#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jti s SER 2 N 0.00 -0.14 0.52 1.61 1.04 -1.26 -5.01 113.70 110.46 1jti s SER 2 Ca 0.00 -0.14 0.28 0.00 0.48 0.00 0.00 55.95 56.58 1jti s SER 2 Cb 0.00 0.25 1.42 0.00 0.10 0.00 0.00 66.02 67.79 1jti s SER 2 CO 0.00 -0.45 1.92 -0.29 0.98 0.00 0.00 173.24 175.40 1jti h ILE 3 N 2.00 0.62 0.61 -1.02 6.09 -1.94 0.63 117.51 124.51 1jti h ILE 3 Ca -0.22 -0.02 -0.03 0.00 -1.37 0.00 0.00 64.86 63.22 1jti h ILE 3 Cb 1.20 0.57 0.01 0.00 0.47 0.00 0.00 36.82 39.07 1jti h ILE 3 CO 0.27 0.01 -0.30 1.23 -3.07 0.00 0.00 178.15 176.29 1jti h GLY 4 N 0.04 -0.86 1.52 8.18 0.00 -1.88 -0.37 103.07 109.71 1jti h GLY 4 Ca 0.38 0.32 -0.04 0.00 0.00 0.00 0.00 47.33 47.99 1jti h GLY 4 CO -0.02 -0.31 0.08 0.00 0.00 0.00 0.00 176.54 176.29 1jti h ALA 5 N -0.66 1.39 -0.32 3.60 0.00 -1.48 -2.56 119.26 119.23 1jti h ALA 5 Ca -0.08 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.60 1jti h ALA 5 Cb 0.67 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1jti h ALA 5 CO 0.14 0.44 -0.02 0.00 0.00 0.00 0.00 179.25 179.81 1jti h ALA 6 N 1.51 0.44 -0.05 0.00 0.00 -0.81 -1.99 119.26 118.35 1jti h ALA 6 Ca 0.13 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 1jti h ALA 6 Cb 0.25 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1jti h ALA 6 CO -0.00 0.21 -0.25 0.66 0.00 0.00 0.00 179.25 179.87 1jti h SER 7 N 0.38 0.08 0.39 0.00 4.64 -0.90 -1.56 113.55 116.58 1jti h SER 7 Ca 0.09 -0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 61.37 1jti h SER 7 Cb 0.47 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 1jti h SER 7 CO 0.02 0.34 -0.19 0.24 -0.87 0.00 0.00 176.83 176.37 1jti h MET 8 N 0.08 -0.51 -0.78 4.77 2.86 -1.24 -0.90 114.93 119.21 1jti h MET 8 Ca 0.01 0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.65 1jti h MET 8 Cb 0.49 0.12 -0.03 0.00 0.06 0.00 0.00 31.60 32.23 1jti h MET 8 CO 0.03 -0.20 0.34 0.93 1.06 0.00 0.00 176.91 179.07 1jti h GLU 9 N -0.84 1.15 -0.66 1.72 5.08 -1.32 -1.67 114.58 118.04 1jti h GLU 9 Ca -0.05 -0.19 -0.04 0.00 -1.00 0.00 0.00 59.36 58.07 1jti h GLU 9 Cb 0.54 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.57 1jti h GLU 9 CO 0.09 0.91 0.25 0.35 -1.00 0.00 0.00 179.01 179.61 1jti h PHE 10 N 1.12 1.02 -0.24 4.33 3.57 -1.32 -0.20 116.94 125.22 1jti h PHE 10 Ca 0.26 -0.08 0.04 0.00 3.53 0.00 0.00 57.97 61.72 1jti h PHE 10 Cb 0.17 -0.30 -0.04 0.00 2.79 0.00 0.00 35.95 38.57 1jti h PHE 10 CO 0.02 0.81 0.00 0.00 -2.23 0.00 0.00 178.31 176.90 1jti h PHE 12 N 0.08 1.12 0.00 0.00 0.04 -1.10 -1.04 116.94 116.04 1jti h PHE 12 Ca 0.11 -0.31 -0.02 0.00 2.80 0.00 0.00 57.97 60.55 1jti h PHE 12 Cb 0.14 -0.25 -0.00 0.00 2.20 0.00 0.00 35.95 38.04 1jti h PHE 12 CO -0.19 1.13 -0.09 -0.44 -0.60 0.00 0.00 178.31 178.12 1jti h ASP 13 N 0.79 0.00 0.26 2.17 3.32 -0.85 -0.47 116.42 121.64 1jti h ASP 13 Ca 0.08 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 56.79 1jti h ASP 13 Cb 0.89 0.00 0.04 0.00 0.22 0.00 0.00 39.33 40.48 1jti h ASP 13 CO 0.08 0.09 -1.50 0.58 -1.72 0.00 0.00 179.24 176.77 1jti h VAL 14 N 0.00 1.27 -0.12 -1.35 2.07 -0.99 -3.27 116.25 113.85 1jti h VAL 14 Ca -0.00 -2.70 0.01 0.00 0.82 0.00 0.00 66.70 64.83 1jti h VAL 14 Cb 0.22 3.03 -0.01 0.00 -1.52 0.00 0.00 31.29 33.01 1jti h VAL 14 CO 0.01 0.81 0.04 0.15 0.02 0.00 0.00 177.57 178.61 1jti h PHE 15 N 0.15 0.07 0.00 1.57 3.57 -0.23 -0.71 116.94 121.36 1jti h PHE 15 Ca -0.26 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.24 1jti h PHE 15 Cb 2.17 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 40.90 1jti h PHE 15 CO 0.13 0.04 0.14 0.87 -2.23 0.00 0.00 178.31 177.25 1jti h LYS 16 N 0.10 0.00 0.04 1.11 6.56 -1.24 0.05 116.57 123.19 1jti h LYS 16 Ca 0.05 0.00 -0.35 0.00 -1.06 0.00 0.00 60.65 59.29 1jti h LYS 16 Cb 0.03 0.00 -0.05 0.00 -0.57 0.00 0.00 32.23 31.64 1jti h LYS 16 CO -0.05 0.00 -2.10 -1.91 -2.06 0.00 0.00 179.45 173.33 1jti n GLU 17 N -2.75 0.69 0.09 3.15 4.07 -0.47 -4.36 120.64 121.06 1jti n GLU 17 Ca -0.02 0.20 -0.14 0.00 -0.06 0.00 0.00 57.16 57.13 1jti n GLU 17 Cb 0.19 -1.66 -0.09 0.00 -0.06 0.00 0.00 31.44 29.82 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 0.02 0.47 -2.41 4.31 3.38 -0.09 -3.30 115.31 117.70 1jti h LEU 18 Ca -0.45 -0.43 -0.00 0.00 0.09 0.00 0.00 57.88 57.09 1jti h LEU 18 Cb 2.04 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 42.64 1jti h LEU 18 CO 0.04 1.28 -0.02 0.07 0.09 0.00 0.00 178.44 179.89 1jti h LYS 19 N 0.15 0.00 -0.07 1.13 2.10 -1.24 -1.06 116.57 117.58 1jti h LYS 19 Ca -0.11 0.00 -0.17 0.00 -2.00 0.00 0.00 60.65 58.38 1jti h LYS 19 Cb 1.77 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 33.09 1jti h LYS 19 CO 0.18 0.02 -0.68 0.28 -2.00 0.00 0.00 179.45 177.25 1jti h VAL 20 N 0.00 1.40 -0.02 0.07 2.07 -1.76 -3.13 116.25 114.88 1jti h VAL 20 Ca -0.00 -2.12 0.00 0.00 0.82 0.00 0.00 66.70 65.40 1jti h VAL 20 Cb 0.06 2.09 0.00 0.00 -1.52 0.00 0.00 31.29 31.92 1jti h VAL 20 CO 0.00 0.63 -0.37 1.41 0.02 0.00 0.00 177.57 179.27 1jti n HIS 21 N -3.83 0.00 -2.98 1.57 8.25 -0.70 -4.49 115.22 113.04 1jti n HIS 21 Ca -0.03 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.26 1jti n HIS 21 Cb 0.67 -0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.76 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 0.25 1.04 -2.48 4.41 8.25 -0.48 -5.10 115.22 121.12 1jti n HIS 22 Ca 0.10 -3.52 -0.39 0.00 -0.26 0.00 0.00 57.72 53.66 1jti n HIS 22 Cb 0.49 -0.40 -0.04 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 -2.79 3.29 -1.51 -1.41 0.00 -1.18 -3.39 121.76 114.76 1jti s ALA 23 Ca 0.38 0.85 -0.06 0.00 0.00 0.00 0.00 51.96 53.13 1jti s ALA 23 Cb 0.38 -3.32 0.02 0.00 0.00 0.00 0.00 23.12 20.20 1jti s ALA 23 CO -0.06 -0.21 0.65 0.09 0.00 0.00 0.00 175.76 176.23 1jti n ASN 24 N 0.71 -5.81 -4.11 0.00 4.13 -1.26 -4.99 115.26 103.93 1jti n ASN 24 Ca 0.01 -0.33 -0.11 0.00 1.68 0.00 0.00 54.58 55.83 1jti n ASN 24 Cb 0.46 -4.69 -0.11 0.00 -1.54 0.00 0.00 39.78 33.90 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 -5.82 0.65 0.69 3.52 2.02 -1.22 -5.01 118.70 113.54 1jti s GLU 25 Ca 0.35 -1.04 -0.14 0.00 0.02 0.00 0.00 54.97 54.16 1jti s GLU 25 Cb -0.16 -0.18 0.02 0.00 0.10 0.00 0.00 34.13 33.91 1jti s GLU 25 CO 0.43 -0.00 1.10 -0.80 0.02 0.00 0.00 175.26 176.01 1jti s ASN 26 N -2.32 4.92 -0.01 -0.19 0.01 -1.26 -4.68 114.94 111.40 1jti s ASN 26 Ca 0.01 1.95 0.01 0.00 -0.71 0.00 0.00 52.86 54.11 1jti s ASN 26 Cb -0.02 -2.54 0.00 0.00 0.41 0.00 0.00 41.25 39.10 1jti s ASN 26 CO -0.03 -1.76 -0.03 -0.63 -1.51 0.00 0.00 177.10 173.14 1jti s ILE 27 N -2.51 0.27 -0.27 0.60 1.01 -0.68 -4.95 121.20 114.65 1jti s ILE 27 Ca 0.65 -0.11 -0.16 0.00 0.00 0.00 0.00 60.65 61.03 1jti s ILE 27 Cb -0.19 -0.25 0.08 0.00 0.01 0.00 0.00 42.46 42.11 1jti s ILE 27 CO 0.46 0.09 0.67 0.12 0.00 0.00 0.00 174.94 176.29 1jti s PHE 28 N 0.10 -1.05 0.26 3.97 5.36 -1.26 -0.26 117.98 125.10 1jti s PHE 28 Ca -0.01 2.10 -0.19 0.00 -0.96 0.00 0.00 56.93 57.87 1jti s PHE 28 Cb -0.03 0.62 0.02 0.00 -0.34 0.00 0.00 43.02 43.29 1jti s PHE 28 CO -0.00 -0.52 0.65 1.52 -1.46 0.00 0.00 175.22 175.41 1jti s TYR 29 N 1.64 -0.09 -0.44 10.12 1.13 -0.93 -4.72 117.35 124.07 1jti s TYR 29 Ca -0.10 -0.33 -0.01 0.00 -1.41 0.00 0.00 57.07 55.22 1jti s TYR 29 Cb -0.05 0.58 0.12 0.00 -1.10 0.00 0.00 41.96 41.50 1jti s TYR 29 CO -0.20 -1.15 0.21 0.00 -2.51 0.00 0.00 175.55 171.90 1jti h PRO 31 N 7.63 0.20 -0.52 0.00 0.11 -1.80 -2.49 132.00 135.13 1jti h PRO 31 Ca -0.08 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 66.04 1jti h PRO 31 Cb 1.01 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 32.04 1jti h PRO 31 CO 0.66 0.13 0.31 0.82 -0.21 0.00 0.00 178.00 179.71 1jti h ILE 32 N 0.21 1.05 -0.64 4.15 1.08 -1.72 -0.81 117.51 120.82 1jti h ILE 32 Ca 0.36 -0.21 -0.04 0.00 -0.39 0.00 0.00 64.86 64.58 1jti h ILE 32 Cb 0.58 0.38 -0.03 0.00 -3.07 0.00 0.00 36.82 34.68 1jti h ILE 32 CO -0.49 0.11 0.25 0.00 -0.69 0.00 0.00 178.15 177.33 1jti h ALA 33 N 1.23 1.24 -0.21 1.87 0.00 -1.77 -2.17 119.26 119.44 1jti h ALA 33 Ca 0.21 -0.17 -0.18 0.00 0.00 0.00 0.00 54.91 54.77 1jti h ALA 33 Cb 0.02 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 1jti h ALA 33 CO -0.10 0.56 -0.60 0.82 0.00 0.00 0.00 179.25 179.93 1jti h ILE 34 N 0.92 1.30 -0.23 0.00 2.04 -1.12 -2.83 117.51 117.59 1jti h ILE 34 Ca 0.22 -1.83 -0.09 0.00 1.00 0.00 0.00 64.86 64.16 1jti h ILE 34 Cb 0.18 1.77 -0.01 0.00 -0.74 0.00 0.00 36.82 38.02 1jti h ILE 34 CO -0.02 0.58 -0.23 0.24 0.00 0.00 0.00 178.15 178.72 1jti h MET 35 N 0.53 0.44 0.12 2.37 2.86 -0.99 -2.11 114.93 118.14 1jti h MET 35 Ca -0.00 -0.15 -0.01 0.00 -2.06 0.00 0.00 59.70 57.48 1jti h MET 35 Cb 1.19 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.82 1jti h MET 35 CO 0.12 0.64 -0.06 1.03 1.06 0.00 0.00 176.91 179.71 1jti h SER 36 N 0.39 -0.13 -0.57 1.22 0.87 -1.30 0.25 113.55 114.28 1jti h SER 36 Ca 0.06 -0.12 0.02 0.00 -1.23 0.00 0.00 61.79 60.52 1jti h SER 36 Cb 0.62 0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 62.59 1jti h SER 36 CO 0.04 0.03 0.36 0.00 -0.53 0.00 0.00 176.83 176.74 1jti h ALA 37 N 0.57 0.73 -0.27 6.23 0.00 -1.44 -1.29 119.26 123.80 1jti h ALA 37 Ca -0.02 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1jti h ALA 37 Cb 0.24 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1jti h ALA 37 CO 0.03 0.11 0.07 1.25 0.00 0.00 0.00 179.25 180.70 1jti h LEU 38 N 0.72 0.35 -0.68 0.00 5.85 -1.14 -2.37 115.31 118.04 1jti h LEU 38 Ca 0.22 -0.04 -0.12 0.00 0.84 0.00 0.00 57.88 58.78 1jti h LEU 38 Cb -0.03 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 1jti h LEU 38 CO -0.08 0.36 -0.28 0.00 -0.34 0.00 0.00 178.44 178.11 1jti h ALA 39 N 1.69 0.86 -0.42 1.25 0.00 0.63 -0.89 119.26 122.38 1jti h ALA 39 Ca 0.09 -0.39 -0.12 0.00 0.00 0.00 0.00 54.91 54.49 1jti h ALA 39 Cb 0.16 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1jti h ALA 39 CO -0.00 0.63 -0.23 0.52 0.00 0.00 0.00 179.25 180.16 1jti h MET 40 N 0.62 0.86 0.18 0.00 2.86 -0.89 -1.43 114.93 117.13 1jti h MET 40 Ca 0.08 -0.36 -0.01 0.00 -2.06 0.00 0.00 59.70 57.35 1jti h MET 40 Cb 0.79 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.42 1jti h MET 40 CO 0.06 1.00 -0.08 0.28 1.06 0.00 0.00 176.91 179.23 1jti h VAL 41 N 0.74 0.92 -1.00 -2.22 2.07 -1.28 -2.90 116.25 112.57 1jti h VAL 41 Ca 0.10 -0.45 0.24 0.00 0.82 0.00 0.00 66.70 67.41 1jti h VAL 41 Cb 0.78 1.19 -0.09 0.00 -1.52 0.00 0.00 31.29 31.64 1jti h VAL 41 CO 0.06 0.10 0.64 0.22 0.02 0.00 0.00 177.57 178.62 1jti h TYR 42 N -0.45 0.71 -0.97 1.57 3.20 -1.06 -0.67 116.97 119.29 1jti h TYR 42 Ca -0.02 0.02 0.21 0.00 3.14 0.00 0.00 58.73 62.08 1jti h TYR 42 Cb 0.35 -0.21 -0.09 0.00 1.54 0.00 0.00 36.73 38.32 1jti h TYR 42 CO -0.00 0.11 0.62 1.25 -1.64 0.00 0.00 178.16 178.50 1jti h LEU 43 N 0.47 0.57 -3.44 2.82 6.46 -1.04 -2.27 115.31 118.87 1jti h LEU 43 Ca 0.56 0.07 -0.28 0.00 -0.12 0.00 0.00 57.88 58.12 1jti h LEU 43 Cb 1.31 -0.03 -0.18 0.00 -0.73 0.00 0.00 40.66 41.03 1jti h LEU 43 CO -0.29 0.20 -0.23 0.61 -0.62 0.00 0.00 178.44 178.11 1jti n GLY 44 N -1.43 5.36 3.56 3.75 0.00 -0.26 -4.86 105.19 111.31 1jti n GLY 44 Ca 0.22 -1.65 -0.30 0.00 0.00 0.00 0.00 46.02 44.30 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 -3.38 2.91 0.23 4.61 0.00 -0.86 -2.17 121.76 123.12 1jti s ALA 45 Ca 0.47 -1.26 0.00 0.00 0.00 0.00 0.00 51.96 51.17 1jti s ALA 45 Cb 0.41 -0.85 -0.04 0.00 0.00 0.00 0.00 23.12 22.63 1jti s ALA 45 CO -0.01 0.63 0.13 0.15 0.00 0.00 0.00 175.76 176.66 1jti s LYS 46 N -2.21 1.33 3.35 0.00 1.02 -0.73 -4.61 119.74 117.90 1jti s LYS 46 Ca 0.21 -1.72 0.00 0.00 0.02 0.00 0.00 55.97 54.48 1jti s LYS 46 Cb -0.11 0.05 0.00 0.00 -0.52 0.00 0.00 37.83 37.25 1jti s LYS 46 CO 0.13 -0.37 0.00 -3.47 -0.92 0.00 0.00 175.35 170.72 1jti n ASP 47 N -0.44 0.00 -0.20 2.83 -0.08 -1.26 -2.58 116.55 114.81 1jti n ASP 47 Ca 0.01 0.00 0.01 0.00 -1.51 0.00 0.00 54.79 53.30 1jti n ASP 47 Cb 0.66 0.00 0.11 0.00 2.34 0.00 0.00 41.12 44.23 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 6.64 -0.02 -0.54 1.67 4.64 -1.97 -1.73 113.55 122.25 1jti h SER 48 Ca 0.00 0.12 0.09 0.00 -0.47 0.00 0.00 61.79 61.52 1jti h SER 48 Cb 0.00 0.16 -0.10 0.00 -0.31 0.00 0.00 62.40 62.15 1jti h SER 48 CO 0.00 -0.00 -0.42 0.74 -0.87 0.00 0.00 176.83 176.28 1jti h THR 49 N 0.25 0.11 0.74 2.95 2.02 -1.86 0.22 112.91 117.34 1jti h THR 49 Ca 0.32 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.46 1jti h THR 49 Cb 0.47 0.11 -0.00 0.00 -1.74 0.00 0.00 68.15 66.99 1jti h THR 49 CO -0.41 0.00 -0.46 -0.09 0.37 0.00 0.00 175.52 174.93 1jti h ARG 50 N -0.24 -1.09 -0.79 6.66 2.43 -1.11 -2.93 114.38 117.31 1jti h ARG 50 Ca 0.18 0.07 0.14 0.00 -0.81 0.00 0.00 59.98 59.56 1jti h ARG 50 Cb 0.57 0.25 -0.09 0.00 -0.42 0.00 0.00 29.97 30.27 1jti h ARG 50 CO -0.66 -0.73 0.37 0.00 -1.51 0.00 0.00 179.97 177.45 1jti h THR 51 N -1.13 0.72 -0.15 0.20 1.03 -0.95 -1.14 112.91 111.49 1jti h THR 51 Ca -0.10 -0.19 0.03 0.00 -0.01 0.00 0.00 66.41 66.14 1jti h THR 51 Cb 0.91 0.12 -0.01 0.00 -1.07 0.00 0.00 68.15 68.10 1jti h THR 51 CO 0.10 0.10 0.11 -0.61 -0.01 0.00 0.00 175.52 175.20 1jti h GLN 52 N 0.55 0.07 -0.03 0.00 4.15 -0.50 0.08 115.11 119.44 1jti h GLN 52 Ca 0.43 -0.00 -0.07 0.00 0.77 0.00 0.00 58.65 59.77 1jti h GLN 52 Cb 0.59 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.27 1jti h GLN 52 CO -0.36 0.05 -0.25 0.82 -1.93 0.00 0.00 178.83 177.16 1jti h ILE 53 N 0.07 1.49 -0.33 2.39 2.04 -1.03 -3.21 117.51 118.94 1jti h ILE 53 Ca 0.07 -1.80 -0.07 0.00 1.00 0.00 0.00 64.86 64.05 1jti h ILE 53 Cb 0.18 2.57 -0.02 0.00 -0.74 0.00 0.00 36.82 38.81 1jti h ILE 53 CO -0.01 0.50 -0.09 -1.13 0.00 0.00 0.00 178.15 177.42 1jti h ASN 54 N -0.39 0.53 0.36 1.72 -0.00 -1.22 -0.57 115.58 116.01 1jti h ASN 54 Ca -0.02 -0.13 0.00 0.00 -0.00 0.00 0.00 56.30 56.14 1jti h ASN 54 Cb 0.95 -0.14 0.00 0.00 -0.00 0.00 0.00 38.32 39.12 1jti h ASN 54 CO 0.05 0.67 0.00 1.17 -0.00 0.00 0.00 177.43 179.32 1jti n LYS 55 N -4.21 0.07 -0.02 6.67 4.81 -0.02 0.18 118.16 125.64 1jti n LYS 55 Ca 0.01 0.41 -0.02 0.00 -0.87 0.00 0.00 58.31 57.84 1jti n LYS 55 Cb 0.31 -1.66 -0.04 0.00 0.02 0.00 0.00 35.03 33.66 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 -1.80 0.29 -0.03 3.15 0.31 -0.78 -4.69 118.33 114.78 1jti n VAL 56 Ca 0.02 -0.19 0.06 0.00 -0.01 0.00 0.00 64.34 64.21 1jti n VAL 56 Cb 0.12 -0.74 -0.17 0.00 -0.91 0.00 0.00 33.84 32.15 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 -2.13 0.35 -4.00 2.52 0.31 -0.29 -4.91 118.33 110.19 1jti n VAL 57 Ca -0.07 -0.59 -0.28 0.00 -0.01 0.00 0.00 64.34 63.39 1jti n VAL 57 Cb 0.60 -0.12 -0.02 0.00 -0.91 0.00 0.00 33.84 33.40 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 -2.39 -3.50 0.00 5.55 1.74 0.13 -4.78 116.66 113.41 1jti n ARG 58 Ca -0.11 0.42 0.06 0.00 -0.77 0.00 0.00 57.85 57.45 1jti n ARG 58 Cb 0.72 -4.75 0.02 0.00 -1.02 0.00 0.00 32.46 27.43 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 -4.42 0.00 -3.92 -1.55 -0.00 -1.26 -4.78 117.46 101.54 1jti n PHE 59 Ca -0.20 0.00 -0.35 0.00 -0.00 0.00 0.00 57.45 56.90 1jti n PHE 59 Cb 0.63 0.00 -0.14 0.00 -0.00 0.00 0.00 39.48 39.97 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 -1.33 4.87 0.05 5.98 2.15 -1.26 -3.73 116.67 123.40 1jti s ASP 60 Ca 0.12 -1.29 -0.30 0.00 0.43 0.00 0.00 52.55 51.51 1jti s ASP 60 Cb 0.10 -1.70 -0.08 0.00 -0.30 0.00 0.00 42.92 40.94 1jti s ASP 60 CO 0.24 -0.26 1.68 -0.75 -0.17 0.00 0.00 175.17 175.91 1jti s LYS 61 N 1.24 4.19 0.52 4.34 2.20 -1.26 -4.88 119.74 126.09 1jti s LYS 61 Ca -0.05 2.33 -0.11 0.00 -0.36 0.00 0.00 55.97 57.78 1jti s LYS 61 Cb -0.20 -3.70 -0.05 0.00 -1.51 0.00 0.00 37.83 32.37 1jti s LYS 61 CO -0.01 -0.77 0.91 -0.51 -0.36 0.00 0.00 175.35 174.61 1jti s LEU 62 N 3.00 3.52 0.79 5.43 1.43 -1.26 -4.53 118.68 127.06 1jti s LEU 62 Ca 0.75 1.28 -0.12 0.00 -1.03 0.00 0.00 54.13 55.01 1jti s LEU 62 Cb -0.39 -4.25 0.06 0.00 0.03 0.00 0.00 46.19 41.64 1jti s LEU 62 CO 0.32 -0.65 1.11 -2.16 0.23 0.00 0.00 176.35 175.20 1jti s PRO 63 N -4.58 2.16 -0.05 1.29 0.04 -1.26 -5.14 135.00 127.45 1jti s PRO 63 Ca 0.53 0.53 -0.12 0.00 0.04 0.00 0.00 61.00 61.99 1jti s PRO 63 Cb -0.10 -1.94 -0.05 0.00 0.04 0.00 0.00 34.50 32.45 1jti s PRO 63 CO 0.43 -1.54 0.30 0.20 0.04 0.00 0.00 177.00 176.42 1jti s GLY 64 N -4.06 2.35 0.00 0.56 0.00 -1.26 -4.98 107.32 99.92 1jti s GLY 64 Ca 0.61 -0.39 0.17 0.00 0.00 0.00 0.00 44.72 45.11 1jti s GLY 64 CO 0.53 -0.04 1.44 0.69 0.00 0.00 0.00 173.10 175.72 1jti n PHE 65 N 1.94 0.32 0.00 1.90 0.99 -1.26 -4.97 117.46 116.38 1jti n PHE 65 Ca -0.16 -0.16 0.00 0.00 -0.00 0.00 0.00 57.45 57.13 1jti n PHE 65 Cb 0.53 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 39.01 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 1.11 4.87 0.00 1.37 0.00 -1.26 -4.89 105.19 106.39 1jti n GLY 66 Ca 0.15 -1.01 0.10 0.00 0.00 0.00 0.00 46.02 45.26 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 0.00 -4.77 1.61 8.00 -1.26 -4.13 116.55 116.00 1jti n ASP 67 Ca 0.00 -0.88 -0.41 0.00 0.71 0.00 0.00 54.79 54.21 1jti n ASP 67 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.08 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 -1.89 6.66 0.35 -2.24 0.15 -1.26 -4.91 113.70 110.57 1jti s SER 68 Ca 0.31 2.73 0.10 0.00 0.70 0.00 0.00 55.95 59.80 1jti s SER 68 Cb 0.14 -2.65 0.66 0.00 -1.71 0.00 0.00 66.02 62.46 1jti s SER 68 CO 0.24 -0.62 1.81 0.40 1.20 0.00 0.00 173.24 176.27 1jti h ILE 69 N 2.94 1.26 -0.09 6.45 2.04 -1.89 -0.80 117.51 127.44 1jti h ILE 69 Ca -0.49 -1.25 -0.14 0.00 1.00 0.00 0.00 64.86 63.98 1jti h ILE 69 Cb 1.23 1.60 -0.01 0.00 -0.74 0.00 0.00 36.82 38.90 1jti h ILE 69 CO 0.65 0.37 -0.56 -0.33 0.00 0.00 0.00 178.15 178.27 1jti h GLU 70 N 0.10 0.26 0.13 2.37 3.07 -1.93 -1.65 114.58 116.92 1jti h GLU 70 Ca 0.01 -0.17 -0.01 0.00 -0.50 0.00 0.00 59.36 58.70 1jti h GLU 70 Cb 0.65 0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.58 1jti h GLU 70 CO 0.05 0.75 -0.06 0.00 -1.40 0.00 0.00 179.01 178.35 1jti h ALA 71 N 1.21 -0.57 -0.76 3.43 0.00 -1.72 -0.73 119.26 120.11 1jti h ALA 71 Ca -0.00 -0.04 0.15 0.00 0.00 0.00 0.00 54.91 55.02 1jti h ALA 71 Cb 1.05 0.07 -0.14 0.00 0.00 0.00 0.00 17.79 18.76 1jti h ALA 71 CO 0.09 -0.56 -0.24 1.96 0.00 0.00 0.00 179.25 180.50 1jti h GLN 72 N -0.30 -0.03 -0.00 0.00 4.20 -1.24 0.40 115.11 118.14 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 0.14 0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.92 1jti h GLN 72 CO 0.03 -0.02 -0.04 0.00 -0.67 0.00 0.00 178.83 178.13 1jti n GLY 74 N 1.33 3.57 0.09 0.00 0.00 0.81 -4.81 105.19 106.19 1jti n GLY 74 Ca 0.13 -1.04 -0.15 0.00 0.00 0.00 0.00 46.02 44.96 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 -0.64 1.48 0.00 2.61 -1.04 0.10 -4.87 114.28 111.93 1jti n THR 75 Ca 0.13 0.04 0.00 0.00 -2.04 0.00 0.00 64.05 62.18 1jti n THR 75 Cb 0.81 -2.20 0.00 0.00 -1.82 0.00 0.00 70.33 67.12 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 -4.48 0.00 -3.41 8.00 7.64 -1.26 -4.94 113.62 115.17 1jti n SER 76 Ca -0.23 0.00 -0.26 0.00 1.01 0.00 0.00 58.87 59.39 1jti n SER 76 Cb 0.53 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.64 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 0.17 -4.00 0.44 0.31 -1.26 -4.87 118.33 107.13 1jti n VAL 77 Ca 0.00 -4.24 -0.11 0.00 -0.01 0.00 0.00 64.34 59.98 1jti n VAL 77 Cb 0.00 -1.94 -0.03 0.00 -0.91 0.00 0.00 33.84 30.95 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 -1.16 0.28 0.30 4.52 2.20 -1.26 -4.77 114.94 115.05 1jti s ASN 78 Ca 0.34 -1.16 0.06 0.00 -0.94 0.00 0.00 52.86 51.17 1jti s ASN 78 Cb 0.10 0.66 0.81 0.00 -2.00 0.00 0.00 41.25 40.81 1jti s ASN 78 CO -0.12 -1.30 1.70 1.62 -2.94 0.00 0.00 177.10 176.06 1jti h VAL 79 N 2.15 0.47 -0.48 3.54 3.04 -1.90 -1.54 116.25 121.54 1jti h VAL 79 Ca -0.28 -0.15 -0.11 0.00 -1.01 0.00 0.00 66.70 65.15 1jti h VAL 79 Cb 1.25 -0.01 -0.01 0.00 -2.01 0.00 0.00 31.29 30.51 1jti h VAL 79 CO 0.37 0.08 -0.14 0.45 -1.01 0.00 0.00 177.57 177.32 1jti h HIS 80 N 0.44 1.05 0.00 3.17 3.86 -1.90 0.40 115.15 122.17 1jti h HIS 80 Ca 0.60 -0.23 -0.16 0.00 -1.16 0.00 0.00 60.37 59.41 1jti h HIS 80 Cb 1.16 -0.25 -0.02 0.00 1.06 0.00 0.00 27.41 29.36 1jti h HIS 80 CO -0.09 1.02 -0.78 0.66 0.86 0.00 0.00 177.93 179.60 1jti h SER 81 N 0.78 0.00 -0.08 2.45 4.64 -1.72 -1.66 113.55 117.97 1jti h SER 81 Ca 0.12 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.41 1jti h SER 81 Cb 0.70 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.79 1jti h SER 81 CO 0.05 0.78 -0.06 -1.28 -0.87 0.00 0.00 176.83 175.46 1jti h SER 82 N 0.00 0.18 -0.31 4.97 0.87 -1.20 -0.96 113.55 117.10 1jti h SER 82 Ca -0.01 -0.46 -0.10 0.00 -1.23 0.00 0.00 61.79 59.99 1jti h SER 82 Cb 1.41 -0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 63.30 1jti h SER 82 CO 0.10 0.60 -0.16 0.25 -0.53 0.00 0.00 176.83 177.09 1jti h LEU 83 N -0.23 0.76 -0.47 2.23 5.85 -0.94 -2.08 115.31 120.42 1jti h LEU 83 Ca 0.01 -0.24 -0.03 0.00 0.84 0.00 0.00 57.88 58.46 1jti h LEU 83 Cb 0.54 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 1jti h LEU 83 CO 0.02 0.92 0.17 -0.09 -0.34 0.00 0.00 178.44 179.12 1jti h ARG 84 N 0.68 0.71 -0.34 1.25 2.43 -1.27 -1.80 114.38 116.04 1jti h ARG 84 Ca 0.11 -0.14 -0.02 0.00 -0.81 0.00 0.00 59.98 59.12 1jti h ARG 84 Cb 0.65 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.07 1jti h ARG 84 CO 0.05 0.66 0.15 0.22 -1.51 0.00 0.00 179.97 179.54 1jti h ASP 85 N 0.62 0.45 -0.70 -3.80 3.58 -0.92 -0.66 116.42 114.98 1jti h ASP 85 Ca 0.15 -0.14 -0.04 0.00 0.42 0.00 0.00 57.03 57.42 1jti h ASP 85 Cb 0.22 -0.12 -0.03 0.00 1.72 0.00 0.00 39.33 41.13 1jti h ASP 85 CO -0.01 0.47 0.27 -0.29 -2.88 0.00 0.00 179.24 176.80 1jti h ILE 86 N 0.41 1.25 -0.51 2.25 -0.00 -1.30 -0.65 117.51 118.96 1jti h ILE 86 Ca 0.12 -0.80 -0.05 0.00 -0.00 0.00 0.00 64.86 64.13 1jti h ILE 86 Cb 0.14 0.46 -0.02 0.00 -0.00 0.00 0.00 36.82 37.40 1jti h ILE 86 CO -0.01 0.32 0.12 -0.07 -0.00 0.00 0.00 178.15 178.50 1jti h LEU 87 N 1.01 0.72 0.15 2.19 3.38 -1.13 -2.43 115.31 119.20 1jti h LEU 87 Ca 0.23 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 1jti h LEU 87 Cb 0.23 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1jti h LEU 87 CO -0.02 0.71 -0.07 0.78 0.09 0.00 0.00 178.44 179.93 1jti h ASN 88 N 0.75 -0.17 -0.88 -0.43 -0.26 -0.40 -2.26 115.58 111.93 1jti h ASN 88 Ca 0.17 -0.13 0.08 0.00 -0.56 0.00 0.00 56.30 55.85 1jti h ASN 88 Cb 0.28 0.04 -0.06 0.00 -1.06 0.00 0.00 38.32 37.53 1jti h ASN 88 CO -0.00 0.03 0.57 1.56 -1.06 0.00 0.00 177.43 178.53 1jti h GLN 89 N -0.37 0.93 -0.00 0.81 4.20 -0.93 -2.80 115.11 116.94 1jti h GLN 89 Ca -0.02 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.63 1jti h GLN 89 Cb 0.29 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 27.86 1jti h GLN 89 CO 0.03 0.61 -0.36 0.44 -0.67 0.00 0.00 178.83 178.88 1jti n ILE 90 N -4.50 0.00 -2.63 2.54 -5.35 -0.93 -4.85 119.36 103.64 1jti n ILE 90 Ca 0.14 -0.08 -0.43 0.00 -0.27 0.00 0.00 62.75 62.11 1jti n ILE 90 Cb 0.24 0.35 -0.02 0.00 -1.74 0.00 0.00 39.64 38.47 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 -2.70 4.57 0.00 7.28 2.01 -0.86 -4.51 115.64 121.43 1jti s THR 91 Ca 0.19 1.87 0.00 0.00 0.31 0.00 0.00 61.69 64.06 1jti s THR 91 Cb 0.18 -4.32 0.00 0.00 0.01 0.00 0.00 72.50 68.38 1jti s THR 91 CO 0.59 -0.29 0.00 0.29 -0.69 0.00 0.00 174.62 174.52 1jti n LYS 92 N 6.57 0.00 -3.04 4.92 5.02 -1.14 -4.97 118.16 125.53 1jti n LYS 92 Ca 0.12 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.41 1jti n LYS 92 Cb 0.46 0.00 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 0.00 0.00 0.00 4.39 5.15 -1.26 -4.97 115.26 118.57 1jti n ASN 94 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 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 -0.05 1.20 2.03 -1.26 -4.35 116.55 114.13 1jti n ASP 95 Ca 0.00 0.00 0.02 0.00 0.52 0.00 0.00 54.79 55.33 1jti n ASP 95 Cb 0.00 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.39 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 0.00 -3.61 5.18 0.24 -1.26 -5.03 118.33 113.84 1jti n VAL 96 Ca 0.00 -0.42 -0.14 0.00 -2.04 0.00 0.00 64.34 61.74 1jti n VAL 96 Cb 0.00 1.02 -0.07 0.00 -1.47 0.00 0.00 33.84 33.33 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 -1.19 -0.72 0.00 6.34 -0.85 -1.26 -1.95 117.35 117.72 1jti s TYR 97 Ca 0.03 1.69 0.02 0.00 -0.52 0.00 0.00 57.07 58.29 1jti s TYR 97 Cb 0.04 0.31 -0.01 0.00 0.38 0.00 0.00 41.96 42.67 1jti s TYR 97 CO 0.16 -0.39 -0.08 -1.54 -1.52 0.00 0.00 175.55 172.17 1jti s SER 98 N 0.10 0.91 -0.06 -0.18 1.04 0.79 -4.01 113.70 112.29 1jti s SER 98 Ca -0.01 -0.20 -0.03 0.00 0.48 0.00 0.00 55.95 56.18 1jti s SER 98 Cb -0.04 -0.08 0.04 0.00 0.10 0.00 0.00 66.02 66.03 1jti s SER 98 CO 0.01 0.05 0.14 0.12 0.98 0.00 0.00 173.24 174.55 1jti s PHE 99 N -0.36 -0.15 -0.08 5.02 5.36 -1.26 -0.64 117.98 125.87 1jti s PHE 99 Ca 0.01 0.46 -0.06 0.00 -0.96 0.00 0.00 56.93 56.38 1jti s PHE 99 Cb -0.04 -0.08 0.02 0.00 -0.34 0.00 0.00 43.02 42.58 1jti s PHE 99 CO -0.00 -0.16 0.20 -1.54 -1.46 0.00 0.00 175.22 172.26 1jti s SER 100 N 1.11 -0.21 -0.13 6.13 1.04 -0.26 -2.86 113.70 118.52 1jti s SER 100 Ca -0.09 0.41 0.02 0.00 0.48 0.00 0.00 55.95 56.77 1jti s SER 100 Cb -0.11 0.39 0.01 0.00 0.10 0.00 0.00 66.02 66.41 1jti s SER 100 CO -0.06 -0.09 -0.20 -0.22 0.98 0.00 0.00 173.24 173.66 1jti s LEU 101 N 0.34 1.99 -0.06 2.42 2.96 -1.26 -1.48 118.68 123.58 1jti s LEU 101 Ca -0.02 -0.56 0.05 0.00 -0.22 0.00 0.00 54.13 53.39 1jti s LEU 101 Cb -0.03 -1.34 -0.01 0.00 0.50 0.00 0.00 46.19 45.31 1jti s LEU 101 CO -0.01 0.05 -0.24 0.00 -1.32 0.00 0.00 176.35 174.83 1jti s ALA 102 N 0.92 2.09 0.08 5.97 0.00 -0.33 -4.97 121.76 125.51 1jti s ALA 102 Ca -0.06 -0.99 0.10 0.00 0.00 0.00 0.00 51.96 51.01 1jti s ALA 102 Cb -0.15 -0.68 -0.03 0.00 0.00 0.00 0.00 23.12 22.26 1jti s ALA 102 CO -0.03 0.38 -0.25 -1.12 0.00 0.00 0.00 175.76 174.74 1jti s SER 103 N -0.04 3.36 -0.02 0.00 0.01 -1.26 -0.76 113.70 114.99 1jti s SER 103 Ca -0.07 -0.62 -0.03 0.00 1.31 0.00 0.00 55.95 56.54 1jti s SER 103 Cb -0.14 -0.32 0.00 0.00 0.21 0.00 0.00 66.02 65.77 1jti s SER 103 CO 0.04 0.22 0.07 -0.13 0.41 0.00 0.00 173.24 173.86 1jti s ARG 104 N -1.62 0.16 -0.22 12.44 0.52 0.59 -3.05 118.95 127.77 1jti s ARG 104 Ca 0.13 -0.04 -0.02 0.00 -0.52 0.00 0.00 55.73 55.29 1jti s ARG 104 Cb -0.10 0.07 0.01 0.00 0.52 0.00 0.00 34.95 35.45 1jti s ARG 104 CO 0.04 -0.03 -0.09 -1.17 0.02 0.00 0.00 175.30 174.07 1jti s LEU 105 N -0.30 2.82 -0.31 2.53 2.96 -0.76 -1.30 118.68 124.32 1jti s LEU 105 Ca -0.04 -0.67 -0.10 0.00 -0.22 0.00 0.00 54.13 53.10 1jti s LEU 105 Cb -0.03 -1.64 -0.02 0.00 0.50 0.00 0.00 46.19 45.01 1jti s LEU 105 CO 0.00 -0.06 0.17 -0.31 -1.32 0.00 0.00 176.35 174.83 1jti s TYR 106 N 1.36 3.19 0.11 5.38 1.51 -0.20 -1.50 117.35 127.20 1jti s TYR 106 Ca 0.03 -0.37 0.10 0.00 -1.01 0.00 0.00 57.07 55.82 1jti s TYR 106 Cb -0.15 -2.37 -0.04 0.00 -0.11 0.00 0.00 41.96 39.29 1jti s TYR 106 CO -0.06 -0.38 -0.24 0.00 -1.11 0.00 0.00 175.55 173.76 1jti s ALA 107 N 1.66 2.11 0.57 3.71 0.00 -0.94 -1.36 121.76 127.51 1jti s ALA 107 Ca 0.05 -1.35 -0.20 0.00 0.00 0.00 0.00 51.96 50.47 1jti s ALA 107 Cb -0.17 -0.33 -0.05 0.00 0.00 0.00 0.00 23.12 22.58 1jti s ALA 107 CO 0.08 0.46 1.11 -1.91 0.00 0.00 0.00 175.76 175.50 1jti n GLU 108 N 1.07 1.18 -1.47 0.00 4.07 -0.91 -0.27 120.64 124.30 1jti n GLU 108 Ca -0.19 0.44 -0.46 0.00 -0.06 0.00 0.00 57.16 56.90 1jti n GLU 108 Cb 0.53 -2.31 -0.08 0.00 -0.06 0.00 0.00 31.44 29.53 1jti n GLU 108 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 1jti n GLU 109 N -1.01 0.86 -3.04 5.31 -0.58 0.13 -3.07 120.64 119.24 1jti n GLU 109 Ca 0.13 0.17 -0.15 0.00 -0.42 0.00 0.00 57.16 56.89 1jti n GLU 109 Cb 0.46 -2.48 0.02 0.00 -0.57 0.00 0.00 31.44 28.86 1jti n GLU 109 CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52 1jti n ARG 110 N 8.41 -2.25 -4.53 3.49 0.00 -1.26 -5.02 116.66 115.50 1jti n ARG 110 Ca 0.45 1.92 -0.28 0.00 -0.00 0.00 0.00 57.85 59.93 1jti n ARG 110 Cb 0.26 -4.17 -0.13 0.00 0.00 0.00 0.00 32.46 28.41 1jti n ARG 110 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.63 177.16 1jti s TYR 111 N -1.97 2.21 0.00 -0.14 5.04 -1.18 -5.00 117.35 116.31 1jti s TYR 111 Ca 0.22 -0.39 0.00 0.00 -2.44 0.00 0.00 57.07 54.46 1jti s TYR 111 Cb -0.04 -1.24 0.00 0.00 0.35 0.00 0.00 41.96 41.03 1jti s TYR 111 CO 0.73 0.25 0.00 -2.30 -1.34 0.00 0.00 175.55 172.89 1jti n PRO 112 N 1.21 0.00 -2.18 4.97 -0.02 -1.26 -4.77 135.00 132.96 1jti n PRO 112 Ca -0.18 0.00 -0.40 0.00 -2.02 0.00 0.00 63.50 60.90 1jti n PRO 112 Cb 0.53 -1.28 -0.03 0.00 -0.02 0.00 0.00 33.50 32.70 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 1.09 3.52 0.07 4.25 1.01 -1.26 -4.08 121.20 125.80 1jti s ILE 113 Ca 0.00 0.39 -0.20 0.00 0.00 0.00 0.00 60.65 60.84 1jti s ILE 113 Cb 0.00 -4.13 -0.11 0.00 0.01 0.00 0.00 42.46 38.23 1jti s ILE 113 CO 0.00 -1.00 0.45 0.18 0.00 0.00 0.00 174.94 174.57 1jti n LEU 114 N 11.24 -0.45 0.17 2.97 4.77 0.36 -4.85 117.00 131.21 1jti n LEU 114 Ca 0.17 0.69 -0.14 0.00 -0.03 0.00 0.00 56.01 56.70 1jti n LEU 114 Cb 0.50 -0.57 -0.07 0.00 -2.33 0.00 0.00 43.42 40.95 1jti n LEU 114 CO 0.71 -1.55 0.75 1.55 -1.33 0.00 0.00 177.39 177.52 1jti h PRO 115 N 1.09 -0.41 -0.01 3.23 0.13 -1.91 -2.75 132.00 131.37 1jti h PRO 115 Ca -0.23 0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.94 1jti h PRO 115 Cb 0.87 0.09 -0.00 0.00 0.13 0.00 0.00 31.00 32.09 1jti h PRO 115 CO 0.36 -0.27 0.02 1.05 -0.23 0.00 0.00 178.00 178.93 1jti h GLU 116 N -0.43 0.00 0.29 0.86 9.09 -1.96 -2.52 114.58 119.91 1jti h GLU 116 Ca -0.02 0.00 -0.01 0.00 0.05 0.00 0.00 59.36 59.38 1jti h GLU 116 Cb 0.37 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.48 1jti h GLU 116 CO -0.00 0.00 -0.14 -0.92 0.05 0.00 0.00 179.01 178.00 1jti h TYR 117 N 0.00 -0.36 -0.06 2.06 3.20 -1.76 -2.47 116.97 117.59 1jti h TYR 117 Ca 0.00 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.81 1jti h TYR 117 Cb 0.05 0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.43 1jti h TYR 117 CO 0.00 -0.04 -0.24 -0.07 -1.64 0.00 0.00 178.16 176.18 1jti h LEU 118 N -0.70 0.09 0.93 2.82 3.38 -1.51 -1.64 115.31 118.68 1jti h LEU 118 Ca -0.04 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 1jti h LEU 118 Cb 0.48 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 41.22 1jti h LEU 118 CO 0.06 0.33 -0.45 1.56 0.09 0.00 0.00 178.44 180.04 1jti h GLN 119 N 0.09 -1.21 -0.13 1.13 7.50 -1.40 -1.75 115.11 119.33 1jti h GLN 119 Ca 0.01 0.08 0.03 0.00 0.50 0.00 0.00 58.65 59.27 1jti h GLN 119 Cb 0.47 0.27 -0.03 0.00 0.05 0.00 0.00 27.48 28.25 1jti h GLN 119 CO 0.03 -0.81 -0.04 0.00 -1.50 0.00 0.00 178.83 176.51 1jti h VAL 121 N -0.02 0.79 -0.43 0.00 2.07 -1.31 0.42 116.25 117.76 1jti h VAL 121 Ca 0.07 -0.28 -0.06 0.00 0.82 0.00 0.00 66.70 67.25 1jti h VAL 121 Cb 0.12 -0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 29.78 1jti h VAL 121 CO -0.15 0.15 0.04 0.50 0.02 0.00 0.00 177.57 178.13 1jti h LYS 122 N 0.81 0.74 0.00 1.57 3.64 -0.51 -1.53 116.57 121.28 1jti h LYS 122 Ca 0.52 -0.22 0.00 0.00 -1.27 0.00 0.00 60.65 59.68 1jti h LYS 122 Cb 0.69 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.44 1jti h LYS 122 CO -0.34 0.79 0.00 -1.91 -2.27 0.00 0.00 179.45 175.72 1jti n GLU 123 N -4.45 0.00 0.36 1.90 4.07 0.66 -2.28 120.64 120.90 1jti n GLU 123 Ca -0.00 0.05 -0.18 0.00 -0.06 0.00 0.00 57.16 56.97 1jti n GLU 123 Cb 0.27 -1.04 -0.09 0.00 -0.06 0.00 0.00 31.44 30.52 1jti n GLU 123 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 1jti h LEU 124 N 0.00 -1.02 -1.15 4.31 3.38 -0.48 -3.22 115.31 117.13 1jti h LEU 124 Ca 0.00 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1jti h LEU 124 Cb 0.00 0.30 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1jti h LEU 124 CO 0.00 -0.63 0.00 -1.22 0.09 0.00 0.00 178.44 176.68 1jti n TYR 125 N -5.54 0.30 -3.33 1.13 4.01 -0.63 -4.85 117.16 108.24 1jti n TYR 125 Ca -0.13 -0.15 -0.22 0.00 -0.16 0.00 0.00 57.90 57.24 1jti n TYR 125 Cb 0.43 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.45 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 0.38 -3.04 -2.96 -0.72 1.74 -0.86 -4.65 116.66 106.55 1jti n ARG 126 Ca 0.15 0.41 -0.40 0.00 -0.77 0.00 0.00 57.85 57.23 1jti n ARG 126 Cb 0.31 -5.08 -0.04 0.00 -1.02 0.00 0.00 32.46 26.63 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 -2.66 2.71 0.16 -0.13 0.00 -0.86 -4.66 107.32 101.88 1jti s GLY 127 Ca 0.37 0.25 -0.13 0.00 0.00 0.00 0.00 44.72 45.21 1jti s GLY 127 CO 0.46 1.29 0.55 -0.32 0.00 0.00 0.00 173.10 175.08 1jti s GLY 128 N 0.77 2.42 -0.07 0.20 0.00 -1.17 -3.88 107.32 105.59 1jti s GLY 128 Ca 0.41 -0.16 -0.12 0.00 0.00 0.00 0.00 44.72 44.85 1jti s GLY 128 CO 0.21 0.10 0.30 -2.27 0.00 0.00 0.00 173.10 171.43 1jti s LEU 129 N -2.12 4.41 -0.17 0.66 1.98 -1.26 -1.83 118.68 120.35 1jti s LEU 129 Ca 0.40 0.72 -0.01 0.00 -2.89 0.00 0.00 54.13 52.35 1jti s LEU 129 Cb -0.14 -2.38 0.05 0.00 0.66 0.00 0.00 46.19 44.38 1jti s LEU 129 CO 0.19 0.32 -0.02 -1.61 -1.89 0.00 0.00 176.35 173.34 1jti s GLU 130 N -0.81 1.12 0.06 1.98 0.41 -0.56 -4.97 118.70 115.92 1jti s GLU 130 Ca 0.20 -0.45 -0.31 0.00 -0.41 0.00 0.00 54.97 54.00 1jti s GLU 130 Cb -0.14 -1.96 -0.07 0.00 -1.78 0.00 0.00 34.13 30.17 1jti s GLU 130 CO 0.09 -0.49 1.46 -1.25 -0.49 0.00 0.00 175.26 174.58 1jti s PRO 131 N 1.72 4.27 0.12 0.39 0.04 -1.26 -2.21 135.00 138.07 1jti s PRO 131 Ca 0.00 2.10 0.03 0.00 0.04 0.00 0.00 61.00 63.18 1jti s PRO 131 Cb -0.16 -3.46 -0.04 0.00 0.04 0.00 0.00 34.50 30.88 1jti s PRO 131 CO -0.07 -0.57 -0.09 -1.50 0.04 0.00 0.00 177.00 174.81 1jti s ILE 132 N 2.01 0.93 -0.68 0.56 1.10 0.63 -4.92 121.20 120.83 1jti s ILE 132 Ca 0.67 -1.92 -0.06 0.00 -0.51 0.00 0.00 60.65 58.82 1jti s ILE 132 Cb -0.36 -1.68 0.18 0.00 0.15 0.00 0.00 42.46 40.75 1jti s ILE 132 CO 0.29 -0.76 0.53 0.21 -2.11 0.00 0.00 174.94 173.10 1jti s ASN 133 N -2.97 5.69 -0.09 4.50 2.47 -1.26 -0.69 114.94 122.59 1jti s ASN 133 Ca 0.12 -2.78 -0.22 0.00 0.42 0.00 0.00 52.86 50.41 1jti s ASN 133 Cb 0.03 -1.96 -0.29 0.00 -1.45 0.00 0.00 41.25 37.58 1jti s ASN 133 CO -0.02 -0.44 0.75 -0.26 -3.72 0.00 0.00 177.10 173.41 1jti h PHE 134 N 7.28 0.39 -0.92 0.43 0.04 -1.87 -2.47 116.94 119.82 1jti h PHE 134 Ca 0.01 -0.29 0.15 0.00 2.80 0.00 0.00 57.97 60.65 1jti h PHE 134 Cb 0.98 -0.02 -0.16 0.00 2.20 0.00 0.00 35.95 38.96 1jti h PHE 134 CO 0.80 1.33 -0.36 1.96 -0.60 0.00 0.00 178.31 181.44 1jti h GLN 135 N -0.50 -0.03 -0.01 1.51 1.08 -1.83 -2.70 115.11 112.64 1jti h GLN 135 Ca -0.17 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.03 1jti h GLN 135 Cb 1.54 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 28.98 1jti h GLN 135 CO 0.08 -0.02 0.00 0.25 -0.95 0.00 0.00 178.83 178.19 1jti n THR 136 N -5.48 0.10 -2.80 -0.54 -2.24 -1.26 -4.56 114.28 97.50 1jti n THR 136 Ca 0.10 -0.55 -0.10 0.00 -2.27 0.00 0.00 64.05 61.22 1jti n THR 136 Cb 0.40 0.98 0.05 0.00 -2.10 0.00 0.00 70.33 69.66 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 0.05 1.92 0.29 6.98 0.00 -0.94 -4.91 120.51 123.90 1jti n ALA 137 Ca 0.01 -2.47 0.18 0.00 0.00 0.00 0.00 53.44 51.16 1jti n ALA 137 Cb 0.07 -0.99 0.76 0.00 0.00 0.00 0.00 19.45 19.29 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 2.74 1.00 -0.17 0.00 0.00 -1.43 -0.80 119.26 120.60 1jti h ALA 138 Ca -0.10 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.63 1jti h ALA 138 Cb 1.15 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.95 1jti h ALA 138 CO 0.30 0.00 -0.60 0.38 0.00 0.00 0.00 179.25 179.33 1jti h ASP 139 N 0.00 0.83 0.22 0.00 2.03 -1.88 -2.37 116.42 115.25 1jti h ASP 139 Ca 0.00 -0.60 -0.25 0.00 -0.73 0.00 0.00 57.03 55.45 1jti h ASP 139 Cb 0.43 -0.24 0.01 0.00 -0.83 0.00 0.00 39.33 38.70 1jti h ASP 139 CO 0.00 1.28 -1.02 -0.61 -1.03 0.00 0.00 179.24 177.87 1jti h GLN 140 N 0.41 0.52 -0.44 4.15 4.15 -1.81 -3.03 115.11 119.07 1jti h GLN 140 Ca -0.02 -0.58 0.02 0.00 0.77 0.00 0.00 58.65 58.84 1jti h GLN 140 Cb 1.22 0.17 -0.03 0.00 0.21 0.00 0.00 27.48 29.05 1jti h GLN 140 CO 0.13 1.21 0.25 0.00 -1.93 0.00 0.00 178.83 178.49 1jti h ALA 141 N 0.58 0.56 -0.35 3.38 0.00 -1.17 -1.15 119.26 121.11 1jti h ALA 141 Ca -0.11 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1jti h ALA 141 Cb 1.66 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.33 1jti h ALA 141 CO 0.19 -0.08 0.20 -0.09 0.00 0.00 0.00 179.25 179.47 1jti h ARG 142 N 0.50 0.48 -0.06 0.00 2.43 -1.46 -0.97 114.38 115.30 1jti h ARG 142 Ca 0.18 -0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 59.22 1jti h ARG 142 Cb 0.03 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 1jti h ARG 142 CO -0.09 0.38 -0.33 0.93 -1.51 0.00 0.00 179.97 179.34 1jti h GLU 143 N 0.44 0.11 -0.16 0.20 5.08 -1.39 0.43 114.58 119.30 1jti h GLU 143 Ca 0.12 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.38 1jti h GLU 143 Cb 0.03 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.27 1jti h GLU 143 CO -0.02 0.44 -0.13 -0.07 -1.00 0.00 0.00 179.01 178.22 1jti h LEU 144 N 0.10 0.39 -0.12 1.33 -0.00 -0.90 -1.39 115.31 114.73 1jti h LEU 144 Ca 0.01 -0.46 -0.01 0.00 -0.00 0.00 0.00 57.88 57.42 1jti h LEU 144 Cb 0.64 -0.11 -0.01 0.00 -0.00 0.00 0.00 40.66 41.18 1jti h LEU 144 CO 0.05 0.77 0.05 0.40 -0.00 0.00 0.00 178.44 179.70 1jti h ILE 145 N 0.02 1.15 -0.81 1.22 2.04 -0.93 -1.94 117.51 118.26 1jti h ILE 145 Ca 0.03 -0.45 0.06 0.00 1.00 0.00 0.00 64.86 65.50 1jti h ILE 145 Cb 0.65 1.23 -0.05 0.00 -0.74 0.00 0.00 36.82 37.91 1jti h ILE 145 CO 0.03 0.13 0.53 0.78 0.00 0.00 0.00 178.15 179.63 1jti h ASN 146 N 0.03 0.80 -0.67 1.72 2.35 -0.93 -2.06 115.58 116.82 1jti h ASN 146 Ca 0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 1jti h ASN 146 Cb 0.17 -0.17 -0.03 0.00 0.05 0.00 0.00 38.32 38.34 1jti h ASN 146 CO -0.00 0.52 0.43 -1.28 -1.65 0.00 0.00 177.43 175.45 1jti h SER 147 N 0.91 0.78 -0.24 5.81 0.87 -0.85 -0.49 113.55 120.35 1jti h SER 147 Ca 0.34 -0.04 -0.03 0.00 -1.23 0.00 0.00 61.79 60.84 1jti h SER 147 Cb 0.18 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 61.94 1jti h SER 147 CO -0.12 0.58 0.05 -0.25 -0.53 0.00 0.00 176.83 176.57 1jti h TRP 148 N 0.91 0.41 -0.63 2.24 7.01 -0.68 -1.61 115.95 123.59 1jti h TRP 148 Ca 0.24 -0.05 -0.02 0.00 2.11 0.00 0.00 58.89 61.17 1jti h TRP 148 Cb -0.08 -0.11 -0.03 0.00 -2.10 0.00 0.00 29.16 26.84 1jti h TRP 148 CO -0.02 0.49 0.31 0.28 -2.79 0.00 0.00 178.44 176.71 1jti h VAL 149 N 0.20 1.22 -0.93 2.65 2.07 -1.20 -0.66 116.25 119.60 1jti h VAL 149 Ca 0.07 -0.60 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 1jti h VAL 149 Cb 0.30 0.45 -0.04 0.00 -1.52 0.00 0.00 31.29 30.47 1jti h VAL 149 CO 0.00 0.25 0.55 -0.08 0.02 0.00 0.00 177.57 178.31 1jti h GLU 150 N 0.87 1.27 -0.14 1.57 4.81 -0.98 -2.21 114.58 119.77 1jti h GLU 150 Ca 0.22 -0.12 -0.19 0.00 -0.13 0.00 0.00 59.36 59.13 1jti h GLU 150 Cb 0.11 -0.26 0.00 0.00 0.63 0.00 0.00 28.75 29.23 1jti h GLU 150 CO -0.03 0.89 -0.70 1.03 -0.73 0.00 0.00 179.01 179.48 1jti h SER 151 N 1.29 0.70 0.68 1.04 0.87 -0.95 0.65 113.55 117.84 1jti h SER 151 Ca 0.33 -0.44 0.00 0.00 -1.23 0.00 0.00 61.79 60.45 1jti h SER 151 Cb -0.04 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 61.71 1jti h SER 151 CO -0.06 1.20 0.00 1.56 -0.53 0.00 0.00 176.83 179.00 1jti h GLN 152 N 0.42 0.00 -0.23 2.24 1.08 -0.78 -2.75 115.11 115.10 1jti h GLN 152 Ca -0.03 0.00 -0.11 0.00 -1.45 0.00 0.00 58.65 57.06 1jti h GLN 152 Cb 1.29 0.00 -0.07 0.00 -0.05 0.00 0.00 27.48 28.65 1jti h GLN 152 CO 0.13 0.00 -0.20 0.25 -0.95 0.00 0.00 178.83 178.06 1jti n THR 153 N -2.81 2.41 -4.27 -0.54 -2.24 -0.86 -4.86 114.28 101.10 1jti n THR 153 Ca 0.00 -2.85 -0.37 0.00 -2.27 0.00 0.00 64.05 58.56 1jti n THR 153 Cb 0.22 -0.29 -0.04 0.00 -2.10 0.00 0.00 70.33 68.12 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 -1.11 -2.68 0.00 3.42 4.13 -1.04 -1.02 115.26 116.96 1jti n ASN 154 Ca 0.28 -1.07 0.00 0.00 1.68 0.00 0.00 54.58 55.47 1jti n ASN 154 Cb 0.91 -2.52 0.00 0.00 -1.54 0.00 0.00 39.78 36.63 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 -1.42 1.94 0.07 7.41 0.00 0.23 -4.92 105.19 108.50 1jti n GLY 155 Ca 0.04 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.93 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 1.48 -3.10 -0.61 2.04 -1.27 -3.40 117.51 112.65 1jti h ILE 156 Ca 0.00 -1.49 -0.70 0.00 1.00 0.00 0.00 64.86 63.67 1jti h ILE 156 Cb 0.00 2.45 -0.19 0.00 -0.74 0.00 0.00 36.82 38.34 1jti h ILE 156 CO 0.00 0.40 0.05 -0.63 0.00 0.00 0.00 178.15 177.96 1jti s ILE 157 N -3.73 4.88 0.10 -0.67 1.01 -1.26 -5.04 121.20 116.49 1jti s ILE 157 Ca -0.16 -0.78 0.05 0.00 0.00 0.00 0.00 60.65 59.76 1jti s ILE 157 Cb 0.01 -4.37 -0.04 0.00 0.01 0.00 0.00 42.46 38.07 1jti s ILE 157 CO 0.69 -0.93 -0.02 -0.13 0.00 0.00 0.00 174.94 174.55 1jti s ARG 158 N 2.56 2.45 -1.30 2.79 0.52 -1.26 -3.38 118.95 121.33 1jti s ARG 158 Ca 0.12 -0.89 -0.10 0.00 -0.52 0.00 0.00 55.73 54.35 1jti s ARG 158 Cb -0.22 -2.48 0.00 0.00 0.52 0.00 0.00 34.95 32.77 1jti s ARG 158 CO 0.09 0.53 0.56 0.09 0.02 0.00 0.00 175.30 176.59 1jti n ASN 159 N 0.58 -2.28 0.26 0.23 3.02 -1.26 -4.87 115.26 110.94 1jti n ASN 159 Ca -0.11 -1.03 0.09 0.00 -0.03 0.00 0.00 54.58 53.49 1jti n ASN 159 Cb 0.52 -3.05 0.67 0.00 -0.61 0.00 0.00 39.78 37.31 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 -1.92 0.92 -3.67 2.41 3.04 -1.86 -3.38 116.25 111.79 1jti h VAL 160 Ca -0.65 -0.11 -0.65 0.00 -1.01 0.00 0.00 66.70 64.28 1jti h VAL 160 Cb 1.37 1.06 -0.21 0.00 -2.01 0.00 0.00 31.29 31.50 1jti h VAL 160 CO 0.57 0.03 -0.61 -0.76 -1.01 0.00 0.00 177.57 175.79 1jti s LEU 161 N -8.70 3.55 0.56 3.16 1.43 -1.26 -5.01 118.68 112.40 1jti s LEU 161 Ca -0.05 -0.16 -0.09 0.00 -1.03 0.00 0.00 54.13 52.80 1jti s LEU 161 Cb 0.16 -1.96 -0.04 0.00 0.03 0.00 0.00 46.19 44.39 1jti s LEU 161 CO 0.65 -0.03 0.93 0.00 0.23 0.00 0.00 176.35 178.13 1jti s GLN 162 N 1.60 3.60 0.25 1.70 -2.07 -1.26 -4.97 119.66 118.50 1jti s GLN 162 Ca 0.06 0.54 -0.27 0.00 -1.82 0.00 0.00 55.36 53.87 1jti s GLN 162 Cb -0.15 -2.21 -0.16 0.00 -1.09 0.00 0.00 33.01 29.41 1jti s GLN 162 CO 0.05 -0.40 0.69 -2.30 -1.32 0.00 0.00 175.29 172.00 1jti n PRO 163 N -2.47 0.53 -4.18 9.60 -0.02 -1.26 -1.95 135.00 135.25 1jti n PRO 163 Ca 0.04 0.19 -0.31 0.00 -2.02 0.00 0.00 63.50 61.40 1jti n PRO 163 Cb 0.54 -1.34 -0.06 0.00 -0.02 0.00 0.00 33.50 32.63 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 1.68 -0.44 -0.00 2.55 7.64 -1.26 -4.77 113.62 119.02 1jti n SER 164 Ca 0.14 -1.13 0.10 0.00 1.01 0.00 0.00 58.87 58.99 1jti n SER 164 Cb 0.29 -2.34 -0.12 0.00 -1.01 0.00 0.00 64.21 61.03 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 -2.85 0.94 -3.87 6.43 3.41 -0.82 -4.87 113.62 111.99 1jti n SER 165 Ca -0.22 -0.95 -0.12 0.00 -0.26 0.00 0.00 58.87 57.32 1jti n SER 165 Cb 0.64 1.03 -0.12 0.00 -0.26 0.00 0.00 64.21 65.50 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 -2.95 0.03 0.00 -3.33 -7.23 -1.26 -4.86 120.40 100.80 1jti s VAL 166 Ca 0.07 -0.28 0.00 0.00 -1.81 0.00 0.00 61.98 59.97 1jti s VAL 166 Cb 0.15 -0.22 0.00 0.00 0.56 0.00 0.00 36.38 36.87 1jti s VAL 166 CO 0.84 -0.15 0.00 -0.90 -0.31 0.00 0.00 175.10 174.58 1jti n ASP 167 N 2.49 0.00 0.05 4.85 5.68 -1.26 -4.87 116.55 123.50 1jti n ASP 167 Ca -0.16 -0.84 0.03 0.00 -0.50 0.00 0.00 54.79 53.32 1jti n ASP 167 Cb 0.58 0.00 0.17 0.00 -1.14 0.00 0.00 41.12 40.73 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 -1.75 0.16 -0.68 -1.12 3.41 -1.26 -0.71 113.62 111.68 1jti n SER 168 Ca 0.00 0.52 0.11 0.00 -0.26 0.00 0.00 58.87 59.24 1jti n SER 168 Cb 0.00 -0.54 0.04 0.00 -0.26 0.00 0.00 64.21 63.45 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 -1.68 1.69 -2.46 4.33 1.13 -1.26 -4.35 117.38 114.77 1jti n GLN 169 Ca -0.00 -1.38 -0.42 0.00 -1.94 0.00 0.00 57.00 53.26 1jti n GLN 169 Cb 0.08 -1.45 -0.03 0.00 0.11 0.00 0.00 30.24 28.95 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 -2.19 4.23 -0.18 5.09 2.01 0.12 -2.14 115.64 122.58 1jti s THR 170 Ca 0.22 1.57 -0.07 0.00 0.31 0.00 0.00 61.69 63.71 1jti s THR 170 Cb 0.18 -4.01 -0.21 0.00 0.01 0.00 0.00 72.50 68.47 1jti s THR 170 CO 0.43 0.03 0.12 0.00 -0.69 0.00 0.00 174.62 174.52 1jti n ALA 171 N 4.87 1.04 -3.41 7.40 0.00 0.16 -4.73 120.51 125.84 1jti n ALA 171 Ca 0.10 -0.75 -0.16 0.00 0.00 0.00 0.00 53.44 52.63 1jti n ALA 171 Cb 0.46 -0.44 -0.06 0.00 0.00 0.00 0.00 19.45 19.42 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 -2.51 1.03 -0.12 0.00 -2.45 -0.83 -2.14 119.30 112.27 1jti s MET 172 Ca -0.28 -0.01 -0.01 0.00 -1.25 0.00 0.00 55.69 54.14 1jti s MET 172 Cb 0.08 0.48 0.03 0.00 1.25 0.00 0.00 34.83 36.66 1jti s MET 172 CO 0.67 -0.35 -0.07 0.08 1.05 0.00 0.00 175.02 176.41 1jti s VAL 173 N -1.83 1.02 0.04 10.11 1.01 -0.47 0.12 120.40 130.40 1jti s VAL 173 Ca -0.08 -0.35 -0.14 0.00 0.00 0.00 0.00 61.98 61.41 1jti s VAL 173 Cb -0.01 -1.08 -0.06 0.00 0.00 0.00 0.00 36.38 35.23 1jti s VAL 173 CO 0.04 0.31 0.43 -0.76 0.00 0.00 0.00 175.10 175.11 1jti s LEU 174 N 1.70 4.43 -0.20 3.92 1.43 0.07 -1.03 118.68 128.99 1jti s LEU 174 Ca 0.04 0.94 -0.27 0.00 -1.03 0.00 0.00 54.13 53.81 1jti s LEU 174 Cb -0.13 -2.78 0.07 0.00 0.03 0.00 0.00 46.19 43.38 1jti s LEU 174 CO -0.08 0.26 0.72 0.54 0.23 0.00 0.00 176.35 178.02 1jti s VAL 175 N -1.21 0.00 0.20 -1.59 0.11 -0.42 -1.59 120.40 115.90 1jti s VAL 175 Ca 0.28 0.00 0.04 0.00 -2.93 0.00 0.00 61.98 59.37 1jti s VAL 175 Cb -0.16 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.64 1jti s VAL 175 CO 0.15 0.00 -0.03 0.54 -3.33 0.00 0.00 175.10 172.43 1jti s ASN 176 N -0.10 1.74 -0.01 3.54 2.20 -0.23 -0.30 114.94 121.77 1jti s ASN 176 Ca -0.03 -1.15 0.01 0.00 -0.94 0.00 0.00 52.86 50.75 1jti s ASN 176 Cb -0.03 0.02 0.01 0.00 -2.00 0.00 0.00 41.25 39.24 1jti s ASN 176 CO 0.03 -0.46 -0.02 0.00 -2.94 0.00 0.00 177.10 173.71 1jti s ALA 177 N -3.42 0.33 -0.05 3.54 0.00 0.07 -3.08 121.76 119.14 1jti s ALA 177 Ca 0.24 -0.03 0.04 0.00 0.00 0.00 0.00 51.96 52.20 1jti s ALA 177 Cb 0.05 -0.18 0.00 0.00 0.00 0.00 0.00 23.12 22.99 1jti s ALA 177 CO 0.05 0.02 -0.15 -1.50 0.00 0.00 0.00 175.76 174.18 1jti s ILE 178 N 0.36 1.31 -0.08 0.00 2.07 0.28 -1.19 121.20 123.96 1jti s ILE 178 Ca -0.04 -0.63 0.02 0.00 -1.41 0.00 0.00 60.65 58.59 1jti s ILE 178 Cb -0.07 -1.14 0.02 0.00 0.13 0.00 0.00 42.46 41.40 1jti s ILE 178 CO -0.01 0.38 -0.11 -0.69 -1.91 0.00 0.00 174.94 172.61 1jti s VAL 179 N 0.19 1.12 -0.04 4.00 1.01 -0.55 -0.81 120.40 125.31 1jti s VAL 179 Ca -0.06 -0.44 0.01 0.00 0.00 0.00 0.00 61.98 61.49 1jti s VAL 179 Cb -0.12 -1.05 0.02 0.00 0.00 0.00 0.00 36.38 35.23 1jti s VAL 179 CO 0.02 0.36 -0.04 0.12 0.00 0.00 0.00 175.10 175.56 1jti s PHE 180 N 0.90 0.71 -0.04 5.22 5.36 0.20 -1.10 117.98 129.23 1jti s PHE 180 Ca -0.10 -0.19 -0.02 0.00 -0.96 0.00 0.00 56.93 55.67 1jti s PHE 180 Cb -0.15 -0.63 0.03 0.00 -0.34 0.00 0.00 43.02 41.93 1jti s PHE 180 CO 0.01 -0.17 0.05 0.21 -1.46 0.00 0.00 175.22 173.85 1jti s LYS 181 N 0.84 0.03 -0.12 10.12 2.20 0.19 -0.09 119.74 132.91 1jti s LYS 181 Ca -0.11 0.31 -0.07 0.00 -0.36 0.00 0.00 55.97 55.73 1jti s LYS 181 Cb -0.14 -0.53 0.04 0.00 -1.51 0.00 0.00 37.83 35.69 1jti s LYS 181 CO 0.00 -0.30 0.29 0.20 -0.36 0.00 0.00 175.35 175.19 1jti s GLY 182 N 1.94 -0.20 0.18 5.54 0.00 -0.70 -0.15 107.32 113.94 1jti s GLY 182 Ca 0.02 1.07 -0.30 0.00 0.00 0.00 0.00 44.72 45.51 1jti s GLY 182 CO -0.03 1.22 0.97 1.08 0.00 0.00 0.00 173.10 176.34 1jti s LEU 183 N 1.04 4.57 0.46 0.66 1.43 -0.82 -1.79 118.68 124.23 1jti s LEU 183 Ca -0.07 1.92 -0.24 0.00 -1.03 0.00 0.00 54.13 54.71 1jti s LEU 183 Cb -0.08 -3.60 -0.07 0.00 0.03 0.00 0.00 46.19 42.47 1jti s LEU 183 CO -0.07 0.01 1.26 0.26 0.23 0.00 0.00 176.35 178.04 1jti s TRP 184 N -0.60 2.71 0.29 0.29 0.23 -0.54 0.27 118.94 121.59 1jti s TRP 184 Ca 0.44 1.45 0.07 0.00 -2.03 0.00 0.00 56.10 56.04 1jti s TRP 184 Cb -0.26 -3.58 0.45 0.00 0.03 0.00 0.00 33.47 30.11 1jti s TRP 184 CO 0.32 -2.05 1.69 1.49 0.96 0.00 0.00 176.95 179.36 1jti h GLU 185 N 2.11 0.19 -3.10 4.98 4.81 -1.46 -3.36 114.58 118.76 1jti h GLU 185 Ca -0.50 -0.10 -0.62 0.00 -0.13 0.00 0.00 59.36 58.01 1jti h GLU 185 Cb 1.26 0.00 -0.41 0.00 0.63 0.00 0.00 28.75 30.24 1jti h GLU 185 CO 0.60 0.61 -0.68 0.15 -0.73 0.00 0.00 179.01 178.95 1jti s LYS 186 N -4.06 1.73 0.86 1.92 1.02 -1.26 -4.86 119.74 115.09 1jti s LYS 186 Ca -0.04 -2.49 -0.11 0.00 0.02 0.00 0.00 55.97 53.35 1jti s LYS 186 Cb 0.13 -2.82 0.11 0.00 -0.52 0.00 0.00 37.83 34.73 1jti s LYS 186 CO 0.77 -1.18 1.16 0.95 -0.92 0.00 0.00 175.35 176.13 1jti s THR 187 N -0.24 2.20 0.40 2.17 -4.23 -1.26 -5.05 115.64 109.64 1jti s THR 187 Ca 0.20 0.07 0.02 0.00 -1.18 0.00 0.00 61.69 60.80 1jti s THR 187 Cb -0.19 -2.28 -0.01 0.00 1.34 0.00 0.00 72.50 71.36 1jti s THR 187 CO -0.04 -0.08 0.60 -0.36 -0.54 0.00 0.00 174.62 174.19 1jti s PHE 188 N -2.49 3.23 -0.10 3.99 0.40 -0.74 -5.04 117.98 117.22 1jti s PHE 188 Ca 0.68 0.11 -0.03 0.00 -0.60 0.00 0.00 56.93 57.10 1jti s PHE 188 Cb -0.24 -2.17 -0.03 0.00 0.51 0.00 0.00 43.02 41.09 1jti s PHE 188 CO 0.55 -0.20 0.01 0.15 0.70 0.00 0.00 175.22 176.43 1jti s LYS 189 N -4.41 3.13 0.10 0.44 1.02 -1.26 -4.72 119.74 114.03 1jti s LYS 189 Ca 0.46 -0.40 -0.35 0.00 0.02 0.00 0.00 55.97 55.71 1jti s LYS 189 Cb -0.10 -2.85 -0.15 0.00 -0.52 0.00 0.00 37.83 34.22 1jti s LYS 189 CO 0.36 0.64 1.56 -0.44 -0.92 0.00 0.00 175.35 176.55 1jti h ASP 190 N 5.37 -1.57 -1.30 2.83 3.45 -1.97 -2.10 116.42 121.14 1jti h ASP 190 Ca -0.49 0.16 0.38 0.00 0.43 0.00 0.00 57.03 57.52 1jti h ASP 190 Cb 1.19 0.58 -0.09 0.00 -0.56 0.00 0.00 39.33 40.45 1jti h ASP 190 CO 0.56 -0.57 0.88 1.05 -1.57 0.00 0.00 179.24 179.60 1jti h GLU 191 N -0.77 0.13 -0.00 3.56 4.11 -2.00 0.36 114.58 119.96 1jti h GLU 191 Ca -0.01 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.41 1jti h GLU 191 Cb 0.77 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.99 1jti h GLU 191 CO -0.27 0.09 -0.06 -0.25 0.07 0.00 0.00 179.01 178.58 1jti n ASP 192 N -4.43 0.29 -4.66 3.06 10.43 -0.80 -4.81 116.55 115.63 1jti n ASP 192 Ca 0.32 -0.50 -0.41 0.00 2.57 0.00 0.00 54.79 56.77 1jti n ASP 192 Cb 1.31 -0.13 -0.04 0.00 1.84 0.00 0.00 41.12 44.10 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 -2.45 4.90 0.19 -3.53 2.01 0.13 -4.24 115.64 112.64 1jti s THR 193 Ca 0.31 1.55 0.03 0.00 0.31 0.00 0.00 61.69 63.88 1jti s THR 193 Cb 0.20 -4.10 -0.05 0.00 0.01 0.00 0.00 72.50 68.56 1jti s THR 193 CO 0.46 0.03 -0.01 -1.10 -0.69 0.00 0.00 174.62 173.30 1jti s GLN 194 N 2.20 1.18 0.37 4.92 -0.21 -0.80 -4.91 119.66 122.41 1jti s GLN 194 Ca 0.36 -1.57 -0.26 0.00 0.02 0.00 0.00 55.36 53.91 1jti s GLN 194 Cb -0.16 -0.43 -0.09 0.00 1.00 0.00 0.00 33.01 33.33 1jti s GLN 194 CO 0.11 -0.09 1.14 0.00 -2.12 0.00 0.00 175.29 174.33 1jti s ALA 195 N -3.54 3.21 -0.15 6.09 0.00 -1.26 -0.42 121.76 125.69 1jti s ALA 195 Ca 0.24 0.91 -0.26 0.00 0.00 0.00 0.00 51.96 52.86 1jti s ALA 195 Cb 0.05 -3.35 0.06 0.00 0.00 0.00 0.00 23.12 19.89 1jti s ALA 195 CO 0.05 -0.39 0.64 1.41 0.00 0.00 0.00 175.76 177.47 1jti s MET 196 N -2.13 0.88 0.06 0.00 1.75 -1.10 -4.86 119.30 113.90 1jti s MET 196 Ca 0.54 0.57 -0.31 0.00 -1.25 0.00 0.00 55.69 55.24 1jti s MET 196 Cb -0.30 0.42 -0.07 0.00 2.84 0.00 0.00 34.83 37.73 1jti s MET 196 CO 0.37 -0.20 1.41 -1.25 -0.65 0.00 0.00 175.02 174.71 1jti s PRO 197 N -0.41 4.29 -0.30 4.11 0.04 -1.26 -2.09 135.00 139.39 1jti s PRO 197 Ca -0.06 2.04 -0.10 0.00 0.04 0.00 0.00 61.00 62.93 1jti s PRO 197 Cb -0.03 -3.43 -0.02 0.00 0.04 0.00 0.00 34.50 31.07 1jti s PRO 197 CO 0.05 -0.52 0.15 0.12 0.04 0.00 0.00 177.00 176.84 1jti s PHE 198 N 1.82 3.17 -0.87 0.56 2.19 0.57 -4.87 117.98 120.55 1jti s PHE 198 Ca 0.65 -0.41 -0.21 0.00 0.33 0.00 0.00 56.93 57.29 1jti s PHE 198 Cb -0.35 -2.35 0.09 0.00 -1.31 0.00 0.00 43.02 39.10 1jti s PHE 198 CO 0.29 -0.39 1.18 1.03 1.83 0.00 0.00 175.22 179.16 1jti s ARG 199 N 1.65 3.45 0.00 10.12 0.52 0.46 -1.03 118.95 134.11 1jti s ARG 199 Ca 0.05 -1.26 0.00 0.00 -0.52 0.00 0.00 55.73 54.00 1jti s ARG 199 Cb -0.17 -4.80 0.00 0.00 0.52 0.00 0.00 34.95 30.50 1jti s ARG 199 CO 0.07 -1.92 0.45 0.28 0.02 0.00 0.00 175.30 174.20 1jti n VAL 200 N 6.01 0.00 -2.64 3.52 0.31 -0.18 -4.32 118.33 121.03 1jti n VAL 200 Ca 0.18 0.93 -0.26 0.00 -0.01 0.00 0.00 64.34 65.18 1jti n VAL 200 Cb 0.49 -1.89 0.02 0.00 -0.91 0.00 0.00 33.84 31.54 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 -0.90 4.10 -1.92 2.52 -4.23 -1.13 -4.70 115.64 109.39 1jti s THR 201 Ca 0.00 -0.10 0.00 0.00 -1.18 0.00 0.00 61.69 60.41 1jti s THR 201 Cb 0.00 -3.57 0.00 0.00 1.34 0.00 0.00 72.50 70.27 1jti s THR 201 CO 0.00 -0.53 0.42 1.21 -0.54 0.00 0.00 174.62 175.18 1jti n GLU 202 N -2.34 0.43 -2.70 3.99 2.13 -1.26 -2.20 120.64 118.69 1jti n GLU 202 Ca 0.02 0.00 -0.05 0.00 0.66 0.00 0.00 57.16 57.80 1jti n GLU 202 Cb 0.57 -1.02 0.10 0.00 0.27 0.00 0.00 31.44 31.36 1jti n GLU 202 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 1jti n GLN 203 N -0.44 1.31 -3.40 5.31 1.13 -1.26 -5.09 117.38 114.94 1jti n GLN 203 Ca 0.00 -2.06 0.02 0.00 -1.94 0.00 0.00 57.00 53.02 1jti n GLN 203 Cb 0.01 -0.27 -0.05 0.00 0.11 0.00 0.00 30.24 30.04 1jti n GLN 203 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 1jti s GLU 204 N -0.85 0.18 0.39 -1.09 2.12 -0.93 -5.09 118.70 113.43 1jti s GLU 204 Ca 0.19 0.41 0.08 0.00 0.36 0.00 0.00 54.97 56.01 1jti s GLU 204 Cb 0.42 0.19 -0.08 0.00 0.26 0.00 0.00 34.13 34.92 1jti s GLU 204 CO -0.08 -0.05 -0.01 -1.12 -0.54 0.00 0.00 175.26 173.45 1jti s SER 205 N 1.95 3.85 -0.25 -1.70 0.01 -1.26 -1.01 113.70 115.28 1jti s SER 205 Ca -0.03 -1.33 -0.15 0.00 1.31 0.00 0.00 55.95 55.74 1jti s SER 205 Cb -0.03 -0.39 0.07 0.00 0.21 0.00 0.00 66.02 65.88 1jti s SER 205 CO -0.16 -0.39 0.62 -0.75 0.41 0.00 0.00 173.24 172.98 1jti s LYS 206 N -3.69 0.65 0.14 12.44 2.20 -0.19 -4.89 119.74 126.40 1jti s LYS 206 Ca 0.34 1.09 -0.31 0.00 -0.36 0.00 0.00 55.97 56.73 1jti s LYS 206 Cb 0.08 0.13 -0.09 0.00 -1.51 0.00 0.00 37.83 36.45 1jti s LYS 206 CO 0.18 -0.14 1.44 -2.14 -0.36 0.00 0.00 175.35 174.32 1jti s PRO 207 N 1.42 4.29 -0.09 4.03 0.02 -1.26 -0.32 135.00 143.09 1jti s PRO 207 Ca -0.09 2.17 -0.07 0.00 0.02 0.00 0.00 61.00 63.03 1jti s PRO 207 Cb -0.06 -3.21 0.03 0.00 0.02 0.00 0.00 34.50 31.29 1jti s PRO 207 CO -0.16 -0.47 0.23 0.14 -0.33 0.00 0.00 177.00 176.42 1jti s VAL 208 N 0.95 -0.01 -0.30 3.83 -7.23 -0.89 -4.93 120.40 111.82 1jti s VAL 208 Ca 0.65 0.05 -0.29 0.00 -1.81 0.00 0.00 61.98 60.58 1jti s VAL 208 Cb -0.39 -0.34 -0.07 0.00 0.56 0.00 0.00 36.38 36.15 1jti s VAL 208 CO 0.32 0.02 2.26 0.00 -0.31 0.00 0.00 175.10 177.39 1jti n GLN 209 N 3.36 1.60 -3.62 4.82 1.13 -1.26 -2.72 117.38 120.70 1jti n GLN 209 Ca -0.17 0.38 -0.37 0.00 -1.94 0.00 0.00 57.00 54.90 1jti n GLN 209 Cb 0.57 -3.11 -0.06 0.00 0.11 0.00 0.00 30.24 27.75 1jti n GLN 209 CO 0.00 0.00 0.00 1.41 -1.44 0.00 0.00 177.06 177.03 1jti s MET 210 N 6.73 3.87 0.14 -1.09 -2.45 0.44 -1.84 119.30 125.11 1jti s MET 210 Ca 1.03 0.17 -0.02 0.00 -1.25 0.00 0.00 55.69 55.62 1jti s MET 210 Cb -0.42 -3.27 -0.05 0.00 1.25 0.00 0.00 34.83 32.35 1jti s MET 210 CO 0.36 0.59 0.34 -1.64 1.05 0.00 0.00 175.02 175.72 1jti s MET 211 N -0.64 3.53 -0.08 4.11 1.00 0.15 -1.91 119.30 125.46 1jti s MET 211 Ca 0.19 -0.29 -0.13 0.00 0.00 0.00 0.00 55.69 55.47 1jti s MET 211 Cb -0.14 -2.89 0.03 0.00 0.00 0.00 0.00 34.83 31.82 1jti s MET 211 CO 0.08 0.48 0.32 -0.47 0.00 0.00 0.00 175.02 175.43 1jti s TYR 212 N -1.70 -0.29 0.01 -0.03 5.04 -1.25 -1.27 117.35 117.85 1jti s TYR 212 Ca 0.38 0.65 -0.28 0.00 -2.44 0.00 0.00 57.07 55.38 1jti s TYR 212 Cb -0.12 0.11 0.09 0.00 0.35 0.00 0.00 41.96 42.40 1jti s TYR 212 CO 0.27 -0.26 0.81 1.14 -1.34 0.00 0.00 175.55 176.18 1jti s GLN 213 N -0.40 0.92 0.02 4.97 -2.07 -0.66 -4.45 119.66 118.00 1jti s GLN 213 Ca -0.05 -0.22 0.07 0.00 -1.82 0.00 0.00 55.36 53.34 1jti s GLN 213 Cb -0.03 0.43 -0.03 0.00 -1.09 0.00 0.00 33.01 32.28 1jti s GLN 213 CO 0.02 -0.38 -0.21 0.42 -1.32 0.00 0.00 175.29 173.82 1jti s ILE 214 N -2.79 2.55 -2.49 3.63 1.01 -1.26 -0.25 121.20 121.60 1jti s ILE 214 Ca 0.01 -1.16 0.00 0.00 0.00 0.00 0.00 60.65 59.51 1jti s ILE 214 Cb -0.01 -2.02 0.00 0.00 0.01 0.00 0.00 42.46 40.44 1jti s ILE 214 CO -0.07 0.42 0.00 0.61 0.00 0.00 0.00 174.94 175.91 1jti n GLY 215 N 1.86 -1.89 3.61 6.18 0.00 -0.99 -4.96 105.19 108.99 1jti n GLY 215 Ca -0.16 -1.14 -0.42 0.00 0.00 0.00 0.00 46.02 44.29 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 4.07 0.03 0.99 1.43 -1.26 -1.23 118.68 122.70 1jti s LEU 216 Ca 0.00 0.59 0.02 0.00 -1.03 0.00 0.00 54.13 53.71 1jti s LEU 216 Cb 0.00 -3.13 -0.02 0.00 0.03 0.00 0.00 46.19 43.07 1jti s LEU 216 CO 0.00 -0.71 -0.06 -0.36 0.23 0.00 0.00 176.35 175.44 1jti s PHE 217 N 3.15 0.56 0.09 0.29 0.08 -1.03 -4.93 117.98 116.19 1jti s PHE 217 Ca 0.34 -0.37 -0.30 0.00 0.12 0.00 0.00 56.93 56.72 1jti s PHE 217 Cb -0.13 -0.34 -0.05 0.00 -0.57 0.00 0.00 43.02 41.92 1jti s PHE 217 CO 0.15 -0.07 0.99 1.03 -0.10 0.00 0.00 175.22 177.22 1jti s ARG 218 N -1.10 4.65 0.12 0.44 0.52 -1.26 -2.27 118.95 120.05 1jti s ARG 218 Ca -0.07 1.48 0.01 0.00 -0.52 0.00 0.00 55.73 56.64 1jti s ARG 218 Cb -0.07 -3.39 -0.04 0.00 0.52 0.00 0.00 34.95 31.97 1jti s ARG 218 CO 0.00 0.13 -0.04 0.08 0.02 0.00 0.00 175.30 175.49 1jti s VAL 219 N 0.23 0.63 -0.04 3.52 1.01 -0.65 -2.28 120.40 122.81 1jti s VAL 219 Ca 0.49 -1.94 -0.02 0.00 0.00 0.00 0.00 61.98 60.51 1jti s VAL 219 Cb -0.24 -1.81 0.03 0.00 0.00 0.00 0.00 36.38 34.36 1jti s VAL 219 CO 0.30 -0.75 0.09 0.00 0.00 0.00 0.00 175.10 174.74 1jti s ALA 220 N -3.68 -0.13 -0.23 5.51 0.00 -0.82 -1.06 121.76 121.36 1jti s ALA 220 Ca 0.16 0.45 -0.07 0.00 0.00 0.00 0.00 51.96 52.50 1jti s ALA 220 Cb 0.06 -0.31 -0.03 0.00 0.00 0.00 0.00 23.12 22.83 1jti s ALA 220 CO -0.02 -0.11 0.05 0.45 0.00 0.00 0.00 175.76 176.13 1jti s SER 221 N 0.90 5.15 -0.85 0.00 0.15 -1.26 -1.51 113.70 116.27 1jti s SER 221 Ca -0.07 -0.16 0.01 0.00 0.70 0.00 0.00 55.95 56.43 1jti s SER 221 Cb -0.10 -1.91 0.30 0.00 -1.71 0.00 0.00 66.02 62.61 1jti s SER 221 CO -0.04 0.02 1.27 0.23 1.20 0.00 0.00 173.24 175.92 1jti n MET 222 N 4.56 3.97 -2.50 5.44 2.81 0.14 -4.96 117.12 126.59 1jti n MET 222 Ca -0.16 -4.68 -0.40 0.00 -1.81 0.00 0.00 57.70 50.65 1jti n MET 222 Cb 0.52 -2.38 -0.03 0.00 -0.71 0.00 0.00 33.22 30.62 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 -3.25 2.67 0.00 3.04 0.00 -1.26 -0.37 121.76 122.59 1jti s ALA 223 Ca 0.39 -2.27 0.00 0.00 0.00 0.00 0.00 51.96 50.08 1jti s ALA 223 Cb 0.16 -4.55 0.00 0.00 0.00 0.00 0.00 23.12 18.73 1jti s ALA 223 CO -0.03 -3.73 0.00 -1.13 0.00 0.00 0.00 175.76 170.86 1jti n SER 224 N 9.47 0.00 0.00 0.00 3.41 -1.26 -4.85 113.62 120.39 1jti n SER 224 Ca 0.36 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.97 1jti n SER 224 Cb 0.50 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 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 1.96 -3.49 4.33 4.71 -0.17 -5.03 120.64 122.95 1jti n GLU 225 Ca 0.00 -0.24 -0.20 0.00 -0.01 0.00 0.00 57.16 56.70 1jti n GLU 225 Cb 0.00 -0.71 0.08 0.00 -1.01 0.00 0.00 31.44 29.81 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 -0.35 -7.21 -3.69 3.49 4.76 0.50 -4.88 118.16 110.77 1jti n LYS 226 Ca 0.00 0.81 -0.10 0.00 -2.87 0.00 0.00 58.31 56.15 1jti n LYS 226 Cb 0.02 -5.77 -0.05 0.00 -1.84 0.00 0.00 35.03 27.40 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 -5.89 1.11 0.24 1.97 0.23 -0.99 0.59 119.30 116.55 1jti s MET 227 Ca 0.34 -0.79 0.10 0.00 -1.03 0.00 0.00 55.69 54.31 1jti s MET 227 Cb -0.15 0.46 -0.05 0.00 -1.53 0.00 0.00 34.83 33.56 1jti s MET 227 CO 0.71 -0.43 -0.17 0.15 -2.03 0.00 0.00 175.02 173.24 1jti s LYS 228 N -3.83 1.48 -0.07 3.16 1.02 -0.91 0.28 119.74 120.86 1jti s LYS 228 Ca 0.05 -1.66 -0.01 0.00 0.02 0.00 0.00 55.97 54.38 1jti s LYS 228 Cb 0.02 -1.43 0.03 0.00 -0.52 0.00 0.00 37.83 35.93 1jti s LYS 228 CO -0.09 0.26 -0.02 0.42 -0.92 0.00 0.00 175.35 174.99 1jti s ILE 229 N -2.70 0.51 -0.12 2.17 1.01 -0.57 -2.24 121.20 119.26 1jti s ILE 229 Ca 0.25 0.01 -0.01 0.00 0.00 0.00 0.00 60.65 60.90 1jti s ILE 229 Cb -0.03 -0.62 -0.02 0.00 0.01 0.00 0.00 42.46 41.80 1jti s ILE 229 CO 0.10 0.27 -0.08 -0.22 0.00 0.00 0.00 174.94 175.02 1jti s LEU 230 N 1.73 3.05 -0.25 2.97 2.96 -0.54 -1.94 118.68 126.65 1jti s LEU 230 Ca 0.02 -0.16 -0.05 0.00 -0.22 0.00 0.00 54.13 53.71 1jti s LEU 230 Cb -0.13 -1.70 -0.01 0.00 0.50 0.00 0.00 46.19 44.86 1jti s LEU 230 CO -0.05 0.23 0.02 -0.70 -1.32 0.00 0.00 176.35 174.53 1jti s GLU 231 N 0.00 3.32 -0.45 1.98 2.12 -0.97 -0.74 118.70 123.96 1jti s GLU 231 Ca -0.01 -0.69 -0.08 0.00 0.36 0.00 0.00 54.97 54.55 1jti s GLU 231 Cb -0.14 -3.20 0.11 0.00 0.26 0.00 0.00 34.13 31.16 1jti s GLU 231 CO 0.03 -0.29 0.30 -0.51 -0.54 0.00 0.00 175.26 174.26 1jti s LEU 232 N 1.51 5.51 0.57 2.70 1.43 -0.25 -4.22 118.68 125.93 1jti s LEU 232 Ca 0.05 -1.85 -0.18 0.00 -1.03 0.00 0.00 54.13 51.11 1jti s LEU 232 Cb -0.16 -1.98 -0.04 0.00 0.03 0.00 0.00 46.19 44.05 1jti s LEU 232 CO 0.00 -0.64 1.13 -2.16 0.23 0.00 0.00 176.35 174.91 1jti s PRO 233 N 1.34 3.19 0.32 1.29 0.04 -1.26 -1.29 135.00 138.62 1jti s PRO 233 Ca 0.05 1.58 -0.07 0.00 0.04 0.00 0.00 61.00 62.60 1jti s PRO 233 Cb -0.25 -1.99 -0.06 0.00 0.04 0.00 0.00 34.50 32.25 1jti s PRO 233 CO -0.01 -0.97 0.61 -0.06 0.04 0.00 0.00 177.00 176.62 1jti s PHE 234 N -1.89 3.47 0.60 0.56 0.08 -0.39 -1.51 117.98 118.90 1jti s PHE 234 Ca 0.72 0.78 0.30 0.00 0.12 0.00 0.00 56.93 58.84 1jti s PHE 234 Cb -0.24 -2.21 1.76 0.00 -0.57 0.00 0.00 43.02 41.76 1jti s PHE 234 CO 0.31 0.10 2.16 0.00 -0.10 0.00 0.00 175.22 177.69 1jti h ALA 235 N 1.64 1.65 -0.04 5.36 0.00 -0.34 -2.06 119.26 125.47 1jti h ALA 235 Ca -0.47 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.42 1jti h ALA 235 Cb 1.19 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 1jti h ALA 235 CO 0.66 -0.18 -0.05 0.66 0.00 0.00 0.00 179.25 180.33 1jti h SER 236 N 0.00 0.05 0.00 0.00 4.64 -1.86 -3.46 113.55 112.91 1jti h SER 236 Ca 0.05 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 1jti h SER 236 Cb 0.30 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 1jti h SER 236 CO -0.00 0.11 0.00 0.61 -0.87 0.00 0.00 176.83 176.68 1jti n GLY 237 N -1.31 0.62 0.02 -0.77 0.00 -0.77 -4.87 105.19 98.10 1jti n GLY 237 Ca -0.02 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.00 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 -2.75 0.00 -3.98 2.61 -2.24 -1.26 -4.97 114.28 101.69 1jti n THR 238 Ca 0.00 -0.48 -0.09 0.00 -2.27 0.00 0.00 64.05 61.22 1jti n THR 238 Cb 0.00 1.01 -0.10 0.00 -2.10 0.00 0.00 70.33 69.14 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 -0.86 0.54 0.06 -0.78 1.00 -1.26 -1.03 119.30 116.97 1jti s MET 239 Ca 0.01 -0.85 -0.17 0.00 0.00 0.00 0.00 55.69 54.68 1jti s MET 239 Cb 0.01 0.20 0.03 0.00 0.00 0.00 0.00 34.83 35.07 1jti s MET 239 CO 0.04 -0.12 0.38 -1.54 0.00 0.00 0.00 175.02 173.79 1jti s SER 240 N -2.20 -0.23 -0.22 3.03 1.04 -1.00 -1.26 113.70 112.84 1jti s SER 240 Ca -0.04 -0.11 -0.06 0.00 0.48 0.00 0.00 55.95 56.22 1jti s SER 240 Cb -0.01 0.42 -0.03 0.00 0.10 0.00 0.00 66.02 66.50 1jti s SER 240 CO -0.05 -0.69 0.03 -0.32 0.98 0.00 0.00 173.24 173.19 1jti s MET 241 N -2.74 3.63 -0.06 4.02 0.00 -0.41 -2.13 119.30 121.60 1jti s MET 241 Ca -0.04 -0.50 -0.15 0.00 0.00 0.00 0.00 55.69 55.01 1jti s MET 241 Cb -0.00 -3.19 -0.05 0.00 0.00 0.00 0.00 34.83 31.58 1jti s MET 241 CO -0.04 -0.09 0.38 -0.51 0.00 0.00 0.00 175.02 174.76 1jti s LEU 242 N 1.30 4.38 -0.16 4.11 1.43 -0.20 -1.09 118.68 128.45 1jti s LEU 242 Ca 0.04 0.81 0.01 0.00 -1.03 0.00 0.00 54.13 53.97 1jti s LEU 242 Cb -0.15 -2.54 0.02 0.00 0.03 0.00 0.00 46.19 43.56 1jti s LEU 242 CO 0.02 0.22 -0.19 -0.69 0.23 0.00 0.00 176.35 175.94 1jti s VAL 243 N -0.41 1.89 -0.35 -1.59 1.01 0.08 -1.98 120.40 119.04 1jti s VAL 243 Ca 0.22 -0.85 -0.08 0.00 0.00 0.00 0.00 61.98 61.27 1jti s VAL 243 Cb -0.15 -1.71 0.03 0.00 0.00 0.00 0.00 36.38 34.55 1jti s VAL 243 CO 0.10 0.51 0.15 -0.76 0.00 0.00 0.00 175.10 175.10 1jti s LEU 244 N 1.20 4.44 -0.29 3.92 1.02 0.26 -1.47 118.68 127.76 1jti s LEU 244 Ca 0.01 -1.03 -0.03 0.00 0.02 0.00 0.00 54.13 53.10 1jti s LEU 244 Cb -0.14 -1.94 0.04 0.00 0.02 0.00 0.00 46.19 44.17 1jti s LEU 244 CO -0.09 -0.34 0.01 -0.22 0.02 0.00 0.00 176.35 175.73 1jti s LEU 245 N 1.48 3.74 0.50 1.79 2.96 -0.95 -1.78 118.68 126.41 1jti s LEU 245 Ca 0.00 -1.05 -0.21 0.00 -0.22 0.00 0.00 54.13 52.65 1jti s LEU 245 Cb -0.19 -1.75 -0.07 0.00 0.50 0.00 0.00 46.19 44.68 1jti s LEU 245 CO 0.04 -0.22 1.11 -2.16 -1.32 0.00 0.00 176.35 173.81 1jti s PRO 246 N 1.33 3.63 0.08 0.98 0.04 -1.26 -2.14 135.00 137.66 1jti s PRO 246 Ca -0.02 1.60 -0.24 0.00 0.04 0.00 0.00 61.00 62.38 1jti s PRO 246 Cb -0.18 -2.18 -0.16 0.00 0.04 0.00 0.00 34.50 32.02 1jti s PRO 246 CO -0.01 -0.62 1.70 -0.44 0.04 0.00 0.00 177.00 177.67 1jti h ASP 247 N 1.62 -0.06 -3.83 6.66 3.32 -0.20 -3.44 116.42 120.49 1jti h ASP 247 Ca -0.50 -0.02 -0.48 0.00 0.02 0.00 0.00 57.03 56.05 1jti h ASP 247 Cb 1.25 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.80 1jti h ASP 247 CO 0.59 -0.02 0.38 -1.61 -1.72 0.00 0.00 179.24 176.85 1jti s GLU 248 N -6.07 4.65 0.00 3.56 2.02 -1.26 -4.89 118.70 116.71 1jti s GLU 248 Ca -0.14 1.49 0.00 0.00 0.02 0.00 0.00 54.97 56.34 1jti s GLU 248 Cb 0.06 -3.02 0.00 0.00 0.10 0.00 0.00 34.13 31.27 1jti s GLU 248 CO 0.66 0.31 0.75 0.28 0.02 0.00 0.00 175.26 177.28 1jti n VAL 249 N 0.95 1.10 -2.50 2.63 0.31 -1.26 -0.98 118.33 118.58 1jti n VAL 249 Ca 0.00 0.43 0.02 0.00 -0.01 0.00 0.00 64.34 64.78 1jti n VAL 249 Cb 0.48 -1.43 0.02 0.00 -0.91 0.00 0.00 33.84 32.00 1jti n VAL 249 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1jti n SER 250 N -1.25 0.85 -0.31 4.52 3.41 -1.26 -4.62 113.62 114.96 1jti n SER 250 Ca 0.00 -2.01 0.14 0.00 -0.26 0.00 0.00 58.87 56.75 1jti n SER 250 Cb 0.15 -0.25 0.64 0.00 -0.26 0.00 0.00 64.21 64.49 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 0.29 -0.38 0.25 5.00 0.00 -0.15 -4.12 105.19 106.08 1jti n GLY 251 Ca 0.03 -0.36 -0.07 0.00 0.00 0.00 0.00 46.02 45.62 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 1.51 0.74 -1.65 0.99 5.85 -1.86 -2.17 115.31 118.72 1jti h LEU 252 Ca 0.00 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.62 1jti h LEU 252 Cb 0.35 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.19 1jti h LEU 252 CO 0.00 0.63 0.06 1.05 -0.34 0.00 0.00 178.44 179.84 1jti h GLU 253 N 0.80 0.00 0.03 1.25 4.11 -1.99 -0.68 114.58 118.10 1jti h GLU 253 Ca 0.21 0.00 -0.37 0.00 0.07 0.00 0.00 59.36 59.26 1jti h GLU 253 Cb 0.06 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.25 1jti h GLU 253 CO -0.03 0.00 -2.30 0.94 0.07 0.00 0.00 179.01 177.69 1jti n GLN 254 N -2.40 0.68 -0.09 1.06 7.27 -0.86 -4.18 117.38 118.86 1jti n GLN 254 Ca -0.02 0.15 -0.11 0.00 0.07 0.00 0.00 57.00 57.09 1jti n GLN 254 Cb 0.10 -1.58 -0.04 0.00 2.41 0.00 0.00 30.24 31.13 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 0.02 0.46 -2.80 1.69 5.85 -0.76 -2.61 115.31 117.15 1jti h LEU 255 Ca -0.52 -0.31 0.00 0.00 0.84 0.00 0.00 57.88 57.90 1jti h LEU 255 Cb 2.01 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 42.92 1jti h LEU 255 CO -0.01 0.66 0.02 -0.33 -0.34 0.00 0.00 178.44 178.44 1jti h GLU 256 N 0.25 0.00 0.00 1.25 5.08 -1.39 -1.55 114.58 118.22 1jti h GLU 256 Ca 0.07 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.29 1jti h GLU 256 Cb 0.42 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.65 1jti h GLU 256 CO 0.01 0.00 -0.72 0.77 -1.00 0.00 0.00 179.01 178.08 1jti h SER 257 N 0.00 0.00 0.00 1.42 0.02 -1.63 -3.38 113.55 109.99 1jti h SER 257 Ca 0.00 0.00 -0.16 0.00 -0.84 0.00 0.00 61.79 60.80 1jti h SER 257 Cb 0.05 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.56 1jti h SER 257 CO -0.00 0.69 -1.82 2.30 -1.14 0.00 0.00 176.83 176.87 1jti n ILE 258 N -3.26 0.59 -1.60 3.27 -0.00 -0.70 -5.02 119.36 112.64 1jti n ILE 258 Ca 0.01 -0.48 -0.43 0.00 -0.00 0.00 0.00 62.75 61.85 1jti n ILE 258 Cb 0.82 -0.37 -0.01 0.00 -0.00 0.00 0.00 39.64 40.08 1jti n ILE 258 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1jti n ILE 259 N -2.32 2.08 -3.82 7.28 3.06 -0.67 -4.88 119.36 120.09 1jti n ILE 259 Ca -0.15 -0.50 -0.02 0.00 -2.50 0.00 0.00 62.75 59.58 1jti n ILE 259 Cb 0.74 -1.08 0.01 0.00 0.54 0.00 0.00 39.64 39.85 1jti n ILE 259 CO 0.00 0.00 0.00 0.54 -2.50 0.00 0.00 176.55 174.59 1jti s ASN 260 N -0.59 -0.05 0.13 9.51 2.20 -1.26 -5.02 114.94 119.86 1jti s ASN 260 Ca 0.59 -0.50 -0.23 0.00 -0.94 0.00 0.00 52.86 51.78 1jti s ASN 260 Cb -0.65 0.43 -0.03 0.00 -2.00 0.00 0.00 41.25 39.00 1jti s ASN 260 CO 0.60 -0.84 1.66 0.15 -2.94 0.00 0.00 177.10 175.72 1jti h PHE 261 N 2.00 -0.48 -0.25 1.54 3.57 -1.94 -1.84 116.94 119.54 1jti h PHE 261 Ca -0.27 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.29 1jti h PHE 261 Cb 1.22 0.23 -0.07 0.00 2.79 0.00 0.00 35.95 40.12 1jti h PHE 261 CO 0.97 -0.26 -0.50 0.93 -2.23 0.00 0.00 178.31 177.22 1jti h GLU 262 N -0.26 -0.42 0.15 1.11 5.08 -1.97 0.88 114.58 119.15 1jti h GLU 262 Ca 0.08 0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.49 1jti h GLU 262 Cb 0.38 0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.68 1jti h GLU 262 CO -0.24 -0.28 -0.35 0.87 -1.00 0.00 0.00 179.01 178.01 1jti h LYS 263 N -0.44 -0.58 -0.69 2.33 1.79 -1.87 0.62 116.57 117.73 1jti h LYS 263 Ca 0.05 0.04 0.11 0.00 -2.18 0.00 0.00 60.65 58.67 1jti h LYS 263 Cb 0.57 0.13 -0.08 0.00 -1.58 0.00 0.00 32.23 31.27 1jti h LYS 263 CO -0.47 -0.39 0.28 1.25 -1.08 0.00 0.00 179.45 179.05 1jti h LEU 264 N -0.60 0.29 -1.47 2.94 5.85 -1.12 0.67 115.31 121.86 1jti h LEU 264 Ca 0.02 0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 1jti h LEU 264 Cb 0.62 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.69 1jti h LEU 264 CO -0.19 0.14 0.18 0.74 -0.34 0.00 0.00 178.44 178.98 1jti h THR 265 N 0.46 1.14 -0.16 1.05 2.02 -0.34 -2.22 112.91 114.86 1jti h THR 265 Ca 0.36 -0.39 -0.22 0.00 0.77 0.00 0.00 66.41 66.93 1jti h THR 265 Cb 0.48 0.66 0.01 0.00 -1.74 0.00 0.00 68.15 67.56 1jti h THR 265 CO -0.34 0.16 -0.76 -0.08 0.37 0.00 0.00 175.52 174.87 1jti h GLU 266 N 0.53 0.79 0.00 6.66 4.81 0.24 -3.30 114.58 124.31 1jti h GLU 266 Ca 0.14 -0.63 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 1jti h GLU 266 Cb 0.07 0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.58 1jti h GLU 266 CO -0.02 1.24 0.00 0.91 -0.73 0.00 0.00 179.01 180.41 1jti n TRP 267 N -3.94 0.96 -1.24 0.92 8.01 0.16 -3.58 117.44 118.74 1jti n TRP 267 Ca -0.07 0.28 -0.01 0.00 -1.31 0.00 0.00 57.50 56.38 1jti n TRP 267 Cb 0.74 -0.96 0.23 0.00 -2.01 0.00 0.00 31.31 29.31 1jti n TRP 267 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.69 179.09 1jti n THR 268 N -2.28 2.55 -1.41 -0.99 -1.04 -0.87 -4.55 114.28 105.68 1jti n THR 268 Ca 0.06 -2.28 -0.17 0.00 -2.04 0.00 0.00 64.05 59.62 1jti n THR 268 Cb 0.43 -0.31 0.12 0.00 -1.82 0.00 0.00 70.33 68.75 1jti n THR 268 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1jti n SER 269 N -0.83 -0.22 0.09 8.00 2.88 -1.23 -4.86 113.62 117.45 1jti n SER 269 Ca 0.32 -1.21 -0.05 0.00 -1.33 0.00 0.00 58.87 56.60 1jti n SER 269 Cb 1.07 -0.58 -0.02 0.00 -0.75 0.00 0.00 64.21 63.93 1jti n SER 269 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1jti h SER 270 N -1.16 -0.26 0.00 -3.46 0.02 -1.92 -2.63 113.55 104.15 1jti h SER 270 Ca -0.24 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.72 1jti h SER 270 Cb 0.68 0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.29 1jti h SER 270 CO 0.17 0.09 0.00 -0.46 -1.14 0.00 0.00 176.83 175.49 1jti n ASN 271 N -4.32 0.00 -0.07 3.07 6.94 -1.26 -2.50 115.26 117.12 1jti n ASN 271 Ca -0.04 -0.21 -0.14 0.00 -0.02 0.00 0.00 54.58 54.17 1jti n ASN 271 Cb 0.12 0.00 -0.05 0.00 -2.36 0.00 0.00 39.78 37.49 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 -0.74 0.74 -3.74 3.53 0.31 -1.23 -5.02 118.33 112.18 1jti n VAL 272 Ca 0.02 -0.21 -0.37 0.00 -0.01 0.00 0.00 64.34 63.77 1jti n VAL 272 Cb 0.01 -1.55 -0.06 0.00 -0.91 0.00 0.00 33.84 31.33 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 -2.25 3.62 -0.04 5.55 -1.94 -0.99 -4.45 119.30 118.80 1jti s MET 273 Ca -0.19 0.05 -0.16 0.00 -1.71 0.00 0.00 55.69 53.68 1jti s MET 273 Cb 0.07 -3.17 0.03 0.00 2.01 0.00 0.00 34.83 33.77 1jti s MET 273 CO 0.25 0.72 0.35 -1.83 -0.01 0.00 0.00 175.02 174.50 1jti s GLU 274 N -1.23 0.66 0.25 2.03 -1.05 -0.22 -4.78 118.70 114.36 1jti s GLU 274 Ca 0.21 -0.05 -0.30 0.00 -0.15 0.00 0.00 54.97 54.69 1jti s GLU 274 Cb -0.14 0.30 -0.09 0.00 -0.44 0.00 0.00 34.13 33.76 1jti s GLU 274 CO 0.10 -0.17 1.17 -2.00 0.95 0.00 0.00 175.26 175.31 1jti s GLU 275 N -1.08 4.53 -0.11 -4.83 2.12 -1.26 -1.64 118.70 116.43 1jti s GLU 275 Ca -0.11 1.90 -0.19 0.00 0.36 0.00 0.00 54.97 56.93 1jti s GLU 275 Cb -0.04 -3.19 0.05 0.00 0.26 0.00 0.00 34.13 31.20 1jti s GLU 275 CO 0.04 0.02 0.48 1.03 -0.54 0.00 0.00 175.26 176.30 1jti s ARG 276 N -1.01 0.71 -0.05 4.30 0.52 -0.96 -4.96 118.95 117.49 1jti s ARG 276 Ca 0.49 0.35 -0.30 0.00 -0.52 0.00 0.00 55.73 55.75 1jti s ARG 276 Cb -0.34 0.33 -0.03 0.00 0.52 0.00 0.00 34.95 35.44 1jti s ARG 276 CO 0.41 -0.16 1.12 0.21 0.02 0.00 0.00 175.30 176.90 1jti s LYS 277 N -0.49 4.40 0.09 3.54 2.20 -1.26 -2.46 119.74 125.76 1jti s LYS 277 Ca -0.06 1.57 -0.11 0.00 -0.36 0.00 0.00 55.97 57.01 1jti s LYS 277 Cb -0.03 -3.52 0.01 0.00 -1.51 0.00 0.00 37.83 32.78 1jti s LYS 277 CO 0.04 -0.35 0.26 0.96 -0.36 0.00 0.00 175.35 175.90 1jti s ILE 278 N 1.92 0.11 0.20 5.43 -4.36 -0.37 -4.83 121.20 119.31 1jti s ILE 278 Ca 0.53 -0.93 -0.24 0.00 -0.26 0.00 0.00 60.65 59.75 1jti s ILE 278 Cb -0.23 -1.20 -0.08 0.00 1.25 0.00 0.00 42.46 42.20 1jti s ILE 278 CO 0.22 -0.52 0.78 -0.54 0.24 0.00 0.00 174.94 175.13 1jti s LYS 279 N -3.54 4.49 -0.07 0.37 1.02 -0.70 -2.35 119.74 118.97 1jti s LYS 279 Ca 0.02 1.11 -0.01 0.00 0.02 0.00 0.00 55.97 57.11 1jti s LYS 279 Cb 0.03 -3.11 0.03 0.00 -0.52 0.00 0.00 37.83 34.25 1jti s LYS 279 CO -0.10 0.49 -0.02 0.08 -0.92 0.00 0.00 175.35 174.89 1jti s VAL 280 N -1.30 0.48 -0.18 3.17 1.01 0.66 -1.50 120.40 122.74 1jti s VAL 280 Ca 0.39 0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.39 1jti s VAL 280 Cb -0.21 -0.59 0.01 0.00 0.00 0.00 0.00 36.38 35.59 1jti s VAL 280 CO 0.25 0.26 -0.17 -0.31 0.00 0.00 0.00 175.10 175.12 1jti s TYR 281 N 1.61 2.79 -0.02 5.22 1.51 -0.34 -1.65 117.35 126.47 1jti s TYR 281 Ca -0.00 -1.40 -0.00 0.00 -1.01 0.00 0.00 57.07 54.66 1jti s TYR 281 Cb -0.13 -1.93 0.03 0.00 -0.11 0.00 0.00 41.96 39.83 1jti s TYR 281 CO -0.04 -0.68 0.03 -1.17 -1.11 0.00 0.00 175.55 172.58 1jti s LEU 282 N 1.17 0.98 0.59 -1.29 2.96 -0.40 -1.92 118.68 120.76 1jti s LEU 282 Ca 0.02 0.04 -0.14 0.00 -0.22 0.00 0.00 54.13 53.83 1jti s LEU 282 Cb -0.14 -0.08 -0.05 0.00 0.50 0.00 0.00 46.19 46.42 1jti s LEU 282 CO -0.08 -0.14 1.02 -2.16 -1.32 0.00 0.00 176.35 173.68 1jti s PRO 283 N 1.19 3.57 0.26 0.98 0.04 -1.26 0.30 135.00 140.08 1jti s PRO 283 Ca -0.08 0.96 -0.29 0.00 0.04 0.00 0.00 61.00 61.63 1jti s PRO 283 Cb -0.13 -2.08 -0.09 0.00 0.04 0.00 0.00 34.50 32.24 1jti s PRO 283 CO -0.03 -0.59 1.22 1.03 0.04 0.00 0.00 177.00 178.67 1jti s ARG 284 N -4.49 4.48 0.09 4.56 0.52 -0.76 -4.82 118.95 118.53 1jti s ARG 284 Ca 0.59 1.99 0.08 0.00 -0.52 0.00 0.00 55.73 57.87 1jti s ARG 284 Cb -0.12 -3.16 -0.03 0.00 0.52 0.00 0.00 34.95 32.15 1jti s ARG 284 CO 0.42 -0.05 -0.20 -1.64 0.02 0.00 0.00 175.30 173.84 1jti s MET 285 N -1.09 1.13 -0.27 3.54 -1.94 -0.10 -4.87 119.30 115.69 1jti s MET 285 Ca 0.50 -1.08 -0.01 0.00 -1.71 0.00 0.00 55.69 53.38 1jti s MET 285 Cb -0.35 -1.33 0.13 0.00 2.01 0.00 0.00 34.83 35.29 1jti s MET 285 CO 0.43 0.31 0.32 0.21 -0.01 0.00 0.00 175.02 176.29 1jti s LYS 286 N -1.73 0.32 0.15 2.03 2.20 -1.22 -1.05 119.74 120.44 1jti s LYS 286 Ca 0.05 0.11 0.09 0.00 -0.36 0.00 0.00 55.97 55.86 1jti s LYS 286 Cb -0.10 -0.66 -0.04 0.00 -1.51 0.00 0.00 37.83 35.53 1jti s LYS 286 CO 0.03 -0.88 -0.16 -1.64 -0.36 0.00 0.00 175.35 172.34 1jti s MET 287 N 2.43 1.83 -0.26 4.03 -1.94 0.25 -4.97 119.30 120.67 1jti s MET 287 Ca 0.10 -1.26 -0.03 0.00 -1.71 0.00 0.00 55.69 52.79 1jti s MET 287 Cb -0.14 -2.09 0.15 0.00 2.01 0.00 0.00 34.83 34.75 1jti s MET 287 CO -0.25 0.45 0.44 -2.00 -0.01 0.00 0.00 175.02 173.65 1jti s GLU 288 N -2.44 0.41 0.11 2.03 2.12 -1.26 -0.69 118.70 118.98 1jti s GLU 288 Ca 0.21 0.69 0.05 0.00 0.36 0.00 0.00 54.97 56.28 1jti s GLU 288 Cb -0.10 -0.15 -0.04 0.00 0.26 0.00 0.00 34.13 34.10 1jti s GLU 288 CO 0.12 -0.62 -0.13 -1.21 -0.54 0.00 0.00 175.26 172.88 1jti s GLU 289 N 2.64 0.97 -0.03 4.30 0.41 -0.74 -5.01 118.70 121.24 1jti s GLU 289 Ca 0.14 -1.18 0.01 0.00 -0.41 0.00 0.00 54.97 53.53 1jti s GLU 289 Cb -0.15 -0.84 0.01 0.00 -1.78 0.00 0.00 34.13 31.38 1jti s GLU 289 CO -0.17 0.16 -0.03 0.21 -0.49 0.00 0.00 175.26 174.94 1jti s LYS 290 N -2.54 0.53 0.05 1.61 2.20 -1.26 -1.17 119.74 119.17 1jti s LYS 290 Ca 0.07 -0.08 0.06 0.00 -0.36 0.00 0.00 55.97 55.66 1jti s LYS 290 Cb -0.05 -0.58 -0.03 0.00 -1.51 0.00 0.00 37.83 35.66 1jti s LYS 290 CO 0.02 -0.03 -0.18 0.71 -0.36 0.00 0.00 175.35 175.51 1jti s TYR 291 N 0.59 1.57 -0.41 4.03 2.02 0.21 -4.98 117.35 120.37 1jti s TYR 291 Ca -0.07 -0.38 -0.19 0.00 -0.37 0.00 0.00 57.07 56.06 1jti s TYR 291 Cb -0.10 -0.92 0.02 0.00 -0.40 0.00 0.00 41.96 40.56 1jti s TYR 291 CO -0.00 0.08 0.57 1.21 -1.57 0.00 0.00 175.55 175.84 1jti s ASN 292 N -1.28 6.30 0.47 2.29 3.84 -1.26 -1.22 114.94 124.07 1jti s ASN 292 Ca 0.05 -0.33 0.27 0.00 0.21 0.00 0.00 52.86 53.05 1jti s ASN 292 Cb -0.09 -2.29 0.84 0.00 -0.55 0.00 0.00 41.25 39.16 1jti s ASN 292 CO 0.02 -0.67 1.79 -0.07 -2.79 0.00 0.00 177.10 175.38 1jti h LEU 293 N 9.42 0.00 -0.11 3.21 3.38 -1.48 -3.35 115.31 126.37 1jti h LEU 293 Ca -0.26 0.00 0.05 0.00 0.09 0.00 0.00 57.88 57.75 1jti h LEU 293 Cb 1.11 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.80 1jti h LEU 293 CO 0.84 0.09 -0.30 0.74 0.09 0.00 0.00 178.44 179.90 1jti h THR 294 N 0.00 0.32 -0.43 0.22 2.02 -1.92 0.12 112.91 113.23 1jti h THR 294 Ca -0.00 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 67.10 1jti h THR 294 Cb 0.79 0.32 -0.01 0.00 -1.74 0.00 0.00 68.15 67.50 1jti h THR 294 CO 0.01 0.00 -0.03 0.77 0.37 0.00 0.00 175.52 176.64 1jti h SER 295 N -0.39 0.78 0.07 4.18 4.64 -1.94 -1.25 113.55 119.64 1jti h SER 295 Ca 0.09 -0.32 0.02 0.00 -0.47 0.00 0.00 61.79 61.11 1jti h SER 295 Cb 0.53 -0.21 -0.05 0.00 -0.31 0.00 0.00 62.40 62.36 1jti h SER 295 CO -0.33 0.92 -0.37 0.58 -0.87 0.00 0.00 176.83 176.75 1jti h VAL 296 N 0.62 0.22 -0.02 0.95 2.07 -1.59 0.50 116.25 119.01 1jti h VAL 296 Ca 0.12 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.55 1jti h VAL 296 Cb 0.54 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 1jti h VAL 296 CO 0.03 0.00 -0.41 -0.07 0.02 0.00 0.00 177.57 177.14 1jti h LEU 297 N -0.57 0.04 -0.21 2.57 3.38 -0.78 -1.98 115.31 117.75 1jti h LEU 297 Ca 0.04 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 1jti h LEU 297 Cb 0.63 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 1jti h LEU 297 CO -0.25 0.45 -0.05 -0.03 0.09 0.00 0.00 178.44 178.64 1jti h MET 298 N 0.03 0.40 -0.87 1.13 4.05 -0.49 -0.45 114.93 118.74 1jti h MET 298 Ca 0.00 -0.15 0.02 0.00 -0.28 0.00 0.00 59.70 59.28 1jti h MET 298 Cb 0.74 -0.02 -0.05 0.00 -0.80 0.00 0.00 31.60 31.47 1jti h MET 298 CO 0.05 0.65 0.57 0.00 0.23 0.00 0.00 176.91 178.42 1jti h ALA 299 N 0.74 1.41 0.00 0.39 0.00 0.21 -1.79 119.26 120.21 1jti h ALA 299 Ca 0.05 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1jti h ALA 299 Cb 0.51 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1jti h ALA 299 CO 0.02 0.53 0.00 -1.33 0.00 0.00 0.00 179.25 178.47 1jti n MET 300 N -4.42 0.05 0.00 0.00 2.00 -0.77 -4.87 117.12 109.11 1jti n MET 300 Ca 0.10 0.20 0.00 0.00 0.00 0.00 0.00 57.70 58.01 1jti n MET 300 Cb 0.05 -1.50 0.00 0.00 0.00 0.00 0.00 33.22 31.77 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 0.15 1.10 3.44 3.03 0.00 -0.67 -4.96 105.19 107.28 1jti n GLY 301 Ca 0.05 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.00 4.53 -0.12 -0.61 1.01 -0.21 -4.80 121.20 119.00 1jti s ILE 302 Ca 0.00 -0.89 0.02 0.00 0.00 0.00 0.00 60.65 59.78 1jti s ILE 302 Cb 0.00 -4.70 -0.09 0.00 0.01 0.00 0.00 42.46 37.69 1jti s ILE 302 CO 0.00 -1.44 -0.08 0.35 0.00 0.00 0.00 174.94 173.77 1jti n THR 303 N 5.72 0.69 -0.13 2.92 -2.24 -1.26 -3.78 114.28 116.20 1jti n THR 303 Ca 0.06 -0.29 0.06 0.00 -2.27 0.00 0.00 64.05 61.61 1jti n THR 303 Cb 0.46 -0.90 0.39 0.00 -2.10 0.00 0.00 70.33 68.18 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 0.59 0.34 3.42 3.32 -1.92 -1.99 116.42 120.17 1jti h ASP 304 Ca -0.27 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.78 1jti h ASP 304 Cb 1.45 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.87 1jti h ASP 304 CO -0.03 0.39 0.00 -0.37 -1.72 0.00 0.00 179.24 177.51 1jti h VAL 305 N 0.67 0.00 -0.00 -1.35 -1.51 -1.88 -1.45 116.25 110.73 1jti h VAL 305 Ca 0.27 -0.17 0.00 0.00 -1.23 0.00 0.00 66.70 65.57 1jti h VAL 305 Cb 0.21 1.14 0.00 0.00 -2.13 0.00 0.00 31.29 30.51 1jti h VAL 305 CO -0.08 0.00 -0.85 0.49 -1.23 0.00 0.00 177.57 175.90 1jti n PHE 306 N -3.04 0.00 -2.53 5.19 3.72 -0.76 -1.27 117.46 118.77 1jti n PHE 306 Ca -0.02 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.16 1jti n PHE 306 Cb 0.15 -0.01 0.06 0.00 -0.94 0.00 0.00 39.48 38.73 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 -2.88 4.95 0.33 4.37 1.04 -0.55 -4.80 113.70 116.16 1jti s SER 307 Ca 0.11 0.00 0.26 0.00 0.48 0.00 0.00 55.95 56.80 1jti s SER 307 Cb 0.17 -0.72 0.97 0.00 0.10 0.00 0.00 66.02 66.54 1jti s SER 307 CO 0.79 -1.41 1.78 -1.28 0.98 0.00 0.00 173.24 174.10 1jti h SER 308 N -0.22 0.00 -0.84 7.02 0.87 -1.94 -2.76 113.55 115.68 1jti h SER 308 Ca -0.41 0.00 -0.33 0.00 -1.23 0.00 0.00 61.79 59.82 1jti h SER 308 Cb 1.29 0.00 -0.19 0.00 -0.44 0.00 0.00 62.40 63.06 1jti h SER 308 CO 0.51 0.00 0.41 -1.54 -0.53 0.00 0.00 176.83 175.68 1jti n SER 309 N -2.51 4.48 -4.80 6.23 3.41 -1.26 -4.98 113.62 114.19 1jti n SER 309 Ca 0.03 -3.35 -0.34 0.00 -0.26 0.00 0.00 58.87 54.94 1jti n SER 309 Cb 0.32 -0.78 -0.05 0.00 -0.26 0.00 0.00 64.21 63.44 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 -3.08 3.00 -0.39 7.33 0.00 -1.04 -4.92 121.76 122.65 1jti s ALA 310 Ca 0.56 0.56 0.03 0.00 0.00 0.00 0.00 51.96 53.10 1jti s ALA 310 Cb 0.45 -3.22 0.11 0.00 0.00 0.00 0.00 23.12 20.47 1jti s ALA 310 CO 0.13 -0.11 0.13 1.21 0.00 0.00 0.00 175.76 177.12 1jti s ASN 311 N -1.92 4.38 -0.38 0.00 3.04 -1.26 -4.76 114.94 114.05 1jti s ASN 311 Ca 0.62 -2.34 0.05 0.00 0.04 0.00 0.00 52.86 51.23 1jti s ASN 311 Cb -0.16 -1.42 0.46 0.00 -1.54 0.00 0.00 41.25 38.59 1jti s ASN 311 CO 0.20 -0.33 1.36 0.18 -3.04 0.00 0.00 177.10 175.47 1jti n LEU 312 N 3.98 5.50 0.10 3.21 4.77 -1.26 -1.76 117.00 131.54 1jti n LEU 312 Ca 0.04 -4.68 0.09 0.00 -0.03 0.00 0.00 56.01 51.43 1jti n LEU 312 Cb 0.39 -0.48 0.43 0.00 -2.33 0.00 0.00 43.42 41.42 1jti n LEU 312 CO 0.23 1.99 0.77 -1.54 -1.33 0.00 0.00 177.39 177.51 1jti n SER 313 N -0.74 0.44 0.00 -1.43 3.41 -1.24 -1.03 113.62 113.02 1jti n SER 313 Ca 0.48 0.65 0.14 0.00 -0.26 0.00 0.00 58.87 59.87 1jti n SER 313 Cb 0.89 -0.73 0.61 0.00 -0.26 0.00 0.00 64.21 64.72 1jti n SER 313 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1jti n GLY 314 N -0.69 -1.46 0.11 5.00 0.00 -0.92 -3.23 105.19 104.01 1jti n GLY 314 Ca 0.01 -0.10 -0.13 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.49 1.35 -3.63 -0.61 5.41 -0.20 -4.68 119.36 115.51 1jti n ILE 315 Ca 0.07 -0.69 -0.11 0.00 1.00 0.00 0.00 62.75 63.02 1jti n ILE 315 Cb 0.32 -0.87 -0.07 0.00 -0.71 0.00 0.00 39.64 38.31 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 -5.79 -0.68 -0.01 4.38 0.15 -1.13 -0.49 113.70 110.13 1jti s SER 316 Ca -0.20 1.28 0.21 0.00 0.70 0.00 0.00 55.95 57.95 1jti s SER 316 Cb 0.07 1.29 -0.26 0.00 -1.71 0.00 0.00 66.02 65.41 1jti s SER 316 CO 0.69 -0.22 0.73 -1.20 1.20 0.00 0.00 173.24 174.44 1jti n SER 317 N 2.80 0.58 0.09 5.45 7.64 -1.26 -4.07 113.62 124.85 1jti n SER 317 Ca -0.14 -0.56 -0.08 0.00 1.01 0.00 0.00 58.87 59.09 1jti n SER 317 Cb 0.56 1.40 -0.03 0.00 -1.01 0.00 0.00 64.21 65.13 1jti n SER 317 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1jti h ALA 318 N 2.57 0.48 -2.43 -0.43 0.00 -1.94 -3.47 119.26 114.05 1jti h ALA 318 Ca 0.00 -0.77 -0.19 0.00 0.00 0.00 0.00 54.91 53.95 1jti h ALA 318 Cb 0.71 -0.09 -0.16 0.00 0.00 0.00 0.00 17.79 18.25 1jti h ALA 318 CO 0.00 1.00 -0.70 -1.21 0.00 0.00 0.00 179.25 178.34 1jti s GLU 319 N -3.06 0.66 -0.19 0.00 2.02 -1.26 -5.12 118.70 111.76 1jti s GLU 319 Ca -0.02 -1.15 -0.27 0.00 0.02 0.00 0.00 54.97 53.56 1jti s GLU 319 Cb 0.10 -0.04 -0.01 0.00 0.10 0.00 0.00 34.13 34.29 1jti s GLU 319 CO 0.82 -0.04 0.91 0.45 0.02 0.00 0.00 175.26 177.42 1jti s SER 320 N -2.65 7.02 0.19 -0.19 0.15 -1.26 -4.88 113.70 112.08 1jti s SER 320 Ca 0.04 1.26 0.08 0.00 0.70 0.00 0.00 55.95 58.04 1jti s SER 320 Cb 0.03 -2.49 -0.04 0.00 -1.71 0.00 0.00 66.02 61.80 1jti s SER 320 CO -0.06 -0.50 -0.16 -0.76 1.20 0.00 0.00 173.24 172.97 1jti s LEU 321 N 2.52 2.52 0.19 3.45 1.43 -1.26 0.51 118.68 128.04 1jti s LEU 321 Ca 0.41 -0.96 -0.15 0.00 -1.03 0.00 0.00 54.13 52.39 1jti s LEU 321 Cb -0.16 -0.73 0.02 0.00 0.03 0.00 0.00 46.19 45.34 1jti s LEU 321 CO 0.11 -0.12 0.47 -1.59 0.23 0.00 0.00 176.35 175.44 1jti s LYS 322 N -3.34 1.35 -0.19 1.70 -2.85 0.57 -4.43 119.74 112.54 1jti s LYS 322 Ca 0.20 -0.98 -0.28 0.00 -1.00 0.00 0.00 55.97 53.91 1jti s LYS 322 Cb -0.03 0.48 0.00 0.00 -2.06 0.00 0.00 37.83 36.23 1jti s LYS 322 CO 0.07 -0.56 0.99 0.42 0.10 0.00 0.00 175.35 176.37 1jti s ILE 323 N -3.91 4.74 -0.14 3.79 1.01 -0.40 -0.23 121.20 126.06 1jti s ILE 323 Ca 0.12 1.95 -0.28 0.00 0.00 0.00 0.00 60.65 62.44 1jti s ILE 323 Cb -0.00 -4.28 -0.26 0.00 0.01 0.00 0.00 42.46 37.94 1jti s ILE 323 CO -0.01 -0.10 0.74 -1.28 0.00 0.00 0.00 174.94 174.29 1jti h SER 324 N 7.37 0.02 -5.08 3.58 0.87 -1.05 -3.41 113.55 115.86 1jti h SER 324 Ca -0.23 -0.96 -0.05 0.00 -1.23 0.00 0.00 61.79 59.31 1jti h SER 324 Cb 1.09 -0.01 -0.13 0.00 -0.44 0.00 0.00 62.40 62.92 1jti h SER 324 CO 0.92 1.06 -0.06 0.00 -0.53 0.00 0.00 176.83 178.22 1jti s GLN 325 N -2.24 1.09 -0.02 2.24 0.00 -1.25 -5.00 119.66 114.49 1jti s GLN 325 Ca -0.19 -0.72 -0.02 0.00 -0.00 0.00 0.00 55.36 54.43 1jti s GLN 325 Cb -0.02 0.47 0.00 0.00 0.00 0.00 0.00 33.01 33.47 1jti s GLN 325 CO 0.69 -0.43 0.05 0.00 0.00 0.00 0.00 175.29 175.60 1jti s ALA 326 N -3.81 -0.13 0.02 2.60 0.00 -1.26 -0.64 121.76 118.55 1jti s ALA 326 Ca 0.03 0.10 -0.06 0.00 0.00 0.00 0.00 51.96 52.03 1jti s ALA 326 Cb 0.02 -0.07 -0.01 0.00 0.00 0.00 0.00 23.12 23.06 1jti s ALA 326 CO -0.11 -0.04 0.11 0.08 0.00 0.00 0.00 175.76 175.80 1jti s VAL 327 N -0.12 0.11 -0.10 0.00 1.01 0.91 -1.18 120.40 121.03 1jti s VAL 327 Ca -0.02 -0.91 -0.04 0.00 0.00 0.00 0.00 61.98 61.02 1jti s VAL 327 Cb -0.01 -0.67 0.05 0.00 0.00 0.00 0.00 36.38 35.75 1jti s VAL 327 CO 0.00 -0.50 0.21 -2.28 0.00 0.00 0.00 175.10 172.53 1jti s HIS 328 N -2.04 -0.28 0.09 5.22 2.46 -0.36 -0.70 115.29 119.68 1jti s HIS 328 Ca -0.10 0.73 0.08 0.00 0.47 0.00 0.00 55.06 56.24 1jti s HIS 328 Cb -0.04 -0.06 -0.03 0.00 -0.13 0.00 0.00 32.58 32.31 1jti s HIS 328 CO -0.02 -0.26 -0.21 0.00 -2.47 0.00 0.00 174.74 171.79 1jti s ALA 329 N 1.73 1.79 -0.06 1.58 0.00 -0.67 0.67 121.76 126.80 1jti s ALA 329 Ca -0.04 -1.21 -0.20 0.00 0.00 0.00 0.00 51.96 50.50 1jti s ALA 329 Cb -0.11 -0.26 0.04 0.00 0.00 0.00 0.00 23.12 22.79 1jti s ALA 329 CO -0.07 0.37 0.46 0.00 0.00 0.00 0.00 175.76 176.51 1jti s ALA 330 N -1.10 -1.18 -0.03 0.00 0.00 -0.31 -1.37 121.76 117.77 1jti s ALA 330 Ca 0.07 0.84 0.01 0.00 0.00 0.00 0.00 51.96 52.87 1jti s ALA 330 Cb -0.10 -0.11 0.02 0.00 0.00 0.00 0.00 23.12 22.94 1jti s ALA 330 CO 0.04 -0.29 -0.04 -1.58 0.00 0.00 0.00 175.76 173.89 1jti s HIS 331 N -1.00 0.61 0.02 0.00 5.04 -0.30 -1.79 115.29 117.87 1jti s HIS 331 Ca -0.10 -0.14 0.03 0.00 -1.54 0.00 0.00 55.06 53.30 1jti s HIS 331 Cb -0.03 -0.55 -0.01 0.00 0.04 0.00 0.00 32.58 32.03 1jti s HIS 331 CO 0.05 -0.14 -0.08 0.00 -2.34 0.00 0.00 174.74 172.23 1jti s ALA 332 N 0.74 0.67 -0.05 1.58 0.00 0.13 -1.70 121.76 123.14 1jti s ALA 332 Ca -0.09 -0.54 -0.00 0.00 0.00 0.00 0.00 51.96 51.33 1jti s ALA 332 Cb -0.12 -0.09 0.03 0.00 0.00 0.00 0.00 23.12 22.93 1jti s ALA 332 CO -0.00 0.10 -0.01 -1.21 0.00 0.00 0.00 175.76 174.64 1jti s GLU 333 N -0.79 0.54 -0.20 0.00 2.02 0.26 -0.58 118.70 119.95 1jti s GLU 333 Ca -0.02 0.04 0.01 0.00 0.02 0.00 0.00 54.97 55.03 1jti s GLU 333 Cb -0.06 -0.75 0.04 0.00 0.10 0.00 0.00 34.13 33.46 1jti s GLU 333 CO 0.00 -0.18 -0.09 0.42 0.02 0.00 0.00 175.26 175.43 1jti s ILE 334 N 1.35 1.55 0.00 -1.63 1.01 -0.21 0.00 121.20 123.27 1jti s ILE 334 Ca -0.05 -0.97 0.00 0.00 0.00 0.00 0.00 60.65 59.63 1jti s ILE 334 Cb -0.13 -1.66 0.00 0.00 0.01 0.00 0.00 42.46 40.68 1jti s ILE 334 CO -0.02 0.14 0.00 -0.46 0.00 0.00 0.00 174.94 174.60 1jti n ASN 335 N 4.71 1.00 -0.08 3.58 0.23 -0.16 -0.93 115.26 123.62 1jti n ASN 335 Ca -0.14 -0.40 0.01 0.00 -0.53 0.00 0.00 54.58 53.52 1jti n ASN 335 Cb 0.46 0.00 0.30 0.00 -2.08 0.00 0.00 39.78 38.47 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 0.70 0.00 -3.83 3.07 -1.98 -3.08 114.58 109.47 1jti h GLU 336 Ca 0.00 -0.09 -0.21 0.00 -0.50 0.00 0.00 59.36 58.56 1jti h GLU 336 Cb 0.00 -0.13 -0.03 0.00 -0.84 0.00 0.00 28.75 27.74 1jti h GLU 336 CO 0.00 0.56 -1.17 0.00 -1.40 0.00 0.00 179.01 177.00 1jti h ALA 337 N 1.55 0.55 0.00 3.43 0.00 -1.97 -1.97 119.26 120.85 1jti h ALA 337 Ca 0.17 -0.99 0.00 0.00 0.00 0.00 0.00 54.91 54.09 1jti h ALA 337 Cb 0.10 0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1jti h ALA 337 CO -0.02 1.22 0.00 0.41 0.00 0.00 0.00 179.25 180.86 1jti n GLY 338 N 1.39 -0.51 3.19 0.00 0.00 -1.16 -1.47 105.19 106.63 1jti n GLY 338 Ca -0.05 -0.84 -0.22 0.00 0.00 0.00 0.00 46.02 44.90 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 -3.71 1.35 -0.09 2.61 -4.23 -0.74 -0.99 115.64 109.85 1jti s THR 339 Ca 0.00 -1.11 0.04 0.00 -1.18 0.00 0.00 61.69 59.44 1jti s THR 339 Cb 0.00 -1.21 0.00 0.00 1.34 0.00 0.00 72.50 72.63 1jti s THR 339 CO 0.00 0.07 -0.22 -1.61 -0.54 0.00 0.00 174.62 172.33 1jti s GLU 340 N -1.21 2.68 -0.02 3.99 2.02 0.10 -1.72 118.70 124.53 1jti s GLU 340 Ca 0.04 -0.78 -0.01 0.00 0.02 0.00 0.00 54.97 54.24 1jti s GLU 340 Cb -0.08 -2.08 0.02 0.00 0.10 0.00 0.00 34.13 32.09 1jti s GLU 340 CO 0.02 0.18 0.04 0.08 0.02 0.00 0.00 175.26 175.60 1jti s VAL 341 N 0.33 -0.04 0.12 2.63 1.01 0.87 -0.57 120.40 124.74 1jti s VAL 341 Ca -0.16 0.15 0.06 0.00 0.00 0.00 0.00 61.98 62.03 1jti s VAL 341 Cb -0.17 -0.09 -0.04 0.00 0.00 0.00 0.00 36.38 36.08 1jti s VAL 341 CO 0.07 0.06 -0.15 0.68 0.00 0.00 0.00 175.10 175.76 1jti s VAL 342 N 0.78 1.38 0.07 2.92 -7.23 -0.69 0.62 120.40 118.24 1jti s VAL 342 Ca -0.06 -1.70 -0.26 0.00 -1.81 0.00 0.00 61.98 58.14 1jti s VAL 342 Cb -0.09 -1.53 0.09 0.00 0.56 0.00 0.00 36.38 35.41 1jti s VAL 342 CO -0.03 -0.38 1.16 -0.83 -0.31 0.00 0.00 175.10 174.72 1jti s GLY 343 N -2.40 -0.14 -0.22 2.32 0.00 0.01 -1.15 107.32 105.74 1jti s GLY 343 Ca 0.09 0.10 -0.16 0.00 0.00 0.00 0.00 44.72 44.75 1jti s GLY 343 CO 0.03 2.34 0.57 -0.45 0.00 0.00 0.00 173.10 175.59 1jti s SER 344 N -3.34 -0.68 -0.07 1.64 0.15 -0.47 -0.55 113.70 110.38 1jti s SER 344 Ca 0.20 1.19 0.04 0.00 0.70 0.00 0.00 55.95 58.08 1jti s SER 344 Cb 0.00 1.13 -0.02 0.00 -1.71 0.00 0.00 66.02 65.43 1jti s SER 344 CO 0.01 -0.21 -0.18 0.00 1.20 0.00 0.00 173.24 174.06 1jti s ALA 345 N 0.96 2.47 -0.04 5.45 0.00 -1.18 -1.67 121.76 127.75 1jti s ALA 345 Ca -0.05 -0.98 -0.06 0.00 0.00 0.00 0.00 51.96 50.86 1jti s ALA 345 Cb -0.05 -0.92 0.01 0.00 0.00 0.00 0.00 23.12 22.15 1jti s ALA 345 CO -0.08 0.42 0.16 -2.00 0.00 0.00 0.00 175.76 174.26 1jti s GLU 346 N -0.23 0.30 -0.05 0.00 -6.30 0.13 -1.07 118.70 111.47 1jti s GLU 346 Ca -0.00 0.01 -0.03 0.00 -2.50 0.00 0.00 54.97 52.44 1jti s GLU 346 Cb -0.13 0.13 0.02 0.00 0.00 0.00 0.00 34.13 34.15 1jti s GLU 346 CO 0.03 -0.06 0.12 0.00 0.02 0.00 0.00 175.26 175.37 1jti s ALA 347 N -0.44 -0.25 -0.09 6.30 0.00 -0.62 -0.07 121.76 126.59 1jti s ALA 347 Ca -0.05 0.42 -0.02 0.00 0.00 0.00 0.00 51.96 52.30 1jti s ALA 347 Cb -0.03 -0.26 -0.03 0.00 0.00 0.00 0.00 23.12 22.79 1jti s ALA 347 CO 0.01 -0.09 0.01 0.20 0.00 0.00 0.00 175.76 175.89 1jti s GLY 348 N 0.43 1.87 -0.21 0.00 0.00 0.19 -0.75 107.32 108.85 1jti s GLY 348 Ca -0.03 -0.79 -0.02 0.00 0.00 0.00 0.00 44.72 43.87 1jti s GLY 348 CO -0.02 -0.55 -0.10 0.14 0.00 0.00 0.00 173.10 172.58 1jti s VAL 349 N -0.87 2.90 0.34 1.40 1.01 0.32 -0.40 120.40 125.11 1jti s VAL 349 Ca 0.13 -0.67 0.09 0.00 0.00 0.00 0.00 61.98 61.53 1jti s VAL 349 Cb -0.11 -2.30 -0.06 0.00 0.00 0.00 0.00 36.38 33.90 1jti s VAL 349 CO 0.02 0.45 -0.06 -1.81 0.00 0.00 0.00 175.10 173.70 1jti s ASP 350 N 1.41 3.88 -0.10 3.32 1.11 0.68 0.35 116.67 127.32 1jti s ASP 350 Ca 0.05 -1.13 -0.30 0.00 0.18 0.00 0.00 52.55 51.36 1jti s ASP 350 Cb -0.14 -0.41 -0.03 0.00 1.07 0.00 0.00 42.92 43.41 1jti s ASP 350 CO -0.07 -0.22 1.40 0.00 1.18 0.00 0.00 175.17 177.47 1jti s ALA 351 N -2.58 3.63 0.00 5.23 0.00 -0.91 -0.32 121.76 126.81 1jti s ALA 351 Ca 0.33 0.68 0.00 0.00 0.00 0.00 0.00 51.96 52.97 1jti s ALA 351 Cb 0.02 -3.65 0.00 0.00 0.00 0.00 0.00 23.12 19.49 1jti s ALA 351 CO 0.17 -1.18 0.00 0.00 0.00 0.00 0.00 175.76 174.75 1jti n ALA 352 N 6.52 0.00 0.00 0.00 0.00 0.18 -4.85 120.51 122.37 1jti n ALA 352 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.59 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 0.00 -3.87 0.00 2.13 -1.26 -4.97 120.64 112.67 1jti n GLU 356 Ca 0.00 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 57.70 1jti n GLU 356 Cb 0.00 -1.79 -0.14 0.00 0.27 0.00 0.00 31.44 29.78 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 -1.60 0.01 -0.32 5.31 2.12 -1.26 -1.72 118.70 121.24 1jti s GLU 357 Ca 0.00 0.02 -0.02 0.00 0.36 0.00 0.00 54.97 55.34 1jti s GLU 357 Cb 0.00 -0.05 0.11 0.00 0.26 0.00 0.00 34.13 34.45 1jti s GLU 357 CO 0.00 -0.02 0.14 0.12 -0.54 0.00 0.00 175.26 174.96 1jti s PHE 358 N 0.16 1.06 -0.09 5.30 5.36 -0.56 -4.95 117.98 124.24 1jti s PHE 358 Ca -0.01 -1.47 0.04 0.00 -0.96 0.00 0.00 56.93 54.53 1jti s PHE 358 Cb -0.02 -1.30 0.00 0.00 -0.34 0.00 0.00 43.02 41.36 1jti s PHE 358 CO -0.00 -0.84 -0.22 -0.98 -1.46 0.00 0.00 175.22 171.71 1jti s ARG 359 N 1.59 2.84 -0.87 10.12 1.70 -1.26 -1.20 118.95 131.87 1jti s ARG 359 Ca 0.12 -0.81 -0.06 0.00 -0.47 0.00 0.00 55.73 54.51 1jti s ARG 359 Cb -0.18 -2.16 0.22 0.00 -0.57 0.00 0.00 34.95 32.26 1jti s ARG 359 CO -0.23 0.16 0.77 0.00 -1.08 0.00 0.00 175.30 174.92 1jti s ALA 360 N 0.39 4.18 -0.53 7.88 0.00 -0.81 -4.77 121.76 128.10 1jti s ALA 360 Ca -0.18 -3.62 0.14 0.00 0.00 0.00 0.00 51.96 48.30 1jti s ALA 360 Cb -0.18 -3.09 0.44 0.00 0.00 0.00 0.00 23.12 20.30 1jti s ALA 360 CO 0.08 -2.18 1.36 -0.40 0.00 0.00 0.00 175.76 174.62 1jti n ASP 361 N 2.98 3.52 -3.81 0.00 5.68 -1.26 -4.53 116.55 119.13 1jti n ASP 361 Ca 0.17 -2.56 -0.12 0.00 -0.50 0.00 0.00 54.79 51.78 1jti n ASP 361 Cb 0.40 -0.41 -0.10 0.00 -1.14 0.00 0.00 41.12 39.86 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 -2.01 -0.12 -0.05 2.11 -3.43 -1.26 0.17 115.29 110.71 1jti s HIS 362 Ca 0.34 0.22 -0.27 0.00 -0.80 0.00 0.00 55.06 54.55 1jti s HIS 362 Cb 0.25 0.04 -0.13 0.00 -1.43 0.00 0.00 32.58 31.30 1jti s HIS 362 CO 0.12 -0.28 0.76 -2.30 -2.00 0.00 0.00 174.74 171.05 1jti n PRO 363 N 1.82 0.00 -4.11 -0.38 -0.02 -1.26 -4.94 135.00 126.11 1jti n PRO 363 Ca -0.20 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.19 1jti n PRO 363 Cb 0.56 -1.00 -0.09 0.00 -0.02 0.00 0.00 33.50 32.95 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 0.29 0.79 0.12 6.00 -0.12 -0.88 -4.59 117.98 119.59 1jti s PHE 364 Ca 0.62 -1.15 0.04 0.00 -0.05 0.00 0.00 56.93 56.39 1jti s PHE 364 Cb -0.87 -0.39 -0.04 0.00 -0.63 0.00 0.00 43.02 41.09 1jti s PHE 364 CO 0.40 -0.58 0.11 -0.51 -0.05 0.00 0.00 175.22 174.59 1jti s LEU 365 N -3.04 3.81 -0.00 -1.99 1.43 -0.74 -0.81 118.68 117.33 1jti s LEU 365 Ca 0.24 -0.07 -0.18 0.00 -1.03 0.00 0.00 54.13 53.10 1jti s LEU 365 Cb 0.06 -2.45 0.03 0.00 0.03 0.00 0.00 46.19 43.86 1jti s LEU 365 CO 0.03 0.12 0.39 0.72 0.23 0.00 0.00 176.35 177.83 1jti s PHE 366 N -1.58 -0.26 -0.06 0.29 -0.71 -0.36 -0.57 117.98 114.72 1jti s PHE 366 Ca 0.30 0.37 -0.16 0.00 -1.04 0.00 0.00 56.93 56.40 1jti s PHE 366 Cb -0.11 0.17 0.03 0.00 -1.21 0.00 0.00 43.02 41.90 1jti s PHE 366 CO 0.23 -0.47 0.37 0.00 -1.34 0.00 0.00 175.22 174.02 1jti s ILE 368 N -0.84 3.71 0.16 0.00 1.01 0.43 -1.04 121.20 124.64 1jti s ILE 368 Ca -0.09 -0.43 0.03 0.00 0.00 0.00 0.00 60.65 60.16 1jti s ILE 368 Cb -0.04 -2.61 -0.05 0.00 0.01 0.00 0.00 42.46 39.78 1jti s ILE 368 CO 0.04 0.51 -0.04 -1.59 0.00 0.00 0.00 174.94 173.86 1jti s LYS 369 N 0.27 1.09 -0.31 2.79 -2.85 -0.91 -1.10 119.74 118.72 1jti s LYS 369 Ca -0.04 -1.51 -0.17 0.00 -1.00 0.00 0.00 55.97 53.25 1jti s LYS 369 Cb -0.14 -0.41 -0.02 0.00 -2.06 0.00 0.00 37.83 35.20 1jti s LYS 369 CO 0.03 -0.05 0.45 -1.58 0.10 0.00 0.00 175.35 174.30 1jti s HIS 370 N -3.53 3.22 0.15 1.78 5.65 0.33 -2.38 115.29 120.51 1jti s HIS 370 Ca 0.21 0.30 -0.25 0.00 0.25 0.00 0.00 55.06 55.56 1jti s HIS 370 Cb 0.05 -2.74 0.00 0.00 -1.18 0.00 0.00 32.58 28.71 1jti s HIS 370 CO 0.02 -0.38 1.60 0.82 -0.65 0.00 0.00 174.74 176.15 1jti h ILE 371 N 5.50 0.23 0.00 0.89 2.04 -1.41 0.52 117.51 125.27 1jti h ILE 371 Ca -0.29 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.57 1jti h ILE 371 Cb 1.14 0.23 0.00 0.00 -0.74 0.00 0.00 36.82 37.45 1jti h ILE 371 CO 0.71 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.86 1jti h ALA 372 N 0.50 1.00 0.00 1.87 0.00 -1.95 -3.29 119.26 117.39 1jti h ALA 372 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1jti h ALA 372 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1jti h ALA 372 CO -0.45 0.00 -0.53 0.25 0.00 0.00 0.00 179.25 178.52 1jti n THR 373 N -2.79 0.00 -1.11 0.00 -2.24 -1.09 -5.00 114.28 102.05 1jti n THR 373 Ca 0.02 -0.29 -0.04 0.00 -2.27 0.00 0.00 64.05 61.47 1jti n THR 373 Cb 0.31 0.77 -0.02 0.00 -2.10 0.00 0.00 70.33 69.30 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 -1.28 -4.67 -4.72 3.42 3.02 0.18 -4.10 115.26 107.11 1jti n ASN 374 Ca 0.00 0.09 -0.42 0.00 -0.03 0.00 0.00 54.58 54.23 1jti n ASN 374 Cb 0.05 -2.50 -0.03 0.00 -0.61 0.00 0.00 39.78 36.70 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 -1.74 3.55 -0.27 5.41 0.00 -1.21 -4.71 121.76 122.78 1jti s ALA 375 Ca 0.00 1.08 -0.18 0.00 0.00 0.00 0.00 51.96 52.86 1jti s ALA 375 Cb 0.00 -3.51 -0.02 0.00 0.00 0.00 0.00 23.12 19.59 1jti s ALA 375 CO 0.00 -0.57 0.51 0.54 0.00 0.00 0.00 175.76 176.25 1jti s VAL 376 N 0.81 5.06 -0.18 0.00 0.11 -1.26 -0.51 120.40 124.43 1jti s VAL 376 Ca 0.62 0.82 -0.18 0.00 -2.93 0.00 0.00 61.98 60.31 1jti s VAL 376 Cb -0.36 -3.84 -0.21 0.00 -1.53 0.00 0.00 36.38 30.44 1jti s VAL 376 CO 0.32 0.05 0.27 -0.07 -3.33 0.00 0.00 175.10 172.34 1jti h LEU 377 N 8.82 0.12 -8.32 2.54 4.07 -1.47 -3.37 115.31 117.70 1jti h LEU 377 Ca -0.29 -0.63 -0.38 0.00 0.08 0.00 0.00 57.88 56.65 1jti h LEU 377 Cb 1.14 -0.04 -0.22 0.00 1.08 0.00 0.00 40.66 42.62 1jti h LEU 377 CO 0.72 1.58 -0.77 -0.36 -1.08 0.00 0.00 178.44 178.53 1jti s PHE 378 N -2.41 1.07 -0.06 1.13 0.08 -1.02 -3.29 117.98 113.48 1jti s PHE 378 Ca -0.27 -0.43 -0.08 0.00 0.12 0.00 0.00 56.93 56.26 1jti s PHE 378 Cb 0.06 -0.62 0.02 0.00 -0.57 0.00 0.00 43.02 41.91 1jti s PHE 378 CO 0.64 0.02 0.21 0.12 -0.10 0.00 0.00 175.22 176.11 1jti s PHE 379 N -1.17 -0.17 0.17 0.36 5.36 -1.01 -0.43 117.98 121.08 1jti s PHE 379 Ca -0.03 0.40 -0.24 0.00 -0.96 0.00 0.00 56.93 56.10 1jti s PHE 379 Cb -0.09 0.06 0.06 0.00 -0.34 0.00 0.00 43.02 42.70 1jti s PHE 379 CO 0.02 -0.18 0.82 0.20 -1.46 0.00 0.00 175.22 174.61 1jti s GLY 380 N -0.36 -0.28 -0.09 13.12 0.00 0.26 -2.18 107.32 117.79 1jti s GLY 380 Ca -0.05 0.17 0.02 0.00 0.00 0.00 0.00 44.72 44.86 1jti s GLY 380 CO 0.01 0.04 -0.14 -1.60 0.00 0.00 0.00 173.10 171.41 1jti s ARG 381 N -3.53 2.05 -0.31 2.90 3.52 0.64 -1.22 118.95 122.99 1jti s ARG 381 Ca 0.09 -0.51 -0.05 0.00 -0.13 0.00 0.00 55.73 55.13 1jti s ARG 381 Cb -0.03 -1.72 0.03 0.00 -1.56 0.00 0.00 34.95 31.67 1jti s ARG 381 CO -0.00 -0.02 0.07 0.00 -0.81 0.00 0.00 175.30 174.54 1jti n VAL 383 N 4.78 0.43 -3.62 0.00 0.24 -1.26 -2.07 118.33 116.84 1jti n VAL 383 Ca -0.13 -0.34 -0.28 0.00 -2.04 0.00 0.00 64.34 61.54 1jti n VAL 383 Cb 0.46 -0.43 -0.16 0.00 -1.47 0.00 0.00 33.84 32.23 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 -3.82 3.33 0.00 -1.34 0.15 -1.26 -4.72 113.70 106.04 1jti s SER 384 Ca -0.04 -1.17 0.00 0.00 0.70 0.00 0.00 55.95 55.44 1jti s SER 384 Cb 0.04 -0.47 0.00 0.00 -1.71 0.00 0.00 66.02 63.88 1jti s SER 384 CO 0.39 -0.40 0.32 -2.65 1.20 0.00 0.00 173.24 172.10