#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d6e s GLN 3 N 0.00 3.18 0.03 -1.46 0.74 -0.57 -4.96 119.66 116.63 1d6e s GLN 3 Ca 0.00 -0.80 -0.30 0.00 0.05 0.00 0.00 55.36 54.31 1d6e s GLN 3 Cb 0.00 -2.46 -0.08 0.00 1.10 0.00 0.00 33.01 31.57 1d6e s GLN 3 CO 0.00 0.15 1.73 -1.25 -0.55 0.00 0.00 175.29 175.36 1d6e s PRO 4 N 0.46 4.18 0.58 1.67 0.04 -1.26 -4.78 135.00 135.89 1d6e s PRO 4 Ca -0.13 2.37 -0.18 0.00 0.04 0.00 0.00 61.00 63.09 1d6e s PRO 4 Cb -0.17 -3.82 -0.08 0.00 0.04 0.00 0.00 34.50 30.48 1d6e s PRO 4 CO 0.06 -0.82 0.60 -0.25 0.04 0.00 0.00 177.00 176.63 1d6e n ASP 5 N 6.41 -0.75 -4.59 6.66 8.00 -1.26 -4.83 116.55 126.19 1d6e n ASP 5 Ca 0.17 0.74 -0.48 0.00 0.71 0.00 0.00 54.79 55.94 1d6e n ASP 5 Cb 0.41 -1.21 -0.03 0.00 -0.02 0.00 0.00 41.12 40.27 1d6e n ASP 5 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 1d6e n PRO 6 N -0.24 1.28 -3.52 -0.24 -0.02 -1.26 -4.95 135.00 126.05 1d6e n PRO 6 Ca 0.12 0.45 -0.38 0.00 -2.02 0.00 0.00 63.50 61.68 1d6e n PRO 6 Cb 0.48 -1.94 -0.06 0.00 -0.02 0.00 0.00 33.50 31.96 1d6e n PRO 6 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1d6e s LYS 7 N -0.62 4.00 0.47 -0.52 1.02 -1.26 -5.01 119.74 117.82 1d6e s LYS 7 Ca 0.70 0.30 -0.22 0.00 0.02 0.00 0.00 55.97 56.77 1d6e s LYS 7 Cb -0.80 -3.29 -0.10 0.00 -0.52 0.00 0.00 37.83 33.12 1d6e s LYS 7 CO 0.53 0.53 0.80 -2.30 -0.92 0.00 0.00 175.35 174.00 1d6e n PRO 8 N 2.46 0.94 0.00 -1.68 -0.02 -1.26 -0.89 135.00 134.54 1d6e n PRO 8 Ca -0.13 0.34 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 1d6e n PRO 8 Cb 0.52 -1.87 0.00 0.00 -0.02 0.00 0.00 33.50 32.14 1d6e n PRO 8 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1d6e n ASP 9 N 0.50 0.00 0.01 2.55 10.43 -1.26 -4.79 116.55 123.99 1d6e n ASP 9 Ca 0.11 0.00 0.11 0.00 2.57 0.00 0.00 54.79 57.58 1d6e n ASP 9 Cb 0.42 0.00 0.13 0.00 1.84 0.00 0.00 41.12 43.51 1d6e n ASP 9 CO 0.00 0.00 0.00 1.21 -1.07 0.00 0.00 177.20 177.34 1d6e n GLU 10 N -2.00 0.07 -3.54 -1.24 2.13 -0.07 -4.89 120.64 111.09 1d6e n GLU 10 Ca 0.00 0.00 -0.37 0.00 0.66 0.00 0.00 57.16 57.45 1d6e n GLU 10 Cb 0.00 -1.53 -0.06 0.00 0.27 0.00 0.00 31.44 30.12 1d6e n GLU 10 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 1d6e s LEU 11 N -3.24 4.44 0.52 4.31 1.43 -1.26 -4.97 118.68 119.92 1d6e s LEU 11 Ca 0.09 0.89 -0.22 0.00 -1.03 0.00 0.00 54.13 53.86 1d6e s LEU 11 Cb 0.16 -2.64 -0.06 0.00 0.03 0.00 0.00 46.19 43.68 1d6e s LEU 11 CO 0.75 0.30 1.34 -1.00 0.23 0.00 0.00 176.35 177.97 1d6e s HIS 12 N -1.15 2.38 -0.17 0.29 3.76 -1.26 -5.00 115.29 114.14 1d6e s HIS 12 Ca 0.25 1.38 0.00 0.00 -0.15 0.00 0.00 55.06 56.55 1d6e s HIS 12 Cb -0.16 -3.76 0.01 0.00 1.11 0.00 0.00 32.58 29.78 1d6e s HIS 12 CO 0.14 -2.73 -0.16 0.15 -0.85 0.00 0.00 174.74 171.29 1d6e s LYS 13 N -2.82 3.14 0.49 1.40 1.02 -1.26 -4.48 119.74 117.24 1d6e s LYS 13 Ca 0.69 -0.77 0.20 0.00 0.02 0.00 0.00 55.97 56.11 1d6e s LYS 13 Cb -0.39 -2.64 1.24 0.00 -0.52 0.00 0.00 37.83 35.52 1d6e s LYS 13 CO 0.47 -0.08 2.01 0.66 -0.92 0.00 0.00 175.35 177.49 1d6e h SER 14 N 7.61 0.13 0.73 2.83 4.64 -1.09 -0.53 113.55 127.87 1d6e h SER 14 Ca -0.38 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.93 1d6e h SER 14 Cb 1.17 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1d6e h SER 14 CO 0.59 0.08 -0.08 0.77 -0.87 0.00 0.00 176.83 177.32 1d6e h SER 15 N 0.15 0.00 0.36 4.97 4.64 -1.87 -1.43 113.55 120.37 1d6e h SER 15 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 1d6e h SER 15 Cb 0.68 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.77 1d6e h SER 15 CO -0.03 0.08 -0.13 0.29 -0.87 0.00 0.00 176.83 176.17 1d6e n LYS 16 N -3.28 0.68 -3.56 4.77 5.02 -0.21 -4.75 118.16 116.83 1d6e n LYS 16 Ca -0.00 -0.26 -0.37 0.00 -2.02 0.00 0.00 58.31 55.65 1d6e n LYS 16 Cb 0.29 -1.49 -0.08 0.00 -0.02 0.00 0.00 35.03 33.72 1d6e n LYS 16 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 1d6e s PHE 17 N -2.50 3.36 -1.06 2.13 5.36 -0.54 -2.61 117.98 122.11 1d6e s PHE 17 Ca 0.28 0.41 0.09 0.00 -0.96 0.00 0.00 56.93 56.74 1d6e s PHE 17 Cb 0.20 -2.36 0.10 0.00 -0.34 0.00 0.00 43.02 40.62 1d6e s PHE 17 CO 0.49 0.07 0.85 0.25 -1.46 0.00 0.00 175.22 175.42 1d6e n THR 18 N 4.19 0.17 -1.23 0.12 -2.24 0.14 -4.95 114.28 110.48 1d6e n THR 18 Ca -0.12 -0.58 0.00 0.00 -2.27 0.00 0.00 64.05 61.07 1d6e n THR 18 Cb 0.52 1.07 0.00 0.00 -2.10 0.00 0.00 70.33 69.82 1d6e n THR 18 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1d6e n GLY 19 N 0.47 -0.07 3.60 3.38 0.00 -1.24 -4.87 105.19 106.45 1d6e n GLY 19 Ca 0.06 -1.79 -0.42 0.00 0.00 0.00 0.00 46.02 43.86 1d6e n GLY 19 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1d6e s LEU 20 N 0.00 4.06 0.55 0.99 1.43 -1.26 -4.83 118.68 119.62 1d6e s LEU 20 Ca 0.00 0.50 0.36 0.00 -1.03 0.00 0.00 54.13 53.96 1d6e s LEU 20 Cb 0.00 -3.15 1.84 0.00 0.03 0.00 0.00 46.19 44.91 1d6e s LEU 20 CO 0.00 -0.78 2.10 -0.03 0.23 0.00 0.00 176.35 177.87 1d6e h MET 21 N 8.44 0.00 -0.75 1.70 1.85 -0.91 -2.19 114.93 123.06 1d6e h MET 21 Ca -0.24 0.00 0.16 0.00 -0.61 0.00 0.00 59.70 59.01 1d6e h MET 21 Cb 1.09 0.00 -0.05 0.00 0.43 0.00 0.00 31.60 33.07 1d6e h MET 21 CO 0.94 0.00 0.51 1.49 -0.40 0.00 0.00 176.91 179.45 1d6e h GLU 22 N 0.00 0.37 0.00 0.39 4.57 -1.16 0.15 114.58 118.89 1d6e h GLU 22 Ca 0.00 -0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.14 1d6e h GLU 22 Cb 0.17 -0.08 -0.00 0.00 -0.16 0.00 0.00 28.75 28.67 1d6e h GLU 22 CO 0.00 0.24 -0.08 -0.91 -1.18 0.00 0.00 179.01 177.08 1d6e h ASN 23 N 0.38 0.00 0.06 1.04 2.35 -1.69 -1.61 115.58 116.11 1d6e h ASN 23 Ca 0.37 0.00 -0.29 0.00 -0.55 0.00 0.00 56.30 55.83 1d6e h ASN 23 Cb 0.90 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.25 1d6e h ASN 23 CO -0.11 0.08 -1.56 -0.03 -1.65 0.00 0.00 177.43 174.15 1d6e h MET 24 N 0.00 0.14 -0.46 0.81 4.05 -0.97 -3.39 114.93 115.11 1d6e h MET 24 Ca -0.00 -0.23 0.09 0.00 -0.28 0.00 0.00 59.70 59.28 1d6e h MET 24 Cb 0.38 0.09 -0.09 0.00 -0.80 0.00 0.00 31.60 31.18 1d6e h MET 24 CO 0.01 1.11 -0.12 -0.22 0.23 0.00 0.00 176.91 177.93 1d6e h LYS 25 N -0.49 0.00 -0.11 0.39 3.64 -0.78 -1.63 116.57 117.58 1d6e h LYS 25 Ca -0.37 -0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.04 1d6e h LYS 25 Cb 1.65 -0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.46 1d6e h LYS 25 CO -0.06 0.00 0.19 -0.39 -2.27 0.00 0.00 179.45 176.92 1d6e h VAL 26 N 0.00 0.29 0.00 2.00 -1.51 -1.49 -0.31 116.25 115.23 1d6e h VAL 26 Ca 0.22 0.00 -0.09 0.00 -1.23 0.00 0.00 66.70 65.61 1d6e h VAL 26 Cb 0.34 0.84 -0.01 0.00 -2.13 0.00 0.00 31.29 30.32 1d6e h VAL 26 CO -0.48 0.00 -0.41 -0.07 -1.23 0.00 0.00 177.57 175.39 1d6e h LEU 27 N 0.00 0.00 -3.22 4.19 3.38 -1.48 -3.19 115.31 114.99 1d6e h LEU 27 Ca 0.05 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.91 1d6e h LEU 27 Cb 0.43 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.11 1d6e h LEU 27 CO -0.00 0.41 -0.24 -1.22 0.09 0.00 0.00 178.44 177.48 1d6e n TYR 28 N -3.57 0.67 -0.75 1.13 4.02 -0.16 -4.70 117.16 113.80 1d6e n TYR 28 Ca -0.00 -1.56 0.00 0.00 -0.01 0.00 0.00 57.90 56.33 1d6e n TYR 28 Cb 0.52 -0.40 0.00 0.00 -0.02 0.00 0.00 39.34 39.44 1d6e n TYR 28 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 1d6e n ASP 29 N -1.12 0.00 -0.10 7.72 10.43 -1.01 -4.04 116.55 128.43 1d6e n ASP 29 Ca 0.28 0.00 -0.11 0.00 2.57 0.00 0.00 54.79 57.53 1d6e n ASP 29 Cb 0.90 0.00 -0.03 0.00 1.84 0.00 0.00 41.12 43.83 1d6e n ASP 29 CO 0.00 0.00 0.00 0.44 -1.07 0.00 0.00 177.20 176.57 1d6e h ASP 30 N 0.00 0.53 -3.74 -2.24 3.45 -1.92 -3.45 116.42 109.05 1d6e h ASP 30 Ca 0.00 -0.32 -0.50 0.00 0.43 0.00 0.00 57.03 56.64 1d6e h ASP 30 Cb 0.00 -0.14 0.01 0.00 -0.56 0.00 0.00 39.33 38.64 1d6e h ASP 30 CO 0.00 0.71 0.46 0.20 -1.57 0.00 0.00 179.24 179.04 1d6e s ASN 31 N -6.05 7.33 0.09 6.45 0.01 -1.26 -5.02 114.94 116.49 1d6e s ASN 31 Ca -0.13 2.18 -0.26 0.00 -0.71 0.00 0.00 52.86 53.93 1d6e s ASN 31 Cb 0.08 -2.62 0.08 0.00 0.41 0.00 0.00 41.25 39.20 1d6e s ASN 31 CO 0.76 -0.12 0.93 -1.38 -1.51 0.00 0.00 177.10 175.78 1d6e s HIS 32 N -0.93 -0.22 0.08 2.20 -3.43 -1.26 -4.80 115.29 106.93 1d6e s HIS 32 Ca 0.45 -0.01 -0.17 0.00 -0.80 0.00 0.00 55.06 54.52 1d6e s HIS 32 Cb -0.30 0.60 -0.07 0.00 -1.43 0.00 0.00 32.58 31.38 1d6e s HIS 32 CO 0.38 -0.72 0.54 0.08 -2.00 0.00 0.00 174.74 173.03 1d6e s VAL 33 N -3.23 4.81 -0.28 -5.38 1.01 -0.35 -4.96 120.40 112.02 1d6e s VAL 33 Ca 0.09 1.07 -0.15 0.00 0.00 0.00 0.00 61.98 62.98 1d6e s VAL 33 Cb -0.01 -3.83 0.10 0.00 0.00 0.00 0.00 36.38 32.63 1d6e s VAL 33 CO -0.03 0.48 0.74 -0.55 0.00 0.00 0.00 175.10 175.75 1d6e s SER 34 N -1.25 -0.89 -0.17 3.32 0.15 -1.25 -1.91 113.70 111.70 1d6e s SER 34 Ca 0.30 1.40 -0.16 0.00 0.70 0.00 0.00 55.95 58.19 1d6e s SER 34 Cb -0.18 1.45 0.04 0.00 -1.71 0.00 0.00 66.02 65.62 1d6e s SER 34 CO 0.18 -0.22 0.46 0.00 1.20 0.00 0.00 173.24 174.86 1d6e s ALA 35 N 1.72 -1.14 -0.04 5.45 0.00 -0.42 -4.97 121.76 122.36 1d6e s ALA 35 Ca -0.09 1.29 0.01 0.00 0.00 0.00 0.00 51.96 53.17 1d6e s ALA 35 Cb -0.05 -0.74 -0.03 0.00 0.00 0.00 0.00 23.12 22.29 1d6e s ALA 35 CO -0.19 -0.22 -0.05 0.42 0.00 0.00 0.00 175.76 175.73 1d6e s ILE 36 N 0.22 3.86 -0.86 0.00 -1.09 -1.26 -0.78 121.20 121.29 1d6e s ILE 36 Ca -0.00 -0.54 -0.04 0.00 -2.23 0.00 0.00 60.65 57.84 1d6e s ILE 36 Cb -0.03 -2.63 0.00 0.00 -1.58 0.00 0.00 42.46 38.22 1d6e s ILE 36 CO 0.01 0.51 0.64 -3.20 -1.23 0.00 0.00 174.94 171.67 1d6e n ASN 37 N 1.91 -5.32 -4.34 3.58 5.15 -1.05 -4.97 115.26 110.22 1d6e n ASN 37 Ca -0.17 -0.85 -0.18 0.00 -0.60 0.00 0.00 54.58 52.79 1d6e n ASN 37 Cb 0.53 -2.38 -0.10 0.00 -0.53 0.00 0.00 39.78 37.29 1d6e n ASN 37 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1d6e s VAL 38 N -3.06 1.34 0.01 3.44 -7.23 -0.47 -4.85 120.40 109.59 1d6e s VAL 38 Ca 0.07 -2.09 0.04 0.00 -1.81 0.00 0.00 61.98 58.18 1d6e s VAL 38 Cb -0.03 -2.23 -0.01 0.00 0.56 0.00 0.00 36.38 34.66 1d6e s VAL 38 CO 0.88 -0.44 -0.12 -0.75 -0.31 0.00 0.00 175.10 174.35 1d6e s LYS 39 N -3.77 0.90 0.43 4.82 2.20 -1.26 -0.67 119.74 122.39 1d6e s LYS 39 Ca 0.25 -0.57 -0.26 0.00 -0.36 0.00 0.00 55.97 55.04 1d6e s LYS 39 Cb 0.03 -0.88 -0.09 0.00 -1.51 0.00 0.00 37.83 35.39 1d6e s LYS 39 CO 0.08 0.23 1.46 -1.54 -0.36 0.00 0.00 175.35 175.22 1d6e s SER 40 N -0.69 5.97 0.00 1.43 1.04 -1.26 -4.71 113.70 115.48 1d6e s SER 40 Ca 0.02 2.99 0.11 0.00 0.48 0.00 0.00 55.95 59.55 1d6e s SER 40 Cb -0.06 -2.66 0.03 0.00 0.10 0.00 0.00 66.02 63.43 1d6e s SER 40 CO 0.00 -1.12 0.73 2.30 0.98 0.00 0.00 173.24 176.13 1d6e n ILE 41 N -0.04 0.00 -4.03 -1.02 -6.64 0.06 -4.95 119.36 102.75 1d6e n ILE 41 Ca 0.04 -0.44 0.04 0.00 -1.77 0.00 0.00 62.75 60.62 1d6e n ILE 41 Cb 0.41 1.17 0.01 0.00 -1.44 0.00 0.00 39.64 39.79 1d6e n ILE 41 CO 0.00 0.00 0.00 -0.62 -1.77 0.00 0.00 176.55 174.16 1d6e s ASP 42 N -1.18 0.00 -0.01 7.28 2.15 -1.18 -5.01 116.67 118.72 1d6e s ASP 42 Ca 0.10 -0.08 -0.07 0.00 0.43 0.00 0.00 52.55 52.93 1d6e s ASP 42 Cb 0.09 0.06 0.00 0.00 -0.30 0.00 0.00 42.92 42.77 1d6e s ASP 42 CO 0.21 -0.12 0.13 -1.10 -0.17 0.00 0.00 175.17 174.12 1d6e s GLN 43 N -2.01 0.43 -0.18 4.34 -0.21 -1.26 0.09 119.66 120.86 1d6e s GLN 43 Ca 0.32 -0.31 -0.18 0.00 0.02 0.00 0.00 55.36 55.21 1d6e s GLN 43 Cb -0.00 0.18 -0.06 0.00 1.00 0.00 0.00 33.01 34.12 1d6e s GLN 43 CO -0.02 -0.10 -0.35 0.34 -2.12 0.00 0.00 175.29 173.05 1d6e n PHE 44 N 1.70 0.00 -4.37 0.91 7.35 -1.26 -4.92 117.46 116.88 1d6e n PHE 44 Ca -0.21 0.00 -0.27 0.00 -0.76 0.00 0.00 57.45 56.21 1d6e n PHE 44 Cb 0.56 -0.52 -0.11 0.00 0.35 0.00 0.00 39.48 39.76 1d6e n PHE 44 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 1d6e s LEU 45 N -7.88 2.66 0.07 -2.13 1.43 -1.26 -5.02 118.68 106.54 1d6e s LEU 45 Ca -0.29 -0.74 0.03 0.00 -1.03 0.00 0.00 54.13 52.10 1d6e s LEU 45 Cb 0.05 -1.38 0.18 0.00 0.03 0.00 0.00 46.19 45.07 1d6e s LEU 45 CO 0.43 0.12 0.97 0.00 0.23 0.00 0.00 176.35 178.10 1d6e n TYR 46 N 0.20 0.11 -0.66 0.29 0.18 -1.26 -1.58 117.16 114.43 1d6e n TYR 46 Ca -0.12 0.06 0.08 0.00 1.88 0.00 0.00 57.90 59.79 1d6e n TYR 46 Cb 0.56 -0.45 0.24 0.00 -0.38 0.00 0.00 39.34 39.31 1d6e n TYR 46 CO 0.00 0.00 0.00 1.97 -2.08 0.00 0.00 176.86 176.75 1d6e n PHE 47 N -1.51 0.89 -4.34 -3.48 1.16 -1.26 -4.61 117.46 104.30 1d6e n PHE 47 Ca -0.00 -0.71 -0.17 0.00 -1.87 0.00 0.00 57.45 54.69 1d6e n PHE 47 Cb 0.16 -0.22 -0.10 0.00 -1.61 0.00 0.00 39.48 37.72 1d6e n PHE 47 CO 0.00 0.00 0.00 0.16 -1.87 0.00 0.00 176.76 175.05 1d6e s ASP 48 N -1.45 1.40 -0.00 5.98 1.47 -0.62 -1.41 116.67 122.05 1d6e s ASP 48 Ca 0.37 -1.39 0.01 0.00 1.18 0.00 0.00 52.55 52.73 1d6e s ASP 48 Cb 0.27 0.12 -0.00 0.00 -0.34 0.00 0.00 42.92 42.96 1d6e s ASP 48 CO 0.13 -0.71 -0.04 -0.76 0.68 0.00 0.00 175.17 174.47 1d6e s LEU 49 N -3.34 2.02 -0.12 2.11 1.43 -0.40 -4.58 118.68 115.78 1d6e s LEU 49 Ca 0.38 -0.09 -0.02 0.00 -1.03 0.00 0.00 54.13 53.37 1d6e s LEU 49 Cb 0.08 -0.20 -0.03 0.00 0.03 0.00 0.00 46.19 46.07 1d6e s LEU 49 CO 0.14 0.04 -0.04 -0.63 0.23 0.00 0.00 176.35 176.09 1d6e s ILE 50 N -0.13 3.95 0.15 -0.59 1.01 0.11 -0.73 121.20 124.97 1d6e s ILE 50 Ca 0.01 -0.36 0.11 0.00 0.00 0.00 0.00 60.65 60.41 1d6e s ILE 50 Cb -0.02 -2.69 -0.04 0.00 0.01 0.00 0.00 42.46 39.72 1d6e s ILE 50 CO -0.00 0.54 -0.26 -0.31 0.00 0.00 0.00 174.94 174.91 1d6e s TYR 51 N -0.15 2.30 -1.04 3.97 1.51 -0.18 -0.76 117.35 123.00 1d6e s TYR 51 Ca 0.03 -0.37 -0.08 0.00 -1.01 0.00 0.00 57.07 55.64 1d6e s TYR 51 Cb -0.13 -1.21 0.26 0.00 -0.11 0.00 0.00 41.96 40.77 1d6e s TYR 51 CO 0.02 0.39 1.01 0.45 -1.11 0.00 0.00 175.55 176.31 1d6e s SER 52 N -2.25 6.98 -0.19 2.29 0.15 -1.26 -0.80 113.70 118.62 1d6e s SER 52 Ca 0.16 -3.55 -0.05 0.00 0.70 0.00 0.00 55.95 53.21 1d6e s SER 52 Cb -0.09 -2.14 -0.03 0.00 -1.71 0.00 0.00 66.02 62.05 1d6e s SER 52 CO 0.07 -0.29 -0.01 -0.63 1.20 0.00 0.00 173.24 173.59 1d6e s ILE 53 N -1.17 3.98 -0.20 6.45 1.01 -0.98 -4.95 121.20 125.35 1d6e s ILE 53 Ca 0.29 -0.31 -0.11 0.00 0.00 0.00 0.00 60.65 60.52 1d6e s ILE 53 Cb -0.10 -2.79 -0.05 0.00 0.01 0.00 0.00 42.46 39.54 1d6e s ILE 53 CO -0.09 0.45 0.17 -0.54 0.00 0.00 0.00 174.94 174.92 1d6e s LYS 54 N 0.81 4.19 -0.89 2.79 1.02 -1.26 -3.90 119.74 122.50 1d6e s LYS 54 Ca 0.00 -0.16 -0.25 0.00 0.02 0.00 0.00 55.97 55.59 1d6e s LYS 54 Cb -0.14 -3.44 -0.04 0.00 -0.52 0.00 0.00 37.83 33.69 1d6e s LYS 54 CO 0.02 0.26 1.91 0.34 -0.92 0.00 0.00 175.35 176.95 1d6e s ASP 55 N 0.46 5.24 0.10 2.83 2.15 -0.74 -4.85 116.67 121.87 1d6e s ASP 55 Ca 0.10 -0.66 -0.31 0.00 0.43 0.00 0.00 52.55 52.11 1d6e s ASP 55 Cb -0.12 -2.56 -0.13 0.00 -0.30 0.00 0.00 42.92 39.82 1d6e s ASP 55 CO -0.00 -2.64 1.61 0.71 -0.17 0.00 0.00 175.17 174.68 1d6e h THR 56 N 7.20 0.24 0.00 1.71 1.35 -1.95 -0.93 112.91 120.53 1d6e h THR 56 Ca 0.08 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.94 1d6e h THR 56 Cb 1.02 0.24 0.00 0.00 -1.73 0.00 0.00 68.15 67.68 1d6e h THR 56 CO 1.23 0.00 0.00 1.17 -0.25 0.00 0.00 175.52 177.67 1d6e n LYS 57 N -5.47 0.00 -0.50 4.72 4.81 -1.26 -3.93 118.16 116.53 1d6e n LYS 57 Ca -0.09 0.12 0.11 0.00 -0.87 0.00 0.00 58.31 57.58 1d6e n LYS 57 Cb 0.37 -0.65 0.34 0.00 0.02 0.00 0.00 35.03 35.11 1d6e n LYS 57 CO 0.00 0.00 0.00 1.47 1.17 0.00 0.00 177.40 180.04 1d6e n LEU 58 N -0.27 4.38 -3.88 3.14 -0.00 -1.26 -5.01 117.00 114.10 1d6e n LEU 58 Ca 0.00 -2.20 -0.36 0.00 -0.00 0.00 0.00 56.01 53.45 1d6e n LEU 58 Cb 0.00 -0.54 0.02 0.00 -0.00 0.00 0.00 43.42 42.90 1d6e n LEU 58 CO 0.00 0.89 -0.15 0.61 -0.00 0.00 0.00 177.39 178.75 1d6e n GLY 59 N 1.41 -0.78 0.06 1.47 0.00 -0.35 -4.93 105.19 102.06 1d6e n GLY 59 Ca 0.25 0.36 0.05 0.00 0.00 0.00 0.00 46.02 46.68 1d6e n GLY 59 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1d6e n ASN 60 N -2.56 0.29 -3.90 1.61 3.02 -1.26 -4.98 115.26 107.48 1d6e n ASN 60 Ca -0.14 0.12 -0.10 0.00 -0.03 0.00 0.00 54.58 54.43 1d6e n ASN 60 Cb 0.60 1.22 -0.09 0.00 -0.61 0.00 0.00 39.78 40.90 1d6e n ASN 60 CO 0.00 0.00 0.00 -0.72 -2.62 0.00 0.00 177.26 173.92 1d6e s TYR 61 N -3.18 0.13 -0.05 3.10 -0.85 -1.26 -4.01 117.35 111.23 1d6e s TYR 61 Ca -0.06 -0.35 0.05 0.00 -0.52 0.00 0.00 57.07 56.19 1d6e s TYR 61 Cb 0.11 -0.09 -0.08 0.00 0.38 0.00 0.00 41.96 42.28 1d6e s TYR 61 CO 0.86 -0.35 0.04 -0.25 -1.52 0.00 0.00 175.55 174.33 1d6e n ASP 62 N 0.97 3.58 -4.30 -0.18 8.00 -1.07 -1.79 116.55 121.76 1d6e n ASP 62 Ca -0.20 0.00 -0.22 0.00 0.71 0.00 0.00 54.79 55.08 1d6e n ASP 62 Cb 0.58 0.74 -0.12 0.00 -0.02 0.00 0.00 41.12 42.30 1d6e n ASP 62 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1d6e s ASN 63 N -3.56 2.54 -0.05 -2.24 0.01 -1.25 -2.33 114.94 108.07 1d6e s ASN 63 Ca -0.03 -0.78 0.01 0.00 -0.71 0.00 0.00 52.86 51.35 1d6e s ASN 63 Cb 0.02 -0.14 0.02 0.00 0.41 0.00 0.00 41.25 41.56 1d6e s ASN 63 CO 0.24 -0.01 -0.05 -0.69 -1.51 0.00 0.00 177.10 175.08 1d6e s VAL 64 N -1.70 0.55 -0.23 1.60 1.01 0.02 -2.56 120.40 119.09 1d6e s VAL 64 Ca 0.11 -0.13 -0.14 0.00 0.00 0.00 0.00 61.98 61.82 1d6e s VAL 64 Cb -0.07 -0.58 -0.04 0.00 0.00 0.00 0.00 36.38 35.68 1d6e s VAL 64 CO 0.05 0.23 0.32 -0.60 0.00 0.00 0.00 175.10 175.11 1d6e s ARG 65 N 0.94 4.09 -0.25 2.72 3.52 -0.59 -1.01 118.95 128.37 1d6e s ARG 65 Ca -0.11 0.02 -0.04 0.00 -0.13 0.00 0.00 55.73 55.47 1d6e s ARG 65 Cb -0.14 -3.58 0.00 0.00 -1.56 0.00 0.00 34.95 29.67 1d6e s ARG 65 CO 0.00 -0.09 -0.01 0.08 -0.81 0.00 0.00 175.30 174.47 1d6e s VAL 66 N 1.49 3.44 -0.09 7.11 1.01 0.10 -1.24 120.40 132.22 1d6e s VAL 66 Ca 0.14 -0.65 -0.05 0.00 0.00 0.00 0.00 61.98 61.42 1d6e s VAL 66 Cb -0.15 -2.66 -0.04 0.00 0.00 0.00 0.00 36.38 33.53 1d6e s VAL 66 CO 0.08 0.29 0.13 -1.61 0.00 0.00 0.00 175.10 173.98 1d6e s GLU 67 N 1.45 3.37 0.29 2.72 2.02 -0.66 -1.28 118.70 126.61 1d6e s GLU 67 Ca 0.04 -0.21 0.11 0.00 0.02 0.00 0.00 54.97 54.92 1d6e s GLU 67 Cb -0.16 -3.11 -0.05 0.00 0.10 0.00 0.00 34.13 30.91 1d6e s GLU 67 CO -0.02 0.75 -0.10 -0.06 0.02 0.00 0.00 175.26 175.85 1d6e s PHE 68 N -1.08 2.48 0.51 1.61 0.40 -0.50 -2.27 117.98 119.14 1d6e s PHE 68 Ca 0.17 -0.31 0.17 0.00 -0.60 0.00 0.00 56.93 56.36 1d6e s PHE 68 Cb -0.12 -1.15 1.27 0.00 0.51 0.00 0.00 43.02 43.53 1d6e s PHE 68 CO 0.07 0.64 2.11 -0.22 0.70 0.00 0.00 175.22 178.53 1d6e h LYS 69 N 2.06 0.04 -3.38 0.44 3.64 -0.93 -3.46 116.57 114.98 1d6e h LYS 69 Ca -0.42 -0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 58.90 1d6e h LYS 69 Cb 1.25 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 33.02 1d6e h LYS 69 CO 0.62 0.02 0.07 0.54 -2.27 0.00 0.00 179.45 178.43 1d6e s ASN 70 N -6.86 0.08 0.32 4.20 2.20 -1.26 -5.05 114.94 108.57 1d6e s ASN 70 Ca -0.05 -1.02 0.01 0.00 -0.94 0.00 0.00 52.86 50.86 1d6e s ASN 70 Cb 0.18 0.72 0.53 0.00 -2.00 0.00 0.00 41.25 40.67 1d6e s ASN 70 CO 0.69 -1.39 1.90 0.50 -2.94 0.00 0.00 177.10 175.86 1d6e h LYS 71 N 2.09 0.74 -0.00 3.55 3.64 -1.87 -3.10 116.57 121.62 1d6e h LYS 71 Ca -0.27 -0.12 0.03 0.00 -1.27 0.00 0.00 60.65 59.03 1d6e h LYS 71 Cb 1.25 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 32.90 1d6e h LYS 71 CO 0.35 0.63 -0.20 -0.44 -2.27 0.00 0.00 179.45 177.52 1d6e h ASP 72 N 0.73 -0.58 -0.67 4.20 3.45 -1.96 -1.16 116.42 120.42 1d6e h ASP 72 Ca 0.17 0.08 0.12 0.00 0.43 0.00 0.00 57.03 57.83 1d6e h ASP 72 Cb 0.18 0.24 -0.08 0.00 -0.56 0.00 0.00 39.33 39.11 1d6e h ASP 72 CO -0.01 -0.26 0.25 -0.07 -1.57 0.00 0.00 179.24 177.57 1d6e h LEU 73 N -0.32 0.23 -0.28 1.55 4.07 -1.95 -1.58 115.31 117.03 1d6e h LEU 73 Ca 0.06 0.09 -0.01 0.00 0.08 0.00 0.00 57.88 58.10 1d6e h LEU 73 Cb 0.40 0.08 -0.01 0.00 1.08 0.00 0.00 40.66 42.20 1d6e h LEU 73 CO -0.18 0.11 0.12 0.00 -1.08 0.00 0.00 178.44 177.41 1d6e h ALA 74 N 1.48 0.36 -0.43 1.53 0.00 -1.43 -2.92 119.26 117.85 1d6e h ALA 74 Ca 0.35 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 1d6e h ALA 74 Cb 0.49 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1d6e h ALA 74 CO -0.36 -0.05 0.11 -0.44 0.00 0.00 0.00 179.25 178.51 1d6e h ASP 75 N 0.31 0.58 -0.62 0.00 3.32 -0.73 -1.75 116.42 117.53 1d6e h ASP 75 Ca 0.09 -0.09 0.05 0.00 0.02 0.00 0.00 57.03 57.11 1d6e h ASP 75 Cb 0.16 -0.15 -0.04 0.00 0.22 0.00 0.00 39.33 39.52 1d6e h ASP 75 CO -0.01 0.58 0.41 0.50 -1.72 0.00 0.00 179.24 179.00 1d6e h LYS 76 N 0.62 0.64 -0.02 3.56 3.64 -1.11 -3.14 116.57 120.77 1d6e h LYS 76 Ca 0.14 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 1d6e h LYS 76 Cb 0.23 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 1d6e h LYS 76 CO -0.00 0.42 0.00 0.66 -2.27 0.00 0.00 179.45 178.26 1d6e n TYR 77 N -4.47 0.01 -0.26 1.91 4.02 -1.10 -4.72 117.16 112.55 1d6e n TYR 77 Ca 0.08 -0.01 0.07 0.00 -0.01 0.00 0.00 57.90 58.03 1d6e n TYR 77 Cb 0.20 -0.00 0.20 0.00 -0.02 0.00 0.00 39.34 39.71 1d6e n TYR 77 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 176.86 175.63 1d6e h LYS 78 N 1.82 0.25 -0.35 -0.72 3.64 -1.27 -2.62 116.57 117.31 1d6e h LYS 78 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1d6e h LYS 78 Cb 0.39 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.16 1d6e h LYS 78 CO 0.00 0.16 0.00 -0.25 -2.27 0.00 0.00 179.45 177.09 1d6e n ASP 79 N -5.17 3.38 -4.95 4.20 8.00 -1.26 -4.00 116.55 116.74 1d6e n ASP 79 Ca 0.15 -2.34 -0.24 0.00 0.71 0.00 0.00 54.79 53.07 1d6e n ASP 79 Cb 0.49 -0.36 -0.03 0.00 -0.02 0.00 0.00 41.12 41.21 1d6e n ASP 79 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1d6e s LYS 80 N -1.62 3.45 -0.16 -1.24 1.02 -0.99 -5.02 119.74 115.19 1d6e s LYS 80 Ca 0.32 -0.61 -0.21 0.00 0.02 0.00 0.00 55.97 55.48 1d6e s LYS 80 Cb 0.21 -2.92 -0.03 0.00 -0.52 0.00 0.00 37.83 34.57 1d6e s LYS 80 CO 0.15 0.46 0.64 0.71 -0.92 0.00 0.00 175.35 176.39 1d6e s TYR 81 N -1.86 3.44 0.27 3.18 1.51 -1.26 -4.47 117.35 118.17 1d6e s TYR 81 Ca 0.35 1.02 0.02 0.00 -1.01 0.00 0.00 57.07 57.45 1d6e s TYR 81 Cb -0.10 -2.79 -0.05 0.00 -0.11 0.00 0.00 41.96 38.91 1d6e s TYR 81 CO 0.29 -0.08 0.07 0.14 -1.11 0.00 0.00 175.55 174.87 1d6e s VAL 82 N 1.51 0.80 -0.10 0.71 -7.23 0.15 -1.56 120.40 114.68 1d6e s VAL 82 Ca 0.31 -2.00 -0.02 0.00 -1.81 0.00 0.00 61.98 58.45 1d6e s VAL 82 Cb -0.16 -2.63 -0.03 0.00 0.56 0.00 0.00 36.38 34.11 1d6e s VAL 82 CO 0.12 -0.05 -0.00 -1.81 -0.31 0.00 0.00 175.10 173.04 1d6e s ASP 83 N -3.36 5.16 -0.07 4.85 1.01 0.11 -1.37 116.67 122.99 1d6e s ASP 83 Ca 0.36 0.09 0.05 0.00 0.71 0.00 0.00 52.55 53.75 1d6e s ASP 83 Cb 0.08 -1.54 -0.01 0.00 1.01 0.00 0.00 42.92 42.46 1d6e s ASP 83 CO 0.13 0.33 -0.22 -0.69 0.21 0.00 0.00 175.17 174.94 1d6e s VAL 84 N -0.59 2.33 -0.20 -1.27 1.01 0.04 -1.74 120.40 119.97 1d6e s VAL 84 Ca 0.10 -0.96 -0.09 0.00 0.00 0.00 0.00 61.98 61.04 1d6e s VAL 84 Cb -0.12 -1.89 0.08 0.00 0.00 0.00 0.00 36.38 34.46 1d6e s VAL 84 CO 0.02 0.56 0.45 0.12 0.00 0.00 0.00 175.10 176.26 1d6e s PHE 85 N -0.08 -0.79 0.05 5.22 5.36 -0.18 -1.30 117.98 126.27 1d6e s PHE 85 Ca -0.05 1.55 -0.28 0.00 -0.96 0.00 0.00 56.93 57.18 1d6e s PHE 85 Cb -0.14 0.35 0.10 0.00 -0.34 0.00 0.00 43.02 42.99 1d6e s PHE 85 CO 0.04 -0.45 1.18 0.20 -1.46 0.00 0.00 175.22 174.73 1d6e s GLY 86 N 2.16 -0.30 -0.10 13.12 0.00 -0.80 -4.24 107.32 117.16 1d6e s GLY 86 Ca -0.05 0.41 -0.20 0.00 0.00 0.00 0.00 44.72 44.88 1d6e s GLY 86 CO -0.14 0.69 0.56 0.00 0.00 0.00 0.00 173.10 174.20 1d6e s ALA 87 N -2.61 3.42 0.30 3.20 0.00 -1.26 -1.21 121.76 123.61 1d6e s ALA 87 Ca 0.15 -0.07 0.09 0.00 0.00 0.00 0.00 51.96 52.13 1d6e s ALA 87 Cb 0.02 -2.76 -0.05 0.00 0.00 0.00 0.00 23.12 20.34 1d6e s ALA 87 CO -0.01 -0.03 0.02 0.54 0.00 0.00 0.00 175.76 176.27 1d6e s ASN 88 N 0.68 4.40 0.09 0.00 4.22 -1.26 -4.61 114.94 118.45 1d6e s ASN 88 Ca 0.30 -0.80 0.01 0.00 -2.14 0.00 0.00 52.86 50.23 1d6e s ASN 88 Cb -0.16 -0.69 -0.04 0.00 1.28 0.00 0.00 41.25 41.64 1d6e s ASN 88 CO 0.13 -0.13 -0.06 -0.72 -2.04 0.00 0.00 177.10 174.28 1d6e s TYR 89 N -2.42 0.82 -0.03 1.54 -0.85 -0.68 -4.84 117.35 110.89 1d6e s TYR 89 Ca 0.34 -0.93 0.00 0.00 -0.52 0.00 0.00 57.07 55.96 1d6e s TYR 89 Cb -0.04 -0.49 -0.02 0.00 0.38 0.00 0.00 41.96 41.80 1d6e s TYR 89 CO 0.20 -0.19 -0.03 0.66 -1.52 0.00 0.00 175.55 174.68 1d6e n TYR 90 N 0.03 0.00 -1.84 -3.49 4.02 -1.26 -1.93 117.16 112.68 1d6e n TYR 90 Ca -0.13 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.34 1d6e n TYR 90 Cb 0.61 -0.11 -0.03 0.00 -0.02 0.00 0.00 39.34 39.79 1d6e n TYR 90 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 176.86 175.38 1d6e s TYR 91 N -2.06 1.82 -0.19 -0.72 5.04 -1.26 -1.75 117.35 118.23 1d6e s TYR 91 Ca -0.04 -0.04 0.00 0.00 -2.44 0.00 0.00 57.07 54.55 1d6e s TYR 91 Cb 0.01 -4.07 0.00 0.00 0.35 0.00 0.00 41.96 38.25 1d6e s TYR 91 CO 0.06 -4.58 0.00 1.04 -1.34 0.00 0.00 175.55 170.73 1d6e n GLN 92 N 6.85 -0.13 -3.31 4.97 1.13 -1.26 -4.76 117.38 120.87 1d6e n GLN 92 Ca 0.18 0.48 -0.42 0.00 -1.94 0.00 0.00 57.00 55.29 1d6e n GLN 92 Cb 0.41 -4.06 -0.09 0.00 0.11 0.00 0.00 30.24 26.62 1d6e n GLN 92 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1d6e s TYR 94 N 2.19 0.79 0.00 0.00 1.51 -1.26 -4.98 117.35 115.61 1d6e s TYR 94 Ca 0.13 -0.23 0.00 0.00 -1.01 0.00 0.00 57.07 55.96 1d6e s TYR 94 Cb -0.17 -0.49 0.00 0.00 -0.11 0.00 0.00 41.96 41.19 1d6e s TYR 94 CO 0.14 -0.01 0.00 1.97 -1.11 0.00 0.00 175.55 176.53 1d6e n PHE 95 N 2.47 0.00 -3.54 2.71 1.16 -1.26 -5.09 117.46 113.91 1d6e n PHE 95 Ca -0.16 0.00 -0.18 0.00 -1.87 0.00 0.00 57.45 55.25 1d6e n PHE 95 Cb 0.56 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 38.37 1d6e n PHE 95 CO 0.00 0.00 0.00 -1.54 -1.87 0.00 0.00 176.76 173.35 1d6e s SER 96 N 0.00 -0.65 0.00 5.98 1.04 -1.26 -5.15 113.70 113.66 1d6e s SER 96 Ca 0.00 0.75 0.00 0.00 0.48 0.00 0.00 55.95 57.18 1d6e s SER 96 Cb 0.00 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.72 1d6e s SER 96 CO 0.00 -0.58 0.00 2.29 0.98 0.00 0.00 173.24 175.93 1d6e n LYS 97 N 1.06 0.00 -0.94 4.02 2.85 -1.26 -4.58 118.16 119.31 1d6e n LYS 97 Ca -0.19 0.00 -0.04 0.00 -1.05 0.00 0.00 58.31 57.04 1d6e n LYS 97 Cb 0.57 0.00 -0.04 0.00 -0.65 0.00 0.00 35.03 34.91 1d6e n LYS 97 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 1d6e n LYS 98 N 0.00 0.00 -0.08 -1.58 4.01 -1.26 -5.05 118.16 114.21 1d6e n LYS 98 Ca 0.00 -0.93 -0.04 0.00 -0.51 0.00 0.00 58.31 56.83 1d6e n LYS 98 Cb 0.00 0.28 0.03 0.00 -0.51 0.00 0.00 35.03 34.83 1d6e n LYS 98 CO 0.00 0.00 0.00 -2.13 -1.11 0.00 0.00 177.40 174.16 1d6e n ARG 110 N 0.07 -1.77 -4.17 1.97 0.00 -1.26 -5.22 116.66 106.28 1d6e n ARG 110 Ca -0.16 -0.19 -0.11 0.00 -0.00 0.00 0.00 57.85 57.39 1d6e n ARG 110 Cb 0.72 -0.21 -0.10 0.00 0.00 0.00 0.00 32.46 32.87 1d6e n ARG 110 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.63 176.04 1d6e s LYS 111 N -3.27 1.04 0.15 -0.14 -2.85 -1.26 -2.60 119.74 110.80 1d6e s LYS 111 Ca 0.08 -1.52 0.00 0.00 -1.00 0.00 0.00 55.97 53.53 1d6e s LYS 111 Cb -0.01 0.24 -0.04 0.00 -2.06 0.00 0.00 37.83 35.95 1d6e s LYS 111 CO 0.07 -0.31 0.04 -0.08 0.10 0.00 0.00 175.35 175.16 1d6e s THR 112 N -4.08 0.32 0.12 3.79 -1.32 -1.06 -4.87 115.64 108.54 1d6e s THR 112 Ca 0.30 -1.94 0.03 0.00 -1.21 0.00 0.00 61.69 58.88 1d6e s THR 112 Cb 0.07 -2.07 -0.04 0.00 -1.51 0.00 0.00 72.50 68.95 1d6e s THR 112 CO 0.06 -0.47 -0.08 0.00 -2.21 0.00 0.00 174.62 171.92 1d6e s MET 114 N -3.79 1.42 -0.02 0.00 0.23 -0.37 -1.69 119.30 115.08 1d6e s MET 114 Ca 0.15 -0.88 0.05 0.00 -1.03 0.00 0.00 55.69 53.98 1d6e s MET 114 Cb 0.04 0.42 -0.01 0.00 -1.53 0.00 0.00 34.83 33.75 1d6e s MET 114 CO -0.02 -0.66 -0.16 0.71 -2.03 0.00 0.00 175.02 172.87 1d6e s TYR 115 N -2.56 1.44 0.00 3.16 1.51 -1.26 -1.65 117.35 117.99 1d6e s TYR 115 Ca 0.18 -0.31 0.00 0.00 -1.01 0.00 0.00 57.07 55.92 1d6e s TYR 115 Cb -0.03 -0.95 0.00 0.00 -0.11 0.00 0.00 41.96 40.88 1d6e s TYR 115 CO 0.05 -0.06 0.00 0.41 -1.11 0.00 0.00 175.55 174.84 1d6e n GLY 116 N 2.85 2.87 2.32 0.71 0.00 -0.96 -4.56 105.19 108.41 1d6e n GLY 116 Ca -0.16 -0.23 -0.10 0.00 0.00 0.00 0.00 46.02 45.54 1d6e n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1d6e n GLY 117 N 0.00 1.14 3.43 -0.02 0.00 -1.26 -4.82 105.19 103.66 1d6e n GLY 117 Ca 0.00 -0.51 -0.35 0.00 0.00 0.00 0.00 46.02 45.16 1d6e n GLY 117 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1d6e s VAL 118 N -2.34 3.83 -0.02 1.61 1.01 -1.26 -1.01 120.40 122.23 1d6e s VAL 118 Ca 0.00 -0.36 0.04 0.00 0.00 0.00 0.00 61.98 61.66 1d6e s VAL 118 Cb 0.00 -2.72 -0.01 0.00 0.00 0.00 0.00 36.38 33.65 1d6e s VAL 118 CO 0.00 0.44 -0.14 0.42 0.00 0.00 0.00 175.10 175.82 1d6e s THR 119 N 0.93 1.12 0.25 3.92 -4.23 -0.71 -4.97 115.64 111.95 1d6e s THR 119 Ca 0.01 -0.60 -0.30 0.00 -1.18 0.00 0.00 61.69 59.62 1d6e s THR 119 Cb -0.14 -0.94 -0.10 0.00 1.34 0.00 0.00 72.50 72.65 1d6e s THR 119 CO 0.02 0.32 1.51 -0.70 -0.54 0.00 0.00 174.62 175.23 1d6e s GLU 120 N -0.25 4.21 0.00 3.99 2.12 -1.26 0.04 118.70 127.55 1d6e s GLU 120 Ca 0.04 2.40 -0.04 0.00 0.36 0.00 0.00 54.97 57.73 1d6e s GLU 120 Cb -0.06 -3.09 -0.02 0.00 0.26 0.00 0.00 34.13 31.21 1d6e s GLU 120 CO -0.00 -0.52 0.74 1.25 -0.54 0.00 0.00 175.26 176.19 1d6e h HIS 121 N 5.26 -0.14 -1.89 5.30 -0.00 -1.58 -3.41 115.15 118.68 1d6e h HIS 121 Ca -0.46 -0.00 -0.65 0.00 -0.00 0.00 0.00 60.37 59.25 1d6e h HIS 121 Cb 1.22 0.05 0.08 0.00 -0.00 0.00 0.00 27.41 28.75 1d6e h HIS 121 CO 0.60 -0.09 0.28 -1.71 -0.00 0.00 0.00 177.93 177.02 1d6e n ASN 122 N -2.57 1.34 0.00 3.26 2.85 -1.26 -1.55 115.26 117.32 1d6e n ASN 122 Ca -0.02 1.14 0.00 0.00 -0.11 0.00 0.00 54.58 55.59 1d6e n ASN 122 Cb 0.06 -1.21 0.00 0.00 1.24 0.00 0.00 39.78 39.88 1d6e n ASN 122 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1d6e n GLY 123 N 2.07 0.32 0.48 8.20 0.00 -1.26 -4.81 105.19 110.19 1d6e n GLY 123 Ca 0.16 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.23 1d6e n GLY 123 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1d6e n ASN 124 N -0.35 2.13 -4.90 1.61 5.15 -0.60 -4.92 115.26 113.37 1d6e n ASN 124 Ca 0.00 -1.57 -0.28 0.00 -0.60 0.00 0.00 54.58 52.13 1d6e n ASN 124 Cb 0.18 -0.05 -0.02 0.00 -0.53 0.00 0.00 39.78 39.35 1d6e n ASN 124 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1d6e s GLN 125 N -0.93 3.62 0.07 1.20 -1.52 -1.26 -1.39 119.66 119.45 1d6e s GLN 125 Ca 0.15 0.07 0.06 0.00 -1.95 0.00 0.00 55.36 53.69 1d6e s GLN 125 Cb 0.10 -2.56 -0.03 0.00 -0.22 0.00 0.00 33.01 30.30 1d6e s GLN 125 CO 0.14 0.10 -0.17 -0.51 -0.25 0.00 0.00 175.29 174.60 1d6e s LEU 126 N -3.89 2.24 0.23 2.90 1.43 -0.76 -4.80 118.68 116.03 1d6e s LEU 126 Ca 0.45 -0.59 0.03 0.00 -1.03 0.00 0.00 54.13 52.99 1d6e s LEU 126 Cb -0.10 -0.70 0.22 0.00 0.03 0.00 0.00 46.19 45.64 1d6e s LEU 126 CO 0.33 0.02 1.55 0.44 0.23 0.00 0.00 176.35 178.92 1d6e h ASP 127 N 4.46 0.35 -3.72 2.29 5.19 -2.00 -3.45 116.42 119.55 1d6e h ASP 127 Ca -0.42 -0.20 -0.41 0.00 -0.62 0.00 0.00 57.03 55.38 1d6e h ASP 127 Cb 1.18 -0.10 -0.16 0.00 0.18 0.00 0.00 39.33 40.43 1d6e h ASP 127 CO 0.41 0.86 -0.74 -0.54 -3.12 0.00 0.00 179.24 176.11 1d6e s LYS 128 N -3.83 1.15 0.25 3.56 1.02 -1.26 -5.13 119.74 115.51 1d6e s LYS 128 Ca -0.05 -1.41 -0.30 0.00 0.02 0.00 0.00 55.97 54.23 1d6e s LYS 128 Cb 0.12 -0.94 -0.09 0.00 -0.52 0.00 0.00 37.83 36.39 1d6e s LYS 128 CO 0.81 0.16 1.15 0.71 -0.92 0.00 0.00 175.35 177.26 1d6e s TYR 129 N -2.67 3.48 0.07 3.18 1.51 -1.26 -4.79 117.35 116.88 1d6e s TYR 129 Ca 0.16 1.59 -0.00 0.00 -1.01 0.00 0.00 57.07 57.80 1d6e s TYR 129 Cb -0.02 -3.37 -0.04 0.00 -0.11 0.00 0.00 41.96 38.43 1d6e s TYR 129 CO 0.04 -0.87 0.22 0.50 -1.11 0.00 0.00 175.55 174.34 1d6e s ARG 130 N -1.08 3.45 -0.15 -0.62 3.52 -0.52 -4.92 118.95 118.62 1d6e s ARG 130 Ca 0.47 -0.43 -0.03 0.00 -0.13 0.00 0.00 55.73 55.61 1d6e s ARG 130 Cb -0.33 -3.02 -0.03 0.00 -1.56 0.00 0.00 34.95 30.01 1d6e s ARG 130 CO 0.41 0.60 -0.04 -1.12 -0.81 0.00 0.00 175.30 174.33 1d6e s SER 131 N -2.56 4.75 -0.20 -2.12 0.01 -1.26 -2.45 113.70 109.87 1d6e s SER 131 Ca 0.35 -0.13 -0.03 0.00 1.31 0.00 0.00 55.95 57.45 1d6e s SER 131 Cb -0.13 -1.75 -0.01 0.00 0.21 0.00 0.00 66.02 64.34 1d6e s SER 131 CO 0.28 0.18 -0.06 -0.63 0.41 0.00 0.00 173.24 173.42 1d6e s ILE 132 N 0.31 3.33 0.14 1.44 1.01 -0.30 -4.95 121.20 122.18 1d6e s ILE 132 Ca -0.04 -0.52 -0.25 0.00 0.00 0.00 0.00 60.65 59.84 1d6e s ILE 132 Cb -0.14 -2.49 -0.07 0.00 0.01 0.00 0.00 42.46 39.76 1d6e s ILE 132 CO 0.03 0.45 0.78 0.42 0.00 0.00 0.00 174.94 176.61 1d6e s THR 133 N 1.22 4.46 -0.14 2.92 -4.23 -1.26 -1.64 115.64 116.98 1d6e s THR 133 Ca 0.03 1.69 0.00 0.00 -1.18 0.00 0.00 61.69 62.23 1d6e s THR 133 Cb -0.14 -4.14 -0.01 0.00 1.34 0.00 0.00 72.50 69.55 1d6e s THR 133 CO -0.02 0.48 -0.14 -0.69 -0.54 0.00 0.00 174.62 173.71 1d6e s VAL 134 N -0.86 2.87 -0.21 2.29 1.01 0.97 -2.16 120.40 124.32 1d6e s VAL 134 Ca 0.37 -0.72 -0.03 0.00 0.00 0.00 0.00 61.98 61.60 1d6e s VAL 134 Cb -0.22 -2.21 -0.01 0.00 0.00 0.00 0.00 36.38 33.94 1d6e s VAL 134 CO 0.26 0.52 -0.07 -0.13 0.00 0.00 0.00 175.10 175.68 1d6e s ARG 135 N 0.53 3.34 -0.19 2.72 0.52 -0.09 -1.77 118.95 124.01 1d6e s ARG 135 Ca -0.09 -0.65 -0.09 0.00 -0.52 0.00 0.00 55.73 54.37 1d6e s ARG 135 Cb -0.16 -2.93 -0.05 0.00 0.52 0.00 0.00 34.95 32.34 1d6e s ARG 135 CO 0.04 -0.15 0.12 0.08 0.02 0.00 0.00 175.30 175.40 1d6e s VAL 136 N 1.33 5.30 -0.13 3.52 1.01 0.33 -1.51 120.40 130.25 1d6e s VAL 136 Ca 0.04 0.15 0.01 0.00 0.00 0.00 0.00 61.98 62.18 1d6e s VAL 136 Cb -0.14 -3.41 -0.01 0.00 0.00 0.00 0.00 36.38 32.82 1d6e s VAL 136 CO -0.03 0.45 -0.17 -0.36 0.00 0.00 0.00 175.10 174.99 1d6e s PHE 137 N 0.31 2.73 -0.25 5.22 0.40 0.78 -3.32 117.98 123.85 1d6e s PHE 137 Ca 0.07 -0.88 -0.00 0.00 -0.60 0.00 0.00 56.93 55.52 1d6e s PHE 137 Cb -0.11 -1.82 0.04 0.00 0.51 0.00 0.00 43.02 41.64 1d6e s PHE 137 CO -0.01 -0.35 -0.08 -1.21 0.70 0.00 0.00 175.22 174.26 1d6e s GLU 138 N 0.48 2.66 -1.49 0.44 2.02 -0.20 0.40 118.70 123.02 1d6e s GLU 138 Ca -0.12 -1.08 -0.06 0.00 0.02 0.00 0.00 54.97 53.73 1d6e s GLU 138 Cb -0.16 -2.93 0.02 0.00 0.10 0.00 0.00 34.13 31.16 1d6e s GLU 138 CO 0.05 -0.44 0.67 -0.25 0.02 0.00 0.00 175.26 175.31 1d6e n ASP 139 N 4.60 -5.67 0.00 -0.19 8.00 0.12 -1.91 116.55 121.50 1d6e n ASP 139 Ca -0.16 -0.36 0.00 0.00 0.71 0.00 0.00 54.79 54.98 1d6e n ASP 139 Cb 0.46 -4.58 0.00 0.00 -0.02 0.00 0.00 41.12 36.98 1d6e n ASP 139 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1d6e n GLY 140 N -1.53 2.14 3.78 0.44 0.00 -1.26 -5.03 105.19 103.73 1d6e n GLY 140 Ca -0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.59 1d6e n GLY 140 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d6e s LYS 141 N -0.30 3.94 -1.02 1.61 -0.14 -0.80 -5.00 119.74 118.02 1d6e s LYS 141 Ca 0.00 -0.16 -0.19 0.00 -1.36 0.00 0.00 55.97 54.27 1d6e s LYS 141 Cb 0.00 -3.34 0.11 0.00 -1.68 0.00 0.00 37.83 32.93 1d6e s LYS 141 CO 0.00 0.47 1.30 1.21 -0.76 0.00 0.00 175.35 177.56 1d6e s ASN 142 N -0.13 6.69 0.17 2.83 3.04 -1.26 -1.04 114.94 125.24 1d6e s ASN 142 Ca 0.11 -2.10 0.23 0.00 0.04 0.00 0.00 52.86 51.14 1d6e s ASN 142 Cb -0.12 -2.45 0.04 0.00 -1.54 0.00 0.00 41.25 37.18 1d6e s ASN 142 CO 0.01 -1.12 1.05 0.18 -3.04 0.00 0.00 177.10 174.18 1d6e n LEU 143 N 7.07 0.76 -3.85 3.21 4.32 -1.21 -4.92 117.00 122.38 1d6e n LEU 143 Ca 0.30 0.27 -0.12 0.00 -0.02 0.00 0.00 56.01 56.43 1d6e n LEU 143 Cb 0.48 -0.08 -0.14 0.00 -1.62 0.00 0.00 43.42 42.07 1d6e n LEU 143 CO 0.58 -0.14 -0.32 -0.22 -1.22 0.00 0.00 177.39 176.07 1d6e s LEU 144 N -5.02 1.74 -0.08 2.23 2.96 -1.25 -5.08 118.68 114.18 1d6e s LEU 144 Ca 0.00 0.08 -0.04 0.00 -0.22 0.00 0.00 54.13 53.96 1d6e s LEU 144 Cb 0.11 0.13 0.04 0.00 0.50 0.00 0.00 46.19 46.96 1d6e s LEU 144 CO 0.79 -0.03 0.19 -0.44 -1.32 0.00 0.00 176.35 175.54 1d6e s SER 145 N 0.16 -0.18 0.30 3.68 0.01 -1.26 -0.51 113.70 115.89 1d6e s SER 145 Ca -0.01 0.40 -0.00 0.00 1.31 0.00 0.00 55.95 57.64 1d6e s SER 145 Cb -0.02 0.30 -0.02 0.00 0.21 0.00 0.00 66.02 66.50 1d6e s SER 145 CO -0.00 -0.14 0.35 0.72 0.41 0.00 0.00 173.24 174.57 1d6e s PHE 146 N 1.06 1.21 0.12 2.43 -0.71 -0.73 -4.99 117.98 116.36 1d6e s PHE 146 Ca -0.08 -1.36 0.10 0.00 -1.04 0.00 0.00 56.93 54.56 1d6e s PHE 146 Cb -0.10 -0.33 -0.04 0.00 -1.21 0.00 0.00 43.02 41.35 1d6e s PHE 146 CO -0.06 -0.95 -0.25 -0.51 -1.34 0.00 0.00 175.22 172.11 1d6e s ASP 147 N -3.24 3.46 0.17 1.98 1.01 -1.26 -0.02 116.67 118.77 1d6e s ASP 147 Ca 0.34 -0.69 0.11 0.00 0.71 0.00 0.00 52.55 53.03 1d6e s ASP 147 Cb 0.02 -0.31 -0.04 0.00 1.01 0.00 0.00 42.92 43.60 1d6e s ASP 147 CO 0.20 0.19 -0.24 0.68 0.21 0.00 0.00 175.17 176.20 1d6e s VAL 148 N -1.06 2.27 0.14 -1.27 -7.23 -0.65 -4.93 120.40 107.68 1d6e s VAL 148 Ca 0.15 -1.94 0.10 0.00 -1.81 0.00 0.00 61.98 58.48 1d6e s VAL 148 Cb -0.10 -2.06 -0.04 0.00 0.56 0.00 0.00 36.38 34.74 1d6e s VAL 148 CO 0.07 -0.08 -0.22 -1.10 -0.31 0.00 0.00 175.10 173.46 1d6e s GLN 149 N -2.50 1.60 -0.08 4.82 1.11 -1.26 -1.15 119.66 122.20 1d6e s GLN 149 Ca 0.18 -1.32 -0.23 0.00 0.01 0.00 0.00 55.36 54.00 1d6e s GLN 149 Cb -0.08 -1.98 0.05 0.00 -1.01 0.00 0.00 33.01 29.99 1d6e s GLN 149 CO 0.08 0.45 0.54 -0.08 0.01 0.00 0.00 175.29 176.29 1d6e s THR 150 N -1.26 0.02 -0.25 -0.19 -1.32 -1.02 -4.98 115.64 106.63 1d6e s THR 150 Ca 0.17 -0.14 0.10 0.00 -1.21 0.00 0.00 61.69 60.62 1d6e s THR 150 Cb -0.10 -0.83 0.47 0.00 -1.51 0.00 0.00 72.50 70.54 1d6e s THR 150 CO 0.09 -0.08 1.38 -0.46 -2.21 0.00 0.00 174.62 173.34 1d6e n ASN 151 N 1.54 2.35 -4.54 8.08 6.94 -1.26 -1.44 115.26 126.92 1d6e n ASN 151 Ca -0.18 -3.73 -0.34 0.00 -0.02 0.00 0.00 54.58 50.31 1d6e n ASN 151 Cb 0.56 -0.59 -0.12 0.00 -2.36 0.00 0.00 39.78 37.28 1d6e n ASN 151 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1d6e s LYS 152 N -3.20 2.72 0.09 -3.83 1.02 -1.26 -1.83 119.74 113.46 1d6e s LYS 152 Ca 0.42 -0.59 -0.15 0.00 0.02 0.00 0.00 55.97 55.67 1d6e s LYS 152 Cb 0.39 -2.54 -0.11 0.00 -0.52 0.00 0.00 37.83 35.05 1d6e s LYS 152 CO -0.01 0.63 1.38 0.87 -0.92 0.00 0.00 175.35 177.29 1d6e h LYS 153 N 5.36 0.71 -4.95 1.68 1.57 -1.54 -3.41 116.57 115.98 1d6e h LYS 153 Ca -0.47 -0.43 -0.67 0.00 -1.87 0.00 0.00 60.65 57.22 1d6e h LYS 153 Cb 1.17 0.04 -0.32 0.00 0.08 0.00 0.00 32.23 33.20 1d6e h LYS 153 CO 0.52 1.05 -0.77 0.15 -0.57 0.00 0.00 179.45 179.83 1d6e s LYS 154 N -4.17 2.90 0.09 3.15 -0.14 -1.26 -1.16 119.74 119.16 1d6e s LYS 154 Ca -0.12 -0.92 0.09 0.00 -1.36 0.00 0.00 55.97 53.66 1d6e s LYS 154 Cb 0.08 -2.89 -0.04 0.00 -1.68 0.00 0.00 37.83 33.31 1d6e s LYS 154 CO 0.84 -0.34 -0.23 0.14 -0.76 0.00 0.00 175.35 175.00 1d6e s VAL 155 N 1.32 2.47 0.53 3.17 -7.23 -0.82 -4.92 120.40 114.92 1d6e s VAL 155 Ca 0.01 -1.52 -0.20 0.00 -1.81 0.00 0.00 61.98 58.47 1d6e s VAL 155 Cb -0.16 -2.07 -0.07 0.00 0.56 0.00 0.00 36.38 34.65 1d6e s VAL 155 CO -0.06 0.20 1.09 0.42 -0.31 0.00 0.00 175.10 176.43 1d6e s THR 156 N -1.00 3.43 0.42 5.32 -4.23 -1.26 -0.51 115.64 117.80 1d6e s THR 156 Ca 0.15 0.88 0.10 0.00 -1.18 0.00 0.00 61.69 61.64 1d6e s THR 156 Cb -0.10 -3.35 0.20 0.00 1.34 0.00 0.00 72.50 70.58 1d6e s THR 156 CO 0.06 -0.20 1.98 0.00 -0.54 0.00 0.00 174.62 175.92 1d6e h ALA 157 N 1.29 1.63 -0.10 3.99 0.00 -1.66 -2.79 119.26 121.62 1d6e h ALA 157 Ca -0.50 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 54.32 1d6e h ALA 157 Cb 1.24 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.90 1d6e h ALA 157 CO 0.58 0.27 -0.22 0.37 0.00 0.00 0.00 179.25 180.25 1d6e h GLN 158 N 0.23 -0.29 -0.73 0.00 4.15 -1.90 0.47 115.11 117.04 1d6e h GLN 158 Ca 0.05 0.02 0.06 0.00 0.77 0.00 0.00 58.65 59.55 1d6e h GLN 158 Cb 0.24 0.07 -0.06 0.00 0.21 0.00 0.00 27.48 27.94 1d6e h GLN 158 CO 0.01 -0.19 0.42 1.49 -1.93 0.00 0.00 178.83 178.63 1d6e h GLU 159 N -0.30 0.76 -0.21 1.69 4.81 -1.75 0.18 114.58 119.76 1d6e h GLU 159 Ca 0.09 -0.05 -0.13 0.00 -0.13 0.00 0.00 59.36 59.14 1d6e h GLU 159 Cb 0.43 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 1d6e h GLU 159 CO -0.27 0.50 -0.43 -0.07 -0.73 0.00 0.00 179.01 178.01 1d6e h LEU 160 N 0.78 0.56 -0.40 1.64 3.38 -1.35 -1.05 115.31 118.87 1d6e h LEU 160 Ca 0.32 -0.25 -0.06 0.00 0.09 0.00 0.00 57.88 57.98 1d6e h LEU 160 Cb 0.18 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 1d6e h LEU 160 CO -0.18 0.92 0.03 -0.78 0.09 0.00 0.00 178.44 178.52 1d6e h ASP 161 N 0.43 0.66 -0.19 -0.43 3.58 0.75 -1.32 116.42 119.89 1d6e h ASP 161 Ca 0.03 -0.29 -0.01 0.00 0.42 0.00 0.00 57.03 57.18 1d6e h ASP 161 Cb 0.93 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 41.79 1d6e h ASP 161 CO 0.08 0.78 0.07 0.22 -2.88 0.00 0.00 179.24 177.52 1d6e h TYR 162 N 0.52 0.29 -0.36 0.28 3.20 -0.46 0.26 116.97 120.70 1d6e h TYR 162 Ca 0.12 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.96 1d6e h TYR 162 Cb 0.43 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.59 1d6e h TYR 162 CO 0.03 0.35 0.23 -0.07 -1.64 0.00 0.00 178.16 177.05 1d6e h LEU 163 N 0.15 0.42 -0.25 2.82 3.38 -1.15 0.94 115.31 121.63 1d6e h LEU 163 Ca 0.06 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1d6e h LEU 163 Cb 0.18 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1d6e h LEU 163 CO -0.00 0.33 0.12 0.74 0.09 0.00 0.00 178.44 179.71 1d6e h THR 164 N 0.48 1.15 -0.39 0.22 2.02 -1.09 -2.49 112.91 112.81 1d6e h THR 164 Ca 0.13 -0.42 -0.13 0.00 0.77 0.00 0.00 66.41 66.75 1d6e h THR 164 Cb -0.02 0.98 -0.01 0.00 -1.74 0.00 0.00 68.15 67.35 1d6e h THR 164 CO -0.03 0.15 -0.29 0.03 0.37 0.00 0.00 175.52 175.75 1d6e h ARG 165 N 0.26 0.83 -0.74 6.66 3.08 -0.79 -2.58 114.38 121.11 1d6e h ARG 165 Ca 0.08 -0.38 0.00 0.00 0.07 0.00 0.00 59.98 59.76 1d6e h ARG 165 Cb 0.13 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.12 1d6e h ARG 165 CO -0.01 1.01 0.47 1.25 -1.07 0.00 0.00 179.97 181.62 1d6e h HIS 166 N 0.71 0.95 -0.49 3.04 2.76 -0.71 0.25 115.15 121.67 1d6e h HIS 166 Ca 0.08 0.01 -0.07 0.00 -2.20 0.00 0.00 60.37 58.20 1d6e h HIS 166 Cb 0.83 -0.32 -0.02 0.00 1.55 0.00 0.00 27.41 29.46 1d6e h HIS 166 CO 0.05 0.62 0.04 -0.92 -1.30 0.00 0.00 177.93 176.41 1d6e h TYR 167 N 1.01 0.90 0.00 5.26 3.20 -1.28 -2.84 116.97 123.21 1d6e h TYR 167 Ca 0.27 -0.14 -0.06 0.00 3.14 0.00 0.00 58.73 61.93 1d6e h TYR 167 Cb -0.08 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 37.94 1d6e h TYR 167 CO 0.00 0.84 -0.31 -0.07 -1.64 0.00 0.00 178.16 176.98 1d6e h LEU 168 N 0.70 0.00 -0.07 2.82 3.38 -0.87 -0.61 115.31 120.66 1d6e h LEU 168 Ca 0.14 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 1d6e h LEU 168 Cb 0.46 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 1d6e h LEU 168 CO 0.02 0.31 -0.03 0.58 0.09 0.00 0.00 178.44 179.40 1d6e h VAL 169 N 0.00 1.32 -0.30 1.22 2.07 -0.83 0.28 116.25 120.01 1d6e h VAL 169 Ca -0.00 -1.04 -0.03 0.00 0.82 0.00 0.00 66.70 66.45 1d6e h VAL 169 Cb 0.66 1.88 -0.01 0.00 -1.52 0.00 0.00 31.29 32.29 1d6e h VAL 169 CO 0.04 0.29 0.07 0.11 0.02 0.00 0.00 177.57 178.10 1d6e h LYS 170 N -0.23 0.48 0.00 1.57 1.57 -1.32 -2.51 116.57 116.13 1d6e h LYS 170 Ca 0.02 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1d6e h LYS 170 Cb 0.47 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.72 1d6e h LYS 170 CO 0.01 0.56 -1.60 0.09 -0.57 0.00 0.00 179.45 177.94 1d6e n ASN 171 N -4.67 0.33 0.00 0.86 3.02 -0.25 -4.51 115.26 110.04 1d6e n ASN 171 Ca -0.02 -0.08 0.00 0.00 -0.03 0.00 0.00 54.58 54.45 1d6e n ASN 171 Cb 0.19 1.48 0.00 0.00 -0.61 0.00 0.00 39.78 40.84 1d6e n ASN 171 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1d6e n LYS 172 N -2.21 1.43 -3.88 3.52 4.76 0.92 -5.00 118.16 117.69 1d6e n LYS 172 Ca -0.02 -0.98 -0.30 0.00 -2.87 0.00 0.00 58.31 54.13 1d6e n LYS 172 Cb 0.52 -0.83 0.02 0.00 -1.84 0.00 0.00 35.03 32.90 1d6e n LYS 172 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1d6e n LYS 173 N -0.26 -5.05 -0.32 1.97 4.76 -0.80 -4.82 118.16 113.65 1d6e n LYS 173 Ca 0.00 0.57 0.08 0.00 -2.87 0.00 0.00 58.31 56.09 1d6e n LYS 173 Cb 0.29 -5.43 0.19 0.00 -1.84 0.00 0.00 35.03 28.24 1d6e n LYS 173 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 1d6e h LEU 174 N -1.90 -0.62 -8.13 -0.35 5.85 -1.56 -3.38 115.31 105.21 1d6e h LEU 174 Ca -0.57 0.26 -0.52 0.00 0.84 0.00 0.00 57.88 57.90 1d6e h LEU 174 Cb 1.37 0.50 -0.31 0.00 0.37 0.00 0.00 40.66 42.58 1d6e h LEU 174 CO 0.67 -0.30 -0.82 -0.31 -0.34 0.00 0.00 178.44 177.35 1d6e s TYR 175 N -6.14 1.45 0.54 1.25 4.12 -1.26 -4.49 117.35 112.82 1d6e s TYR 175 Ca -0.14 -0.41 0.02 0.00 0.02 0.00 0.00 57.07 56.57 1d6e s TYR 175 Cb 0.26 -0.99 0.02 0.00 -1.52 0.00 0.00 41.96 39.72 1d6e s TYR 175 CO 0.77 -0.15 0.17 -1.21 0.02 0.00 0.00 175.55 175.15 1d6e s GLU 176 N 0.12 2.23 0.14 -0.62 2.02 -0.56 -4.92 118.70 117.11 1d6e s GLU 176 Ca -0.04 -2.28 -0.17 0.00 0.02 0.00 0.00 54.97 52.49 1d6e s GLU 176 Cb -0.11 -1.75 0.01 0.00 0.10 0.00 0.00 34.13 32.38 1d6e s GLU 176 CO 0.02 -0.51 1.77 0.35 0.02 0.00 0.00 175.26 176.91 1d6e h PHE 177 N 1.05 0.29 0.00 1.61 3.57 -1.96 -3.18 116.94 118.32 1d6e h PHE 177 Ca -0.41 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.10 1d6e h PHE 177 Cb 1.32 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.97 1d6e h PHE 177 CO 1.38 0.16 -0.40 -0.91 -2.23 0.00 0.00 178.31 176.31 1d6e h ASN 178 N 0.33 0.00 -0.02 0.41 4.21 -1.93 -1.01 115.58 117.58 1d6e h ASN 178 Ca 0.13 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.64 1d6e h ASN 178 Cb 0.04 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.24 1d6e h ASN 178 CO -0.09 0.62 0.00 -3.20 -1.29 0.00 0.00 177.43 173.47 1d6e n ASN 179 N -4.23 0.04 -4.11 5.81 2.85 -1.26 -1.15 115.26 113.21 1d6e n ASN 179 Ca -0.06 0.00 -0.16 0.00 -0.11 0.00 0.00 54.58 54.25 1d6e n ASN 179 Cb 0.21 0.00 -0.12 0.00 1.24 0.00 0.00 39.78 41.11 1d6e n ASN 179 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 1d6e s SER 180 N 1.00 1.29 0.00 1.20 0.15 -1.26 -1.50 113.70 114.57 1d6e s SER 180 Ca 0.00 -0.54 0.18 0.00 0.70 0.00 0.00 55.95 56.29 1d6e s SER 180 Cb 0.00 -0.02 0.88 0.00 -1.71 0.00 0.00 66.02 65.16 1d6e s SER 180 CO 0.00 -0.11 1.56 -0.81 1.20 0.00 0.00 173.24 175.08 1d6e n PRO 181 N 1.52 0.19 -4.41 5.44 -0.04 -1.26 -4.71 135.00 131.73 1d6e n PRO 181 Ca -0.21 0.14 -0.31 0.00 -0.04 0.00 0.00 63.50 63.08 1d6e n PRO 181 Cb 0.55 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.40 1d6e n PRO 181 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1d6e s TYR 182 N -2.69 2.72 -0.18 0.54 1.51 -1.26 -3.50 117.35 114.49 1d6e s TYR 182 Ca 0.15 -0.15 -0.25 0.00 -1.01 0.00 0.00 57.07 55.81 1d6e s TYR 182 Cb 0.12 -1.49 -0.22 0.00 -0.11 0.00 0.00 41.96 40.26 1d6e s TYR 182 CO 0.29 0.36 0.45 1.49 -1.11 0.00 0.00 175.55 177.04 1d6e h GLU 183 N 4.12 0.00 -5.12 -0.62 4.57 -1.28 -3.41 114.58 112.84 1d6e h GLU 183 Ca -0.48 -0.01 -0.34 0.00 -1.18 0.00 0.00 59.36 57.35 1d6e h GLU 183 Cb 1.16 0.00 -0.15 0.00 -0.16 0.00 0.00 28.75 29.61 1d6e h GLU 183 CO 0.51 1.00 -0.72 0.95 -1.18 0.00 0.00 179.01 179.58 1d6e s THR 184 N -2.30 1.23 -0.29 0.32 -4.23 -1.24 -0.62 115.64 108.51 1d6e s THR 184 Ca -0.25 -2.07 -0.20 0.00 -1.18 0.00 0.00 61.69 58.00 1d6e s THR 184 Cb 0.02 -1.86 0.15 0.00 1.34 0.00 0.00 72.50 72.15 1d6e s THR 184 CO 0.64 -0.72 1.07 -0.83 -0.54 0.00 0.00 174.62 174.23 1d6e s GLY 185 N -3.16 0.03 -0.02 3.99 0.00 -1.26 -1.78 107.32 105.12 1d6e s GLY 185 Ca 0.17 3.07 -0.06 0.00 0.00 0.00 0.00 44.72 47.90 1d6e s GLY 185 CO 0.01 2.27 0.14 -2.52 0.00 0.00 0.00 173.10 173.00 1d6e s TYR 186 N 0.78 -0.03 -0.18 1.90 -0.85 -0.86 -0.74 117.35 117.38 1d6e s TYR 186 Ca -0.03 0.05 -0.04 0.00 -0.52 0.00 0.00 57.07 56.53 1d6e s TYR 186 Cb -0.04 -0.01 -0.03 0.00 0.38 0.00 0.00 41.96 42.26 1d6e s TYR 186 CO -0.12 -0.21 -0.02 -1.50 -1.52 0.00 0.00 175.55 172.18 1d6e s ILE 187 N -0.88 3.88 -0.14 -3.49 2.07 -0.05 -1.69 121.20 120.90 1d6e s ILE 187 Ca -0.10 -0.35 -0.01 0.00 -1.41 0.00 0.00 60.65 58.79 1d6e s ILE 187 Cb -0.05 -2.72 -0.01 0.00 0.13 0.00 0.00 42.46 39.80 1d6e s ILE 187 CO 0.01 0.47 -0.12 -0.75 -1.91 0.00 0.00 174.94 172.63 1d6e s LYS 188 N 0.66 3.38 -0.23 3.50 2.20 0.57 -0.77 119.74 129.03 1d6e s LYS 188 Ca -0.02 -0.68 -0.08 0.00 -0.36 0.00 0.00 55.97 54.84 1d6e s LYS 188 Cb -0.14 -2.67 -0.03 0.00 -1.51 0.00 0.00 37.83 33.47 1d6e s LYS 188 CO 0.02 0.16 0.08 -0.06 -0.36 0.00 0.00 175.35 175.19 1d6e s PHE 189 N 0.49 3.13 -0.18 4.03 0.40 -0.14 -1.49 117.98 124.22 1d6e s PHE 189 Ca -0.09 -0.25 -0.02 0.00 -0.60 0.00 0.00 56.93 55.97 1d6e s PHE 189 Cb -0.16 -2.21 -0.01 0.00 0.51 0.00 0.00 43.02 41.16 1d6e s PHE 189 CO 0.04 -0.21 -0.08 0.42 0.70 0.00 0.00 175.22 176.09 1d6e s ILE 190 N 1.31 3.24 -0.31 0.64 1.01 -0.28 -2.72 121.20 124.08 1d6e s ILE 190 Ca 0.05 -0.56 -0.03 0.00 0.00 0.00 0.00 60.65 60.11 1d6e s ILE 190 Cb -0.15 -2.42 0.11 0.00 0.01 0.00 0.00 42.46 40.01 1d6e s ILE 190 CO 0.04 0.47 0.15 -0.70 0.00 0.00 0.00 174.94 174.90 1d6e s GLU 191 N 0.97 0.33 -0.84 2.79 2.12 0.11 -0.49 118.70 123.69 1d6e s GLU 191 Ca -0.01 -0.77 -0.04 0.00 0.36 0.00 0.00 54.97 54.51 1d6e s GLU 191 Cb -0.15 -1.28 -0.04 0.00 0.26 0.00 0.00 34.13 32.92 1d6e s GLU 191 CO -0.00 -1.06 0.75 0.09 -0.54 0.00 0.00 175.26 174.49 1d6e n ASN 192 N 4.93 -6.36 -3.30 -1.70 3.02 -1.26 -2.89 115.26 107.70 1d6e n ASN 192 Ca -0.02 -0.46 -0.19 0.00 -0.03 0.00 0.00 54.58 53.88 1d6e n ASN 192 Cb 0.41 -4.67 -0.02 0.00 -0.61 0.00 0.00 39.78 34.89 1d6e n ASN 192 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1d6e n GLU 193 N -2.62 -2.50 -4.30 3.52 1.02 -1.26 -4.90 120.64 109.60 1d6e n GLU 193 Ca -0.04 0.24 -0.21 0.00 -0.02 0.00 0.00 57.16 57.13 1d6e n GLU 193 Cb 0.57 -4.84 -0.16 0.00 -0.02 0.00 0.00 31.44 26.99 1d6e n GLU 193 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1d6e s ASN 194 N -2.56 1.14 0.21 1.62 3.84 -1.14 -4.53 114.94 113.52 1d6e s ASN 194 Ca 0.34 -0.17 -0.14 0.00 0.21 0.00 0.00 52.86 53.10 1d6e s ASN 194 Cb -0.19 -0.50 0.01 0.00 -0.55 0.00 0.00 41.25 40.02 1d6e s ASN 194 CO 0.42 -0.01 0.45 -0.94 -2.79 0.00 0.00 177.10 174.23 1d6e s SER 195 N 0.69 -0.12 0.23 -4.21 1.04 -1.26 -0.71 113.70 109.36 1d6e s SER 195 Ca -0.11 -0.74 -0.15 0.00 0.48 0.00 0.00 55.95 55.43 1d6e s SER 195 Cb -0.13 0.55 0.01 0.00 0.10 0.00 0.00 66.02 66.54 1d6e s SER 195 CO 0.01 -1.05 0.52 0.72 0.98 0.00 0.00 173.24 174.42 1d6e s PHE 196 N -3.95 0.16 0.18 5.02 -0.12 -1.10 -1.51 117.98 116.66 1d6e s PHE 196 Ca 0.16 -0.53 -0.11 0.00 -0.05 0.00 0.00 56.93 56.40 1d6e s PHE 196 Cb 0.00 0.31 -0.00 0.00 -0.63 0.00 0.00 43.02 42.70 1d6e s PHE 196 CO 0.02 -1.00 0.35 1.67 -0.05 0.00 0.00 175.22 176.21 1d6e s TRP 197 N -3.96 0.33 0.02 3.49 1.48 -1.26 -0.97 118.94 118.07 1d6e s TRP 197 Ca 0.17 -0.68 0.04 0.00 -1.06 0.00 0.00 56.10 54.57 1d6e s TRP 197 Cb -0.01 0.04 -0.02 0.00 -1.16 0.00 0.00 33.47 32.32 1d6e s TRP 197 CO 0.05 -0.79 -0.13 0.71 -4.06 0.00 0.00 176.95 172.73 1d6e s TYR 198 N -3.96 1.19 -0.17 1.66 4.12 0.05 -4.95 117.35 115.27 1d6e s TYR 198 Ca 0.17 -0.30 -0.26 0.00 0.02 0.00 0.00 57.07 56.70 1d6e s TYR 198 Cb 0.02 -0.72 -0.01 0.00 -1.52 0.00 0.00 41.96 39.72 1d6e s TYR 198 CO 0.01 0.01 0.87 0.34 0.02 0.00 0.00 175.55 176.80 1d6e s ASP 199 N -0.83 6.99 0.00 2.29 -1.08 -1.26 -0.87 116.67 121.91 1d6e s ASP 199 Ca 0.03 1.22 0.28 0.00 -0.52 0.00 0.00 52.55 53.55 1d6e s ASP 199 Cb -0.07 -2.47 0.99 0.00 -1.46 0.00 0.00 42.92 39.91 1d6e s ASP 199 CO 0.01 -0.43 1.71 0.23 0.52 0.00 0.00 175.17 177.21 1d6e n MET 200 N 5.33 0.74 -3.94 4.34 2.81 0.08 -4.91 117.12 121.58 1d6e n MET 200 Ca 0.06 -0.35 -0.32 0.00 -1.81 0.00 0.00 57.70 55.28 1d6e n MET 200 Cb 0.48 -1.49 -0.05 0.00 -0.71 0.00 0.00 33.22 31.46 1d6e n MET 200 CO 0.00 0.00 0.00 -1.64 1.51 0.00 0.00 175.97 175.84 1d6e s MET 201 N -2.50 3.35 0.59 0.03 -1.94 -1.25 -4.99 119.30 112.58 1d6e s MET 201 Ca 0.26 -0.45 -0.19 0.00 -1.71 0.00 0.00 55.69 53.60 1d6e s MET 201 Cb 0.20 -3.00 -0.03 0.00 2.01 0.00 0.00 34.83 34.00 1d6e s MET 201 CO 0.50 0.62 1.24 -2.14 -0.01 0.00 0.00 175.02 175.23 1d6e s PRO 202 N -2.32 2.95 0.63 2.03 0.02 -1.26 -4.80 135.00 132.24 1d6e s PRO 202 Ca 0.32 1.92 -0.17 0.00 0.02 0.00 0.00 61.00 63.09 1d6e s PRO 202 Cb -0.13 -1.98 -0.02 0.00 0.02 0.00 0.00 34.50 32.40 1d6e s PRO 202 CO 0.24 -1.25 1.16 0.00 -0.33 0.00 0.00 177.00 176.82 1d6e s ALA 203 N -1.51 2.48 0.43 -1.55 0.00 -1.26 -4.56 121.76 115.79 1d6e s ALA 203 Ca 0.77 0.79 -0.25 0.00 0.00 0.00 0.00 51.96 53.27 1d6e s ALA 203 Cb -0.33 -3.39 -0.10 0.00 0.00 0.00 0.00 23.12 19.30 1d6e s ALA 203 CO 0.36 -1.23 1.28 -0.35 0.00 0.00 0.00 175.76 175.82 1d6e n PRO 204 N -1.99 1.94 -0.72 0.00 -0.04 -1.26 -4.77 135.00 128.15 1d6e n PRO 204 Ca 0.12 0.69 0.00 0.00 -0.04 0.00 0.00 63.50 64.27 1d6e n PRO 204 Cb 0.51 -2.40 0.00 0.00 -0.04 0.00 0.00 33.50 31.57 1d6e n PRO 204 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1d6e n GLY 205 N 0.80 0.53 0.17 0.55 0.00 -1.07 -4.91 105.19 101.26 1d6e n GLY 205 Ca 0.07 -1.79 0.05 0.00 0.00 0.00 0.00 46.02 44.34 1d6e n GLY 205 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1d6e n ASP 206 N 3.00 1.01 -4.22 1.61 5.75 -1.26 0.28 116.55 122.72 1d6e n ASP 206 Ca 0.00 -1.01 -0.25 0.00 -0.01 0.00 0.00 54.79 53.53 1d6e n ASP 206 Cb 0.00 0.58 -0.14 0.00 -1.03 0.00 0.00 41.12 40.53 1d6e n ASP 206 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 1d6e s LYS 207 N -1.42 1.33 -0.15 0.11 2.20 -1.26 -3.77 119.74 116.77 1d6e s LYS 207 Ca 0.07 -0.87 0.02 0.00 -0.36 0.00 0.00 55.97 54.82 1d6e s LYS 207 Cb 0.07 -1.41 0.02 0.00 -1.51 0.00 0.00 37.83 35.00 1d6e s LYS 207 CO 0.27 0.36 -0.19 0.12 -0.36 0.00 0.00 175.35 175.54 1d6e s PHE 208 N -0.75 2.57 -0.64 4.03 5.36 -1.26 -4.95 117.98 122.33 1d6e s PHE 208 Ca 0.06 -1.40 -0.16 0.00 -0.96 0.00 0.00 56.93 54.47 1d6e s PHE 208 Cb -0.08 -1.78 0.14 0.00 -0.34 0.00 0.00 43.02 40.96 1d6e s PHE 208 CO 0.01 -0.69 0.65 0.34 -1.46 0.00 0.00 175.22 174.08 1d6e s ASP 209 N 1.12 6.35 0.18 6.13 -1.08 -1.26 -4.94 116.67 123.17 1d6e s ASP 209 Ca -0.00 -1.92 -0.14 0.00 -0.52 0.00 0.00 52.55 49.96 1d6e s ASP 209 Cb -0.14 -2.25 0.15 0.00 -1.46 0.00 0.00 42.92 39.23 1d6e s ASP 209 CO -0.08 -0.87 1.73 1.56 0.52 0.00 0.00 175.17 178.03 1d6e h GLN 210 N 8.70 0.25 -0.92 4.34 4.20 -1.93 -1.14 115.11 128.61 1d6e h GLN 210 Ca -0.18 -0.01 0.09 0.00 0.06 0.00 0.00 58.65 58.61 1d6e h GLN 210 Cb 1.08 -0.06 -0.07 0.00 0.30 0.00 0.00 27.48 28.73 1d6e h GLN 210 CO 0.99 0.16 0.56 1.03 -0.67 0.00 0.00 178.83 180.91 1d6e h SER 211 N 0.26 0.84 0.75 1.46 0.87 -1.92 -0.91 113.55 114.90 1d6e h SER 211 Ca 0.23 0.04 -0.17 0.00 -1.23 0.00 0.00 61.79 60.65 1d6e h SER 211 Cb 0.27 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 62.08 1d6e h SER 211 CO -0.28 0.49 -0.81 0.11 -0.53 0.00 0.00 176.83 175.82 1d6e h LYS 212 N 0.95 0.04 -0.10 2.24 1.79 -1.82 -2.93 116.57 116.74 1d6e h LYS 212 Ca 0.43 -0.04 -0.04 0.00 -2.18 0.00 0.00 60.65 58.81 1d6e h LYS 212 Cb 0.34 0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 31.00 1d6e h LYS 212 CO -0.23 0.82 -0.11 -0.92 -1.08 0.00 0.00 179.45 177.93 1d6e h TYR 213 N 0.02 0.30 0.00 -1.35 3.20 -0.57 -3.19 116.97 115.38 1d6e h TYR 213 Ca -0.01 -0.09 -0.01 0.00 3.14 0.00 0.00 58.73 61.75 1d6e h TYR 213 Cb 1.42 -0.06 -0.00 0.00 1.54 0.00 0.00 36.73 39.63 1d6e h TYR 213 CO 0.01 0.69 -0.04 -0.07 -1.64 0.00 0.00 178.16 177.10 1d6e h LEU 214 N -0.17 0.00 -2.15 2.82 3.38 -1.25 -2.98 115.31 114.96 1d6e h LEU 214 Ca 0.01 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.05 1d6e h LEU 214 Cb 0.64 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 1d6e h LEU 214 CO 0.03 0.04 0.29 -0.03 0.09 0.00 0.00 178.44 178.86 1d6e h MET 215 N 0.00 0.00 0.00 1.13 4.05 -1.50 0.34 114.93 118.96 1d6e h MET 215 Ca -0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1d6e h MET 215 Cb 0.32 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.12 1d6e h MET 215 CO 0.01 0.00 0.00 0.00 0.23 0.00 0.00 176.91 177.15 1d6e h MET 216 N 0.00 0.00 -0.00 0.39 -0.00 -1.72 -0.38 114.93 113.21 1d6e h MET 216 Ca 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.80 1d6e h MET 216 Cb 0.68 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.28 1d6e h MET 216 CO -0.00 0.00 -0.34 0.66 -0.00 0.00 0.00 176.91 177.22 1d6e n TYR 217 N -2.35 0.00 0.57 -0.10 0.53 0.11 -4.33 117.16 111.59 1d6e n TYR 217 Ca -0.01 0.00 0.05 0.00 -1.02 0.00 0.00 57.90 56.91 1d6e n TYR 217 Cb 0.05 -0.18 0.27 0.00 -1.03 0.00 0.00 39.34 38.45 1d6e n TYR 217 CO 0.00 0.00 0.00 0.27 -1.02 0.00 0.00 176.86 176.11 1d6e n ASN 218 N -1.00 0.00 0.01 7.72 6.94 -0.15 -1.50 115.26 127.27 1d6e n ASN 218 Ca 0.10 -0.26 0.12 0.00 -0.02 0.00 0.00 54.58 54.52 1d6e n ASN 218 Cb 0.34 -0.02 0.30 0.00 -2.36 0.00 0.00 39.78 38.04 1d6e n ASN 218 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 1d6e n ASP 219 N -1.02 0.45 -3.76 0.53 5.75 -1.26 -0.27 116.55 116.96 1d6e n ASP 219 Ca 0.07 -0.06 -0.27 0.00 -0.01 0.00 0.00 54.79 54.51 1d6e n ASP 219 Cb 0.04 0.10 0.05 0.00 -1.03 0.00 0.00 41.12 40.28 1d6e n ASP 219 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1d6e n ASN 220 N -1.59 -5.54 -4.75 -1.12 5.15 -0.56 -4.91 115.26 101.93 1d6e n ASN 220 Ca 0.05 -0.66 -0.41 0.00 -0.60 0.00 0.00 54.58 52.96 1d6e n ASN 220 Cb 0.35 -4.45 -0.02 0.00 -0.53 0.00 0.00 39.78 35.14 1d6e n ASN 220 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 1d6e s LYS 221 N -6.46 4.16 0.20 1.20 2.20 -1.26 -4.92 119.74 114.86 1d6e s LYS 221 Ca 0.62 2.50 0.11 0.00 -0.36 0.00 0.00 55.97 58.84 1d6e s LYS 221 Cb -0.29 -3.04 -0.04 0.00 -1.51 0.00 0.00 37.83 32.94 1d6e s LYS 221 CO 0.78 -0.55 -0.23 -1.64 -0.36 0.00 0.00 175.35 173.35 1d6e s MET 222 N -0.75 1.55 0.19 4.03 -1.94 -1.26 -1.68 119.30 119.44 1d6e s MET 222 Ca 0.60 -1.55 0.02 0.00 -1.71 0.00 0.00 55.69 53.05 1d6e s MET 222 Cb -0.46 -1.84 -0.05 0.00 2.01 0.00 0.00 34.83 34.49 1d6e s MET 222 CO 0.49 0.39 0.02 0.14 -0.01 0.00 0.00 175.02 176.06 1d6e s VAL 223 N -1.78 0.63 -0.34 -6.03 -7.23 0.33 -4.87 120.40 101.10 1d6e s VAL 223 Ca 0.22 -1.98 -0.21 0.00 -1.81 0.00 0.00 61.98 58.19 1d6e s VAL 223 Cb -0.08 -2.23 0.00 0.00 0.56 0.00 0.00 36.38 34.64 1d6e s VAL 223 CO 0.11 -0.37 0.69 -0.62 -0.31 0.00 0.00 175.10 174.59 1d6e s ASP 224 N -3.20 6.50 0.61 4.85 2.15 -1.26 -1.95 116.67 124.37 1d6e s ASP 224 Ca 0.27 0.31 0.31 0.00 0.43 0.00 0.00 52.55 53.87 1d6e s ASP 224 Cb 0.06 -2.35 1.76 0.00 -0.30 0.00 0.00 42.92 42.09 1d6e s ASP 224 CO 0.06 -0.61 2.11 0.77 -0.17 0.00 0.00 175.17 177.33 1d6e h SER 225 N 8.37 0.00 1.35 -0.34 4.64 -1.37 -0.40 113.55 125.80 1d6e h SER 225 Ca -0.26 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 60.93 1d6e h SER 225 Cb 1.11 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.18 1d6e h SER 225 CO 0.85 0.00 -0.66 0.50 -0.87 0.00 0.00 176.83 176.65 1d6e h LYS 226 N 0.00 0.00 0.00 4.77 3.64 -1.90 -3.38 116.57 119.69 1d6e h LYS 226 Ca 0.06 0.00 -0.36 0.00 -1.27 0.00 0.00 60.65 59.09 1d6e h LYS 226 Cb 0.46 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.21 1d6e h LYS 226 CO -0.00 0.56 -2.35 -0.25 -2.27 0.00 0.00 179.45 175.14 1d6e n ASP 227 N -3.22 0.57 -4.74 4.20 8.00 -0.26 -5.03 116.55 116.08 1d6e n ASP 227 Ca 0.01 -0.03 -0.39 0.00 0.71 0.00 0.00 54.79 55.09 1d6e n ASP 227 Cb 0.78 0.72 0.03 0.00 -0.02 0.00 0.00 41.12 42.62 1d6e n ASP 227 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 1d6e n VAL 228 N -2.82 3.33 -4.31 2.53 0.24 -0.61 -4.56 118.33 112.13 1d6e n VAL 228 Ca -0.34 -0.50 -0.20 0.00 -2.04 0.00 0.00 64.34 61.26 1d6e n VAL 228 Cb 1.10 -1.69 -0.13 0.00 -1.47 0.00 0.00 33.84 31.65 1d6e n VAL 228 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1d6e s LYS 229 N -2.65 0.92 -0.06 7.34 -0.14 0.36 -4.67 119.74 120.84 1d6e s LYS 229 Ca 0.67 -0.81 0.04 0.00 -1.36 0.00 0.00 55.97 54.50 1d6e s LYS 229 Cb -0.44 -0.93 0.00 0.00 -1.68 0.00 0.00 37.83 34.78 1d6e s LYS 229 CO 0.53 0.22 -0.16 0.42 -0.76 0.00 0.00 175.35 175.60 1d6e s ILE 230 N -0.95 1.41 -0.04 2.17 1.01 -0.92 -1.13 121.20 122.74 1d6e s ILE 230 Ca 0.01 -0.67 0.04 0.00 0.00 0.00 0.00 60.65 60.03 1d6e s ILE 230 Cb -0.08 -1.23 -0.00 0.00 0.01 0.00 0.00 42.46 41.15 1d6e s ILE 230 CO 0.02 0.41 -0.18 -1.61 0.00 0.00 0.00 174.94 173.58 1d6e s GLU 231 N 0.29 1.83 -0.11 2.79 2.02 -0.55 -0.91 118.70 124.05 1d6e s GLU 231 Ca -0.09 -0.63 0.03 0.00 0.02 0.00 0.00 54.97 54.30 1d6e s GLU 231 Cb -0.14 -1.59 0.01 0.00 0.10 0.00 0.00 34.13 32.52 1d6e s GLU 231 CO 0.04 0.25 -0.20 0.08 0.02 0.00 0.00 175.26 175.45 1d6e s VAL 232 N 0.02 1.84 -0.25 2.63 1.01 -0.57 -0.32 120.40 124.77 1d6e s VAL 232 Ca -0.04 -0.87 -0.03 0.00 0.00 0.00 0.00 61.98 61.05 1d6e s VAL 232 Cb -0.12 -1.63 0.01 0.00 0.00 0.00 0.00 36.38 34.65 1d6e s VAL 232 CO 0.02 0.51 -0.04 -0.31 0.00 0.00 0.00 175.10 175.29 1d6e s TYR 233 N 0.71 3.04 0.01 5.22 1.51 -0.68 -0.15 117.35 127.01 1d6e s TYR 233 Ca -0.11 -1.30 0.08 0.00 -1.01 0.00 0.00 57.07 54.73 1d6e s TYR 233 Cb -0.16 -2.10 -0.02 0.00 -0.11 0.00 0.00 41.96 39.57 1d6e s TYR 233 CO 0.02 -0.66 -0.25 -0.51 -1.11 0.00 0.00 175.55 173.04 1d6e s LEU 234 N 1.39 2.11 -0.02 -1.29 1.43 0.16 -2.02 118.68 120.44 1d6e s LEU 234 Ca 0.02 -0.51 0.07 0.00 -1.03 0.00 0.00 54.13 52.68 1d6e s LEU 234 Cb -0.16 -1.23 -0.02 0.00 0.03 0.00 0.00 46.19 44.81 1d6e s LEU 234 CO -0.03 0.27 -0.23 0.42 0.23 0.00 0.00 176.35 177.01 1d6e s THR 235 N -0.69 2.36 0.43 5.49 -4.23 -0.73 0.10 115.64 118.37 1d6e s THR 235 Ca 0.10 -1.03 -0.07 0.00 -1.18 0.00 0.00 61.69 59.50 1d6e s THR 235 Cb -0.10 -1.86 -0.05 0.00 1.34 0.00 0.00 72.50 71.83 1d6e s THR 235 CO 0.01 0.55 0.76 -0.89 -0.54 0.00 0.00 174.62 174.51 1d6e s THR 236 N -0.67 4.87 -2.69 3.99 2.01 -1.26 -0.94 115.64 120.94 1d6e s THR 236 Ca 0.11 0.36 0.22 0.00 0.31 0.00 0.00 61.69 62.68 1d6e s THR 236 Cb -0.10 -3.80 0.17 0.00 0.01 0.00 0.00 72.50 68.78 1d6e s THR 236 CO -0.00 -0.66 1.18 0.29 -0.69 0.00 0.00 174.62 174.74