0.11 -0.05 0.15 0.00 0.00 0.00 0.00 54.91 55.12 1jti h ALA 71 Cb 0.66 0.09 -0.15 0.00 0.00 0.00 0.00 17.79 18.39 1jti h ALA 71 CO 0.05 -0.88 -0.25 1.96 0.00 0.00 0.00 179.25 180.12 1jti h GLN 72 N -0.27 -0.03 0.00 0.00 4.20 -1.00 0.41 115.11 118.43 1jti h GLN 72 Ca -0.02 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.69 1jti h GLN 72 Cb 0.18 0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.97 1jti h GLN 72 CO 0.04 -0.02 0.00 0.00 -0.67 0.00 0.00 178.83 178.18 1jti n GLY 74 N 1.33 4.22 0.08 0.00 0.00 0.68 -4.78 105.19 106.72 1jti n GLY 74 Ca 0.06 -1.15 -0.07 0.00 0.00 0.00 0.00 46.02 44.86 1jti n GLY 74 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1jti n THR 75 N -0.85 1.44 -0.07 2.61 -1.04 0.11 -4.88 114.28 111.60 1jti n THR 75 Ca 0.16 0.18 0.00 0.00 -2.04 0.00 0.00 64.05 62.35 1jti n THR 75 Cb 0.76 -2.36 0.00 0.00 -1.82 0.00 0.00 70.33 66.92 1jti n THR 75 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1jti n SER 76 N -4.58 0.00 -3.14 8.00 7.64 -1.26 -4.97 113.62 115.31 1jti n SER 76 Ca -0.11 0.00 -0.22 0.00 1.01 0.00 0.00 58.87 59.55 1jti n SER 76 Cb 0.34 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.48 1jti n SER 76 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1jti n VAL 77 N -2.00 -0.62 -4.02 0.44 0.31 -1.26 -4.95 118.33 106.24 1jti n VAL 77 Ca 0.00 -3.74 -0.12 0.00 -0.01 0.00 0.00 64.34 60.47 1jti n VAL 77 Cb 0.00 -1.56 -0.03 0.00 -0.91 0.00 0.00 33.84 31.34 1jti n VAL 77 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1jti s ASN 78 N -1.25 0.47 0.28 4.52 2.20 -1.26 -4.76 114.94 115.15 1jti s ASN 78 Ca 0.35 -1.27 0.02 0.00 -0.94 0.00 0.00 52.86 51.02 1jti s ASN 78 Cb 0.18 0.67 0.66 0.00 -2.00 0.00 0.00 41.25 40.76 1jti s ASN 78 CO -0.12 -1.31 1.73 1.62 -2.94 0.00 0.00 177.10 176.07 1jti h VAL 79 N 2.14 0.60 -0.68 3.54 3.04 -1.91 -0.59 116.25 122.38 1jti h VAL 79 Ca -0.28 -0.18 -0.07 0.00 -1.01 0.00 0.00 66.70 65.16 1jti h VAL 79 Cb 1.24 0.02 -0.03 0.00 -2.01 0.00 0.00 31.29 30.52 1jti h VAL 79 CO 0.38 0.10 0.15 0.45 -1.01 0.00 0.00 177.57 177.64 1jti h HIS 80 N 0.53 1.14 0.00 3.17 3.86 -1.91 0.23 115.15 122.18 1jti h HIS 80 Ca 0.53 -0.14 -0.18 0.00 -1.16 0.00 0.00 60.37 59.42 1jti h HIS 80 Cb 0.90 -0.32 -0.03 0.00 1.06 0.00 0.00 27.41 29.02 1jti h HIS 80 CO -0.10 0.94 -0.86 0.66 0.86 0.00 0.00 177.93 179.43 1jti h SER 81 N 1.03 0.00 0.04 2.45 4.64 -1.74 -1.42 113.55 118.56 1jti h SER 81 Ca 0.21 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.53 1jti h SER 81 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 1jti h SER 81 CO 0.00 0.86 -0.02 -1.28 -0.87 0.00 0.00 176.83 175.52 1jti h SER 82 N 0.00 -0.05 -0.03 4.97 0.87 -0.85 -1.36 113.55 117.10 1jti h SER 82 Ca -0.01 -0.40 -0.09 0.00 -1.23 0.00 0.00 61.79 60.06 1jti h SER 82 Cb 1.62 0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 63.58 1jti h SER 82 CO 0.11 0.38 -0.23 0.25 -0.53 0.00 0.00 176.83 176.81 1jti h LEU 83 N -0.49 0.43 -0.31 2.23 5.85 -0.60 -2.58 115.31 119.83 1jti h LEU 83 Ca -0.01 -0.14 -0.08 0.00 0.84 0.00 0.00 57.88 58.50 1jti h LEU 83 Cb 0.45 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 1jti h LEU 83 CO 0.01 0.67 -0.10 -0.09 -0.34 0.00 0.00 178.44 178.59 1jti h ARG 84 N 0.39 0.62 -0.28 1.25 2.43 -1.23 -2.55 114.38 115.01 1jti h ARG 84 Ca 0.06 -0.25 -0.01 0.00 -0.81 0.00 0.00 59.98 58.97 1jti h ARG 84 Cb 0.62 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.13 1jti h ARG 84 CO 0.04 0.82 0.15 0.22 -1.51 0.00 0.00 179.97 179.69 1jti h ASP 85 N 0.39 0.35 -0.91 -3.80 3.58 -1.11 -1.93 116.42 112.98 1jti h ASP 85 Ca 0.08 -0.10 0.01 0.00 0.42 0.00 0.00 57.03 57.44 1jti h ASP 85 Cb 0.61 -0.09 -0.05 0.00 1.72 0.00 0.00 39.33 41.52 1jti h ASP 85 CO 0.04 0.35 0.60 -0.29 -2.88 0.00 0.00 179.24 177.06 1jti h ILE 86 N 0.32 1.23 -0.16 2.25 -0.00 -1.46 -0.96 117.51 118.74 1jti h ILE 86 Ca 0.10 -0.42 -0.08 0.00 -0.00 0.00 0.00 64.86 64.45 1jti h ILE 86 Cb 0.08 -0.11 -0.01 0.00 -0.00 0.00 0.00 36.82 36.78 1jti h ILE 86 CO -0.01 0.23 -0.25 -0.07 -0.00 0.00 0.00 178.15 178.04 1jti h LEU 87 N 1.24 0.29 -0.34 2.19 3.38 -1.25 -2.46 115.31 118.36 1jti h LEU 87 Ca 0.33 -0.09 -0.16 0.00 0.09 0.00 0.00 57.88 58.06 1jti h LEU 87 Cb -0.14 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.53 1jti h LEU 87 CO -0.07 0.55 -0.40 0.78 0.09 0.00 0.00 178.44 179.38 1jti h ASN 88 N 0.27 0.94 -0.59 -0.43 -0.26 -0.54 -2.37 115.58 112.60 1jti h ASN 88 Ca 0.04 -0.49 -0.09 0.00 -0.56 0.00 0.00 56.30 55.21 1jti h ASN 88 Cb 0.58 -0.27 -0.02 0.00 -1.06 0.00 0.00 38.32 37.55 1jti h ASN 88 CO 0.04 1.24 0.05 1.56 -1.06 0.00 0.00 177.43 179.26 1jti h GLN 89 N 0.67 1.04 -0.00 0.81 4.20 -0.91 -3.15 115.11 117.76 1jti h GLN 89 Ca 0.05 -0.30 0.00 0.00 0.06 0.00 0.00 58.65 58.46 1jti h GLN 89 Cb 1.00 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.67 1jti h GLN 89 CO 0.10 0.99 -0.33 0.44 -0.67 0.00 0.00 178.83 179.36 1jti n ILE 90 N -4.20 0.00 -2.66 2.54 -5.35 -0.95 -4.81 119.36 103.93 1jti n ILE 90 Ca 0.04 -0.07 -0.43 0.00 -0.27 0.00 0.00 62.75 62.01 1jti n ILE 90 Cb 0.32 0.28 -0.02 0.00 -1.74 0.00 0.00 39.64 38.48 1jti n ILE 90 CO 0.00 0.00 0.00 -0.89 -1.76 0.00 0.00 176.55 173.90 1jti s THR 91 N -2.69 4.54 0.00 7.28 2.01 -0.89 -4.44 115.64 121.44 1jti s THR 91 Ca 0.20 1.72 0.00 0.00 0.31 0.00 0.00 61.69 63.92 1jti s THR 91 Cb 0.19 -4.39 0.00 0.00 0.01 0.00 0.00 72.50 68.30 1jti s THR 91 CO 0.58 -0.45 0.00 0.29 -0.69 0.00 0.00 174.62 174.35 1jti n LYS 92 N 6.80 0.00 -0.10 4.92 5.02 -1.22 -4.97 118.16 128.61 1jti n LYS 92 Ca 0.11 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.40 1jti n LYS 92 Cb 0.47 -0.01 0.00 0.00 -0.02 0.00 0.00 35.03 35.47 1jti n LYS 92 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1jti n ASN 94 N -0.07 0.00 0.00 4.39 5.15 -1.25 -4.99 115.26 118.49 1jti n ASN 94 Ca 0.00 -0.05 0.00 0.00 -0.60 0.00 0.00 54.58 53.93 1jti n ASN 94 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 1jti n ASN 94 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 1jti n ASP 95 N -0.01 0.00 0.00 1.20 2.03 -1.26 -4.38 116.55 114.13 1jti n ASP 95 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1jti n ASP 95 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1jti n ASP 95 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 1jti n VAL 96 N 0.00 0.92 -3.65 5.18 0.24 -1.26 -5.03 118.33 114.73 1jti n VAL 96 Ca 0.00 -0.93 -0.01 0.00 -2.04 0.00 0.00 64.34 61.36 1jti n VAL 96 Cb 0.00 0.54 -0.07 0.00 -1.47 0.00 0.00 33.84 32.85 1jti n VAL 96 CO 0.00 0.00 0.00 -0.72 -2.14 0.00 0.00 176.83 173.97 1jti s TYR 97 N -0.92 -0.13 0.01 6.34 -0.85 -1.26 -2.21 117.35 118.33 1jti s TYR 97 Ca 0.00 0.29 0.04 0.00 -0.52 0.00 0.00 57.07 56.88 1jti s TYR 97 Cb 0.00 0.28 -0.01 0.00 0.38 0.00 0.00 41.96 42.61 1jti s TYR 97 CO 0.00 -0.07 -0.12 -1.54 -1.52 0.00 0.00 175.55 172.30 1jti s SER 98 N 0.56 1.41 -0.02 -0.18 1.04 -0.14 -3.87 113.70 112.51 1jti s SER 98 Ca -0.01 -0.32 -0.00 0.00 0.48 0.00 0.00 55.95 56.10 1jti s SER 98 Cb -0.04 -0.12 0.02 0.00 0.10 0.00 0.00 66.02 65.98 1jti s SER 98 CO -0.13 0.08 0.04 0.12 0.98 0.00 0.00 173.24 174.33 1jti s PHE 99 N -0.55 -0.00 -0.09 5.02 5.36 -1.26 -1.02 117.98 125.45 1jti s PHE 99 Ca 0.02 0.14 -0.10 0.00 -0.96 0.00 0.00 56.93 56.03 1jti s PHE 99 Cb -0.06 -0.14 0.02 0.00 -0.34 0.00 0.00 43.02 42.50 1jti s PHE 99 CO 0.00 -0.07 0.27 -1.54 -1.46 0.00 0.00 175.22 172.42 1jti s SER 100 N 0.74 -0.26 -0.17 6.13 1.04 0.01 -3.41 113.70 117.78 1jti s SER 100 Ca -0.06 0.47 -0.02 0.00 0.48 0.00 0.00 55.95 56.82 1jti s SER 100 Cb -0.09 0.52 0.05 0.00 0.10 0.00 0.00 66.02 66.60 1jti s SER 100 CO -0.02 -0.14 0.01 -0.22 0.98 0.00 0.00 173.24 173.84 1jti s LEU 101 N -0.07 1.29 -0.12 2.42 2.96 -1.26 -1.04 118.68 122.86 1jti s LEU 101 Ca -0.02 -0.71 -0.02 0.00 -0.22 0.00 0.00 54.13 53.17 1jti s LEU 101 Cb -0.03 -0.68 -0.03 0.00 0.50 0.00 0.00 46.19 45.96 1jti s LEU 101 CO 0.01 -0.26 -0.06 0.00 -1.32 0.00 0.00 176.35 174.71 1jti s ALA 102 N 1.79 2.92 0.24 5.97 0.00 -0.50 -4.96 121.76 127.24 1jti s ALA 102 Ca -0.00 -0.85 0.10 0.00 0.00 0.00 0.00 51.96 51.20 1jti s ALA 102 Cb -0.16 -1.39 -0.04 0.00 0.00 0.00 0.00 23.12 21.53 1jti s ALA 102 CO -0.07 0.34 -0.05 -1.12 0.00 0.00 0.00 175.76 174.85 1jti s SER 103 N -0.01 4.37 -0.07 0.00 0.01 -1.26 -1.00 113.70 115.73 1jti s SER 103 Ca -0.00 -0.67 -0.20 0.00 1.31 0.00 0.00 55.95 56.39 1jti s SER 103 Cb -0.13 -0.75 0.04 0.00 0.21 0.00 0.00 66.02 65.38 1jti s SER 103 CO 0.03 0.03 0.46 -0.13 0.41 0.00 0.00 173.24 174.04 1jti s ARG 104 N -3.43 0.74 -0.18 12.44 0.52 -0.14 -3.51 118.95 125.40 1jti s ARG 104 Ca 0.30 0.17 0.01 0.00 -0.52 0.00 0.00 55.73 55.69 1jti s ARG 104 Cb -0.07 0.34 0.02 0.00 0.52 0.00 0.00 34.95 35.77 1jti s ARG 104 CO 0.18 -0.19 -0.17 -0.51 0.02 0.00 0.00 175.30 174.63 1jti s LEU 105 N -0.83 2.07 -0.30 2.53 1.02 -0.47 -2.01 118.68 120.68 1jti s LEU 105 Ca -0.09 -0.66 -0.09 0.00 0.02 0.00 0.00 54.13 53.31 1jti s LEU 105 Cb -0.03 -1.38 -0.01 0.00 0.02 0.00 0.00 46.19 44.79 1jti s LEU 105 CO 0.05 -0.04 0.14 -0.31 0.02 0.00 0.00 176.35 176.21 1jti s TYR 106 N 1.35 3.17 0.08 0.29 1.51 -0.73 -0.26 117.35 122.75 1jti s TYR 106 Ca 0.04 -0.57 0.06 0.00 -1.01 0.00 0.00 57.07 55.59 1jti s TYR 106 Cb -0.14 -2.33 -0.03 0.00 -0.11 0.00 0.00 41.96 39.35 1jti s TYR 106 CO -0.12 -0.45 -0.17 0.00 -1.11 0.00 0.00 175.55 173.71 1jti s ALA 107 N 1.61 1.45 0.82 3.71 0.00 -0.73 -0.92 121.76 127.69 1jti s ALA 107 Ca 0.05 -1.07 -0.15 0.00 0.00 0.00 0.00 51.96 50.79 1jti s ALA 107 Cb -0.17 -0.18 -0.02 0.00 0.00 0.00 0.00 23.12 22.75 1jti s ALA 107 CO 0.06 0.26 0.41 -1.91 0.00 0.00 0.00 175.76 174.58 1jti n GLU 108 N 1.33 0.06 -1.63 0.00 4.07 -1.02 -0.57 120.64 122.88 1jti n GLU 108 Ca -0.20 0.06 -0.43 0.00 -0.06 0.00 0.00 57.16 56.54 1jti n GLU 108 Cb 0.54 -1.79 -0.03 0.00 -0.06 0.00 0.00 31.44 30.10 1jti n GLU 108 CO 0.00 0.00 0.00 -1.21 -0.06 0.00 0.00 177.13 175.86 1jti s GLU 109 N -3.03 3.47 -0.88 5.31 0.41 -0.78 -3.35 118.70 119.85 1jti s GLU 109 Ca 0.61 2.22 -0.06 0.00 -0.41 0.00 0.00 54.97 57.33 1jti s GLU 109 Cb -0.29 -4.30 0.00 0.00 -1.78 0.00 0.00 34.13 27.76 1jti s GLU 109 CO 0.63 -1.72 0.67 0.54 -0.49 0.00 0.00 175.26 174.89 1jti n ARG 110 N 8.34 -1.35 -4.08 1.61 5.12 -1.26 -4.99 116.66 120.05 1jti n ARG 110 Ca 0.26 0.88 -0.32 0.00 -1.93 0.00 0.00 57.85 56.74 1jti n ARG 110 Cb 0.44 -3.65 -0.07 0.00 -1.16 0.00 0.00 32.46 28.02 1jti n ARG 110 CO 0.00 0.00 0.00 -0.47 -1.93 0.00 0.00 177.63 175.23 1jti s TYR 111 N -3.11 3.23 -0.36 -1.55 5.04 -1.21 -4.99 117.35 114.39 1jti s TYR 111 Ca 0.12 0.13 -0.12 0.00 -2.44 0.00 0.00 57.07 54.76 1jti s TYR 111 Cb -0.05 -1.67 -0.13 0.00 0.35 0.00 0.00 41.96 40.46 1jti s TYR 111 CO 0.85 0.53 1.57 -2.30 -1.34 0.00 0.00 175.55 174.86 1jti n PRO 112 N 0.81 0.78 -3.03 4.97 -0.02 -1.26 -4.84 135.00 132.41 1jti n PRO 112 Ca -0.11 -1.08 -0.44 0.00 -2.02 0.00 0.00 63.50 59.85 1jti n PRO 112 Cb 0.52 -2.38 -0.05 0.00 -0.02 0.00 0.00 33.50 31.57 1jti n PRO 112 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1jti s ILE 113 N 5.05 4.66 -0.27 4.25 1.01 -1.26 -4.25 121.20 130.39 1jti s ILE 113 Ca 0.35 -0.55 -0.25 0.00 0.00 0.00 0.00 60.65 60.19 1jti s ILE 113 Cb 0.08 -4.49 -0.11 0.00 0.01 0.00 0.00 42.46 37.95 1jti s ILE 113 CO 0.09 -1.12 0.86 0.18 0.00 0.00 0.00 174.94 174.95 1jti n LEU 114 N 6.77 0.65 -0.24 2.97 4.77 -0.22 -4.77 117.00 126.93 1jti n LEU 114 Ca -0.06 0.64 0.04 0.00 -0.03 0.00 0.00 56.01 56.60 1jti n LEU 114 Cb 0.45 -0.47 0.14 0.00 -2.33 0.00 0.00 43.42 41.20 1jti n LEU 114 CO 0.59 -0.45 0.84 1.55 -1.33 0.00 0.00 177.39 178.59 1jti h PRO 115 N 2.69 0.12 0.00 3.23 0.13 -1.93 -0.62 132.00 135.63 1jti h PRO 115 Ca -0.24 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 64.87 1jti h PRO 115 Cb 0.74 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 31.84 1jti h PRO 115 CO 0.53 0.08 -0.06 1.05 -0.23 0.00 0.00 178.00 179.37 1jti h GLU 116 N 0.12 0.00 0.20 0.86 9.09 -1.97 -1.79 114.58 121.10 1jti h GLU 116 Ca 0.38 0.00 -0.01 0.00 0.05 0.00 0.00 59.36 59.78 1jti h GLU 116 Cb 0.65 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.75 1jti h GLU 116 CO -0.60 0.06 -0.10 -0.92 0.05 0.00 0.00 179.01 177.50 1jti h TYR 117 N 0.00 -0.25 -0.26 2.06 3.20 -1.39 -1.24 116.97 119.09 1jti h TYR 117 Ca -0.00 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.85 1jti h TYR 117 Cb 0.15 0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.48 1jti h TYR 117 CO 0.00 -0.01 0.08 -0.07 -1.64 0.00 0.00 178.16 176.53 1jti h LEU 118 N -0.47 0.32 0.81 2.82 3.38 -1.44 -1.70 115.31 119.03 1jti h LEU 118 Ca -0.03 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.87 1jti h LEU 118 Cb 0.36 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 41.04 1jti h LEU 118 CO 0.05 0.31 -0.39 1.56 0.09 0.00 0.00 178.44 180.06 1jti h GLN 119 N 0.36 -1.05 0.18 1.13 7.50 -0.99 -2.53 115.11 119.70 1jti h GLN 119 Ca 0.09 0.07 -0.01 0.00 0.50 0.00 0.00 58.65 59.30 1jti h GLN 119 Cb 0.11 0.24 0.00 0.00 0.05 0.00 0.00 27.48 27.88 1jti h GLN 119 CO -0.01 -0.69 -0.09 0.00 -1.50 0.00 0.00 178.83 176.55 1jti h VAL 121 N -0.25 0.60 -0.16 0.00 2.07 -1.37 0.74 116.25 117.88 1jti h VAL 121 Ca -0.02 -0.16 -0.21 0.00 0.82 0.00 0.00 66.70 67.13 1jti h VAL 121 Cb 0.19 0.09 0.01 0.00 -1.52 0.00 0.00 31.29 30.06 1jti h VAL 121 CO 0.04 0.09 -0.72 0.50 0.02 0.00 0.00 177.57 177.49 1jti h LYS 122 N 0.47 0.72 0.30 1.57 3.64 -0.98 -1.34 116.57 120.95 1jti h LYS 122 Ca 0.56 -0.56 -0.01 0.00 -1.27 0.00 0.00 60.65 59.36 1jti h LYS 122 Cb 1.30 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 33.23 1jti h LYS 122 CO -0.28 1.18 -0.14 0.93 -2.27 0.00 0.00 179.45 178.87 1jti h GLU 123 N 0.51 -0.38 0.06 1.90 3.07 0.19 -2.76 114.58 117.16 1jti h GLU 123 Ca -0.04 0.03 -0.28 0.00 -0.50 0.00 0.00 59.36 58.57 1jti h GLU 123 Cb 1.33 0.09 0.02 0.00 -0.84 0.00 0.00 28.75 29.35 1jti h GLU 123 CO 0.15 -0.26 -1.13 -0.07 -1.40 0.00 0.00 179.01 176.30 1jti h LEU 124 N -0.55 0.83 -2.27 1.33 3.38 0.04 -3.35 115.31 114.72 1jti h LEU 124 Ca -0.04 -0.71 0.00 0.00 0.09 0.00 0.00 57.88 57.21 1jti h LEU 124 Cb 0.31 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1jti h LEU 124 CO 0.07 1.52 0.00 -1.22 0.09 0.00 0.00 178.44 178.90 1jti n TYR 125 N -3.80 0.39 -2.75 1.13 4.01 -0.58 -4.77 117.16 110.79 1jti n TYR 125 Ca -0.11 -0.26 -0.16 0.00 -0.16 0.00 0.00 57.90 57.21 1jti n TYR 125 Cb 0.93 -0.01 -0.00 0.00 -0.31 0.00 0.00 39.34 39.95 1jti n TYR 125 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1jti n ARG 126 N 1.10 -2.78 -3.07 -0.72 1.74 -0.78 -4.65 116.66 107.50 1jti n ARG 126 Ca 0.15 0.58 -0.40 0.00 -0.77 0.00 0.00 57.85 57.41 1jti n ARG 126 Cb 0.50 -5.23 -0.05 0.00 -1.02 0.00 0.00 32.46 26.66 1jti n ARG 126 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1jti s GLY 127 N -2.28 2.68 0.25 -0.13 0.00 -0.89 -4.66 107.32 102.29 1jti s GLY 127 Ca 0.14 0.16 -0.16 0.00 0.00 0.00 0.00 44.72 44.86 1jti s GLY 127 CO 0.17 1.03 0.69 -0.32 0.00 0.00 0.00 173.10 174.67 1jti s GLY 128 N 0.21 2.44 -0.24 0.20 0.00 -1.23 -4.08 107.32 104.63 1jti s GLY 128 Ca 0.36 0.03 -0.10 0.00 0.00 0.00 0.00 44.72 45.00 1jti s GLY 128 CO 0.20 0.29 0.15 -2.27 0.00 0.00 0.00 173.10 171.47 1jti s LEU 129 N -2.48 4.10 -0.17 0.66 1.98 -1.26 -1.37 118.68 120.14 1jti s LEU 129 Ca 0.47 0.11 -0.01 0.00 -2.89 0.00 0.00 54.13 51.82 1jti s LEU 129 Cb -0.13 -2.10 -0.00 0.00 0.66 0.00 0.00 46.19 44.62 1jti s LEU 129 CO 0.19 0.07 -0.13 -1.61 -1.89 0.00 0.00 176.35 172.98 1jti s GLU 130 N 1.03 3.25 -0.20 1.98 0.41 0.64 -4.97 118.70 120.83 1jti s GLU 130 Ca 0.07 -0.72 -0.29 0.00 -0.41 0.00 0.00 54.97 53.62 1jti s GLU 130 Cb -0.13 -2.70 -0.00 0.00 -1.78 0.00 0.00 34.13 29.52 1jti s GLU 130 CO 0.04 -0.02 1.14 -1.25 -0.49 0.00 0.00 175.26 174.68 1jti s PRO 131 N 0.92 4.24 0.15 0.39 0.04 -1.26 -1.78 135.00 137.70 1jti s PRO 131 Ca -0.03 1.48 0.07 0.00 0.04 0.00 0.00 61.00 62.57 1jti s PRO 131 Cb -0.15 -3.70 -0.04 0.00 0.04 0.00 0.00 34.50 30.65 1jti s PRO 131 CO -0.01 -0.67 -0.16 -1.50 0.04 0.00 0.00 177.00 174.69 1jti s ILE 132 N 3.35 1.63 -0.68 0.56 1.10 0.27 -4.93 121.20 122.51 1jti s ILE 132 Ca 0.49 -1.86 -0.12 0.00 -0.51 0.00 0.00 60.65 58.65 1jti s ILE 132 Cb -0.18 -1.75 0.17 0.00 0.15 0.00 0.00 42.46 40.86 1jti s ILE 132 CO 0.10 -0.37 0.59 0.21 -2.11 0.00 0.00 174.94 173.36 1jti s ASN 133 N -2.63 6.22 -0.15 4.50 2.47 -1.26 -1.87 114.94 122.20 1jti s ASN 133 Ca 0.14 -2.41 -0.24 0.00 0.42 0.00 0.00 52.86 50.77 1jti s ASN 133 Cb -0.05 -2.12 -0.24 0.00 -1.45 0.00 0.00 41.25 37.39 1jti s ASN 133 CO 0.05 -0.62 0.53 -0.26 -3.72 0.00 0.00 177.10 173.09 1jti h PHE 134 N 7.99 0.10 -0.85 0.43 0.04 -1.87 -2.82 116.94 119.96 1jti h PHE 134 Ca -0.05 -0.08 0.16 0.00 2.80 0.00 0.00 57.97 60.80 1jti h PHE 134 Cb 1.04 -0.00 -0.16 0.00 2.20 0.00 0.00 35.95 39.03 1jti h PHE 134 CO 0.85 1.29 -0.27 1.96 -0.60 0.00 0.00 178.31 181.55 1jti h GLN 135 N -0.85 -0.02 -0.02 1.51 1.08 -1.82 -2.51 115.11 112.48 1jti h GLN 135 Ca -0.19 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.01 1jti h GLN 135 Cb 1.28 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 28.71 1jti h GLN 135 CO -0.06 -0.02 0.00 0.25 -0.95 0.00 0.00 178.83 178.05 1jti n THR 136 N -5.52 0.90 -2.71 -0.54 -2.24 -1.26 -4.59 114.28 98.32 1jti n THR 136 Ca 0.11 -0.95 -0.04 0.00 -2.27 0.00 0.00 64.05 60.90 1jti n THR 136 Cb 0.42 0.55 0.10 0.00 -2.10 0.00 0.00 70.33 69.30 1jti n THR 136 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1jti n ALA 137 N -0.40 2.42 0.29 6.98 0.00 -1.07 -4.92 120.51 123.81 1jti n ALA 137 Ca 0.01 -1.74 0.14 0.00 0.00 0.00 0.00 53.44 51.85 1jti n ALA 137 Cb 0.23 -0.90 0.86 0.00 0.00 0.00 0.00 19.45 19.64 1jti n ALA 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jti h ALA 138 N 1.91 1.47 -0.44 0.00 0.00 -1.41 -0.79 119.26 119.99 1jti h ALA 138 Ca -0.29 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.55 1jti h ALA 138 Cb 1.28 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 1jti h ALA 138 CO 0.02 0.04 0.10 0.38 0.00 0.00 0.00 179.25 179.80 1jti h ASP 139 N 0.00 0.67 0.22 0.00 2.03 -1.88 -2.18 116.42 115.29 1jti h ASP 139 Ca -0.00 -0.24 -0.25 0.00 -0.73 0.00 0.00 57.03 55.82 1jti h ASP 139 Cb 0.09 -0.18 0.01 0.00 -0.83 0.00 0.00 39.33 38.42 1jti h ASP 139 CO 0.00 0.73 -1.02 -0.61 -1.03 0.00 0.00 179.24 177.32 1jti h GLN 140 N 0.58 0.52 -0.19 4.15 4.15 -1.59 -3.22 115.11 119.50 1jti h GLN 140 Ca 0.14 -0.58 0.03 0.00 0.77 0.00 0.00 58.65 59.01 1jti h GLN 140 Cb 0.33 0.17 -0.03 0.00 0.21 0.00 0.00 27.48 28.15 1jti h GLN 140 CO 0.00 1.21 -0.02 0.00 -1.93 0.00 0.00 178.83 178.09 1jti h ALA 141 N 0.58 0.15 -0.38 3.38 0.00 -1.10 -1.46 119.26 120.44 1jti h ALA 141 Ca -0.11 0.06 0.07 0.00 0.00 0.00 0.00 54.91 54.93 1jti h ALA 141 Cb 1.66 0.11 -0.06 0.00 0.00 0.00 0.00 17.79 19.50 1jti h ALA 141 CO 0.19 -0.45 0.00 -0.09 0.00 0.00 0.00 179.25 178.90 1jti h ARG 142 N 0.04 0.10 0.00 0.00 2.43 -1.47 -1.04 114.38 114.45 1jti h ARG 142 Ca 0.09 -0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.20 1jti h ARG 142 Cb 0.12 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 1jti h ARG 142 CO -0.17 0.07 -0.27 0.93 -1.51 0.00 0.00 179.97 179.02 1jti h GLU 143 N 0.11 0.00 -0.09 0.20 5.08 -1.51 -0.82 114.58 117.54 1jti h GLU 143 Ca 0.18 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.49 1jti h GLU 143 Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1jti h GLU 143 CO -0.30 0.27 -0.16 -0.07 -1.00 0.00 0.00 179.01 177.74 1jti h LEU 144 N 0.00 0.31 0.04 1.33 -0.00 -0.52 -2.01 115.31 114.46 1jti h LEU 144 Ca -0.00 -0.55 -0.00 0.00 -0.00 0.00 0.00 57.88 57.33 1jti h LEU 144 Cb 0.72 -0.09 0.00 0.00 -0.00 0.00 0.00 40.66 41.30 1jti h LEU 144 CO 0.04 0.80 -0.02 0.40 -0.00 0.00 0.00 178.44 179.65 1jti h ILE 145 N -0.17 1.04 -0.73 1.22 2.04 -1.01 -1.92 117.51 117.97 1jti h ILE 145 Ca 0.01 -0.27 0.06 0.00 1.00 0.00 0.00 64.86 65.66 1jti h ILE 145 Cb 0.74 1.22 -0.06 0.00 -0.74 0.00 0.00 36.82 37.98 1jti h ILE 145 CO 0.04 0.07 0.43 0.78 0.00 0.00 0.00 178.15 179.46 1jti h ASN 146 N -0.18 0.66 -0.63 1.72 2.35 -1.21 -1.06 115.58 117.23 1jti h ASN 146 Ca -0.01 0.02 0.06 0.00 -0.55 0.00 0.00 56.30 55.83 1jti h ASN 146 Cb 0.16 -0.11 -0.04 0.00 0.05 0.00 0.00 38.32 38.38 1jti h ASN 146 CO 0.01 0.43 0.42 -1.28 -1.65 0.00 0.00 177.43 175.35 1jti h SER 147 N 0.79 0.55 -0.08 5.81 0.87 -1.10 0.12 113.55 120.50 1jti h SER 147 Ca 0.32 0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.79 1jti h SER 147 Cb 0.17 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 62.01 1jti h SER 147 CO -0.17 0.36 -0.30 -0.25 -0.53 0.00 0.00 176.83 175.94 1jti h TRP 148 N 0.63 0.46 -0.81 2.24 7.01 -0.42 -2.21 115.95 122.84 1jti h TRP 148 Ca 0.27 -0.19 -0.03 0.00 2.11 0.00 0.00 58.89 61.05 1jti h TRP 148 Cb 0.27 -0.07 -0.04 0.00 -2.10 0.00 0.00 29.16 27.21 1jti h TRP 148 CO -0.00 0.91 0.40 0.28 -2.79 0.00 0.00 178.44 177.25 1jti h VAL 149 N -0.13 1.25 -0.37 2.65 2.07 -0.79 -1.31 116.25 119.62 1jti h VAL 149 Ca -0.01 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 66.83 1jti h VAL 149 Cb 0.93 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 1jti h VAL 149 CO 0.06 0.29 0.21 -0.08 0.02 0.00 0.00 177.57 178.07 1jti h GLU 150 N 1.14 0.51 -0.08 1.57 4.81 -0.75 -2.34 114.58 119.44 1jti h GLU 150 Ca 0.28 -0.06 -0.11 0.00 -0.13 0.00 0.00 59.36 59.35 1jti h GLU 150 Cb 0.09 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 1jti h GLU 150 CO -0.04 0.41 -0.44 1.03 -0.73 0.00 0.00 179.01 179.24 1jti h SER 151 N 0.48 0.21 1.13 1.04 0.87 -1.07 0.33 113.55 116.53 1jti h SER 151 Ca 0.13 -0.09 -0.02 0.00 -1.23 0.00 0.00 61.79 60.58 1jti h SER 151 Cb 0.04 -0.06 -0.00 0.00 -0.44 0.00 0.00 62.40 61.94 1jti h SER 151 CO -0.02 0.62 -0.11 1.56 -0.53 0.00 0.00 176.83 178.35 1jti h GLN 152 N 0.16 0.00 -0.48 2.24 1.08 -1.00 -3.03 115.11 114.09 1jti h GLN 152 Ca 0.01 0.00 -0.20 0.00 -1.45 0.00 0.00 58.65 57.01 1jti h GLN 152 Cb 0.84 0.00 -0.12 0.00 -0.05 0.00 0.00 27.48 28.15 1jti h GLN 152 CO 0.07 0.11 0.09 0.25 -0.95 0.00 0.00 178.83 178.40 1jti n THR 153 N -3.22 2.65 -4.08 -0.54 -2.24 -0.90 -4.87 114.28 101.08 1jti n THR 153 Ca 0.01 -2.32 -0.34 0.00 -2.27 0.00 0.00 64.05 59.13 1jti n THR 153 Cb 0.40 -0.34 -0.01 0.00 -2.10 0.00 0.00 70.33 68.28 1jti n THR 153 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1jti n ASN 154 N -0.90 -3.79 0.00 3.42 4.13 -1.08 -0.94 115.26 116.11 1jti n ASN 154 Ca 0.36 -0.90 0.00 0.00 1.68 0.00 0.00 54.58 55.72 1jti n ASN 154 Cb 1.15 -3.07 0.00 0.00 -1.54 0.00 0.00 39.78 36.32 1jti n ASN 154 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1jti n GLY 155 N -1.45 1.37 0.20 7.41 0.00 0.11 -4.90 105.19 107.92 1jti n GLY 155 Ca 0.07 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.92 1jti n GLY 155 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1jti h ILE 156 N 0.00 1.31 -3.45 -0.61 2.04 -1.23 -3.41 117.51 112.17 1jti h ILE 156 Ca 0.00 -2.15 -0.72 0.00 1.00 0.00 0.00 64.86 62.99 1jti h ILE 156 Cb 0.00 2.18 -0.27 0.00 -0.74 0.00 0.00 36.82 37.99 1jti h ILE 156 CO 0.00 0.66 -0.46 -0.63 0.00 0.00 0.00 178.15 177.73 1jti s ILE 157 N -3.53 4.35 0.14 -0.67 1.01 -1.26 -5.05 121.20 116.18 1jti s ILE 157 Ca -0.09 -1.33 0.06 0.00 0.00 0.00 0.00 60.65 59.30 1jti s ILE 157 Cb 0.08 -3.64 -0.04 0.00 0.01 0.00 0.00 42.46 38.88 1jti s ILE 157 CO 0.89 -0.49 0.00 -0.13 0.00 0.00 0.00 174.94 175.21 1jti s ARG 158 N 1.45 2.46 -1.35 2.79 0.52 -1.26 -3.45 118.95 120.11 1jti s ARG 158 Ca 0.03 -0.99 -0.15 0.00 -0.52 0.00 0.00 55.73 54.10 1jti s ARG 158 Cb -0.23 -2.44 0.02 0.00 0.52 0.00 0.00 34.95 32.82 1jti s ARG 158 CO 0.03 0.49 0.42 0.09 0.02 0.00 0.00 175.30 176.35 1jti n ASN 159 N 0.16 -1.87 0.26 0.23 3.02 -1.26 -4.81 115.26 110.99 1jti n ASN 159 Ca -0.10 -1.21 0.16 0.00 -0.03 0.00 0.00 54.58 53.40 1jti n ASN 159 Cb 0.54 -2.11 0.87 0.00 -0.61 0.00 0.00 39.78 38.47 1jti n ASN 159 CO 0.00 0.00 0.00 1.62 -2.62 0.00 0.00 177.26 176.26 1jti h VAL 160 N -2.12 0.53 -3.52 2.41 3.04 -1.87 -3.37 116.25 111.35 1jti h VAL 160 Ca -0.68 0.00 -0.66 0.00 -1.01 0.00 0.00 66.70 64.35 1jti h VAL 160 Cb 1.39 0.94 -0.27 0.00 -2.01 0.00 0.00 31.29 31.34 1jti h VAL 160 CO 0.60 0.00 -0.68 -0.76 -1.01 0.00 0.00 177.57 175.72 1jti s LEU 161 N -7.74 3.31 0.60 3.16 1.43 -1.26 -5.00 118.68 113.18 1jti s LEU 161 Ca -0.05 -0.49 -0.12 0.00 -1.03 0.00 0.00 54.13 52.44 1jti s LEU 161 Cb 0.15 -1.81 -0.05 0.00 0.03 0.00 0.00 46.19 44.51 1jti s LEU 161 CO 0.56 -0.08 1.02 0.00 0.23 0.00 0.00 176.35 178.07 1jti s GLN 162 N 1.50 3.67 0.13 1.70 -2.07 -1.26 -4.96 119.66 118.37 1jti s GLN 162 Ca 0.04 0.80 -0.33 0.00 -1.82 0.00 0.00 55.36 54.06 1jti s GLN 162 Cb -0.15 -2.09 -0.18 0.00 -1.09 0.00 0.00 33.01 29.50 1jti s GLN 162 CO -0.00 -0.51 0.86 -2.30 -1.32 0.00 0.00 175.29 172.01 1jti n PRO 163 N -2.48 0.31 -4.02 9.60 -0.02 -1.26 -2.24 135.00 134.88 1jti n PRO 163 Ca 0.06 0.11 -0.27 0.00 -2.02 0.00 0.00 63.50 61.38 1jti n PRO 163 Cb 0.54 -1.39 -0.03 0.00 -0.02 0.00 0.00 33.50 32.59 1jti n PRO 163 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1jti n SER 164 N 1.80 -0.26 -0.35 2.55 7.64 -1.26 -4.80 113.62 118.95 1jti n SER 164 Ca 0.18 -1.07 0.11 0.00 1.01 0.00 0.00 58.87 59.09 1jti n SER 164 Cb 0.20 -2.74 -0.03 0.00 -1.01 0.00 0.00 64.21 60.63 1jti n SER 164 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1jti n SER 165 N -2.94 1.71 -3.81 6.43 3.41 -0.95 -4.84 113.62 112.63 1jti n SER 165 Ca -0.31 -1.35 -0.12 0.00 -0.26 0.00 0.00 58.87 56.83 1jti n SER 165 Cb 0.68 0.63 -0.12 0.00 -0.26 0.00 0.00 64.21 65.14 1jti n SER 165 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1jti s VAL 166 N -2.63 0.01 0.00 -3.33 -7.23 -1.26 -4.82 120.40 101.14 1jti s VAL 166 Ca 0.15 -0.11 0.00 0.00 -1.81 0.00 0.00 61.98 60.22 1jti s VAL 166 Cb 0.17 -0.31 0.00 0.00 0.56 0.00 0.00 36.38 36.81 1jti s VAL 166 CO 0.66 -0.06 0.00 -0.90 -0.31 0.00 0.00 175.10 174.49 1jti n ASP 167 N 2.72 0.00 0.00 4.85 5.68 -1.26 -4.88 116.55 123.66 1jti n ASP 167 Ca -0.14 -0.46 0.04 0.00 -0.50 0.00 0.00 54.79 53.73 1jti n ASP 167 Cb 0.58 0.00 0.22 0.00 -1.14 0.00 0.00 41.12 40.78 1jti n ASP 167 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1jti n SER 168 N -1.15 0.00 -0.81 -1.12 3.41 -1.26 -1.53 113.62 111.17 1jti n SER 168 Ca 0.00 0.09 0.08 0.00 -0.26 0.00 0.00 58.87 58.78 1jti n SER 168 Cb 0.00 -0.24 0.16 0.00 -0.26 0.00 0.00 64.21 63.87 1jti n SER 168 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1jti n GLN 169 N -1.24 2.14 -2.87 4.33 1.13 -1.26 -4.35 117.38 115.27 1jti n GLN 169 Ca 0.04 -1.94 -0.41 0.00 -1.94 0.00 0.00 57.00 52.75 1jti n GLN 169 Cb 0.06 -1.36 -0.04 0.00 0.11 0.00 0.00 30.24 29.02 1jti n GLN 169 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 1jti s THR 170 N -1.15 4.93 -0.19 5.09 2.01 -0.58 -1.25 115.64 124.50 1jti s THR 170 Ca 0.27 1.74 0.06 0.00 0.31 0.00 0.00 61.69 64.07 1jti s THR 170 Cb 0.16 -4.18 -0.22 0.00 0.01 0.00 0.00 72.50 68.27 1jti s THR 170 CO 0.22 0.15 0.08 0.00 -0.69 0.00 0.00 174.62 174.38 1jti n ALA 171 N 4.27 1.36 -3.54 7.40 0.00 0.61 -4.74 120.51 125.88 1jti n ALA 171 Ca 0.03 -1.03 -0.17 0.00 0.00 0.00 0.00 53.44 52.27 1jti n ALA 171 Cb 0.50 -0.33 -0.06 0.00 0.00 0.00 0.00 19.45 19.56 1jti n ALA 171 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 1jti s MET 172 N -2.53 1.01 -0.18 0.00 -2.45 -0.84 -2.44 119.30 111.86 1jti s MET 172 Ca -0.22 0.33 -0.00 0.00 -1.25 0.00 0.00 55.69 54.55 1jti s MET 172 Cb 0.08 0.48 0.04 0.00 1.25 0.00 0.00 34.83 36.67 1jti s MET 172 CO 0.73 -0.30 -0.07 0.08 1.05 0.00 0.00 175.02 176.51 1jti s VAL 173 N -1.02 1.26 -0.03 10.11 1.01 -0.10 0.78 120.40 132.40 1jti s VAL 173 Ca -0.09 -0.74 -0.19 0.00 0.00 0.00 0.00 61.98 60.96 1jti s VAL 173 Cb -0.01 -1.41 -0.05 0.00 0.00 0.00 0.00 36.38 34.92 1jti s VAL 173 CO 0.08 0.14 0.53 -0.76 0.00 0.00 0.00 175.10 175.10 1jti s LEU 174 N 1.57 4.39 -0.19 3.92 1.43 0.23 -1.78 118.68 128.25 1jti s LEU 174 Ca 0.00 1.04 -0.18 0.00 -1.03 0.00 0.00 54.13 53.96 1jti s LEU 174 Cb -0.16 -2.81 0.05 0.00 0.03 0.00 0.00 46.19 43.31 1jti s LEU 174 CO -0.08 0.11 0.52 0.54 0.23 0.00 0.00 176.35 177.68 1jti s VAL 175 N -0.12 0.00 0.17 -1.59 0.11 -0.85 -0.56 120.40 117.56 1jti s VAL 175 Ca 0.29 -0.01 0.06 0.00 -2.93 0.00 0.00 61.98 59.39 1jti s VAL 175 Cb -0.17 -0.74 -0.04 0.00 -1.53 0.00 0.00 36.38 33.90 1jti s VAL 175 CO 0.15 -0.01 -0.13 0.54 -3.33 0.00 0.00 175.10 172.32 1jti s ASN 176 N 0.21 2.20 -0.02 3.54 2.20 0.05 -0.96 114.94 122.14 1jti s ASN 176 Ca -0.01 -0.98 0.03 0.00 -0.94 0.00 0.00 52.86 50.96 1jti s ASN 176 Cb -0.04 -0.08 0.00 0.00 -2.00 0.00 0.00 41.25 39.14 1jti s ASN 176 CO 0.01 -0.22 -0.09 0.00 -2.94 0.00 0.00 177.10 173.86 1jti s ALA 177 N -2.96 0.87 -0.03 3.54 0.00 -0.17 -2.66 121.76 120.35 1jti s ALA 177 Ca 0.18 -0.34 0.05 0.00 0.00 0.00 0.00 51.96 51.85 1jti s ALA 177 Cb -0.00 -0.31 -0.01 0.00 0.00 0.00 0.00 23.12 22.79 1jti s ALA 177 CO 0.04 0.14 -0.18 -1.50 0.00 0.00 0.00 175.76 174.26 1jti s ILE 178 N 0.16 1.47 -0.08 0.00 2.07 -0.11 -1.41 121.20 123.30 1jti s ILE 178 Ca -0.03 -0.76 -0.00 0.00 -1.41 0.00 0.00 60.65 58.45 1jti s ILE 178 Cb -0.08 -1.24 0.02 0.00 0.13 0.00 0.00 42.46 41.29 1jti s ILE 178 CO 0.00 0.42 -0.05 -0.69 -1.91 0.00 0.00 174.94 172.71 1jti s VAL 179 N -0.19 0.77 -0.06 4.00 1.01 -0.21 -0.56 120.40 125.16 1jti s VAL 179 Ca 0.01 -0.17 0.02 0.00 0.00 0.00 0.00 61.98 61.85 1jti s VAL 179 Cb -0.10 -0.81 0.02 0.00 0.00 0.00 0.00 36.38 35.49 1jti s VAL 179 CO 0.01 0.31 -0.10 0.12 0.00 0.00 0.00 175.10 175.44 1jti s PHE 180 N 1.51 1.21 -0.11 5.22 5.36 0.13 -0.81 117.98 130.50 1jti s PHE 180 Ca -0.00 -0.42 -0.02 0.00 -0.96 0.00 0.00 56.93 55.52 1jti s PHE 180 Cb -0.13 -0.93 0.04 0.00 -0.34 0.00 0.00 43.02 41.66 1jti s PHE 180 CO -0.04 -0.24 0.03 0.21 -1.46 0.00 0.00 175.22 173.72 1jti s LYS 181 N 0.71 0.41 -0.02 10.12 2.20 -0.19 -0.37 119.74 132.60 1jti s LYS 181 Ca -0.13 0.01 0.00 0.00 -0.36 0.00 0.00 55.97 55.49 1jti s LYS 181 Cb -0.15 -1.27 0.03 0.00 -1.51 0.00 0.00 37.83 34.92 1jti s LYS 181 CO 0.03 -0.44 0.01 0.20 -0.36 0.00 0.00 175.35 174.79 1jti s GLY 182 N 2.01 0.17 0.09 5.54 0.00 -0.37 -0.96 107.32 113.79 1jti s GLY 182 Ca 0.03 0.22 -0.30 0.00 0.00 0.00 0.00 44.72 44.68 1jti s GLY 182 CO -0.06 0.61 0.95 1.08 0.00 0.00 0.00 173.10 175.68 1jti s LEU 183 N 1.00 4.48 0.47 0.66 1.43 -0.94 -1.64 118.68 124.13 1jti s LEU 183 Ca -0.09 1.75 -0.23 0.00 -1.03 0.00 0.00 54.13 54.52 1jti s LEU 183 Cb -0.13 -3.56 -0.07 0.00 0.03 0.00 0.00 46.19 42.46 1jti s LEU 183 CO -0.02 -0.09 1.22 0.26 0.23 0.00 0.00 176.35 177.95 1jti s TRP 184 N 0.15 2.76 0.05 0.29 0.23 -0.75 0.11 118.94 121.80 1jti s TRP 184 Ca 0.47 1.49 -0.19 0.00 -2.03 0.00 0.00 56.10 55.84 1jti s TRP 184 Cb -0.23 -3.50 -0.13 0.00 0.03 0.00 0.00 33.47 29.64 1jti s TRP 184 CO 0.29 -1.85 1.38 1.49 0.96 0.00 0.00 176.95 179.22 1jti h GLU 185 N 2.05 0.41 -3.67 4.98 4.81 -1.59 -3.37 114.58 118.20 1jti h GLU 185 Ca -0.50 -0.20 -0.70 0.00 -0.13 0.00 0.00 59.36 57.84 1jti h GLU 185 Cb 1.26 -0.00 -0.35 0.00 0.63 0.00 0.00 28.75 30.28 1jti h GLU 185 CO 0.60 0.75 -0.39 0.15 -0.73 0.00 0.00 179.01 179.39 1jti s LYS 186 N -4.42 2.50 1.15 1.92 1.02 -1.26 -4.87 119.74 115.79 1jti s LYS 186 Ca -0.14 -2.47 -0.16 0.00 0.02 0.00 0.00 55.97 53.22 1jti s LYS 186 Cb 0.06 -3.71 0.26 0.00 -0.52 0.00 0.00 37.83 33.92 1jti s LYS 186 CO 0.76 -1.16 1.06 0.95 -0.92 0.00 0.00 175.35 176.04 1jti s THR 187 N 0.03 1.78 0.16 2.17 -4.23 -1.26 -5.06 115.64 109.24 1jti s THR 187 Ca 0.16 0.00 0.06 0.00 -1.18 0.00 0.00 61.69 60.73 1jti s THR 187 Cb -0.21 -2.36 -0.04 0.00 1.34 0.00 0.00 72.50 71.24 1jti s THR 187 CO -0.03 0.00 0.08 -0.36 -0.54 0.00 0.00 174.62 173.77 1jti s PHE 188 N -2.80 3.03 -0.01 3.99 0.40 -0.86 -5.02 117.98 116.72 1jti s PHE 188 Ca 0.68 -0.06 -0.16 0.00 -0.60 0.00 0.00 56.93 56.79 1jti s PHE 188 Cb -0.16 -1.46 -0.06 0.00 0.51 0.00 0.00 43.02 41.85 1jti s PHE 188 CO 0.59 0.52 0.46 0.15 0.70 0.00 0.00 175.22 177.63 1jti s LYS 189 N -3.01 4.07 0.13 0.44 1.02 -1.26 -4.69 119.74 116.44 1jti s LYS 189 Ca 0.29 0.49 -0.22 0.00 0.02 0.00 0.00 55.97 56.55 1jti s LYS 189 Cb -0.10 -3.27 -0.04 0.00 -0.52 0.00 0.00 37.83 33.90 1jti s LYS 189 CO 0.21 0.56 1.68 -0.44 -0.92 0.00 0.00 175.35 176.45 1jti h ASP 190 N 5.11 -0.40 -0.88 2.83 3.45 -1.97 -2.82 116.42 121.73 1jti h ASP 190 Ca -0.49 0.08 0.19 0.00 0.43 0.00 0.00 57.03 57.24 1jti h ASP 190 Cb 1.21 0.19 -0.11 0.00 -0.56 0.00 0.00 39.33 40.06 1jti h ASP 190 CO 0.65 -0.17 0.43 1.05 -1.57 0.00 0.00 179.24 179.62 1jti h GLU 191 N -0.17 0.50 0.00 3.56 4.11 -2.00 -0.30 114.58 120.29 1jti h GLU 191 Ca 0.08 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.48 1jti h GLU 191 Cb 0.29 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1jti h GLU 191 CO -0.21 0.33 0.00 -0.25 0.07 0.00 0.00 179.01 178.95 1jti n ASP 192 N -4.95 0.00 -4.61 3.06 10.43 -1.06 -4.72 116.55 114.69 1jti n ASP 192 Ca 0.20 -1.00 -0.40 0.00 2.57 0.00 0.00 54.79 56.16 1jti n ASP 192 Cb 0.56 0.00 -0.07 0.00 1.84 0.00 0.00 41.12 43.45 1jti n ASP 192 CO 0.00 0.00 0.00 -0.89 -1.07 0.00 0.00 177.20 175.24 1jti s THR 193 N -2.00 5.02 0.36 -3.53 2.01 -0.12 -4.03 115.64 113.35 1jti s THR 193 Ca 0.21 0.93 0.03 0.00 0.31 0.00 0.00 61.69 63.17 1jti s THR 193 Cb 0.10 -3.89 -0.05 0.00 0.01 0.00 0.00 72.50 68.67 1jti s THR 193 CO 0.16 0.02 0.09 -1.10 -0.69 0.00 0.00 174.62 173.10 1jti s GLN 194 N 2.42 1.76 0.50 4.92 -0.21 -0.99 -4.91 119.66 123.14 1jti s GLN 194 Ca 0.23 -2.02 -0.18 0.00 0.02 0.00 0.00 55.36 53.41 1jti s GLN 194 Cb -0.15 -0.73 -0.08 0.00 1.00 0.00 0.00 33.01 33.04 1jti s GLN 194 CO 0.09 -0.32 0.99 0.00 -2.12 0.00 0.00 175.29 173.94 1jti s ALA 195 N -3.29 3.01 -0.18 6.09 0.00 -1.26 0.45 121.76 126.58 1jti s ALA 195 Ca 0.31 0.29 -0.29 0.00 0.00 0.00 0.00 51.96 52.26 1jti s ALA 195 Cb 0.06 -3.15 0.12 0.00 0.00 0.00 0.00 23.12 20.15 1jti s ALA 195 CO 0.15 -0.22 0.99 1.41 0.00 0.00 0.00 175.76 178.08 1jti s MET 196 N -3.80 0.60 -0.03 0.00 1.75 -0.98 -4.80 119.30 112.05 1jti s MET 196 Ca 0.61 0.24 -0.30 0.00 -1.25 0.00 0.00 55.69 54.98 1jti s MET 196 Cb -0.11 0.29 -0.04 0.00 2.84 0.00 0.00 34.83 37.81 1jti s MET 196 CO 0.27 -0.17 1.23 -1.25 -0.65 0.00 0.00 175.02 174.45 1jti s PRO 197 N -0.86 4.36 -0.41 4.11 0.04 -1.26 -1.51 135.00 139.47 1jti s PRO 197 Ca -0.01 1.73 -0.12 0.00 0.04 0.00 0.00 61.00 62.64 1jti s PRO 197 Cb -0.01 -3.52 0.04 0.00 0.04 0.00 0.00 34.50 31.05 1jti s PRO 197 CO 0.01 -0.43 0.27 0.12 0.04 0.00 0.00 177.00 177.00 1jti s PHE 198 N 2.04 3.26 -0.85 0.56 2.19 0.15 -4.85 117.98 120.48 1jti s PHE 198 Ca 0.58 -0.99 -0.25 0.00 0.33 0.00 0.00 56.93 56.59 1jti s PHE 198 Cb -0.27 -2.69 0.00 0.00 -1.31 0.00 0.00 43.02 38.76 1jti s PHE 198 CO 0.24 -0.70 1.66 1.03 1.83 0.00 0.00 175.22 179.28 1jti s ARG 199 N 1.57 2.99 0.00 10.12 0.52 0.17 -2.28 118.95 132.04 1jti s ARG 199 Ca 0.03 -0.35 0.00 0.00 -0.52 0.00 0.00 55.73 54.89 1jti s ARG 199 Cb -0.21 -4.86 0.00 0.00 0.52 0.00 0.00 34.95 30.41 1jti s ARG 199 CO 0.06 -2.68 0.64 0.28 0.02 0.00 0.00 175.30 173.63 1jti n VAL 200 N 7.18 0.00 -2.78 3.52 0.31 -0.51 -4.31 118.33 121.75 1jti n VAL 200 Ca 0.27 1.12 -0.22 0.00 -0.01 0.00 0.00 64.34 65.51 1jti n VAL 200 Cb 0.50 -2.09 0.03 0.00 -0.91 0.00 0.00 33.84 31.37 1jti n VAL 200 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1jti s THR 201 N -1.66 3.16 -2.00 2.52 -4.23 -1.19 -4.69 115.64 107.56 1jti s THR 201 Ca 0.00 -0.61 0.08 0.00 -1.18 0.00 0.00 61.69 59.98 1jti s THR 201 Cb 0.00 -3.18 0.23 0.00 1.34 0.00 0.00 72.50 70.89 1jti s THR 201 CO 0.00 -0.12 0.89 1.21 -0.54 0.00 0.00 174.62 176.06 1jti n GLU 202 N -2.23 0.34 -2.92 3.99 2.13 -1.26 -3.03 120.64 117.66 1jti n GLU 202 Ca 0.06 0.00 -0.14 0.00 0.66 0.00 0.00 57.16 57.74 1jti n GLU 202 Cb 0.59 -1.37 0.02 0.00 0.27 0.00 0.00 31.44 30.95 1jti n GLU 202 CO 0.00 0.00 0.00 0.94 -0.41 0.00 0.00 177.13 177.66 1jti n GLN 203 N -0.87 0.84 0.00 5.31 0.00 -1.26 -5.08 117.38 116.32 1jti n GLN 203 Ca 0.06 -2.40 0.00 0.00 -0.00 0.00 0.00 57.00 54.66 1jti n GLN 203 Cb 0.03 -1.34 0.00 0.00 0.00 0.00 0.00 30.24 28.93 1jti n GLN 203 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.06 175.15 1jti n GLU 204 N 1.10 0.00 -4.24 3.69 2.13 -1.17 -5.07 120.64 117.08 1jti n GLU 204 Ca 0.14 0.00 -0.26 0.00 0.66 0.00 0.00 57.16 57.70 1jti n GLU 204 Cb 0.62 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 32.26 1jti n GLU 204 CO 0.00 0.00 0.00 -1.12 -0.41 0.00 0.00 177.13 175.60 1jti s SER 205 N 0.00 4.34 -0.28 4.31 0.01 -1.26 -1.42 113.70 119.40 1jti s SER 205 Ca 0.00 -1.20 -0.21 0.00 1.31 0.00 0.00 55.95 55.85 1jti s SER 205 Cb 0.00 -0.27 0.08 0.00 0.21 0.00 0.00 66.02 66.04 1jti s SER 205 CO 0.00 -0.62 0.74 -0.75 0.41 0.00 0.00 173.24 173.02 1jti s LYS 206 N -3.91 0.75 0.08 12.44 2.20 -0.96 -4.90 119.74 125.44 1jti s LYS 206 Ca 0.36 1.05 -0.31 0.00 -0.36 0.00 0.00 55.97 56.71 1jti s LYS 206 Cb 0.04 0.28 -0.07 0.00 -1.51 0.00 0.00 37.83 36.57 1jti s LYS 206 CO 0.20 -0.12 1.40 -2.14 -0.36 0.00 0.00 175.35 174.33 1jti s PRO 207 N 0.91 4.31 -0.08 4.03 0.02 -1.26 0.34 135.00 143.26 1jti s PRO 207 Ca -0.04 2.05 -0.08 0.00 0.02 0.00 0.00 61.00 62.95 1jti s PRO 207 Cb -0.05 -3.35 0.02 0.00 0.02 0.00 0.00 34.50 31.14 1jti s PRO 207 CO -0.08 -0.47 0.22 0.14 -0.33 0.00 0.00 177.00 176.47 1jti s VAL 208 N 1.48 0.00 -0.15 3.83 -7.23 -0.57 -4.93 120.40 112.83 1jti s VAL 208 Ca 0.65 -0.01 -0.29 0.00 -1.81 0.00 0.00 61.98 60.51 1jti s VAL 208 Cb -0.35 -0.31 -0.05 0.00 0.56 0.00 0.00 36.38 36.22 1jti s VAL 208 CO 0.29 -0.01 2.01 -1.10 -0.31 0.00 0.00 175.10 175.99 1jti s GLN 209 N 0.08 3.55 -0.32 4.82 -1.52 -1.26 -2.31 119.66 122.71 1jti s GLN 209 Ca -0.00 2.09 -0.11 0.00 -1.95 0.00 0.00 55.36 55.39 1jti s GLN 209 Cb -0.02 -4.24 -0.02 0.00 -0.22 0.00 0.00 33.01 28.52 1jti s GLN 209 CO 0.00 -1.62 0.18 1.41 -0.25 0.00 0.00 175.29 175.02 1jti s MET 210 N 5.47 3.45 0.56 2.91 -2.45 0.17 -2.01 119.30 127.41 1jti s MET 210 Ca 0.90 -0.65 -0.16 0.00 -1.25 0.00 0.00 55.69 54.53 1jti s MET 210 Cb -0.34 -3.65 -0.05 0.00 1.25 0.00 0.00 34.83 32.04 1jti s MET 210 CO 0.36 -0.40 1.03 -1.64 1.05 0.00 0.00 175.02 175.42 1jti s MET 211 N 1.66 3.57 -0.06 4.11 1.00 0.60 -2.35 119.30 127.83 1jti s MET 211 Ca 0.05 1.11 -0.15 0.00 0.00 0.00 0.00 55.69 56.70 1jti s MET 211 Cb -0.17 -2.07 0.03 0.00 0.00 0.00 0.00 34.83 32.62 1jti s MET 211 CO 0.08 -0.60 0.36 -0.47 0.00 0.00 0.00 175.02 174.39 1jti s TYR 212 N -2.52 -0.29 -0.06 -0.03 5.04 -1.26 -1.66 117.35 116.57 1jti s TYR 212 Ca 0.62 0.56 -0.30 0.00 -2.44 0.00 0.00 57.07 55.51 1jti s TYR 212 Cb -0.14 0.13 0.11 0.00 0.35 0.00 0.00 41.96 42.42 1jti s TYR 212 CO 0.35 -0.34 0.96 1.14 -1.34 0.00 0.00 175.55 176.31 1jti s GLN 213 N -0.84 0.69 0.07 4.97 -2.07 -0.74 -4.40 119.66 117.34 1jti s GLN 213 Ca -0.09 -0.18 0.09 0.00 -1.82 0.00 0.00 55.36 53.36 1jti s GLN 213 Cb -0.04 0.32 -0.03 0.00 -1.09 0.00 0.00 33.01 32.17 1jti s GLN 213 CO 0.03 -0.29 -0.25 0.42 -1.32 0.00 0.00 175.29 173.88 1jti s ILE 214 N -2.61 2.26 -2.99 3.63 1.01 -1.26 -0.28 121.20 120.94 1jti s ILE 214 Ca 0.04 -1.46 0.00 0.00 0.00 0.00 0.00 60.65 59.23 1jti s ILE 214 Cb -0.01 -1.92 0.00 0.00 0.01 0.00 0.00 42.46 40.54 1jti s ILE 214 CO -0.06 0.29 0.00 0.61 0.00 0.00 0.00 174.94 175.78 1jti n GLY 215 N 1.52 -2.04 3.69 6.18 0.00 -1.05 -4.98 105.19 108.50 1jti n GLY 215 Ca -0.17 -1.17 -0.40 0.00 0.00 0.00 0.00 46.02 44.28 1jti n GLY 215 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jti s LEU 216 N 0.00 4.23 -0.00 0.99 1.43 -1.26 -1.33 118.68 122.73 1jti s LEU 216 Ca 0.00 1.01 -0.11 0.00 -1.03 0.00 0.00 54.13 54.00 1jti s LEU 216 Cb 0.00 -2.98 0.01 0.00 0.03 0.00 0.00 46.19 43.25 1jti s LEU 216 CO 0.00 -0.20 0.21 -0.36 0.23 0.00 0.00 176.35 176.24 1jti s PHE 217 N 1.36 -0.06 0.15 0.29 0.08 -0.35 -4.94 117.98 114.52 1jti s PHE 217 Ca 0.33 0.05 -0.28 0.00 0.12 0.00 0.00 56.93 57.14 1jti s PHE 217 Cb -0.17 0.02 -0.07 0.00 -0.57 0.00 0.00 43.02 42.23 1jti s PHE 217 CO 0.13 -0.33 0.88 1.03 -0.10 0.00 0.00 175.22 176.83 1jti s ARG 218 N -1.35 4.69 0.09 0.44 0.52 -1.26 -1.85 118.95 120.23 1jti s ARG 218 Ca -0.14 1.33 -0.02 0.00 -0.52 0.00 0.00 55.73 56.38 1jti s ARG 218 Cb -0.07 -3.32 -0.03 0.00 0.52 0.00 0.00 34.95 32.05 1jti s ARG 218 CO 0.03 0.41 0.05 0.08 0.02 0.00 0.00 175.30 175.89 1jti s VAL 219 N -0.65 0.15 -0.08 3.52 1.01 -0.74 -2.41 120.40 121.20 1jti s VAL 219 Ca 0.41 -1.74 -0.04 0.00 0.00 0.00 0.00 61.98 60.61 1jti s VAL 219 Cb -0.24 -1.72 0.04 0.00 0.00 0.00 0.00 36.38 34.46 1jti s VAL 219 CO 0.29 -0.70 0.19 0.00 0.00 0.00 0.00 175.10 174.87 1jti s ALA 220 N -3.97 -0.39 -0.26 5.51 0.00 -0.96 -1.02 121.76 120.67 1jti s ALA 220 Ca 0.14 0.80 -0.09 0.00 0.00 0.00 0.00 51.96 52.80 1jti s ALA 220 Cb 0.07 -0.52 -0.04 0.00 0.00 0.00 0.00 23.12 22.63 1jti s ALA 220 CO -0.05 -0.17 0.14 0.45 0.00 0.00 0.00 175.76 176.13 1jti s SER 221 N 1.13 5.66 -0.69 0.00 0.15 -1.26 -1.78 113.70 116.91 1jti s SER 221 Ca -0.09 -0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.49 1jti s SER 221 Cb -0.10 -2.04 0.39 0.00 -1.71 0.00 0.00 66.02 62.56 1jti s SER 221 CO -0.07 -0.03 1.79 0.23 1.20 0.00 0.00 173.24 176.36 1jti n MET 222 N 4.92 2.94 -1.73 5.44 2.81 0.11 -4.95 117.12 126.64 1jti n MET 222 Ca -0.15 -3.71 -0.24 0.00 -1.81 0.00 0.00 57.70 51.79 1jti n MET 222 Cb 0.52 -2.27 -0.05 0.00 -0.71 0.00 0.00 33.22 30.70 1jti n MET 222 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1jti s ALA 223 N -3.89 1.27 0.00 3.04 0.00 -1.26 0.77 121.76 121.69 1jti s ALA 223 Ca 0.54 -0.78 0.00 0.00 0.00 0.00 0.00 51.96 51.72 1jti s ALA 223 Cb 0.44 -4.50 0.00 0.00 0.00 0.00 0.00 23.12 19.07 1jti s ALA 223 CO -0.26 -5.15 0.00 -1.13 0.00 0.00 0.00 175.76 169.22 1jti n SER 224 N 16.38 0.00 0.00 0.00 3.41 -1.26 -4.83 113.62 127.32 1jti n SER 224 Ca 0.40 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.01 1jti n SER 224 Cb 0.47 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.42 1jti n SER 224 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1jti n GLU 225 N 0.00 -0.07 -3.82 4.33 4.71 0.23 -5.04 120.64 120.99 1jti n GLU 225 Ca 0.00 -0.05 -0.25 0.00 -0.01 0.00 0.00 57.16 56.85 1jti n GLU 225 Cb 0.00 -0.54 0.02 0.00 -1.01 0.00 0.00 31.44 29.91 1jti n GLU 225 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 1jti n LYS 226 N -0.00 -4.79 -3.82 3.49 4.76 -0.67 -4.85 118.16 112.29 1jti n LYS 226 Ca 0.00 0.57 -0.10 0.00 -2.87 0.00 0.00 58.31 55.92 1jti n LYS 226 Cb 0.23 -5.16 -0.05 0.00 -1.84 0.00 0.00 35.03 28.21 1jti n LYS 226 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1jti s MET 227 N -6.28 1.20 0.13 1.97 0.23 -1.22 0.13 119.30 115.45 1jti s MET 227 Ca 0.21 -0.96 0.04 0.00 -1.03 0.00 0.00 55.69 53.95 1jti s MET 227 Cb -0.11 0.44 -0.04 0.00 -1.53 0.00 0.00 34.83 33.59 1jti s MET 227 CO 0.83 -0.47 -0.10 0.15 -2.03 0.00 0.00 175.02 173.40 1jti s LYS 228 N -3.90 0.97 -0.06 3.16 1.02 -0.45 0.04 119.74 120.53 1jti s LYS 228 Ca 0.11 -1.34 0.01 0.00 0.02 0.00 0.00 55.97 54.77 1jti s LYS 228 Cb 0.02 -0.58 0.02 0.00 -0.52 0.00 0.00 37.83 36.77 1jti s LYS 228 CO -0.04 0.08 -0.08 0.42 -0.92 0.00 0.00 175.35 174.81 1jti s ILE 229 N -3.01 0.83 -0.11 2.17 1.01 -0.73 -1.35 121.20 120.00 1jti s ILE 229 Ca 0.12 -0.27 0.00 0.00 0.00 0.00 0.00 60.65 60.51 1jti s ILE 229 Cb 0.01 -0.81 -0.02 0.00 0.01 0.00 0.00 42.46 41.65 1jti s ILE 229 CO 0.00 0.30 -0.13 -0.22 0.00 0.00 0.00 174.94 174.89 1jti s LEU 230 N 0.99 2.74 -0.26 2.97 2.96 -0.40 -2.26 118.68 125.43 1jti s LEU 230 Ca -0.09 -0.29 -0.06 0.00 -0.22 0.00 0.00 54.13 53.46 1jti s LEU 230 Cb -0.15 -1.61 -0.01 0.00 0.50 0.00 0.00 46.19 44.93 1jti s LEU 230 CO 0.00 0.20 0.05 -0.70 -1.32 0.00 0.00 176.35 174.58 1jti s GLU 231 N 0.12 3.43 -0.45 1.98 2.12 -1.01 -0.90 118.70 123.99 1jti s GLU 231 Ca -0.06 -0.62 -0.06 0.00 0.36 0.00 0.00 54.97 54.59 1jti s GLU 231 Cb -0.15 -3.26 0.12 0.00 0.26 0.00 0.00 34.13 31.10 1jti s GLU 231 CO 0.05 -0.26 0.28 -0.51 -0.54 0.00 0.00 175.26 174.28 1jti s LEU 232 N 1.55 5.48 0.50 2.70 1.43 -0.41 -4.29 118.68 125.64 1jti s LEU 232 Ca 0.05 -2.00 -0.21 0.00 -1.03 0.00 0.00 54.13 50.93 1jti s LEU 232 Cb -0.15 -1.92 -0.07 0.00 0.03 0.00 0.00 46.19 44.08 1jti s LEU 232 CO 0.02 -0.61 1.15 -2.16 0.23 0.00 0.00 176.35 174.97 1jti s PRO 233 N 1.21 3.57 0.50 1.29 0.04 -1.26 -1.64 135.00 138.71 1jti s PRO 233 Ca 0.07 1.70 -0.07 0.00 0.04 0.00 0.00 61.00 62.74 1jti s PRO 233 Cb -0.24 -2.22 -0.04 0.00 0.04 0.00 0.00 34.50 32.04 1jti s PRO 233 CO -0.03 -0.69 0.83 -0.06 0.04 0.00 0.00 177.00 177.10 1jti s PHE 234 N -1.65 3.57 0.56 0.56 0.08 -0.17 -2.06 117.98 118.87 1jti s PHE 234 Ca 0.68 0.93 0.28 0.00 0.12 0.00 0.00 56.93 58.94 1jti s PHE 234 Cb -0.26 -2.40 1.73 0.00 -0.57 0.00 0.00 43.02 41.52 1jti s PHE 234 CO 0.31 -0.34 2.22 0.00 -0.10 0.00 0.00 175.22 177.31 1jti h ALA 235 N 0.23 1.51 -0.12 5.36 0.00 0.69 -2.74 119.26 124.19 1jti h ALA 235 Ca -0.46 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 1jti h ALA 235 Cb 1.20 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1jti h ALA 235 CO 0.62 0.03 0.00 0.66 0.00 0.00 0.00 179.25 180.56 1jti h SER 236 N 0.00 0.14 0.00 0.00 4.64 -1.83 -3.46 113.55 113.04 1jti h SER 236 Ca -0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1jti h SER 236 Cb 0.06 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 1jti h SER 236 CO 0.00 0.18 0.00 0.61 -0.87 0.00 0.00 176.83 176.75 1jti n GLY 237 N -1.31 1.31 0.29 -0.77 0.00 -1.03 -4.86 105.19 98.81 1jti n GLY 237 Ca -0.01 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.08 1jti n GLY 237 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1jti n THR 238 N -2.00 0.00 -3.92 2.61 -2.24 -1.26 -4.92 114.28 102.54 1jti n THR 238 Ca 0.00 -0.30 -0.09 0.00 -2.27 0.00 0.00 64.05 61.39 1jti n THR 238 Cb 0.00 1.15 -0.09 0.00 -2.10 0.00 0.00 70.33 69.28 1jti n THR 238 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 1jti s MET 239 N -1.97 0.57 0.10 -0.78 1.00 -1.26 -1.27 119.30 115.69 1jti s MET 239 Ca 0.12 -0.72 -0.14 0.00 0.00 0.00 0.00 55.69 54.94 1jti s MET 239 Cb 0.12 0.23 0.03 0.00 0.00 0.00 0.00 34.83 35.21 1jti s MET 239 CO 0.44 -0.14 0.35 -1.54 0.00 0.00 0.00 175.02 174.13 1jti s SER 240 N -2.05 -0.15 -0.16 3.03 1.04 -0.98 -1.00 113.70 113.42 1jti s SER 240 Ca -0.06 -0.36 -0.03 0.00 0.48 0.00 0.00 55.95 55.99 1jti s SER 240 Cb -0.02 0.43 -0.02 0.00 0.10 0.00 0.00 66.02 66.51 1jti s SER 240 CO -0.04 -0.79 -0.07 -0.32 0.98 0.00 0.00 173.24 173.00 1jti s MET 241 N -3.62 3.50 -0.18 4.02 0.00 -0.65 -1.82 119.30 120.55 1jti s MET 241 Ca 0.02 -0.60 -0.09 0.00 0.00 0.00 0.00 55.69 55.02 1jti s MET 241 Cb 0.02 -2.85 -0.05 0.00 0.00 0.00 0.00 34.83 31.96 1jti s MET 241 CO -0.10 0.11 0.12 -0.51 0.00 0.00 0.00 175.02 174.64 1jti s LEU 242 N 0.66 4.17 -0.23 4.11 1.43 0.04 -1.29 118.68 127.58 1jti s LEU 242 Ca -0.04 0.25 -0.00 0.00 -1.03 0.00 0.00 54.13 53.32 1jti s LEU 242 Cb -0.15 -2.06 0.03 0.00 0.03 0.00 0.00 46.19 44.04 1jti s LEU 242 CO 0.02 0.23 -0.11 -0.69 0.23 0.00 0.00 176.35 176.04 1jti s VAL 243 N 0.04 2.54 -0.37 -1.59 1.01 -0.08 -1.81 120.40 120.14 1jti s VAL 243 Ca 0.09 -1.09 -0.14 0.00 0.00 0.00 0.00 61.98 60.83 1jti s VAL 243 Cb -0.11 -2.27 -0.00 0.00 0.00 0.00 0.00 36.38 34.00 1jti s VAL 243 CO -0.00 0.26 0.29 -0.76 0.00 0.00 0.00 175.10 174.89 1jti s LEU 244 N 1.28 4.70 -0.22 3.92 1.02 -0.35 -1.28 118.68 127.74 1jti s LEU 244 Ca 0.00 -0.54 -0.02 0.00 0.02 0.00 0.00 54.13 53.59 1jti s LEU 244 Cb -0.16 -2.20 0.01 0.00 0.02 0.00 0.00 46.19 43.86 1jti s LEU 244 CO -0.07 -0.34 -0.08 -0.22 0.02 0.00 0.00 176.35 175.66 1jti s LEU 245 N 1.80 2.84 0.33 1.79 2.96 -0.46 -2.26 118.68 125.68 1jti s LEU 245 Ca 0.07 -0.63 -0.27 0.00 -0.22 0.00 0.00 54.13 53.09 1jti s LEU 245 Cb -0.18 -1.66 -0.09 0.00 0.50 0.00 0.00 46.19 44.76 1jti s LEU 245 CO 0.11 -0.06 1.02 -2.16 -1.32 0.00 0.00 176.35 173.94 1jti s PRO 246 N 1.38 4.47 0.11 0.98 0.04 -1.26 -1.34 135.00 139.38 1jti s PRO 246 Ca 0.04 1.53 -0.20 0.00 0.04 0.00 0.00 61.00 62.40 1jti s PRO 246 Cb -0.15 -2.85 -0.09 0.00 0.04 0.00 0.00 34.50 31.45 1jti s PRO 246 CO -0.06 0.14 1.76 -0.44 0.04 0.00 0.00 177.00 178.44 1jti h ASP 247 N 3.19 0.18 -3.56 6.66 3.32 0.75 -3.43 116.42 123.52 1jti h ASP 247 Ca -0.47 -0.01 -0.52 0.00 0.02 0.00 0.00 57.03 56.05 1jti h ASP 247 Cb 1.21 -0.04 -0.03 0.00 0.22 0.00 0.00 39.33 40.68 1jti h ASP 247 CO 0.65 0.13 0.23 -1.61 -1.72 0.00 0.00 179.24 176.92 1jti s GLU 248 N -6.16 4.63 0.63 3.56 2.02 -1.26 -4.94 118.70 117.18 1jti s GLU 248 Ca -0.13 1.24 0.21 0.00 0.02 0.00 0.00 54.97 56.31 1jti s GLU 248 Cb 0.08 -3.30 0.94 0.00 0.10 0.00 0.00 34.13 31.95 1jti s GLU 248 CO 0.68 0.47 1.46 0.28 0.02 0.00 0.00 175.26 178.18 1jti h VAL 249 N 3.51 0.08 0.00 2.63 2.07 -1.96 0.12 116.25 122.70 1jti h VAL 249 Ca -0.46 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.00 1jti h VAL 249 Cb 1.21 0.25 -0.13 0.00 -1.52 0.00 0.00 31.29 31.10 1jti h VAL 249 CO 0.68 0.00 -0.59 -1.54 0.02 0.00 0.00 177.57 176.14 1jti n SER 250 N -3.11 1.20 -0.05 0.57 3.41 -1.26 -4.60 113.62 109.78 1jti n SER 250 Ca 0.10 -2.69 0.09 0.00 -0.26 0.00 0.00 58.87 56.11 1jti n SER 250 Cb 1.02 -0.36 0.54 0.00 -0.26 0.00 0.00 64.21 65.15 1jti n SER 250 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1jti n GLY 251 N -0.39 -0.89 0.27 5.00 0.00 0.41 -3.69 105.19 105.90 1jti n GLY 251 Ca 0.10 -0.14 -0.11 0.00 0.00 0.00 0.00 46.02 45.86 1jti n GLY 251 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1jti h LEU 252 N 0.19 0.94 -0.13 0.99 5.85 -1.86 -2.43 115.31 118.86 1jti h LEU 252 Ca 0.00 -0.39 0.00 0.00 0.84 0.00 0.00 57.88 58.33 1jti h LEU 252 Cb 0.04 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 40.81 1jti h LEU 252 CO 0.00 1.12 0.00 -1.84 -0.34 0.00 0.00 178.44 177.38 1jti n GLU 253 N -4.19 0.02 -0.11 1.25 0.28 -1.24 -1.44 120.64 115.20 1jti n GLU 253 Ca -0.00 0.42 -0.16 0.00 -0.16 0.00 0.00 57.16 57.25 1jti n GLU 253 Cb 0.43 -1.55 -0.13 0.00 1.43 0.00 0.00 31.44 31.62 1jti n GLU 253 CO 0.00 0.00 0.00 0.94 -0.16 0.00 0.00 177.13 177.91 1jti n GLN 254 N -1.59 0.67 -0.15 3.44 7.27 -1.03 -4.42 117.38 121.57 1jti n GLN 254 Ca 0.01 0.12 -0.06 0.00 0.07 0.00 0.00 57.00 57.14 1jti n GLN 254 Cb 0.07 -1.54 0.10 0.00 2.41 0.00 0.00 30.24 31.29 1jti n GLN 254 CO 0.00 0.00 0.00 1.25 0.07 0.00 0.00 177.06 178.38 1jti h LEU 255 N 0.00 0.88 0.00 1.69 5.85 -0.88 -2.58 115.31 120.27 1jti h LEU 255 Ca -0.56 -0.23 0.00 0.00 0.84 0.00 0.00 57.88 57.93 1jti h LEU 255 Cb 1.99 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 42.78 1jti h LEU 255 CO -0.05 0.94 0.00 -0.62 -0.34 0.00 0.00 178.44 178.37 1jti n GLU 256 N -4.20 0.07 -0.01 1.25 1.02 -0.52 -2.46 120.64 115.79 1jti n GLU 256 Ca 0.03 0.26 -0.22 0.00 -0.02 0.00 0.00 57.16 57.21 1jti n GLU 256 Cb 0.32 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 30.11 1jti n GLU 256 CO 0.00 0.00 0.00 0.77 1.18 0.00 0.00 177.13 179.08 1jti h SER 257 N 0.00 0.34 0.20 1.62 0.02 -1.67 -3.40 113.55 110.67 1jti h SER 257 Ca 0.00 -0.87 0.00 0.00 -0.84 0.00 0.00 61.79 60.08 1jti h SER 257 Cb 0.16 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.59 1jti h SER 257 CO 0.00 1.79 -0.76 2.30 -1.14 0.00 0.00 176.83 179.01 1jti n ILE 258 N -3.68 0.00 -2.19 3.27 -0.00 -1.17 -4.97 119.36 110.62 1jti n ILE 258 Ca -0.32 -0.01 -0.41 0.00 -0.00 0.00 0.00 62.75 62.01 1jti n ILE 258 Cb 0.98 0.70 -0.03 0.00 -0.00 0.00 0.00 39.64 41.28 1jti n ILE 258 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.55 176.04 1jti s ILE 259 N -2.97 2.94 0.17 7.28 2.07 -1.03 -4.83 121.20 124.84 1jti s ILE 259 Ca 0.10 0.90 -0.23 0.00 -1.41 0.00 0.00 60.65 60.01 1jti s ILE 259 Cb 0.17 -3.57 0.08 0.00 0.13 0.00 0.00 42.46 39.26 1jti s ILE 259 CO 0.78 0.20 1.04 0.54 -1.91 0.00 0.00 174.94 175.59 1jti s ASN 260 N -0.34 -0.01 0.24 4.50 2.20 -1.26 -5.02 114.94 115.25 1jti s ASN 260 Ca 0.50 -0.63 -0.05 0.00 -0.94 0.00 0.00 52.86 51.75 1jti s ASN 260 Cb -0.38 0.48 0.39 0.00 -2.00 0.00 0.00 41.25 39.75 1jti s ASN 260 CO 0.47 -0.95 1.80 0.15 -2.94 0.00 0.00 177.10 175.63 1jti h PHE 261 N 2.00 0.81 0.29 1.54 3.57 -1.95 -0.81 116.94 122.40 1jti h PHE 261 Ca -0.27 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.25 1jti h PHE 261 Cb 1.22 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 39.71 1jti h PHE 261 CO 1.26 0.31 -0.27 0.93 -2.23 0.00 0.00 178.31 178.31 1jti h GLU 262 N 0.74 -0.54 -0.44 1.11 5.08 -1.96 -0.11 114.58 118.45 1jti h GLU 262 Ca 0.39 0.04 0.09 0.00 -1.00 0.00 0.00 59.36 58.88 1jti h GLU 262 Cb 0.38 0.12 -0.08 0.00 0.50 0.00 0.00 28.75 29.67 1jti h GLU 262 CO -0.26 -0.36 -0.11 0.87 -1.00 0.00 0.00 179.01 178.15 1jti h LYS 263 N -0.56 0.00 -0.29 2.33 1.79 -1.84 0.34 116.57 118.34 1jti h LYS 263 Ca -0.04 -0.00 0.03 0.00 -2.18 0.00 0.00 60.65 58.47 1jti h LYS 263 Cb 0.48 -0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.10 1jti h LYS 263 CO -0.02 0.00 0.09 1.25 -1.08 0.00 0.00 179.45 179.69 1jti h LEU 264 N 0.00 0.08 -0.95 2.94 5.85 -1.07 0.83 115.31 122.99 1jti h LEU 264 Ca 0.21 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.95 1jti h LEU 264 Cb 0.32 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.34 1jti h LEU 264 CO -0.45 0.08 0.50 0.74 -0.34 0.00 0.00 178.44 178.96 1jti h THR 265 N 0.21 1.25 -0.55 1.05 2.02 -0.33 -0.95 112.91 115.62 1jti h THR 265 Ca 0.13 -0.62 -0.08 0.00 0.77 0.00 0.00 66.41 66.61 1jti h THR 265 Cb 0.11 0.04 -0.02 0.00 -1.74 0.00 0.00 68.15 66.54 1jti h THR 265 CO -0.14 0.28 0.03 -0.08 0.37 0.00 0.00 175.52 175.98 1jti h GLU 266 N 1.24 0.95 0.00 6.66 4.81 0.11 -3.10 114.58 125.25 1jti h GLU 266 Ca 0.31 -0.29 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1jti h GLU 266 Cb 0.01 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.30 1jti h GLU 266 CO -0.05 0.94 0.00 -1.49 -0.73 0.00 0.00 179.01 177.68 1jti h TRP 267 N 0.83 0.00 -0.59 0.92 6.55 0.10 -3.23 115.95 120.53 1jti h TRP 267 Ca 0.16 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.00 1jti h TRP 267 Cb 0.50 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.80 1jti h TRP 267 CO 0.04 0.00 0.00 2.41 -1.05 0.00 0.00 178.44 179.84 1jti n THR 268 N -3.04 2.34 -1.20 1.49 -1.04 -0.40 -4.57 114.28 107.86 1jti n THR 268 Ca 0.04 -1.35 -0.30 0.00 -2.04 0.00 0.00 64.05 60.40 1jti n THR 268 Cb 0.50 -0.10 0.22 0.00 -1.82 0.00 0.00 70.33 69.12 1jti n THR 268 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1jti s SER 269 N -0.91 1.62 -0.07 8.00 0.15 -1.18 -4.85 113.70 116.45 1jti s SER 269 Ca 0.52 0.74 -0.27 0.00 0.70 0.00 0.00 55.95 57.64 1jti s SER 269 Cb 0.37 -1.08 -0.22 0.00 -1.71 0.00 0.00 66.02 63.38 1jti s SER 269 CO 0.19 -3.70 1.05 0.28 1.20 0.00 0.00 173.24 172.26 1jti h SER 270 N -2.29 -0.01 0.05 5.45 0.02 -1.92 -2.57 113.55 112.28 1jti h SER 270 Ca -0.47 -0.68 0.00 0.00 -0.84 0.00 0.00 61.79 59.80 1jti h SER 270 Cb 1.30 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.84 1jti h SER 270 CO 0.42 0.68 0.00 -0.46 -1.14 0.00 0.00 176.83 176.33 1jti n ASN 271 N -4.76 0.00 -0.11 3.07 6.94 -1.26 -3.21 115.26 115.93 1jti n ASN 271 Ca -0.09 -0.37 -0.22 0.00 -0.02 0.00 0.00 54.58 53.88 1jti n ASN 271 Cb 0.34 -0.05 -0.08 0.00 -2.36 0.00 0.00 39.78 37.63 1jti n ASN 271 CO 0.00 0.00 0.00 0.52 -1.03 0.00 0.00 177.26 176.75 1jti n VAL 272 N -1.05 1.17 -3.48 3.53 0.31 -1.21 -4.98 118.33 112.63 1jti n VAL 272 Ca 0.10 -0.31 -0.38 0.00 -0.01 0.00 0.00 64.34 63.75 1jti n VAL 272 Cb 0.06 -1.74 -0.06 0.00 -0.91 0.00 0.00 33.84 31.19 1jti n VAL 272 CO 0.00 0.00 0.00 -0.04 -1.32 0.00 0.00 176.83 175.47 1jti s MET 273 N -2.39 4.10 0.03 5.55 -1.94 -0.97 -4.47 119.30 119.20 1jti s MET 273 Ca -0.30 0.32 0.01 0.00 -1.71 0.00 0.00 55.69 54.01 1jti s MET 273 Cb 0.11 -3.33 -0.02 0.00 2.01 0.00 0.00 34.83 33.60 1jti s MET 273 CO 0.38 0.44 -0.06 -1.83 -0.01 0.00 0.00 175.02 173.95 1jti s GLU 274 N -0.23 0.43 0.21 2.03 -1.05 -0.19 -4.77 118.70 115.14 1jti s GLU 274 Ca 0.22 -0.68 -0.30 0.00 -0.15 0.00 0.00 54.97 54.07 1jti s GLU 274 Cb -0.15 -0.12 -0.08 0.00 -0.44 0.00 0.00 34.13 33.33 1jti s GLU 274 CO 0.10 0.01 1.16 -2.00 0.95 0.00 0.00 175.26 175.48 1jti s GLU 275 N -1.49 4.54 0.06 -4.83 2.12 -1.26 -1.80 118.70 116.04 1jti s GLU 275 Ca -0.12 1.84 -0.14 0.00 0.36 0.00 0.00 54.97 56.91 1jti s GLU 275 Cb -0.10 -3.23 0.02 0.00 0.26 0.00 0.00 34.13 31.09 1jti s GLU 275 CO -0.00 0.01 0.32 1.03 -0.54 0.00 0.00 175.26 176.08 1jti s ARG 276 N -0.64 0.86 -0.33 4.30 0.52 -0.77 -4.97 118.95 117.93 1jti s ARG 276 Ca 0.50 -0.54 -0.18 0.00 -0.52 0.00 0.00 55.73 54.99 1jti s ARG 276 Cb -0.32 0.37 -0.01 0.00 0.52 0.00 0.00 34.95 35.51 1jti s ARG 276 CO 0.38 -0.28 0.49 0.21 0.02 0.00 0.00 175.30 176.12 1jti s LYS 277 N -2.77 3.74 0.17 3.54 2.20 -1.26 -1.21 119.74 124.14 1jti s LYS 277 Ca -0.03 -0.07 -0.03 0.00 -0.36 0.00 0.00 55.97 55.47 1jti s LYS 277 Cb -0.00 -3.76 -0.03 0.00 -1.51 0.00 0.00 37.83 32.52 1jti s LYS 277 CO -0.05 -0.55 0.15 0.96 -0.36 0.00 0.00 175.35 175.50 1jti s ILE 278 N 2.32 0.06 -0.06 5.43 -4.36 -0.44 -4.84 121.20 119.31 1jti s ILE 278 Ca 0.18 -1.81 -0.19 0.00 -0.26 0.00 0.00 60.65 58.57 1jti s ILE 278 Cb -0.16 -2.16 -0.05 0.00 1.25 0.00 0.00 42.46 41.35 1jti s ILE 278 CO 0.12 -0.26 0.54 -0.54 0.24 0.00 0.00 174.94 175.04 1jti s LYS 279 N -4.07 4.31 -0.12 0.37 1.02 -0.27 -2.53 119.74 118.45 1jti s LYS 279 Ca 0.27 0.61 0.01 0.00 0.02 0.00 0.00 55.97 56.88 1jti s LYS 279 Cb 0.06 -3.38 0.02 0.00 -0.52 0.00 0.00 37.83 34.01 1jti s LYS 279 CO 0.05 0.28 -0.13 0.08 -0.92 0.00 0.00 175.35 174.71 1jti s VAL 280 N 0.17 1.38 -0.19 3.17 1.01 0.61 -0.23 120.40 126.32 1jti s VAL 280 Ca 0.29 -0.54 -0.00 0.00 0.00 0.00 0.00 61.98 61.73 1jti s VAL 280 Cb -0.17 -1.30 0.01 0.00 0.00 0.00 0.00 36.38 34.92 1jti s VAL 280 CO 0.14 0.42 -0.15 -0.31 0.00 0.00 0.00 175.10 175.20 1jti s TYR 281 N 1.28 2.82 -0.03 5.22 1.51 -0.25 -1.79 117.35 126.11 1jti s TYR 281 Ca -0.01 -1.37 0.00 0.00 -1.01 0.00 0.00 57.07 54.68 1jti s TYR 281 Cb -0.14 -1.96 0.03 0.00 -0.11 0.00 0.00 41.96 39.78 1jti s TYR 281 CO -0.06 -0.69 -0.01 -1.17 -1.11 0.00 0.00 175.55 172.52 1jti s LEU 282 N 1.26 1.14 0.47 -1.29 2.96 -0.67 -1.14 118.68 121.41 1jti s LEU 282 Ca 0.03 -0.04 -0.20 0.00 -0.22 0.00 0.00 54.13 53.70 1jti s LEU 282 Cb -0.14 -0.27 -0.09 0.00 0.50 0.00 0.00 46.19 46.19 1jti s LEU 282 CO -0.08 -0.10 1.01 -2.16 -1.32 0.00 0.00 176.35 173.70 1jti s PRO 283 N 1.08 3.91 0.29 0.98 0.04 -1.26 -0.29 135.00 139.74 1jti s PRO 283 Ca -0.09 1.29 -0.29 0.00 0.04 0.00 0.00 61.00 61.95 1jti s PRO 283 Cb -0.14 -2.12 -0.10 0.00 0.04 0.00 0.00 34.50 32.19 1jti s PRO 283 CO -0.02 -0.33 1.26 1.03 0.04 0.00 0.00 177.00 178.98 1jti s ARG 284 N -3.25 4.43 0.12 4.56 0.52 -0.85 -4.84 118.95 119.64 1jti s ARG 284 Ca 0.66 2.08 0.08 0.00 -0.52 0.00 0.00 55.73 58.02 1jti s ARG 284 Cb -0.14 -3.13 -0.04 0.00 0.52 0.00 0.00 34.95 32.16 1jti s ARG 284 CO 0.19 -0.10 -0.19 -1.64 0.02 0.00 0.00 175.30 173.58 1jti s MET 285 N -1.35 1.12 -0.22 3.54 -1.94 -0.25 -4.86 119.30 115.34 1jti s MET 285 Ca 0.49 -1.22 -0.03 0.00 -1.71 0.00 0.00 55.69 53.22 1jti s MET 285 Cb -0.37 -1.26 0.11 0.00 2.01 0.00 0.00 34.83 35.32 1jti s MET 285 CO 0.47 0.28 0.27 0.21 -0.01 0.00 0.00 175.02 176.24 1jti s LYS 286 N -2.23 0.25 0.02 2.03 2.20 -1.24 -0.87 119.74 119.89 1jti s LYS 286 Ca 0.09 0.25 0.09 0.00 -0.36 0.00 0.00 55.97 56.03 1jti s LYS 286 Cb -0.08 -0.96 -0.03 0.00 -1.51 0.00 0.00 37.83 35.25 1jti s LYS 286 CO 0.05 -0.69 -0.26 -1.64 -0.36 0.00 0.00 175.35 172.45 1jti s MET 287 N 2.39 1.94 -0.14 4.03 -1.94 0.63 -4.98 119.30 121.23 1jti s MET 287 Ca 0.09 -1.03 -0.04 0.00 -1.71 0.00 0.00 55.69 52.99 1jti s MET 287 Cb -0.15 -2.02 0.06 0.00 2.01 0.00 0.00 34.83 34.72 1jti s MET 287 CO -0.15 0.53 0.09 -2.00 -0.01 0.00 0.00 175.02 173.48 1jti s GLU 288 N -1.02 0.04 0.07 2.03 2.56 -1.26 -0.67 118.70 120.45 1jti s GLU 288 Ca 0.11 0.05 0.03 0.00 0.00 0.00 0.00 54.97 55.15 1jti s GLU 288 Cb -0.10 -1.49 -0.03 0.00 2.00 0.00 0.00 34.13 34.51 1jti s GLU 288 CO 0.01 -0.59 -0.09 -1.21 -0.56 0.00 0.00 175.26 172.82 1jti s GLU 289 N 2.16 0.68 -0.02 4.30 0.41 -0.51 -5.03 118.70 120.68 1jti s GLU 289 Ca 0.03 -0.97 -0.01 0.00 -0.41 0.00 0.00 54.97 53.61 1jti s GLU 289 Cb -0.15 -0.38 0.02 0.00 -1.78 0.00 0.00 34.13 31.84 1jti s GLU 289 CO -0.08 0.06 0.05 0.21 -0.49 0.00 0.00 175.26 175.01 1jti s LYS 290 N -2.29 0.03 0.09 1.61 2.20 -1.26 -1.20 119.74 118.92 1jti s LYS 290 Ca -0.02 0.14 0.04 0.00 -0.36 0.00 0.00 55.97 55.77 1jti s LYS 290 Cb -0.06 -0.08 -0.03 0.00 -1.51 0.00 0.00 37.83 36.15 1jti s LYS 290 CO -0.01 -0.07 -0.11 0.71 -0.36 0.00 0.00 175.35 175.51 1jti s TYR 291 N 0.48 1.07 -0.37 4.03 2.02 0.07 -5.00 117.35 119.66 1jti s TYR 291 Ca -0.04 -0.60 -0.13 0.00 -0.37 0.00 0.00 57.07 55.93 1jti s TYR 291 Cb -0.05 -0.59 0.00 0.00 -0.40 0.00 0.00 41.96 40.92 1jti s TYR 291 CO -0.02 0.01 0.25 1.21 -1.57 0.00 0.00 175.55 175.43 1jti s ASN 292 N -2.25 5.98 0.42 2.29 2.47 -1.26 -1.70 114.94 120.89 1jti s ASN 292 Ca 0.03 -0.68 0.23 0.00 0.42 0.00 0.00 52.86 52.86 1jti s ASN 292 Cb -0.05 -2.12 0.71 0.00 -1.45 0.00 0.00 41.25 38.35 1jti s ASN 292 CO 0.01 -0.33 1.73 -0.07 -3.72 0.00 0.00 177.10 174.72 1jti h LEU 293 N 8.52 0.00 -0.34 3.21 3.38 -1.05 -3.32 115.31 125.71 1jti h LEU 293 Ca -0.29 0.00 0.08 0.00 0.09 0.00 0.00 57.88 57.75 1jti h LEU 293 Cb 1.14 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.80 1jti h LEU 293 CO 0.67 0.23 -0.25 0.74 0.09 0.00 0.00 178.44 179.92 1jti h THR 294 N 0.00 0.36 -0.51 0.22 2.02 -1.93 0.30 112.91 113.37 1jti h THR 294 Ca -0.00 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 67.06 1jti h THR 294 Cb 0.89 0.36 -0.02 0.00 -1.74 0.00 0.00 68.15 67.64 1jti h THR 294 CO 0.03 0.00 -0.15 0.77 0.37 0.00 0.00 175.52 176.54 1jti h SER 295 N -0.20 1.02 0.39 4.18 4.64 -1.93 -1.52 113.55 120.13 1jti h SER 295 Ca 0.17 -0.37 -0.02 0.00 -0.47 0.00 0.00 61.79 61.10 1jti h SER 295 Cb 0.47 -0.28 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 1jti h SER 295 CO -0.46 1.15 -0.19 0.58 -0.87 0.00 0.00 176.83 177.05 1jti h VAL 296 N 0.87 0.62 -0.47 0.95 2.07 -1.42 0.07 116.25 118.94 1jti h VAL 296 Ca 0.13 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.55 1jti h VAL 296 Cb 0.72 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 31.09 1jti h VAL 296 CO 0.06 0.00 -0.11 -0.07 0.02 0.00 0.00 177.57 177.47 1jti h LEU 297 N -0.52 0.86 -0.49 2.57 3.38 -0.46 -1.49 115.31 119.15 1jti h LEU 297 Ca -0.05 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.64 1jti h LEU 297 Cb 0.40 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 1jti h LEU 297 CO 0.09 0.99 0.27 -0.03 0.09 0.00 0.00 178.44 179.85 1jti h MET 298 N 0.78 0.68 -0.70 1.13 4.05 -1.17 -1.66 114.93 118.04 1jti h MET 298 Ca 0.13 -0.08 -0.04 0.00 -0.28 0.00 0.00 59.70 59.43 1jti h MET 298 Cb 0.62 -0.13 -0.03 0.00 -0.80 0.00 0.00 31.60 31.26 1jti h MET 298 CO 0.04 0.53 0.26 0.00 0.23 0.00 0.00 176.91 177.98 1jti h ALA 299 N 1.11 1.14 0.00 0.39 0.00 -0.72 -2.37 119.26 118.81 1jti h ALA 299 Ca 0.17 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1jti h ALA 299 Cb 0.05 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.56 1jti h ALA 299 CO -0.03 0.61 0.00 -1.33 0.00 0.00 0.00 179.25 178.50 1jti n MET 300 N -4.28 0.14 0.00 0.00 2.00 -0.59 -4.84 117.12 109.54 1jti n MET 300 Ca 0.06 0.47 0.00 0.00 0.00 0.00 0.00 57.70 58.23 1jti n MET 300 Cb 0.19 -1.82 0.00 0.00 0.00 0.00 0.00 33.22 31.59 1jti n MET 300 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1jti n GLY 301 N -0.50 1.40 3.45 3.03 0.00 -0.89 -4.96 105.19 106.71 1jti n GLY 301 Ca 0.01 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.60 1jti n GLY 301 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1jti s ILE 302 N -1.90 4.56 -0.03 -0.61 1.01 -0.69 -4.84 121.20 118.72 1jti s ILE 302 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 60.65 60.23 1jti s ILE 302 Cb 0.00 -4.53 -0.02 0.00 0.01 0.00 0.00 42.46 37.92 1jti s ILE 302 CO 0.00 -1.18 -0.02 0.35 0.00 0.00 0.00 174.94 174.09 1jti n THR 303 N 5.82 0.15 -0.10 2.92 -2.24 -1.26 -3.55 114.28 116.02 1jti n THR 303 Ca -0.05 -0.06 0.12 0.00 -2.27 0.00 0.00 64.05 61.78 1jti n THR 303 Cb 0.45 -0.65 0.48 0.00 -2.10 0.00 0.00 70.33 68.51 1jti n THR 303 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1jti h ASP 304 N 0.00 0.40 0.23 3.42 3.32 -1.92 -0.94 116.42 120.93 1jti h ASP 304 Ca -0.06 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.00 1jti h ASP 304 Cb 1.10 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.57 1jti h ASP 304 CO -0.01 0.24 0.00 -0.37 -1.72 0.00 0.00 179.24 177.38 1jti h VAL 305 N 0.45 0.00 -0.02 -1.35 -1.51 -1.88 -0.63 116.25 111.31 1jti h VAL 305 Ca 0.29 -0.09 0.00 0.00 -1.23 0.00 0.00 66.70 65.66 1jti h VAL 305 Cb 0.53 0.80 0.00 0.00 -2.13 0.00 0.00 31.29 30.49 1jti h VAL 305 CO -0.08 0.00 -0.10 0.49 -1.23 0.00 0.00 177.57 176.65 1jti n PHE 306 N -2.55 0.00 -2.90 5.19 3.72 -0.37 -1.01 117.46 119.54 1jti n PHE 306 Ca -0.01 0.00 -0.19 0.00 -0.05 0.00 0.00 57.45 57.20 1jti n PHE 306 Cb 0.11 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 38.69 1jti n PHE 306 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1jti s SER 307 N -1.71 5.24 0.40 4.37 1.04 -0.24 -4.84 113.70 117.95 1jti s SER 307 Ca 0.20 -0.49 0.19 0.00 0.48 0.00 0.00 55.95 56.33 1jti s SER 307 Cb 0.15 -0.29 0.80 0.00 0.10 0.00 0.00 66.02 66.78 1jti s SER 307 CO 0.29 -1.16 1.79 -1.28 0.98 0.00 0.00 173.24 173.87 1jti h SER 308 N 0.24 0.00 -0.79 7.02 0.87 -1.94 -2.92 113.55 116.03 1jti h SER 308 Ca -0.36 0.00 -0.47 0.00 -1.23 0.00 0.00 61.79 59.73 1jti h SER 308 Cb 1.28 0.00 -0.24 0.00 -0.44 0.00 0.00 62.40 63.01 1jti h SER 308 CO 0.44 0.34 0.60 -1.54 -0.53 0.00 0.00 176.83 176.14 1jti n SER 309 N -3.62 5.28 -4.82 6.23 3.41 -1.26 -4.96 113.62 113.87 1jti n SER 309 Ca -0.01 -3.38 -0.36 0.00 -0.26 0.00 0.00 58.87 54.87 1jti n SER 309 Cb 0.46 -0.88 -0.06 0.00 -0.26 0.00 0.00 64.21 63.46 1jti n SER 309 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1jti s ALA 310 N -2.80 3.46 -0.34 7.33 0.00 -1.10 -4.91 121.76 123.39 1jti s ALA 310 Ca 0.48 0.10 0.02 0.00 0.00 0.00 0.00 51.96 52.56 1jti s ALA 310 Cb 0.39 -2.75 0.09 0.00 0.00 0.00 0.00 23.12 20.85 1jti s ALA 310 CO 0.04 0.36 0.05 1.21 0.00 0.00 0.00 175.76 177.42 1jti s ASN 311 N -1.64 4.82 -0.27 0.00 3.04 -1.26 -4.69 114.94 114.94 1jti s ASN 311 Ca 0.41 -2.00 0.10 0.00 0.04 0.00 0.00 52.86 51.41 1jti s ASN 311 Cb -0.16 -1.66 0.46 0.00 -1.54 0.00 0.00 41.25 38.35 1jti s ASN 311 CO 0.21 -0.38 1.18 0.18 -3.04 0.00 0.00 177.10 175.25 1jti n LEU 312 N 4.35 4.09 0.26 3.21 4.77 -1.26 -2.24 117.00 130.17 1jti n LEU 312 Ca -0.00 -4.34 0.18 0.00 -0.03 0.00 0.00 56.01 51.81 1jti n LEU 312 Cb 0.42 -0.26 0.85 0.00 -2.33 0.00 0.00 43.42 42.10 1jti n LEU 312 CO 0.24 1.83 1.02 0.77 -1.33 0.00 0.00 177.39 179.92 1jti h SER 313 N 2.03 0.00 0.48 -1.43 4.64 -1.74 -0.41 113.55 117.12 1jti h SER 313 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 1jti h SER 313 Cb 1.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.53 1jti h SER 313 CO 0.56 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.13 1jti n GLY 314 N -0.63 -1.00 0.08 -0.77 0.00 -0.88 -2.69 105.19 99.29 1jti n GLY 314 Ca -0.01 -0.07 -0.08 0.00 0.00 0.00 0.00 46.02 45.85 1jti n GLY 314 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1jti n ILE 315 N -1.39 1.03 -3.58 -0.61 5.41 -0.17 -4.69 119.36 115.35 1jti n ILE 315 Ca 0.06 -0.59 -0.02 0.00 1.00 0.00 0.00 62.75 63.20 1jti n ILE 315 Cb 0.18 -0.71 -0.06 0.00 -0.71 0.00 0.00 39.64 38.34 1jti n ILE 315 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 1jti s SER 316 N -5.01 -0.73 0.26 4.38 0.15 -1.10 -1.06 113.70 110.60 1jti s SER 316 Ca -0.11 1.09 0.20 0.00 0.70 0.00 0.00 55.95 57.83 1jti s SER 316 Cb 0.05 1.55 0.08 0.00 -1.71 0.00 0.00 66.02 65.98 1jti s SER 316 CO 0.58 -0.16 1.25 0.28 1.20 0.00 0.00 173.24 176.38 1jti h SER 317 N 6.95 0.00 0.00 5.45 0.02 -1.74 -3.38 113.55 120.85 1jti h SER 317 Ca -0.24 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.71 1jti h SER 317 Cb 1.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.71 1jti h SER 317 CO 0.14 0.24 0.00 0.00 -1.14 0.00 0.00 176.83 176.07 1jti n ALA 318 N -2.21 -0.07 -2.78 3.77 0.00 -1.26 -4.83 120.51 113.13 1jti n ALA 318 Ca -0.00 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.20 1jti n ALA 318 Cb 0.65 0.10 -0.05 0.00 0.00 0.00 0.00 19.45 20.14 1jti n ALA 318 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1jti s GLU 319 N -1.41 2.79 0.13 0.00 2.02 -1.26 -5.09 118.70 115.87 1jti s GLU 319 Ca 0.00 -1.05 -0.30 0.00 0.02 0.00 0.00 54.97 53.64 1jti s GLU 319 Cb 0.00 -2.52 -0.06 0.00 0.10 0.00 0.00 34.13 31.65 1jti s GLU 319 CO 0.00 0.43 1.06 0.45 0.02 0.00 0.00 175.26 177.22 1jti s SER 320 N -3.50 7.31 0.20 -0.19 0.15 -1.26 -4.87 113.70 111.54 1jti s SER 320 Ca 0.32 1.96 0.04 0.00 0.70 0.00 0.00 55.95 58.96 1jti s SER 320 Cb -0.08 -2.59 -0.05 0.00 -1.71 0.00 0.00 66.02 61.58 1jti s SER 320 CO 0.23 -0.21 -0.03 -0.76 1.20 0.00 0.00 173.24 173.67 1jti s LEU 321 N 0.05 2.27 0.22 3.45 1.43 -1.26 0.08 118.68 124.91 1jti s LEU 321 Ca 0.50 -1.16 -0.19 0.00 -1.03 0.00 0.00 54.13 52.25 1jti s LEU 321 Cb -0.27 -0.26 0.03 0.00 0.03 0.00 0.00 46.19 45.72 1jti s LEU 321 CO 0.32 -0.47 0.60 -1.59 0.23 0.00 0.00 176.35 175.44 1jti s LYS 322 N -3.84 1.52 -0.15 1.70 -2.85 -0.52 -4.46 119.74 111.13 1jti s LYS 322 Ca 0.25 -0.87 -0.28 0.00 -1.00 0.00 0.00 55.97 54.07 1jti s LYS 322 Cb 0.05 0.56 -0.01 0.00 -2.06 0.00 0.00 37.83 36.37 1jti s LYS 322 CO 0.06 -0.67 0.96 0.42 0.10 0.00 0.00 175.35 176.22 1jti s ILE 323 N -3.88 4.79 -0.15 3.79 1.01 -0.18 -0.61 121.20 125.98 1jti s ILE 323 Ca 0.09 1.91 -0.21 0.00 0.00 0.00 0.00 60.65 62.44 1jti s ILE 323 Cb -0.03 -4.26 -0.18 0.00 0.01 0.00 0.00 42.46 38.00 1jti s ILE 323 CO -0.00 -0.03 0.44 -1.28 0.00 0.00 0.00 174.94 174.07 1jti h SER 324 N 7.25 0.00 -5.10 3.58 0.87 -0.56 -3.42 113.55 116.18 1jti h SER 324 Ca -0.28 -0.64 -0.08 0.00 -1.23 0.00 0.00 61.79 59.56 1jti h SER 324 Cb 1.12 0.00 -0.15 0.00 -0.44 0.00 0.00 62.40 62.94 1jti h SER 324 CO 0.88 1.00 -0.23 0.00 -0.53 0.00 0.00 176.83 177.95 1jti s GLN 325 N -2.13 0.90 -0.04 2.24 0.00 -1.24 -4.99 119.66 114.40 1jti s GLN 325 Ca -0.18 -0.72 -0.01 0.00 -0.00 0.00 0.00 55.36 54.45 1jti s GLN 325 Cb -0.00 0.39 0.03 0.00 0.00 0.00 0.00 33.01 33.43 1jti s GLN 325 CO 0.51 -0.31 0.07 0.00 0.00 0.00 0.00 175.29 175.56 1jti s ALA 326 N -3.38 -0.05 0.07 2.60 0.00 -1.26 -0.43 121.76 119.29 1jti s ALA 326 Ca 0.01 0.44 0.03 0.00 0.00 0.00 0.00 51.96 52.44 1jti s ALA 326 Cb 0.02 -0.32 -0.03 0.00 0.00 0.00 0.00 23.12 22.79 1jti s ALA 326 CO -0.09 -0.12 -0.09 0.08 0.00 0.00 0.00 175.76 175.54 1jti s VAL 327 N 1.08 0.76 -0.08 0.00 1.01 -0.11 -0.37 120.40 122.69 1jti s VAL 327 Ca -0.09 -1.35 -0.03 0.00 0.00 0.00 0.00 61.98 60.51 1jti s VAL 327 Cb -0.12 -0.99 0.04 0.00 0.00 0.00 0.00 36.38 35.31 1jti s VAL 327 CO -0.04 -0.45 0.10 -2.28 0.00 0.00 0.00 175.10 172.43 1jti s HIS 328 N -1.86 0.01 0.03 5.22 2.46 -0.69 -0.59 115.29 119.87 1jti s HIS 328 Ca -0.02 0.24 0.05 0.00 0.47 0.00 0.00 55.06 55.79 1jti s HIS 328 Cb -0.07 -0.46 -0.03 0.00 -0.13 0.00 0.00 32.58 31.89 1jti s HIS 328 CO 0.00 -0.29 -0.12 0.00 -2.47 0.00 0.00 174.74 171.86 1jti s ALA 329 N 2.20 2.82 -0.16 1.58 0.00 -0.40 -0.75 121.76 127.06 1jti s ALA 329 Ca 0.04 -1.11 -0.15 0.00 0.00 0.00 0.00 51.96 50.74 1jti s ALA 329 Cb -0.13 -0.94 0.04 0.00 0.00 0.00 0.00 23.12 22.09 1jti s ALA 329 CO -0.05 0.60 0.43 0.00 0.00 0.00 0.00 175.76 176.73 1jti s ALA 330 N -0.97 -1.06 -0.04 0.00 0.00 -0.34 -1.12 121.76 118.23 1jti s ALA 330 Ca 0.16 1.19 0.02 0.00 0.00 0.00 0.00 51.96 53.33 1jti s ALA 330 Cb -0.11 -0.68 0.01 0.00 0.00 0.00 0.00 23.12 22.35 1jti s ALA 330 CO 0.07 -0.21 -0.07 -1.58 0.00 0.00 0.00 175.76 173.97 1jti s HIS 331 N 0.18 0.89 0.01 0.00 5.04 -0.37 -1.43 115.29 119.61 1jti s HIS 331 Ca -0.00 -0.26 0.02 0.00 -1.54 0.00 0.00 55.06 53.28 1jti s HIS 331 Cb -0.03 -0.71 -0.01 0.00 0.04 0.00 0.00 32.58 31.87 1jti s HIS 331 CO 0.01 -0.17 -0.07 0.00 -2.34 0.00 0.00 174.74 172.16 1jti s ALA 332 N 0.63 0.60 -0.05 1.58 0.00 0.16 -1.60 121.76 123.07 1jti s ALA 332 Ca -0.10 -0.48 0.01 0.00 0.00 0.00 0.00 51.96 51.40 1jti s ALA 332 Cb -0.13 -0.08 0.02 0.00 0.00 0.00 0.00 23.12 22.93 1jti s ALA 332 CO 0.01 0.09 -0.07 -1.21 0.00 0.00 0.00 175.76 174.58 1jti s GLU 333 N -0.70 1.14 -0.22 0.00 2.02 0.30 -0.27 118.70 120.97 1jti s GLU 333 Ca -0.02 -0.21 0.00 0.00 0.02 0.00 0.00 54.97 54.77 1jti s GLU 333 Cb -0.05 -1.05 0.06 0.00 0.10 0.00 0.00 34.13 33.18 1jti s GLU 333 CO 0.00 -0.05 -0.05 0.42 0.02 0.00 0.00 175.26 175.60 1jti s ILE 334 N 0.87 1.41 0.00 -1.63 1.01 -0.05 -0.54 121.20 122.27 1jti s ILE 334 Ca -0.12 -1.08 0.00 0.00 0.00 0.00 0.00 60.65 59.45 1jti s ILE 334 Cb -0.15 -1.67 0.00 0.00 0.01 0.00 0.00 42.46 40.65 1jti s ILE 334 CO 0.01 -0.06 0.00 -0.46 0.00 0.00 0.00 174.94 174.43 1jti n ASN 335 N 4.73 1.20 -0.28 3.58 0.23 -0.33 -1.09 115.26 123.29 1jti n ASN 335 Ca -0.12 -0.20 -0.05 0.00 -0.53 0.00 0.00 54.58 53.68 1jti n ASN 335 Cb 0.45 0.00 0.06 0.00 -2.08 0.00 0.00 39.78 38.21 1jti n ASN 335 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1jti h GLU 336 N 0.00 1.05 0.00 -3.83 3.07 -1.97 -3.11 114.58 109.79 1jti h GLU 336 Ca 0.00 -0.11 -0.08 0.00 -0.50 0.00 0.00 59.36 58.67 1jti h GLU 336 Cb 0.00 -0.21 -0.01 0.00 -0.84 0.00 0.00 28.75 27.69 1jti h GLU 336 CO 0.00 0.77 -0.37 0.00 -1.40 0.00 0.00 179.01 178.01 1jti h ALA 337 N 1.22 0.80 0.00 3.43 0.00 -1.97 -2.29 119.26 120.46 1jti h ALA 337 Ca 0.27 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1jti h ALA 337 Cb 0.01 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1jti h ALA 337 CO -0.05 0.46 0.00 0.41 0.00 0.00 0.00 179.25 180.08 1jti n GLY 338 N 0.94 -0.27 3.03 0.00 0.00 -1.18 -1.80 105.19 105.91 1jti n GLY 338 Ca 0.02 -0.79 -0.13 0.00 0.00 0.00 0.00 46.02 45.12 1jti n GLY 338 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1jti s THR 339 N -4.00 0.48 -0.06 2.61 -4.23 -0.65 -1.19 115.64 108.60 1jti s THR 339 Ca 0.00 -0.85 0.04 0.00 -1.18 0.00 0.00 61.69 59.69 1jti s THR 339 Cb 0.00 -0.52 0.00 0.00 1.34 0.00 0.00 72.50 73.32 1jti s THR 339 CO 0.00 -0.26 -0.17 -1.61 -0.54 0.00 0.00 174.62 172.04 1jti s GLU 340 N -1.21 2.05 -0.01 3.99 2.02 0.30 -1.23 118.70 124.60 1jti s GLU 340 Ca -0.07 -0.60 0.01 0.00 0.02 0.00 0.00 54.97 54.32 1jti s GLU 340 Cb -0.08 -1.68 0.01 0.00 0.10 0.00 0.00 34.13 32.48 1jti s GLU 340 CO 0.00 0.15 -0.02 0.08 0.02 0.00 0.00 175.26 175.50 1jti s VAL 341 N 0.33 0.21 0.05 2.63 1.01 0.51 -0.54 120.40 124.58 1jti s VAL 341 Ca -0.11 -0.04 0.04 0.00 0.00 0.00 0.00 61.98 61.87 1jti s VAL 341 Cb -0.15 -0.22 -0.02 0.00 0.00 0.00 0.00 36.38 35.99 1jti s VAL 341 CO 0.04 0.09 -0.13 0.68 0.00 0.00 0.00 175.10 175.79 1jti s VAL 342 N 0.35 1.02 0.32 2.92 -7.23 -0.63 0.23 120.40 117.37 1jti s VAL 342 Ca -0.03 -1.05 -0.18 0.00 -1.81 0.00 0.00 61.98 58.90 1jti s VAL 342 Cb -0.06 -0.95 0.06 0.00 0.56 0.00 0.00 36.38 35.99 1jti s VAL 342 CO -0.01 -0.09 0.85 -0.83 -0.31 0.00 0.00 175.10 174.71 1jti s GLY 343 N -1.30 0.24 -0.28 2.32 0.00 0.27 -1.23 107.32 107.34 1jti s GLY 343 Ca -0.01 -0.57 -0.18 0.00 0.00 0.00 0.00 44.72 43.96 1jti s GLY 343 CO 0.01 0.41 0.80 -0.45 0.00 0.00 0.00 173.10 173.87 1jti s SER 344 N -3.14 -0.76 -0.01 1.64 0.15 -0.27 -0.94 113.70 110.38 1jti s SER 344 Ca 0.16 1.26 0.06 0.00 0.70 0.00 0.00 55.95 58.14 1jti s SER 344 Cb -0.04 1.31 -0.03 0.00 -1.71 0.00 0.00 66.02 65.55 1jti s SER 344 CO 0.09 -0.20 -0.20 0.00 1.20 0.00 0.00 173.24 174.13 1jti s ALA 345 N 1.28 2.44 0.02 5.45 0.00 -1.09 -1.28 121.76 128.58 1jti s ALA 345 Ca -0.07 -1.10 -0.10 0.00 0.00 0.00 0.00 51.96 50.68 1jti s ALA 345 Cb -0.05 -0.73 0.01 0.00 0.00 0.00 0.00 23.12 22.36 1jti s ALA 345 CO -0.15 0.55 0.21 -2.00 0.00 0.00 0.00 175.76 174.37 1jti s GLU 346 N -0.90 0.65 -0.18 0.00 -6.30 0.24 -0.77 118.70 111.44 1jti s GLU 346 Ca 0.12 -0.50 -0.13 0.00 -2.50 0.00 0.00 54.97 51.96 1jti s GLU 346 Cb -0.10 0.27 0.05 0.00 0.00 0.00 0.00 34.13 34.35 1jti s GLU 346 CO 0.01 -0.18 0.46 0.00 0.02 0.00 0.00 175.26 175.57 1jti s ALA 347 N -2.09 -1.17 -0.12 6.30 0.00 0.28 -0.94 121.76 124.02 1jti s ALA 347 Ca -0.09 1.51 -0.06 0.00 0.00 0.00 0.00 51.96 53.33 1jti s ALA 347 Cb -0.03 -0.90 -0.04 0.00 0.00 0.00 0.00 23.12 22.15 1jti s ALA 347 CO -0.01 -0.25 0.08 0.20 0.00 0.00 0.00 175.76 175.78 1jti s GLY 348 N 0.86 2.02 -0.27 0.00 0.00 0.43 -0.60 107.32 109.76 1jti s GLY 348 Ca -0.05 -0.71 -0.03 0.00 0.00 0.00 0.00 44.72 43.93 1jti s GLY 348 CO -0.07 -0.34 -0.01 0.14 0.00 0.00 0.00 173.10 172.82 1jti s VAL 349 N -0.69 3.22 0.28 1.40 1.01 0.23 0.21 120.40 126.07 1jti s VAL 349 Ca 0.12 -0.96 0.09 0.00 0.00 0.00 0.00 61.98 61.24 1jti s VAL 349 Cb -0.12 -2.67 -0.04 0.00 0.00 0.00 0.00 36.38 33.55 1jti s VAL 349 CO 0.03 0.13 0.04 -1.81 0.00 0.00 0.00 175.10 173.49 1jti s ASP 350 N 1.37 4.69 -0.17 3.32 1.11 0.22 -0.28 116.67 126.93 1jti s ASP 350 Ca 0.00 -0.62 -0.29 0.00 0.18 0.00 0.00 52.55 51.83 1jti s ASP 350 Cb -0.17 -0.90 -0.05 0.00 1.07 0.00 0.00 42.92 42.87 1jti s ASP 350 CO -0.02 -0.05 1.91 0.00 1.18 0.00 0.00 175.17 178.19 1jti s ALA 351 N -2.32 3.13 0.21 5.23 0.00 -0.38 -1.44 121.76 126.19 1jti s ALA 351 Ca 0.33 0.76 0.00 0.00 0.00 0.00 0.00 51.96 53.04 1jti s ALA 351 Cb -0.06 -3.94 0.00 0.00 0.00 0.00 0.00 23.12 19.12 1jti s ALA 351 CO 0.21 -2.19 0.00 0.00 0.00 0.00 0.00 175.76 173.78 1jti n ALA 352 N 9.44 0.00 0.24 0.00 0.00 0.11 -4.88 120.51 125.43 1jti n ALA 352 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.67 1jti n ALA 352 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.89 1jti n ALA 352 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1jti n GLU 356 N 0.00 0.02 -4.36 0.00 2.13 -1.26 -4.95 120.64 112.22 1jti n GLU 356 Ca 0.00 0.68 -0.20 0.00 0.66 0.00 0.00 57.16 58.30 1jti n GLU 356 Cb 0.00 -2.24 -0.13 0.00 0.27 0.00 0.00 31.44 29.34 1jti n GLU 356 CO 0.00 0.00 0.00 -2.00 -0.41 0.00 0.00 177.13 174.72 1jti s GLU 357 N -3.32 0.96 -0.35 5.31 2.12 -1.26 -1.12 118.70 121.03 1jti s GLU 357 Ca 0.00 -0.79 0.01 0.00 0.36 0.00 0.00 54.97 54.55 1jti s GLU 357 Cb 0.00 -0.98 0.14 0.00 0.26 0.00 0.00 34.13 33.56 1jti s GLU 357 CO 0.00 0.24 0.25 0.12 -0.54 0.00 0.00 175.26 175.33 1jti s PHE 358 N -0.88 0.48 -0.19 5.30 5.36 0.67 -4.91 117.98 123.81 1jti s PHE 358 Ca 0.02 -1.44 -0.02 0.00 -0.96 0.00 0.00 56.93 54.53 1jti s PHE 358 Cb -0.08 -0.79 -0.01 0.00 -0.34 0.00 0.00 43.02 41.80 1jti s PHE 358 CO 0.01 -0.86 -0.08 -0.98 -1.46 0.00 0.00 175.22 171.86 1jti s ARG 359 N 1.16 3.37 -1.02 10.12 1.70 -1.26 -1.09 118.95 131.93 1jti s ARG 359 Ca 0.18 -0.65 -0.10 0.00 -0.47 0.00 0.00 55.73 54.69 1jti s ARG 359 Cb -0.21 -2.87 0.26 0.00 -0.57 0.00 0.00 34.95 31.55 1jti s ARG 359 CO -0.00 -0.06 0.99 0.00 -1.08 0.00 0.00 175.30 175.15 1jti s ALA 360 N 1.09 4.52 -1.88 7.88 0.00 -0.30 -4.73 121.76 128.35 1jti s ALA 360 Ca 0.01 -3.70 0.16 0.00 0.00 0.00 0.00 51.96 48.43 1jti s ALA 360 Cb -0.15 -3.50 0.16 0.00 0.00 0.00 0.00 23.12 19.63 1jti s ALA 360 CO -0.01 -2.22 1.04 -0.40 0.00 0.00 0.00 175.76 174.17 1jti n ASP 361 N 3.04 2.43 -4.19 0.00 5.68 -1.26 -4.43 116.55 117.81 1jti n ASP 361 Ca 0.21 -1.70 -0.17 0.00 -0.50 0.00 0.00 54.79 52.63 1jti n ASP 361 Cb 0.41 -0.04 -0.11 0.00 -1.14 0.00 0.00 41.12 40.24 1jti n ASP 361 CO 0.00 0.00 0.00 -1.38 -1.33 0.00 0.00 177.20 174.49 1jti s HIS 362 N -1.27 1.23 0.02 2.11 -3.43 -1.26 0.45 115.29 113.13 1jti s HIS 362 Ca 0.20 -0.54 -0.34 0.00 -0.80 0.00 0.00 55.06 53.58 1jti s HIS 362 Cb 0.14 -0.67 -0.17 0.00 -1.43 0.00 0.00 32.58 30.45 1jti s HIS 362 CO 0.20 0.07 0.88 -2.30 -2.00 0.00 0.00 174.74 171.59 1jti n PRO 363 N 0.86 0.00 -3.93 -0.38 -0.02 -1.26 -4.95 135.00 125.32 1jti n PRO 363 Ca -0.18 0.00 -0.08 0.00 -2.02 0.00 0.00 63.50 61.22 1jti n PRO 363 Cb 0.56 -1.26 -0.08 0.00 -0.02 0.00 0.00 33.50 32.70 1jti n PRO 363 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 1jti s PHE 364 N -0.09 0.28 0.12 6.00 -0.12 -1.02 -4.56 117.98 118.58 1jti s PHE 364 Ca 0.77 -0.74 0.02 0.00 -0.05 0.00 0.00 56.93 56.93 1jti s PHE 364 Cb -1.08 -0.17 -0.04 0.00 -0.63 0.00 0.00 43.02 41.11 1jti s PHE 364 CO 0.50 -0.49 0.22 -0.51 -0.05 0.00 0.00 175.22 174.88 1jti s LEU 365 N -2.88 4.20 0.07 -1.99 1.43 -0.96 -0.62 118.68 117.93 1jti s LEU 365 Ca 0.06 0.14 -0.17 0.00 -1.03 0.00 0.00 54.13 53.13 1jti s LEU 365 Cb 0.06 -2.80 0.03 0.00 0.03 0.00 0.00 46.19 43.51 1jti s LEU 365 CO -0.10 0.11 0.39 0.72 0.23 0.00 0.00 176.35 177.69 1jti s PHE 366 N -1.63 -0.21 -0.08 0.29 -0.71 -0.06 -1.21 117.98 114.37 1jti s PHE 366 Ca 0.34 0.07 -0.23 0.00 -1.04 0.00 0.00 56.93 56.06 1jti s PHE 366 Cb -0.12 0.20 0.05 0.00 -1.21 0.00 0.00 43.02 41.95 1jti s PHE 366 CO 0.27 -0.60 0.54 0.00 -1.34 0.00 0.00 175.22 174.09 1jti s ILE 368 N -0.89 4.37 0.11 0.00 1.01 -0.28 -0.78 121.20 124.75 1jti s ILE 368 Ca -0.09 -0.18 0.03 0.00 0.00 0.00 0.00 60.65 60.40 1jti s ILE 368 Cb -0.03 -2.95 -0.04 0.00 0.01 0.00 0.00 42.46 39.46 1jti s ILE 368 CO 0.06 0.48 -0.08 -1.59 0.00 0.00 0.00 174.94 173.81 1jti s LYS 369 N 0.34 0.91 -0.29 2.79 -2.85 -0.76 -1.36 119.74 118.52 1jti s LYS 369 Ca -0.00 -1.35 -0.21 0.00 -1.00 0.00 0.00 55.97 53.42 1jti s LYS 369 Cb -0.13 -0.38 -0.01 0.00 -2.06 0.00 0.00 37.83 35.25 1jti s LYS 369 CO 0.01 0.02 0.64 -1.58 0.10 0.00 0.00 175.35 174.55 1jti s HIS 370 N -3.37 3.23 0.15 1.78 5.65 0.24 -2.31 115.29 120.67 1jti s HIS 370 Ca 0.12 0.68 -0.19 0.00 0.25 0.00 0.00 55.06 55.93 1jti s HIS 370 Cb 0.03 -2.96 0.03 0.00 -1.18 0.00 0.00 32.58 28.50 1jti s HIS 370 CO -0.02 -0.44 1.68 0.82 -0.65 0.00 0.00 174.74 176.13 1jti h ILE 371 N 5.51 0.69 0.00 0.89 2.04 -1.51 0.32 117.51 125.44 1jti h ILE 371 Ca -0.26 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.52 1jti h ILE 371 Cb 1.12 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 37.88 1jti h ILE 371 CO 0.80 0.00 -0.34 0.00 0.00 0.00 0.00 178.15 178.61 1jti h ALA 372 N 1.29 1.03 0.00 1.87 0.00 -1.94 -3.30 119.26 118.21 1jti h ALA 372 Ca 0.15 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1jti h ALA 372 Cb 0.23 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1jti h ALA 372 CO -0.31 0.42 -0.78 0.25 0.00 0.00 0.00 179.25 178.83 1jti n THR 373 N -3.53 0.00 -1.62 0.00 -2.24 -1.15 -4.98 114.28 100.75 1jti n THR 373 Ca -0.00 -0.25 -0.16 0.00 -2.27 0.00 0.00 64.05 61.36 1jti n THR 373 Cb 0.48 0.79 -0.06 0.00 -2.10 0.00 0.00 70.33 69.44 1jti n THR 373 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1jti n ASN 374 N -1.42 -4.94 -4.72 3.42 3.02 0.11 -4.12 115.26 106.61 1jti n ASN 374 Ca 0.01 0.33 -0.42 0.00 -0.03 0.00 0.00 54.58 54.47 1jti n ASN 374 Cb 0.20 -3.91 -0.03 0.00 -0.61 0.00 0.00 39.78 35.43 1jti n ASN 374 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1jti s ALA 375 N -2.64 3.29 -0.32 5.41 0.00 -1.21 -4.63 121.76 121.65 1jti s ALA 375 Ca 0.00 0.70 -0.17 0.00 0.00 0.00 0.00 51.96 52.49 1jti s ALA 375 Cb 0.00 -3.36 -0.01 0.00 0.00 0.00 0.00 23.12 19.74 1jti s ALA 375 CO 0.00 -0.25 0.46 0.54 0.00 0.00 0.00 175.76 176.51 1jti s VAL 376 N 0.57 5.08 -0.15 0.00 0.11 -1.26 -0.59 120.40 124.16 1jti s VAL 376 Ca 0.52 0.42 -0.12 0.00 -2.93 0.00 0.00 61.98 59.88 1jti s VAL 376 Cb -0.26 -3.87 -0.24 0.00 -1.53 0.00 0.00 36.38 30.49 1jti s VAL 376 CO 0.30 -0.08 0.30 0.18 -3.33 0.00 0.00 175.10 172.47 1jti n LEU 377 N 5.58 2.38 -4.06 2.54 4.32 -0.46 -4.10 117.00 123.20 1jti n LEU 377 Ca -0.06 0.28 -0.16 0.00 -0.02 0.00 0.00 56.01 56.04 1jti n LEU 377 Cb 0.49 -1.07 -0.13 0.00 -1.62 0.00 0.00 43.42 41.10 1jti n LEU 377 CO 0.42 0.66 -0.42 -0.36 -1.22 0.00 0.00 177.39 176.47 1jti s PHE 378 N -2.49 0.79 0.01 -1.77 0.08 -1.07 -3.29 117.98 110.23 1jti s PHE 378 Ca -0.25 -0.32 0.00 0.00 0.12 0.00 0.00 56.93 56.48 1jti s PHE 378 Cb 0.07 -0.48 -0.01 0.00 -0.57 0.00 0.00 43.02 42.03 1jti s PHE 378 CO 0.71 -0.02 -0.01 0.12 -0.10 0.00 0.00 175.22 175.91 1jti s PHE 379 N -0.80 0.10 0.15 0.36 5.36 -0.92 -1.12 117.98 121.10 1jti s PHE 379 Ca -0.02 -0.14 -0.23 0.00 -0.96 0.00 0.00 56.93 55.57 1jti s PHE 379 Cb -0.07 -0.07 0.07 0.00 -0.34 0.00 0.00 43.02 42.61 1jti s PHE 379 CO 0.00 -0.05 0.63 0.20 -1.46 0.00 0.00 175.22 174.55 1jti s GLY 380 N -0.39 -0.58 -0.13 13.12 0.00 0.12 -1.91 107.32 117.54 1jti s GLY 380 Ca -0.04 0.50 0.02 0.00 0.00 0.00 0.00 44.72 45.20 1jti s GLY 380 CO -0.00 0.16 -0.19 -1.60 0.00 0.00 0.00 173.10 171.47 1jti s ARG 381 N -3.70 2.67 -0.43 2.90 3.52 0.18 -0.88 118.95 123.22 1jti s ARG 381 Ca 0.02 -0.73 -0.07 0.00 -0.13 0.00 0.00 55.73 54.82 1jti s ARG 381 Cb -0.01 -2.21 0.10 0.00 -1.56 0.00 0.00 34.95 31.26 1jti s ARG 381 CO -0.12 -0.05 0.26 0.00 -0.81 0.00 0.00 175.30 174.58 1jti n VAL 383 N 4.83 0.41 -3.49 0.00 0.24 -1.26 -2.44 118.33 116.62 1jti n VAL 383 Ca -0.08 -0.50 -0.27 0.00 -2.04 0.00 0.00 64.34 61.46 1jti n VAL 383 Cb 0.42 -0.15 -0.13 0.00 -1.47 0.00 0.00 33.84 32.51 1jti n VAL 383 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1jti s SER 384 N -4.35 2.99 0.00 -1.34 0.15 -1.26 -4.76 113.70 105.14 1jti s SER 384 Ca -0.07 -1.49 0.00 0.00 0.70 0.00 0.00 55.95 55.09 1jti s SER 384 Cb 0.09 -0.20 0.00 0.00 -1.71 0.00 0.00 66.02 64.20 1jti s SER 384 CO 0.69 -0.39 0.33 -2.65 1.20 0.00 0.00 173.24 172.42