#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d5x n GLN 3 N 0.00 1.27 -2.01 1.43 7.27 -1.17 -4.91 117.38 119.25 1d5x n GLN 3 Ca 0.00 0.48 -0.39 0.00 0.07 0.00 0.00 57.00 57.16 1d5x n GLN 3 Cb 0.00 -2.39 0.00 0.00 2.41 0.00 0.00 30.24 30.26 1d5x n GLN 3 CO 0.00 0.00 0.00 -2.14 0.07 0.00 0.00 177.06 174.99 1d5x s PRO 4 N -2.90 3.85 0.73 3.69 0.02 -1.26 -4.90 135.00 134.23 1d5x s PRO 4 Ca 0.75 2.17 -0.12 0.00 0.02 0.00 0.00 61.00 63.82 1d5x s PRO 4 Cb -0.42 -2.68 0.04 0.00 0.02 0.00 0.00 34.50 31.46 1d5x s PRO 4 CO 0.47 -0.60 1.10 0.34 -0.33 0.00 0.00 177.00 177.98 1d5x s ASP 5 N -0.77 4.71 0.84 2.53 2.15 -1.26 -4.98 116.67 119.88 1d5x s ASP 5 Ca 0.59 1.90 -0.11 0.00 0.43 0.00 0.00 52.55 55.35 1d5x s ASP 5 Cb -0.38 -2.53 0.12 0.00 -0.30 0.00 0.00 42.92 39.83 1d5x s ASP 5 CO 0.49 -1.90 1.18 -2.16 -0.17 0.00 0.00 175.17 172.61 1d5x s PRO 6 N -4.59 1.50 -0.04 4.34 0.04 -1.26 -5.09 135.00 129.89 1d5x s PRO 6 Ca 0.63 -0.26 0.03 0.00 0.04 0.00 0.00 61.00 61.45 1d5x s PRO 6 Cb -0.19 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.37 1d5x s PRO 6 CO 0.51 -1.81 -0.14 0.21 0.04 0.00 0.00 177.00 175.80 1d5x s LYS 7 N -5.59 1.60 0.00 4.56 2.36 -1.26 -5.06 119.74 116.35 1d5x s LYS 7 Ca 0.66 -0.50 0.00 0.00 -2.55 0.00 0.00 55.97 53.58 1d5x s LYS 7 Cb -0.08 -1.38 0.00 0.00 -1.05 0.00 0.00 37.83 35.32 1d5x s LYS 7 CO 0.49 0.17 0.00 -2.30 1.55 0.00 0.00 175.35 175.26 1d5x n PRO 8 N 3.32 0.00 0.00 4.03 -0.01 -1.26 0.69 135.00 141.77 1d5x n PRO 8 Ca -0.19 0.00 0.14 0.00 -0.01 0.00 0.00 63.50 63.44 1d5x n PRO 8 Cb 0.53 0.00 0.61 0.00 -0.01 0.00 0.00 33.50 34.63 1d5x n PRO 8 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 175.50 172.02 1d5x n ASP 9 N -3.95 0.00 0.10 2.55 2.03 -1.26 -3.48 116.55 112.55 1d5x n ASP 9 Ca 0.00 0.47 -0.05 0.00 0.52 0.00 0.00 54.79 55.73 1d5x n ASP 9 Cb 0.00 -0.49 0.07 0.00 -0.72 0.00 0.00 41.12 39.98 1d5x n ASP 9 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 1d5x h GLU 10 N 0.00 0.08 -6.70 -0.67 5.08 -0.15 -3.45 114.58 108.77 1d5x h GLU 10 Ca 0.00 -0.08 -0.50 0.00 -1.00 0.00 0.00 59.36 57.78 1d5x h GLU 10 Cb 0.48 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.72 1d5x h GLU 10 CO 0.00 0.79 0.22 -0.51 -1.00 0.00 0.00 179.01 178.51 1d5x s LEU 11 N -7.46 4.37 0.54 1.33 2.01 -1.23 -5.04 118.68 113.20 1d5x s LEU 11 Ca -0.02 1.62 -0.17 0.00 0.01 0.00 0.00 54.13 55.57 1d5x s LEU 11 Cb 0.11 -3.74 -0.06 0.00 0.01 0.00 0.00 46.19 42.51 1d5x s LEU 11 CO 0.79 0.01 1.03 -1.00 1.01 0.00 0.00 176.35 178.20 1d5x s HIS 12 N -1.52 3.09 -0.11 0.29 3.76 -1.26 -5.04 115.29 114.50 1d5x s HIS 12 Ca 0.45 1.52 -0.01 0.00 -0.15 0.00 0.00 55.06 56.87 1d5x s HIS 12 Cb -0.18 -2.98 -0.03 0.00 1.11 0.00 0.00 32.58 30.50 1d5x s HIS 12 CO 0.23 -0.86 -0.05 0.15 -0.85 0.00 0.00 174.74 173.35 1d5x s LYS 13 N -3.81 3.18 0.52 1.40 1.02 -1.26 -4.48 119.74 116.31 1d5x s LYS 13 Ca 0.64 -0.53 0.27 0.00 0.02 0.00 0.00 55.97 56.37 1d5x s LYS 13 Cb -0.15 -2.74 1.43 0.00 -0.52 0.00 0.00 37.83 35.85 1d5x s LYS 13 CO 0.30 0.48 2.07 0.66 -0.92 0.00 0.00 175.35 177.94 1d5x h SER 14 N 5.89 0.00 0.00 2.83 4.64 -0.19 -1.80 113.55 124.92 1d5x h SER 14 Ca -0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 1d5x h SER 14 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1d5x h SER 14 CO 0.57 0.12 0.00 -1.20 -0.87 0.00 0.00 176.83 175.45 1d5x n SER 15 N -3.67 0.00 -0.00 4.97 7.64 -1.26 -2.67 113.62 118.63 1d5x n SER 15 Ca -0.02 -1.06 0.05 0.00 1.01 0.00 0.00 58.87 58.85 1d5x n SER 15 Cb 0.24 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.37 1d5x n SER 15 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1d5x n LYS 16 N -0.79 2.31 -2.78 1.43 5.02 -0.68 -4.93 118.16 117.74 1d5x n LYS 16 Ca 0.10 -0.04 -0.43 0.00 -2.02 0.00 0.00 58.31 55.93 1d5x n LYS 16 Cb 0.05 -1.07 -0.04 0.00 -0.02 0.00 0.00 35.03 33.95 1d5x n LYS 16 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 1d5x s PHE 17 N -2.24 2.90 0.11 2.13 5.36 -1.09 -3.31 117.98 121.84 1d5x s PHE 17 Ca 0.00 0.43 0.03 0.00 -0.96 0.00 0.00 56.93 56.43 1d5x s PHE 17 Cb 0.07 -4.06 -0.19 0.00 -0.34 0.00 0.00 43.02 38.50 1d5x s PHE 17 CO 0.40 -1.14 1.25 1.15 -1.46 0.00 0.00 175.22 175.43 1d5x h THR 18 N 6.11 1.61 -3.47 0.12 2.02 -1.43 -3.47 112.91 114.40 1d5x h THR 18 Ca -0.24 -3.17 -0.42 0.00 0.77 0.00 0.00 66.41 63.35 1d5x h THR 18 Cb 1.07 2.82 0.19 0.00 -1.74 0.00 0.00 68.15 70.49 1d5x h THR 18 CO 1.05 0.91 0.08 -0.83 0.37 0.00 0.00 175.52 177.10 1d5x s GLY 19 N -4.66 1.54 0.27 2.16 0.00 -1.19 -4.97 107.32 100.47 1d5x s GLY 19 Ca -0.01 -0.58 -0.30 0.00 0.00 0.00 0.00 44.72 43.82 1d5x s GLY 19 CO 0.84 0.21 1.59 0.48 0.00 0.00 0.00 173.10 176.23 1d5x s LEU 20 N -7.03 4.35 0.12 0.66 2.34 -1.26 -4.87 118.68 112.99 1d5x s LEU 20 Ca 0.68 2.89 0.25 0.00 0.06 0.00 0.00 54.13 58.01 1d5x s LEU 20 Cb -0.16 -3.63 0.45 0.00 -0.56 0.00 0.00 46.19 42.29 1d5x s LEU 20 CO 0.59 -0.89 1.41 0.23 -1.06 0.00 0.00 176.35 176.63 1d5x n MET 21 N 2.53 0.26 -0.20 1.48 2.81 -0.45 -3.78 117.12 119.78 1d5x n MET 21 Ca 0.09 0.10 0.25 0.00 -1.81 0.00 0.00 57.70 56.34 1d5x n MET 21 Cb 0.37 -1.69 0.65 0.00 -0.71 0.00 0.00 33.22 31.85 1d5x n MET 21 CO 0.00 0.00 0.00 1.49 1.51 0.00 0.00 175.97 178.97 1d5x h GLU 22 N 0.00 0.14 0.00 0.03 4.57 -1.47 0.84 114.58 118.69 1d5x h GLU 22 Ca 0.00 -0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 58.17 1d5x h GLU 22 Cb 0.72 -0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 29.28 1d5x h GLU 22 CO 0.00 0.09 -0.01 -0.91 -1.18 0.00 0.00 179.01 177.00 1d5x h ASN 23 N 0.14 0.00 0.05 1.04 -0.26 -1.88 0.11 115.58 114.78 1d5x h ASN 23 Ca 0.44 0.00 -0.38 0.00 -0.56 0.00 0.00 56.30 55.80 1d5x h ASN 23 Cb 1.53 0.00 -0.05 0.00 -1.06 0.00 0.00 38.32 38.73 1d5x h ASN 23 CO -0.07 0.01 -2.31 0.80 -1.06 0.00 0.00 177.43 174.80 1d5x n MET 24 N -3.19 0.69 -0.20 0.81 1.56 0.23 -4.37 117.12 112.64 1d5x n MET 24 Ca -0.02 0.18 -0.03 0.00 -0.27 0.00 0.00 57.70 57.57 1d5x n MET 24 Cb 0.15 -1.59 0.04 0.00 2.15 0.00 0.00 33.22 33.97 1d5x n MET 24 CO 0.00 0.00 0.00 -0.22 -0.73 0.00 0.00 175.97 175.02 1d5x h LYS 25 N 0.02 -0.08 0.00 2.12 3.64 -0.62 0.52 116.57 122.17 1d5x h LYS 25 Ca -0.52 0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 58.86 1d5x h LYS 25 Cb 1.96 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 33.80 1d5x h LYS 25 CO -0.03 -0.05 -0.02 -0.39 -2.27 0.00 0.00 179.45 176.69 1d5x h VAL 26 N -0.08 0.33 0.00 2.00 -1.51 -1.02 0.30 116.25 116.26 1d5x h VAL 26 Ca 0.27 -0.09 0.00 0.00 -1.23 0.00 0.00 66.70 65.65 1d5x h VAL 26 Cb 0.51 1.06 0.00 0.00 -2.13 0.00 0.00 31.29 30.74 1d5x h VAL 26 CO -0.66 0.02 0.00 -0.07 -1.23 0.00 0.00 177.57 175.62 1d5x h LEU 27 N 0.00 0.00 -0.99 4.19 3.38 -1.09 -3.34 115.31 117.47 1d5x h LEU 27 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1d5x h LEU 27 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1d5x h LEU 27 CO 0.00 0.00 0.00 -1.22 0.09 0.00 0.00 178.44 177.31 1d5x n TYR 28 N -2.69 0.00 -1.35 1.13 4.02 -0.02 -4.77 117.16 113.48 1d5x n TYR 28 Ca 0.03 -0.04 0.00 0.00 -0.01 0.00 0.00 57.90 57.88 1d5x n TYR 28 Cb 0.38 -0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.70 1d5x n TYR 28 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 176.86 175.45 1d5x n ASP 29 N -0.04 0.00 -0.05 7.72 5.75 -0.53 -3.85 116.55 125.56 1d5x n ASP 29 Ca 0.00 -0.27 -0.01 0.00 -0.01 0.00 0.00 54.79 54.50 1d5x n ASP 29 Cb 0.07 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.15 1d5x n ASP 29 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1d5x n ASP 30 N -0.81 -0.13 -4.72 -1.12 10.43 -1.26 -4.59 116.55 114.35 1d5x n ASP 30 Ca 0.00 0.44 -0.42 0.00 2.57 0.00 0.00 54.79 57.38 1d5x n ASP 30 Cb 0.00 -0.14 -0.03 0.00 1.84 0.00 0.00 41.12 42.79 1d5x n ASP 30 CO 0.00 0.00 0.00 0.20 -1.07 0.00 0.00 177.20 176.33 1d5x s ASN 31 N -3.75 6.47 0.08 -2.24 -0.87 -1.26 -4.98 114.94 108.40 1d5x s ASN 31 Ca -0.01 2.76 -0.26 0.00 -1.57 0.00 0.00 52.86 53.78 1d5x s ASN 31 Cb 0.01 -2.60 0.08 0.00 -0.02 0.00 0.00 41.25 38.73 1d5x s ASN 31 CO 0.07 -0.90 0.82 -1.38 -2.57 0.00 0.00 177.10 173.14 1d5x s HIS 32 N 1.10 -0.34 0.26 2.20 -3.43 -1.26 -4.79 115.29 109.02 1d5x s HIS 32 Ca 0.72 0.14 -0.26 0.00 -0.80 0.00 0.00 55.06 54.85 1d5x s HIS 32 Cb -0.47 0.57 -0.09 0.00 -1.43 0.00 0.00 32.58 31.16 1d5x s HIS 32 CO 0.32 -0.72 0.89 0.08 -2.00 0.00 0.00 174.74 173.32 1d5x s VAL 33 N -3.36 4.23 -0.29 -5.38 1.01 0.14 -4.95 120.40 111.80 1d5x s VAL 33 Ca 0.06 1.83 -0.05 0.00 0.00 0.00 0.00 61.98 63.81 1d5x s VAL 33 Cb -0.01 -4.11 0.16 0.00 0.00 0.00 0.00 36.38 32.41 1d5x s VAL 33 CO -0.07 0.32 0.61 -0.55 0.00 0.00 0.00 175.10 175.41 1d5x s SER 34 N -1.42 -1.19 -0.08 3.32 0.15 -1.26 -2.16 113.70 111.06 1d5x s SER 34 Ca 0.44 1.17 -0.03 0.00 0.70 0.00 0.00 55.95 58.23 1d5x s SER 34 Cb -0.21 2.17 0.04 0.00 -1.71 0.00 0.00 66.02 66.31 1d5x s SER 34 CO 0.26 -0.24 0.17 0.00 1.20 0.00 0.00 173.24 174.63 1d5x s ALA 35 N 2.86 -0.31 -0.25 5.45 0.00 0.12 -4.98 121.76 124.66 1d5x s ALA 35 Ca 0.08 0.72 -0.10 0.00 0.00 0.00 0.00 51.96 52.67 1d5x s ALA 35 Cb -0.14 -0.59 -0.05 0.00 0.00 0.00 0.00 23.12 22.35 1d5x s ALA 35 CO -0.20 -0.27 0.15 0.42 0.00 0.00 0.00 175.76 175.86 1d5x s ILE 36 N 1.48 5.13 -0.57 0.00 -1.09 -1.26 0.40 121.20 125.29 1d5x s ILE 36 Ca -0.06 0.10 -0.03 0.00 -2.23 0.00 0.00 60.65 58.43 1d5x s ILE 36 Cb -0.12 -3.40 0.00 0.00 -1.58 0.00 0.00 42.46 37.37 1d5x s ILE 36 CO -0.06 0.33 0.50 -3.20 -1.23 0.00 0.00 174.94 171.27 1d5x n ASN 37 N 4.52 -3.45 -4.99 3.58 5.15 -1.09 -5.02 115.26 113.95 1d5x n ASN 37 Ca -0.15 -0.24 -0.18 0.00 -0.60 0.00 0.00 54.58 53.41 1d5x n ASN 37 Cb 0.52 -2.48 0.00 0.00 -0.53 0.00 0.00 39.78 37.30 1d5x n ASN 37 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1d5x s VAL 38 N -3.14 3.12 -0.08 3.44 0.11 -0.72 -4.77 120.40 118.36 1d5x s VAL 38 Ca 0.19 -1.04 -0.04 0.00 -2.93 0.00 0.00 61.98 58.17 1d5x s VAL 38 Cb -0.09 -3.06 0.04 0.00 -1.53 0.00 0.00 36.38 31.75 1d5x s VAL 38 CO 0.32 -0.02 0.18 -0.75 -3.33 0.00 0.00 175.10 171.50 1d5x s LYS 39 N -4.30 0.12 -0.29 1.54 2.20 -1.26 -0.87 119.74 116.88 1d5x s LYS 39 Ca 0.53 0.46 -0.43 0.00 -0.36 0.00 0.00 55.97 56.16 1d5x s LYS 39 Cb -0.09 -0.17 -0.19 0.00 -1.51 0.00 0.00 37.83 35.87 1d5x s LYS 39 CO 0.32 -0.19 1.48 0.45 -0.36 0.00 0.00 175.35 177.06 1d5x n SER 40 N 4.38 1.19 -0.05 1.43 2.88 -1.25 -4.75 113.62 117.45 1d5x n SER 40 Ca -0.23 1.16 0.00 0.00 -1.33 0.00 0.00 58.87 58.47 1d5x n SER 40 Cb 0.52 -0.96 -0.16 0.00 -0.75 0.00 0.00 64.21 62.85 1d5x n SER 40 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1d5x n ILE 41 N 3.41 0.69 -3.51 2.46 -5.35 -0.25 -4.90 119.36 111.91 1d5x n ILE 41 Ca 0.27 -0.67 -0.03 0.00 -0.27 0.00 0.00 62.75 62.04 1d5x n ILE 41 Cb 0.03 -0.23 0.01 0.00 -1.74 0.00 0.00 39.64 37.71 1d5x n ILE 41 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 1d5x n ASP 42 N -2.50 -1.03 -3.86 7.28 4.64 -1.17 -5.03 116.55 114.88 1d5x n ASP 42 Ca -0.18 -1.65 -0.11 0.00 -1.38 0.00 0.00 54.79 51.47 1d5x n ASP 42 Cb 0.86 1.70 -0.09 0.00 -1.04 0.00 0.00 41.12 42.56 1d5x n ASP 42 CO 0.00 0.00 0.00 -1.10 -0.82 0.00 0.00 177.20 175.28 1d5x s GLN 43 N -2.04 0.63 -0.16 -0.67 -0.21 -1.26 -0.23 119.66 115.71 1d5x s GLN 43 Ca 0.09 -0.58 -0.13 0.00 0.02 0.00 0.00 55.36 54.77 1d5x s GLN 43 Cb -0.02 0.26 -0.07 0.00 1.00 0.00 0.00 33.01 34.18 1d5x s GLN 43 CO 0.05 -0.17 -0.28 0.34 -2.12 0.00 0.00 175.29 173.11 1d5x n PHE 44 N 0.90 0.00 -4.38 0.91 7.35 -1.26 -4.95 117.46 116.03 1d5x n PHE 44 Ca -0.20 0.00 -0.19 0.00 -0.76 0.00 0.00 57.45 56.30 1d5x n PHE 44 Cb 0.58 -0.57 -0.10 0.00 0.35 0.00 0.00 39.48 39.74 1d5x n PHE 44 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 1d5x s LEU 45 N -7.46 2.46 0.30 -2.13 1.43 -1.26 -5.01 118.68 107.00 1d5x s LEU 45 Ca -0.26 -1.14 0.20 0.00 -1.03 0.00 0.00 54.13 51.90 1d5x s LEU 45 Cb 0.07 -0.57 1.11 0.00 0.03 0.00 0.00 46.19 46.82 1d5x s LEU 45 CO 0.36 -0.32 1.63 0.00 0.23 0.00 0.00 176.35 178.24 1d5x n TYR 46 N -0.48 0.69 -0.55 0.29 0.18 -1.26 -1.76 117.16 114.27 1d5x n TYR 46 Ca -0.06 0.36 0.09 0.00 1.88 0.00 0.00 57.90 60.17 1d5x n TYR 46 Cb 0.62 -1.08 0.30 0.00 -0.38 0.00 0.00 39.34 38.80 1d5x n TYR 46 CO 0.00 0.00 0.00 1.97 -2.08 0.00 0.00 176.86 176.75 1d5x n PHE 47 N -2.21 1.13 -4.05 -3.48 1.16 -1.26 -4.45 117.46 104.29 1d5x n PHE 47 Ca -0.01 -0.61 -0.10 0.00 -1.87 0.00 0.00 57.45 54.85 1d5x n PHE 47 Cb 0.04 -0.18 -0.11 0.00 -1.61 0.00 0.00 39.48 37.62 1d5x n PHE 47 CO 0.00 0.00 0.00 0.16 -1.87 0.00 0.00 176.76 175.05 1d5x s ASP 48 N -1.09 0.59 0.08 5.98 1.47 -0.72 0.09 116.67 123.07 1d5x s ASP 48 Ca 0.44 -0.66 0.10 0.00 1.18 0.00 0.00 52.55 53.60 1d5x s ASP 48 Cb 0.28 0.10 -0.03 0.00 -0.34 0.00 0.00 42.92 42.92 1d5x s ASP 48 CO 0.21 -0.34 -0.25 -0.76 0.68 0.00 0.00 175.17 174.71 1d5x s LEU 49 N -1.94 2.31 -0.12 2.11 1.43 0.34 -4.39 118.68 118.42 1d5x s LEU 49 Ca -0.07 -0.63 0.01 0.00 -1.03 0.00 0.00 54.13 52.41 1d5x s LEU 49 Cb -0.05 -1.31 -0.01 0.00 0.03 0.00 0.00 46.19 44.85 1d5x s LEU 49 CO -0.03 0.22 -0.16 -0.63 0.23 0.00 0.00 176.35 175.99 1d5x s ILE 50 N -0.94 2.76 0.18 -0.59 1.01 0.67 -0.81 121.20 123.49 1d5x s ILE 50 Ca 0.13 -0.77 0.09 0.00 0.00 0.00 0.00 60.65 60.10 1d5x s ILE 50 Cb -0.10 -2.14 -0.04 0.00 0.01 0.00 0.00 42.46 40.19 1d5x s ILE 50 CO 0.04 0.53 -0.08 -0.31 0.00 0.00 0.00 174.94 175.13 1d5x s TYR 51 N 0.34 2.66 -0.86 3.97 1.51 0.62 -1.09 117.35 124.51 1d5x s TYR 51 Ca -0.13 -0.21 -0.04 0.00 -1.01 0.00 0.00 57.07 55.67 1d5x s TYR 51 Cb -0.17 -1.29 0.21 0.00 -0.11 0.00 0.00 41.96 40.60 1d5x s TYR 51 CO 0.07 0.52 0.75 0.45 -1.11 0.00 0.00 175.55 176.22 1d5x s SER 52 N -2.87 6.08 -0.53 2.29 0.15 -1.26 -1.38 113.70 116.17 1d5x s SER 52 Ca 0.25 -3.41 -0.16 0.00 0.70 0.00 0.00 55.95 53.33 1d5x s SER 52 Cb -0.09 -1.97 0.11 0.00 -1.71 0.00 0.00 66.02 62.37 1d5x s SER 52 CO 0.16 -0.28 0.51 -0.63 1.20 0.00 0.00 173.24 174.20 1d5x s ILE 53 N -0.89 5.15 0.32 6.45 1.01 0.21 -4.99 121.20 128.46 1d5x s ILE 53 Ca 0.24 -1.33 -0.29 0.00 0.00 0.00 0.00 60.65 59.28 1d5x s ILE 53 Cb -0.11 -4.32 -0.10 0.00 0.01 0.00 0.00 42.46 37.93 1d5x s ILE 53 CO -0.09 -0.85 1.40 -0.75 0.00 0.00 0.00 174.94 174.65 1d5x s LYS 54 N 1.79 4.26 -0.03 2.79 2.20 -1.25 -4.32 119.74 125.17 1d5x s LYS 54 Ca 0.05 2.35 0.02 0.00 -0.36 0.00 0.00 55.97 58.03 1d5x s LYS 54 Cb -0.28 -3.05 0.00 0.00 -1.51 0.00 0.00 37.83 32.99 1d5x s LYS 54 CO 0.04 -0.36 -0.08 0.34 -0.36 0.00 0.00 175.35 174.93 1d5x s ASP 55 N -0.13 1.09 -0.01 1.43 2.15 -1.26 -5.00 116.67 114.94 1d5x s ASP 55 Ca 0.53 -0.17 0.02 0.00 0.43 0.00 0.00 52.55 53.36 1d5x s ASP 55 Cb -0.42 -0.31 0.03 0.00 -0.30 0.00 0.00 42.92 41.92 1d5x s ASP 55 CO 0.53 0.05 0.80 0.35 -0.17 0.00 0.00 175.17 176.73 1d5x n THR 56 N 3.34 0.29 0.03 1.71 -2.24 -1.26 -4.40 114.28 111.76 1d5x n THR 56 Ca -0.18 -0.33 -0.05 0.00 -2.27 0.00 0.00 64.05 61.22 1d5x n THR 56 Cb 0.54 0.65 -0.03 0.00 -2.10 0.00 0.00 70.33 69.39 1d5x n THR 56 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1d5x h LYS 57 N 0.00 -0.18 0.00 -0.78 3.11 -2.00 -3.44 116.57 113.28 1d5x h LYS 57 Ca 0.00 0.01 0.00 0.00 -2.81 0.00 0.00 60.65 57.85 1d5x h LYS 57 Cb 1.09 0.04 0.00 0.00 -1.00 0.00 0.00 32.23 32.36 1d5x h LYS 57 CO 0.00 -0.00 -0.02 1.47 -2.81 0.00 0.00 179.45 178.09 1d5x n LEU 58 N -4.89 0.00 -2.67 5.20 -0.00 -1.26 -5.09 117.00 108.29 1d5x n LEU 58 Ca -0.04 0.00 -0.10 0.00 -0.00 0.00 0.00 56.01 55.87 1d5x n LEU 58 Cb 0.13 0.00 0.05 0.00 -0.00 0.00 0.00 43.42 43.60 1d5x n LEU 58 CO 0.10 0.00 0.03 0.61 -0.00 0.00 0.00 177.39 178.13 1d5x n GLY 59 N 0.40 -0.42 0.00 1.47 0.00 -1.26 -4.93 105.19 100.45 1d5x n GLY 59 Ca 0.00 0.23 0.14 0.00 0.00 0.00 0.00 46.02 46.39 1d5x n GLY 59 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1d5x n ASN 60 N -2.62 0.00 -3.57 1.61 2.85 -1.26 -4.89 115.26 107.38 1d5x n ASN 60 Ca -0.08 -0.06 -0.02 0.00 -0.11 0.00 0.00 54.58 54.32 1d5x n ASN 60 Cb 0.59 -0.31 0.00 0.00 1.24 0.00 0.00 39.78 41.30 1d5x n ASN 60 CO 0.00 0.00 0.00 -0.72 -2.11 0.00 0.00 177.26 174.43 1d5x s TYR 61 N -2.61 -0.02 0.00 1.20 -0.85 -1.26 -4.85 117.35 108.96 1d5x s TYR 61 Ca 0.25 -0.28 0.00 0.00 -0.52 0.00 0.00 57.07 56.52 1d5x s TYR 61 Cb 0.19 0.65 0.00 0.00 0.38 0.00 0.00 41.96 43.17 1d5x s TYR 61 CO 0.44 -0.75 0.00 -3.47 -1.52 0.00 0.00 175.55 170.25 1d5x n ASP 62 N -0.82 0.19 -4.58 -0.18 4.64 -1.26 -4.34 116.55 110.20 1d5x n ASP 62 Ca -0.05 0.00 -0.36 0.00 -1.38 0.00 0.00 54.79 53.01 1d5x n ASP 62 Cb 0.60 0.00 -0.11 0.00 -1.04 0.00 0.00 41.12 40.58 1d5x n ASP 62 CO 0.00 0.00 0.00 0.20 -0.82 0.00 0.00 177.20 176.58 1d5x s ASN 63 N -4.00 5.60 -0.08 1.67 0.01 -1.26 -0.61 114.94 116.26 1d5x s ASN 63 Ca 0.00 -0.00 0.02 0.00 -0.71 0.00 0.00 52.86 52.16 1d5x s ASN 63 Cb 0.00 -1.99 -0.02 0.00 0.41 0.00 0.00 41.25 39.65 1d5x s ASN 63 CO 0.00 0.08 -0.12 -0.69 -1.51 0.00 0.00 177.10 174.86 1d5x s VAL 64 N 0.95 3.23 -0.18 1.60 1.01 -0.48 -3.10 120.40 123.43 1d5x s VAL 64 Ca 0.05 -0.64 -0.05 0.00 0.00 0.00 0.00 61.98 61.34 1d5x s VAL 64 Cb -0.14 -2.31 -0.03 0.00 0.00 0.00 0.00 36.38 33.90 1d5x s VAL 64 CO 0.03 0.57 0.01 -0.60 0.00 0.00 0.00 175.10 175.11 1d5x s ARG 65 N -0.37 3.76 -0.16 2.72 3.52 -0.90 -0.28 118.95 127.25 1d5x s ARG 65 Ca 0.04 -0.46 0.00 0.00 -0.13 0.00 0.00 55.73 55.18 1d5x s ARG 65 Cb -0.12 -3.07 0.00 0.00 -1.56 0.00 0.00 34.95 30.20 1d5x s ARG 65 CO 0.02 0.18 -0.16 0.08 -0.81 0.00 0.00 175.30 174.62 1d5x s VAL 66 N 0.56 2.52 0.01 7.11 1.01 0.01 -1.37 120.40 130.25 1d5x s VAL 66 Ca -0.00 -0.81 0.02 0.00 0.00 0.00 0.00 61.98 61.19 1d5x s VAL 66 Cb -0.14 -2.07 -0.04 0.00 0.00 0.00 0.00 36.38 34.14 1d5x s VAL 66 CO 0.02 0.52 -0.01 -1.61 0.00 0.00 0.00 175.10 174.02 1d5x s GLU 67 N 0.98 2.72 0.44 2.72 2.02 -0.62 -0.50 118.70 126.45 1d5x s GLU 67 Ca -0.02 -0.66 0.05 0.00 0.02 0.00 0.00 54.97 54.36 1d5x s GLU 67 Cb -0.15 -2.63 -0.05 0.00 0.10 0.00 0.00 34.13 31.40 1d5x s GLU 67 CO -0.03 0.61 0.04 -0.06 0.02 0.00 0.00 175.26 175.83 1d5x s PHE 68 N -1.11 2.30 0.28 1.61 0.40 0.11 -1.62 117.98 119.96 1d5x s PHE 68 Ca 0.20 -0.75 -0.00 0.00 -0.60 0.00 0.00 56.93 55.78 1d5x s PHE 68 Cb -0.11 -1.75 0.41 0.00 0.51 0.00 0.00 43.02 42.08 1d5x s PHE 68 CO 0.11 0.33 1.79 -0.22 0.70 0.00 0.00 175.22 177.94 1d5x h LYS 69 N 1.58 0.71 0.00 0.44 3.64 -1.55 -3.46 116.57 117.93 1d5x h LYS 69 Ca -0.44 -0.18 -0.02 0.00 -1.27 0.00 0.00 60.65 58.74 1d5x h LYS 69 Cb 1.27 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.99 1d5x h LYS 69 CO 0.77 0.72 0.01 0.27 -2.27 0.00 0.00 179.45 178.96 1d5x n ASN 70 N -4.23 -0.26 0.09 4.20 0.23 -1.26 -5.06 115.26 108.97 1d5x n ASN 70 Ca 0.02 -1.25 -0.07 0.00 -0.53 0.00 0.00 54.58 52.75 1d5x n ASN 70 Cb 0.28 0.46 0.03 0.00 -2.08 0.00 0.00 39.78 38.47 1d5x n ASN 70 CO 0.00 0.00 0.00 0.50 -0.93 0.00 0.00 177.26 176.83 1d5x h LYS 71 N 0.00 0.17 -0.53 -3.83 3.64 -1.90 -3.25 116.57 110.87 1d5x h LYS 71 Ca -0.04 -0.17 0.11 0.00 -1.27 0.00 0.00 60.65 59.28 1d5x h LYS 71 Cb 0.17 0.04 -0.09 0.00 -0.41 0.00 0.00 32.23 31.95 1d5x h LYS 71 CO 0.06 0.88 -0.02 -0.44 -2.27 0.00 0.00 179.45 177.66 1d5x h ASP 72 N 0.10 -0.26 -0.21 4.20 5.19 -1.97 -0.67 116.42 122.80 1d5x h ASP 72 Ca -0.03 0.13 -0.02 0.00 -0.62 0.00 0.00 57.03 56.49 1d5x h ASP 72 Cb 1.39 0.24 -0.01 0.00 0.18 0.00 0.00 39.33 41.13 1d5x h ASP 72 CO 0.12 -0.10 0.05 -0.07 -3.12 0.00 0.00 179.24 176.13 1d5x h LEU 73 N 0.10 0.32 -1.33 1.55 4.07 -1.96 0.71 115.31 118.77 1d5x h LEU 73 Ca 0.27 -0.23 0.08 0.00 0.08 0.00 0.00 57.88 58.08 1d5x h LEU 73 Cb 0.41 -0.08 -0.05 0.00 1.08 0.00 0.00 40.66 42.02 1d5x h LEU 73 CO -0.46 0.46 0.52 0.00 -1.08 0.00 0.00 178.44 177.88 1d5x h ALA 74 N 0.87 1.71 -0.09 1.53 0.00 -1.47 -1.65 119.26 120.17 1d5x h ALA 74 Ca 0.07 -0.01 -0.24 0.00 0.00 0.00 0.00 54.91 54.72 1d5x h ALA 74 Cb 0.27 -0.19 0.02 0.00 0.00 0.00 0.00 17.79 17.89 1d5x h ALA 74 CO 0.00 0.14 -0.89 -0.44 0.00 0.00 0.00 179.25 178.06 1d5x h ASP 75 N 0.77 0.93 -0.41 0.00 3.32 -0.75 -1.80 116.42 118.49 1d5x h ASP 75 Ca 0.35 -0.68 0.08 0.00 0.02 0.00 0.00 57.03 56.81 1d5x h ASP 75 Cb 0.37 -0.28 -0.09 0.00 0.22 0.00 0.00 39.33 39.54 1d5x h ASP 75 CO -0.13 1.47 -0.34 0.11 -1.72 0.00 0.00 179.24 178.63 1d5x h LYS 76 N 0.47 -0.25 -0.36 3.56 1.57 0.10 -2.57 116.57 119.09 1d5x h LYS 76 Ca -0.09 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1d5x h LYS 76 Cb 1.53 0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.90 1d5x h LYS 76 CO 0.18 -0.17 0.00 0.66 -0.57 0.00 0.00 179.45 179.55 1d5x n TYR 77 N -5.42 0.46 0.00 -1.35 4.02 -1.01 -4.76 117.16 109.11 1d5x n TYR 77 Ca 0.01 -0.23 0.00 0.00 -0.01 0.00 0.00 57.90 57.67 1d5x n TYR 77 Cb 0.34 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.66 1d5x n TYR 77 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02 1d5x n LYS 78 N 1.08 0.00 -2.24 -0.72 4.81 -0.67 -3.44 118.16 116.97 1d5x n LYS 78 Ca 0.18 0.08 -0.42 0.00 -0.87 0.00 0.00 58.31 57.28 1d5x n LYS 78 Cb 0.50 -0.62 0.00 0.00 0.02 0.00 0.00 35.03 34.93 1d5x n LYS 78 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1d5x n ASP 79 N -0.20 5.65 -3.96 3.14 9.92 -1.26 -3.89 116.55 125.96 1d5x n ASP 79 Ca 0.00 -3.11 -0.08 0.00 -0.53 0.00 0.00 54.79 51.07 1d5x n ASP 79 Cb 0.00 -1.46 -0.09 0.00 -0.64 0.00 0.00 41.12 38.93 1d5x n ASP 79 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 1d5x s LYS 80 N 0.17 0.70 -0.20 -1.24 1.02 -1.22 -5.08 119.74 113.89 1d5x s LYS 80 Ca 0.43 -1.01 -0.16 0.00 0.02 0.00 0.00 55.97 55.25 1d5x s LYS 80 Cb 0.11 0.27 -0.04 0.00 -0.52 0.00 0.00 37.83 37.66 1d5x s LYS 80 CO -0.02 -0.18 0.43 0.71 -0.92 0.00 0.00 175.35 175.37 1d5x s TYR 81 N -3.60 3.37 0.33 3.18 1.51 -1.26 -4.32 117.35 116.56 1d5x s TYR 81 Ca 0.03 0.65 0.04 0.00 -1.01 0.00 0.00 57.07 56.78 1d5x s TYR 81 Cb 0.05 -2.56 -0.06 0.00 -0.11 0.00 0.00 41.96 39.27 1d5x s TYR 81 CO -0.09 -0.03 0.06 0.14 -1.11 0.00 0.00 175.55 174.52 1d5x s VAL 82 N 1.38 1.17 -0.18 0.71 -7.23 -0.05 -2.20 120.40 114.00 1d5x s VAL 82 Ca 0.20 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.31 1d5x s VAL 82 Cb -0.15 -2.79 -0.04 0.00 0.56 0.00 0.00 36.38 33.97 1d5x s VAL 82 CO 0.08 0.00 0.03 -1.81 -0.31 0.00 0.00 175.10 173.09 1d5x s ASP 83 N -3.49 5.30 -0.07 4.85 1.11 0.35 -1.75 116.67 122.97 1d5x s ASP 83 Ca 0.36 -0.01 -0.01 0.00 0.18 0.00 0.00 52.55 53.07 1d5x s ASP 83 Cb 0.09 -1.90 -0.03 0.00 1.07 0.00 0.00 42.92 42.15 1d5x s ASP 83 CO 0.15 0.16 -0.01 -0.69 1.18 0.00 0.00 175.17 175.97 1d5x s VAL 84 N 0.43 4.23 -0.29 -1.27 1.01 0.16 -1.18 120.40 123.50 1d5x s VAL 84 Ca 0.01 -0.31 -0.15 0.00 0.00 0.00 0.00 61.98 61.52 1d5x s VAL 84 Cb -0.13 -2.79 0.13 0.00 0.00 0.00 0.00 36.38 33.60 1d5x s VAL 84 CO 0.01 0.58 0.88 0.12 0.00 0.00 0.00 175.10 176.70 1d5x s PHE 85 N -0.90 -0.77 0.00 5.22 5.36 -0.80 -0.70 117.98 125.39 1d5x s PHE 85 Ca 0.14 1.48 0.00 0.00 -0.96 0.00 0.00 56.93 57.59 1d5x s PHE 85 Cb -0.11 0.46 0.00 0.00 -0.34 0.00 0.00 43.02 43.03 1d5x s PHE 85 CO 0.03 -0.38 0.00 0.41 -1.46 0.00 0.00 175.22 173.82 1d5x n GLY 86 N 4.24 -0.54 3.71 13.12 0.00 -0.92 -4.31 105.19 120.49 1d5x n GLY 86 Ca -0.16 -0.99 -0.41 0.00 0.00 0.00 0.00 46.02 44.46 1d5x n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d5x s ALA 87 N -2.00 3.32 0.24 4.61 0.00 -1.26 -0.68 121.76 125.99 1d5x s ALA 87 Ca 0.00 0.24 0.09 0.00 0.00 0.00 0.00 51.96 52.29 1d5x s ALA 87 Cb 0.00 -3.12 -0.04 0.00 0.00 0.00 0.00 23.12 19.95 1d5x s ALA 87 CO 0.00 -0.25 -0.02 0.54 0.00 0.00 0.00 175.76 176.03 1d5x s ASN 88 N 0.93 4.52 0.04 0.00 4.22 -1.26 -4.50 114.94 118.88 1d5x s ASN 88 Ca 0.42 -0.61 0.01 0.00 -2.14 0.00 0.00 52.86 50.54 1d5x s ASN 88 Cb -0.18 -0.84 -0.03 0.00 1.28 0.00 0.00 41.25 41.48 1d5x s ASN 88 CO 0.20 0.03 -0.05 -0.72 -2.04 0.00 0.00 177.10 174.52 1d5x s TYR 89 N -2.15 0.47 -0.10 1.54 -0.85 -0.24 -4.86 117.35 111.16 1d5x s TYR 89 Ca 0.30 -0.63 0.03 0.00 -0.52 0.00 0.00 57.07 56.25 1d5x s TYR 89 Cb -0.07 -0.31 -0.08 0.00 0.38 0.00 0.00 41.96 41.88 1d5x s TYR 89 CO 0.19 -0.18 -0.06 0.66 -1.52 0.00 0.00 175.55 174.64 1d5x n TYR 90 N 1.22 0.00 0.00 -3.49 4.02 -1.26 -1.63 117.16 116.01 1d5x n TYR 90 Ca -0.21 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.68 1d5x n TYR 90 Cb 0.56 -0.42 0.00 0.00 -0.02 0.00 0.00 39.34 39.47 1d5x n TYR 90 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 176.86 176.83 1d5x n TYR 91 N -2.67 0.00 -1.80 -0.72 9.36 -1.26 -2.10 117.16 117.98 1d5x n TYR 91 Ca -0.17 0.00 -0.27 0.00 3.32 0.00 0.00 57.90 60.77 1d5x n TYR 91 Cb 0.72 -0.02 0.04 0.00 -0.63 0.00 0.00 39.34 39.46 1d5x n TYR 91 CO 0.00 0.00 0.00 1.04 0.22 0.00 0.00 176.86 178.12 1d5x n GLN 92 N -0.87 3.30 -2.55 2.98 6.02 -1.26 -4.99 117.38 120.01 1d5x n GLN 92 Ca 0.00 -3.88 -0.43 0.00 -0.01 0.00 0.00 57.00 52.68 1d5x n GLN 92 Cb 0.00 -2.28 -0.02 0.00 1.02 0.00 0.00 30.24 28.96 1d5x n GLN 92 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1d5x s TYR 94 N 3.33 0.80 -0.29 0.00 1.51 -1.26 -4.69 117.35 116.75 1d5x s TYR 94 Ca 0.49 -0.16 -0.34 0.00 -1.01 0.00 0.00 57.07 56.05 1d5x s TYR 94 Cb -0.18 -0.52 0.17 0.00 -0.11 0.00 0.00 41.96 41.32 1d5x s TYR 94 CO 0.10 -0.02 1.37 -0.59 -1.11 0.00 0.00 175.55 175.30 1d5x s PHE 95 N -0.15 -0.02 -0.44 2.71 -0.12 -1.26 -5.08 117.98 113.61 1d5x s PHE 95 Ca 0.03 0.03 0.06 0.00 -0.05 0.00 0.00 56.93 57.00 1d5x s PHE 95 Cb -0.04 0.50 0.22 0.00 -0.63 0.00 0.00 43.02 43.07 1d5x s PHE 95 CO -0.00 -0.03 0.61 0.45 -0.05 0.00 0.00 175.22 176.20 1d5x n SER 96 N 0.22 -1.30 0.00 1.98 2.88 -1.26 -5.15 113.62 111.00 1d5x n SER 96 Ca 0.03 -2.82 0.00 0.00 -1.33 0.00 0.00 58.87 54.75 1d5x n SER 96 Cb 0.57 0.37 0.00 0.00 -0.75 0.00 0.00 64.21 64.40 1d5x n SER 96 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1d5x n LYS 111 N 2.00 0.00 -4.18 -1.46 4.76 -1.26 -4.84 118.16 113.17 1d5x n LYS 111 Ca 0.19 0.00 -0.12 0.00 -2.87 0.00 0.00 58.31 55.51 1d5x n LYS 111 Cb 0.55 0.00 -0.10 0.00 -1.84 0.00 0.00 35.03 33.64 1d5x n LYS 111 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 1d5x s THR 112 N 0.00 0.82 0.14 -0.18 -1.32 -1.18 -4.66 115.64 109.25 1d5x s THR 112 Ca 0.00 -1.87 0.04 0.00 -1.21 0.00 0.00 61.69 58.65 1d5x s THR 112 Cb 0.00 -1.61 -0.04 0.00 -1.51 0.00 0.00 72.50 69.33 1d5x s THR 112 CO 0.00 -0.78 -0.10 0.00 -2.21 0.00 0.00 174.62 171.53 1d5x s MET 114 N -3.71 1.75 0.05 0.00 0.23 -0.47 -1.08 119.30 116.07 1d5x s MET 114 Ca 0.16 -1.05 0.08 0.00 -1.03 0.00 0.00 55.69 53.85 1d5x s MET 114 Cb 0.03 0.55 -0.03 0.00 -1.53 0.00 0.00 34.83 33.85 1d5x s MET 114 CO -0.00 -0.81 -0.22 0.71 -2.03 0.00 0.00 175.02 172.67 1d5x s TYR 115 N -3.08 1.88 0.00 3.16 1.51 -1.26 -1.59 117.35 117.97 1d5x s TYR 115 Ca 0.14 -0.38 0.00 0.00 -1.01 0.00 0.00 57.07 55.82 1d5x s TYR 115 Cb -0.04 -1.12 0.00 0.00 -0.11 0.00 0.00 41.96 40.69 1d5x s TYR 115 CO 0.07 0.10 0.00 0.41 -1.11 0.00 0.00 175.55 175.03 1d5x n GLY 116 N 1.79 2.90 3.83 0.71 0.00 -0.64 -4.65 105.19 109.13 1d5x n GLY 116 Ca -0.17 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.77 1d5x n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1d5x n GLY 117 N 0.00 1.09 3.89 -0.02 0.00 -1.26 -4.86 105.19 104.03 1d5x n GLY 117 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1d5x n GLY 117 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1d5x s VAL 118 N -2.16 4.76 -0.28 1.61 -7.23 -1.26 -1.91 120.40 113.94 1d5x s VAL 118 Ca 0.00 0.47 -0.20 0.00 -1.81 0.00 0.00 61.98 60.44 1d5x s VAL 118 Cb 0.00 -3.85 0.08 0.00 0.56 0.00 0.00 36.38 33.17 1d5x s VAL 118 CO 0.00 -0.95 0.74 0.28 -0.31 0.00 0.00 175.10 174.85 1d5x s THR 119 N -2.94 0.00 0.28 5.32 -1.32 -0.32 -4.91 115.64 111.75 1d5x s THR 119 Ca 0.51 0.00 -0.28 0.00 -1.21 0.00 0.00 61.69 60.71 1d5x s THR 119 Cb -0.11 -1.00 -0.14 0.00 -1.51 0.00 0.00 72.50 69.74 1d5x s THR 119 CO 0.49 0.00 0.97 1.21 -2.21 0.00 0.00 174.62 175.07 1d5x n GLU 120 N 3.48 1.21 -0.02 7.08 0.00 -1.26 0.13 120.64 131.26 1d5x n GLU 120 Ca -0.17 0.42 -0.01 0.00 0.00 0.00 0.00 57.16 57.41 1d5x n GLU 120 Cb 0.57 -1.76 -0.00 0.00 0.00 0.00 0.00 31.44 30.24 1d5x n GLU 120 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.13 178.38 1d5x h HIS 121 N 1.95 0.00 -3.04 4.31 -0.00 -1.74 -3.41 115.15 113.22 1d5x h HIS 121 Ca -0.38 0.00 -0.53 0.00 -0.00 0.00 0.00 60.37 59.46 1d5x h HIS 121 Cb 1.35 0.00 0.08 0.00 -0.00 0.00 0.00 27.41 28.84 1d5x h HIS 121 CO 0.47 0.00 0.94 0.09 -0.00 0.00 0.00 177.93 179.43 1d5x n ASN 122 N -3.06 3.94 0.00 3.26 3.02 -1.26 -2.29 115.26 118.87 1d5x n ASN 122 Ca -0.01 1.11 0.00 0.00 -0.03 0.00 0.00 54.58 55.65 1d5x n ASN 122 Cb 0.05 -1.59 0.00 0.00 -0.61 0.00 0.00 39.78 37.63 1d5x n ASN 122 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1d5x n GLY 123 N 2.87 2.38 0.81 7.41 0.00 -1.26 -4.80 105.19 112.60 1d5x n GLY 123 Ca 0.11 -0.19 -0.00 0.00 0.00 0.00 0.00 46.02 45.95 1d5x n GLY 123 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1d5x n ASN 124 N 1.01 2.18 -4.76 1.61 5.15 -0.97 -4.84 115.26 114.63 1d5x n ASN 124 Ca 0.00 -2.03 -0.32 0.00 -0.60 0.00 0.00 54.58 51.63 1d5x n ASN 124 Cb 0.00 -0.51 -0.07 0.00 -0.53 0.00 0.00 39.78 38.67 1d5x n ASN 124 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1d5x s GLN 125 N -0.50 2.19 -0.29 1.20 -1.52 -1.26 -2.90 119.66 116.57 1d5x s GLN 125 Ca 0.01 -2.37 -0.24 0.00 -1.95 0.00 0.00 55.36 50.82 1d5x s GLN 125 Cb 0.01 -1.57 0.17 0.00 -0.22 0.00 0.00 33.01 31.40 1d5x s GLN 125 CO 0.00 -0.35 1.26 -0.48 -0.25 0.00 0.00 175.29 175.47 1d5x s LEU 126 N -3.89 -0.22 0.38 2.90 2.34 -1.23 -4.67 118.68 114.29 1d5x s LEU 126 Ca 0.09 0.41 0.06 0.00 0.06 0.00 0.00 54.13 54.75 1d5x s LEU 126 Cb 0.02 1.41 0.78 0.00 -0.56 0.00 0.00 46.19 47.84 1d5x s LEU 126 CO 0.05 -0.07 2.00 0.44 -1.06 0.00 0.00 176.35 177.70 1d5x h ASP 127 N 3.81 0.59 -2.52 1.48 5.19 -2.01 -3.44 116.42 119.52 1d5x h ASP 127 Ca -0.27 -0.00 -0.55 0.00 -0.62 0.00 0.00 57.03 55.58 1d5x h ASP 127 Cb 1.19 -0.13 -0.07 0.00 0.18 0.00 0.00 39.33 40.49 1d5x h ASP 127 CO 0.16 0.40 -0.57 -0.54 -3.12 0.00 0.00 179.24 175.57 1d5x s LYS 128 N -5.61 2.81 0.20 3.56 1.02 -1.26 -5.11 119.74 115.35 1d5x s LYS 128 Ca -0.09 -1.00 -0.29 0.00 0.02 0.00 0.00 55.97 54.61 1d5x s LYS 128 Cb 0.19 -2.55 -0.08 0.00 -0.52 0.00 0.00 37.83 34.86 1d5x s LYS 128 CO 0.76 0.44 0.90 0.71 -0.92 0.00 0.00 175.35 177.25 1d5x s TYR 129 N -1.91 3.93 0.41 3.18 1.51 -1.26 -4.72 117.35 118.48 1d5x s TYR 129 Ca 0.31 1.83 -0.01 0.00 -1.01 0.00 0.00 57.07 58.19 1d5x s TYR 129 Cb -0.09 -2.94 -0.03 0.00 -0.11 0.00 0.00 41.96 38.79 1d5x s TYR 129 CO 0.23 0.42 0.64 1.03 -1.11 0.00 0.00 175.55 176.76 1d5x s ARG 130 N -0.93 3.41 -0.12 -0.62 0.52 0.10 -4.87 118.95 116.44 1d5x s ARG 130 Ca 0.41 -0.21 0.02 0.00 -0.52 0.00 0.00 55.73 55.43 1d5x s ARG 130 Cb -0.25 -2.56 -0.01 0.00 0.52 0.00 0.00 34.95 32.66 1d5x s ARG 130 CO 0.30 -0.04 -0.19 -1.12 0.02 0.00 0.00 175.30 174.27 1d5x s SER 131 N -4.09 3.46 -0.17 0.23 0.01 -1.26 -2.45 113.70 109.43 1d5x s SER 131 Ca 0.44 -0.47 -0.05 0.00 1.31 0.00 0.00 55.95 57.18 1d5x s SER 131 Cb -0.10 -1.49 -0.03 0.00 0.21 0.00 0.00 66.02 64.61 1d5x s SER 131 CO 0.39 0.15 -0.00 -0.63 0.41 0.00 0.00 173.24 173.56 1d5x s ILE 132 N 0.39 4.16 0.20 1.44 1.01 0.43 -4.93 121.20 123.90 1d5x s ILE 132 Ca -0.15 -0.26 -0.30 0.00 0.00 0.00 0.00 60.65 59.94 1d5x s ILE 132 Cb -0.17 -2.85 -0.08 0.00 0.01 0.00 0.00 42.46 39.37 1d5x s ILE 132 CO 0.07 0.47 0.95 -0.89 0.00 0.00 0.00 174.94 175.54 1d5x s THR 133 N 0.46 4.19 -0.27 2.92 2.01 -1.26 -1.30 115.64 122.39 1d5x s THR 133 Ca -0.01 2.08 -0.01 0.00 0.31 0.00 0.00 61.69 64.06 1d5x s THR 133 Cb -0.14 -4.33 0.08 0.00 0.01 0.00 0.00 72.50 68.13 1d5x s THR 133 CO 0.02 0.45 0.05 -0.69 -0.69 0.00 0.00 174.62 173.76 1d5x s VAL 134 N -0.85 1.03 -0.25 3.82 1.01 0.27 -2.40 120.40 123.03 1d5x s VAL 134 Ca 0.43 -1.23 -0.15 0.00 0.00 0.00 0.00 61.98 61.02 1d5x s VAL 134 Cb -0.25 -1.62 -0.04 0.00 0.00 0.00 0.00 36.38 34.47 1d5x s VAL 134 CO 0.31 -0.44 0.39 -0.13 0.00 0.00 0.00 175.10 175.24 1d5x s ARG 135 N 1.57 4.07 -0.28 2.72 0.52 -1.21 -0.10 118.95 126.24 1d5x s ARG 135 Ca 0.04 0.11 -0.11 0.00 -0.52 0.00 0.00 55.73 55.25 1d5x s ARG 135 Cb -0.18 -3.62 -0.05 0.00 0.52 0.00 0.00 34.95 31.62 1d5x s ARG 135 CO -0.16 -0.21 0.19 0.08 0.02 0.00 0.00 175.30 175.22 1d5x s VAL 136 N 1.86 5.31 -0.66 3.52 1.01 0.14 -2.62 120.40 128.97 1d5x s VAL 136 Ca 0.17 0.18 -0.11 0.00 0.00 0.00 0.00 61.98 62.22 1d5x s VAL 136 Cb -0.15 -3.53 0.17 0.00 0.00 0.00 0.00 36.38 32.86 1d5x s VAL 136 CO 0.09 0.25 0.56 -0.36 0.00 0.00 0.00 175.10 175.64 1d5x s PHE 137 N 1.75 3.53 -0.52 5.22 2.99 0.13 -2.93 117.98 128.15 1d5x s PHE 137 Ca 0.07 -1.97 -0.24 0.00 0.00 0.00 0.00 56.93 54.80 1d5x s PHE 137 Cb -0.16 -3.63 0.04 0.00 0.00 0.00 0.00 43.02 39.27 1d5x s PHE 137 CO 0.11 -0.97 0.89 -1.21 -0.00 0.00 0.00 175.22 174.04 1d5x s GLU 138 N 0.66 3.34 -0.96 0.44 8.01 -0.12 -0.95 118.70 129.12 1d5x s GLU 138 Ca 0.12 -0.26 -0.02 0.00 0.01 0.00 0.00 54.97 54.82 1d5x s GLU 138 Cb -0.19 -4.03 -0.02 0.00 -4.31 0.00 0.00 34.13 25.58 1d5x s GLU 138 CO -0.04 -1.38 0.81 -0.25 0.01 0.00 0.00 175.26 174.41 1d5x n ASP 139 N 7.21 -3.35 0.00 -0.19 8.00 0.19 -2.32 116.55 126.09 1d5x n ASP 139 Ca 0.01 -0.54 0.00 0.00 0.71 0.00 0.00 54.79 54.97 1d5x n ASP 139 Cb 0.47 -4.39 0.00 0.00 -0.02 0.00 0.00 41.12 37.18 1d5x n ASP 139 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1d5x n GLY 140 N -1.17 0.81 3.34 0.44 0.00 -1.26 -4.97 105.19 102.38 1d5x n GLY 140 Ca -0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.50 1d5x n GLY 140 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d5x s LYS 141 N -0.34 3.37 -1.09 1.61 -0.14 -0.98 -5.02 119.74 117.14 1d5x s LYS 141 Ca 0.00 -0.67 -0.22 0.00 -1.36 0.00 0.00 55.97 53.72 1d5x s LYS 141 Cb 0.00 -2.76 0.01 0.00 -1.68 0.00 0.00 37.83 33.40 1d5x s LYS 141 CO 0.00 0.05 1.70 1.21 -0.76 0.00 0.00 175.35 177.55 1d5x s ASN 142 N 0.78 6.08 0.00 2.83 2.47 -1.26 -0.95 114.94 124.89 1d5x s ASN 142 Ca -0.04 -1.58 0.24 0.00 0.42 0.00 0.00 52.86 51.91 1d5x s ASN 142 Cb -0.15 -2.57 0.33 0.00 -1.45 0.00 0.00 41.25 37.41 1d5x s ASN 142 CO 0.01 -1.92 1.31 0.18 -3.72 0.00 0.00 177.10 172.96 1d5x n LEU 143 N 10.67 1.81 -3.65 3.21 4.77 -1.15 -4.90 117.00 127.75 1d5x n LEU 143 Ca 0.40 -0.62 -0.05 0.00 -0.03 0.00 0.00 56.01 55.72 1d5x n LEU 143 Cb 0.48 -0.04 -0.06 0.00 -2.33 0.00 0.00 43.42 41.47 1d5x n LEU 143 CO 0.68 0.33 0.18 -0.22 -1.33 0.00 0.00 177.39 177.02 1d5x s LEU 144 N -2.39 -0.91 -0.07 2.23 2.96 -1.24 -5.05 118.68 114.21 1d5x s LEU 144 Ca 0.23 1.34 0.04 0.00 -0.22 0.00 0.00 54.13 55.52 1d5x s LEU 144 Cb 0.19 1.95 0.00 0.00 0.50 0.00 0.00 46.19 48.83 1d5x s LEU 144 CO 0.50 -0.22 -0.20 -0.44 -1.32 0.00 0.00 176.35 174.67 1d5x s SER 145 N 2.61 2.56 0.19 3.68 0.01 -1.26 0.29 113.70 121.78 1d5x s SER 145 Ca -0.05 -0.44 -0.12 0.00 1.31 0.00 0.00 55.95 56.64 1d5x s SER 145 Cb -0.11 -1.02 0.00 0.00 0.21 0.00 0.00 66.02 65.10 1d5x s SER 145 CO -0.17 0.14 0.40 0.72 0.41 0.00 0.00 173.24 174.74 1d5x s PHE 146 N 0.30 0.24 0.08 2.43 -0.71 0.86 -4.97 117.98 116.21 1d5x s PHE 146 Ca -0.13 -0.60 0.05 0.00 -1.04 0.00 0.00 56.93 55.21 1d5x s PHE 146 Cb -0.16 0.13 -0.04 0.00 -1.21 0.00 0.00 43.02 41.75 1d5x s PHE 146 CO 0.06 -0.84 -0.03 -0.51 -1.34 0.00 0.00 175.22 172.55 1d5x s ASP 147 N -2.95 4.86 0.02 1.98 1.01 -1.26 0.93 116.67 121.26 1d5x s ASP 147 Ca 0.16 -0.21 0.07 0.00 0.71 0.00 0.00 52.55 53.29 1d5x s ASP 147 Cb 0.01 -1.12 -0.02 0.00 1.01 0.00 0.00 42.92 42.80 1d5x s ASP 147 CO 0.01 0.19 -0.22 0.68 0.21 0.00 0.00 175.17 176.04 1d5x s VAL 148 N -1.25 1.78 0.26 -1.27 -7.23 -0.42 -4.93 120.40 107.34 1d5x s VAL 148 Ca 0.24 -1.12 0.07 0.00 -1.81 0.00 0.00 61.98 59.36 1d5x s VAL 148 Cb -0.11 -1.51 -0.04 0.00 0.56 0.00 0.00 36.38 35.28 1d5x s VAL 148 CO 0.16 0.36 0.21 -1.10 -0.31 0.00 0.00 175.10 174.42 1d5x s GLN 149 N -0.89 2.94 -0.17 4.82 1.11 -1.26 -0.43 119.66 125.78 1d5x s GLN 149 Ca 0.09 -1.05 -0.29 0.00 0.01 0.00 0.00 55.36 54.12 1d5x s GLN 149 Cb -0.09 -2.57 0.10 0.00 -1.01 0.00 0.00 33.01 29.44 1d5x s GLN 149 CO 0.01 0.39 0.88 -0.08 0.01 0.00 0.00 175.29 176.50 1d5x s THR 150 N -2.14 0.00 -0.27 -0.19 -1.32 -1.03 -4.96 115.64 105.73 1d5x s THR 150 Ca 0.33 0.00 0.09 0.00 -1.21 0.00 0.00 61.69 60.90 1d5x s THR 150 Cb -0.08 -1.00 0.48 0.00 -1.51 0.00 0.00 72.50 70.39 1d5x s THR 150 CO 0.25 0.00 1.38 -0.46 -2.21 0.00 0.00 174.62 173.58 1d5x n ASN 151 N 1.37 2.39 -4.20 8.08 6.94 -1.26 0.01 115.26 128.58 1d5x n ASN 151 Ca -0.14 -3.84 -0.30 0.00 -0.02 0.00 0.00 54.58 50.29 1d5x n ASN 151 Cb 0.57 -0.59 -0.17 0.00 -2.36 0.00 0.00 39.78 37.23 1d5x n ASN 151 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1d5x s LYS 152 N -3.28 2.45 0.13 -3.83 1.02 -1.26 -3.50 119.74 111.47 1d5x s LYS 152 Ca 0.43 -0.79 -0.18 0.00 0.02 0.00 0.00 55.97 55.45 1d5x s LYS 152 Cb 0.40 -2.00 -0.02 0.00 -0.52 0.00 0.00 37.83 35.68 1d5x s LYS 152 CO -0.03 0.26 1.78 0.87 -0.92 0.00 0.00 175.35 177.31 1d5x h LYS 153 N 6.37 0.30 -5.16 1.68 1.57 -1.80 -3.39 116.57 116.13 1d5x h LYS 153 Ca -0.28 -0.02 -0.66 0.00 -1.87 0.00 0.00 60.65 57.82 1d5x h LYS 153 Cb 1.19 -0.07 -0.30 0.00 0.08 0.00 0.00 32.23 33.14 1d5x h LYS 153 CO 0.47 0.20 -0.79 0.21 -0.57 0.00 0.00 179.45 178.97 1d5x s LYS 154 N -6.17 3.25 0.20 3.15 2.20 -1.26 -0.28 119.74 120.83 1d5x s LYS 154 Ca -0.13 -0.72 0.10 0.00 -0.36 0.00 0.00 55.97 54.85 1d5x s LYS 154 Cb 0.10 -2.69 -0.04 0.00 -1.51 0.00 0.00 37.83 33.68 1d5x s LYS 154 CO 0.70 -0.01 -0.12 0.08 -0.36 0.00 0.00 175.35 175.64 1d5x s VAL 155 N 0.91 3.00 0.46 4.02 1.01 0.39 -4.90 120.40 125.30 1d5x s VAL 155 Ca -0.03 -1.82 -0.14 0.00 0.00 0.00 0.00 61.98 59.99 1d5x s VAL 155 Cb -0.15 -2.50 -0.07 0.00 0.00 0.00 0.00 36.38 33.66 1d5x s VAL 155 CO -0.01 -0.16 0.89 0.42 0.00 0.00 0.00 175.10 176.24 1d5x s THR 156 N -1.83 4.63 0.26 3.92 -4.23 -1.26 0.13 115.64 117.25 1d5x s THR 156 Ca 0.25 1.00 -0.02 0.00 -1.18 0.00 0.00 61.69 61.74 1d5x s THR 156 Cb -0.08 -3.72 0.10 0.00 1.34 0.00 0.00 72.50 70.15 1d5x s THR 156 CO 0.15 -0.59 1.75 0.00 -0.54 0.00 0.00 174.62 175.38 1d5x h ALA 157 N 1.13 1.09 -0.51 3.99 0.00 -1.60 -3.00 119.26 120.36 1d5x h ALA 157 Ca -0.47 -0.28 0.07 0.00 0.00 0.00 0.00 54.91 54.24 1d5x h ALA 157 Cb 1.18 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 18.73 1d5x h ALA 157 CO 0.62 0.57 0.16 0.37 0.00 0.00 0.00 179.25 180.98 1d5x h GLN 158 N 0.70 0.31 -0.43 0.00 4.15 -1.92 0.40 115.11 118.32 1d5x h GLN 158 Ca 0.13 -0.02 0.02 0.00 0.77 0.00 0.00 58.65 59.56 1d5x h GLN 158 Cb 0.49 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 28.08 1d5x h GLN 158 CO 0.03 0.21 0.24 1.49 -1.93 0.00 0.00 178.83 178.87 1d5x h GLU 159 N 0.32 0.48 -0.38 1.69 4.81 -1.79 -0.80 114.58 118.91 1d5x h GLU 159 Ca 0.25 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.42 1d5x h GLU 159 Cb 0.29 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 1d5x h GLU 159 CO -0.27 0.31 0.13 -0.07 -0.73 0.00 0.00 179.01 178.38 1d5x h LEU 160 N 0.49 0.54 -0.26 1.64 3.38 -1.32 -1.46 115.31 118.32 1d5x h LEU 160 Ca 0.18 -0.19 0.04 0.00 0.09 0.00 0.00 57.88 58.00 1d5x h LEU 160 Cb 0.04 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.60 1d5x h LEU 160 CO -0.10 0.59 -0.00 -0.78 0.09 0.00 0.00 178.44 178.24 1d5x h ASP 161 N 0.46 -0.11 -0.40 -0.43 1.82 0.01 -0.86 116.42 116.91 1d5x h ASP 161 Ca 0.12 0.06 -0.00 0.00 -0.39 0.00 0.00 57.03 56.82 1d5x h ASP 161 Cb 0.23 0.11 -0.02 0.00 0.68 0.00 0.00 39.33 40.33 1d5x h ASP 161 CO -0.01 -0.02 0.24 0.22 -1.61 0.00 0.00 179.24 178.06 1d5x h TYR 162 N 0.08 0.52 -0.66 0.28 3.20 -0.98 -1.44 116.97 117.96 1d5x h TYR 162 Ca 0.12 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.00 1d5x h TYR 162 Cb 0.16 -0.17 -0.03 0.00 1.54 0.00 0.00 36.73 38.23 1d5x h TYR 162 CO -0.21 0.37 0.43 -0.07 -1.64 0.00 0.00 178.16 177.05 1d5x h LEU 163 N 0.52 0.77 0.35 2.82 3.38 -0.81 0.24 115.31 122.59 1d5x h LEU 163 Ca 0.14 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 1d5x h LEU 163 Cb 0.00 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.56 1d5x h LEU 163 CO -0.03 0.57 -0.17 0.74 0.09 0.00 0.00 178.44 179.65 1d5x h THR 164 N 0.90 0.65 -0.63 0.22 2.02 -0.97 -2.24 112.91 112.86 1d5x h THR 164 Ca 0.24 -0.40 -0.02 0.00 0.77 0.00 0.00 66.41 67.01 1d5x h THR 164 Cb -0.08 0.85 -0.03 0.00 -1.74 0.00 0.00 68.15 67.15 1d5x h THR 164 CO -0.05 0.08 0.32 0.03 0.37 0.00 0.00 175.52 176.26 1d5x h ARG 165 N -0.70 0.88 -0.72 6.66 3.08 -1.17 -1.05 114.38 121.35 1d5x h ARG 165 Ca -0.05 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 59.89 1d5x h ARG 165 Cb 0.49 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.33 1d5x h ARG 165 CO 0.08 0.66 0.41 1.25 -1.07 0.00 0.00 179.97 181.30 1d5x h HIS 166 N 0.88 0.96 -0.47 3.04 2.76 -0.42 0.10 115.15 122.00 1d5x h HIS 166 Ca 0.22 -0.01 -0.11 0.00 -2.20 0.00 0.00 60.37 58.27 1d5x h HIS 166 Cb 0.06 -0.31 -0.01 0.00 1.55 0.00 0.00 27.41 28.70 1d5x h HIS 166 CO 0.01 0.66 -0.13 -0.92 -1.30 0.00 0.00 177.93 176.25 1d5x h TYR 167 N 0.99 1.02 0.00 5.26 3.20 -0.65 -3.16 116.97 123.64 1d5x h TYR 167 Ca 0.26 -0.22 -0.10 0.00 3.14 0.00 0.00 58.73 61.80 1d5x h TYR 167 Cb -0.00 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.01 1d5x h TYR 167 CO 0.01 1.00 -0.49 -0.07 -1.64 0.00 0.00 178.16 176.97 1d5x h LEU 168 N 0.75 0.00 -0.41 2.82 3.38 -0.21 -0.42 115.31 121.22 1d5x h LEU 168 Ca 0.12 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.04 1d5x h LEU 168 Cb 0.68 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 1d5x h LEU 168 CO 0.05 0.49 -0.23 -0.37 0.09 0.00 0.00 178.44 178.47 1d5x h VAL 169 N 0.00 0.43 0.08 1.22 -1.51 -0.82 0.18 116.25 115.83 1d5x h VAL 169 Ca -0.00 -1.40 -0.34 0.00 -1.23 0.00 0.00 66.70 63.72 1d5x h VAL 169 Cb 0.93 2.05 -0.03 0.00 -2.13 0.00 0.00 31.29 32.11 1d5x h VAL 169 CO 0.06 0.22 -1.93 0.29 -1.23 0.00 0.00 177.57 174.99 1d5x n LYS 170 N -3.21 0.72 -0.00 5.19 5.02 -1.09 -3.38 118.16 121.40 1d5x n LYS 170 Ca 0.02 0.27 0.08 0.00 -2.02 0.00 0.00 58.31 56.66 1d5x n LYS 170 Cb 0.56 -1.73 -0.10 0.00 -0.02 0.00 0.00 35.03 33.73 1d5x n LYS 170 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1d5x n ASN 171 N -3.33 0.85 0.00 4.39 5.03 -0.19 -4.57 115.26 117.45 1d5x n ASN 171 Ca -0.28 -0.68 0.00 0.00 0.87 0.00 0.00 54.58 54.50 1d5x n ASN 171 Cb 1.05 1.19 0.00 0.00 -1.02 0.00 0.00 39.78 41.00 1d5x n ASN 171 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.26 176.60 1d5x n LYS 172 N -1.57 1.69 -3.40 3.52 3.00 0.47 -5.02 118.16 116.86 1d5x n LYS 172 Ca 0.02 -0.17 -0.24 0.00 -0.00 0.00 0.00 58.31 57.91 1d5x n LYS 172 Cb 0.31 -0.59 0.06 0.00 0.00 0.00 0.00 35.03 34.80 1d5x n LYS 172 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1d5x n LYS 173 N -0.29 -6.62 -0.25 1.64 4.01 -0.25 -4.89 118.16 111.51 1d5x n LYS 173 Ca 0.00 0.84 0.03 0.00 -0.51 0.00 0.00 58.31 58.67 1d5x n LYS 173 Cb 0.05 -5.81 0.12 0.00 -0.51 0.00 0.00 35.03 28.88 1d5x n LYS 173 CO 0.00 0.00 0.00 1.25 -1.11 0.00 0.00 177.40 177.54 1d5x h LEU 174 N -2.16 -0.46 -7.45 -0.35 5.85 -1.59 -3.33 115.31 105.81 1d5x h LEU 174 Ca -0.55 0.20 -0.62 0.00 0.84 0.00 0.00 57.88 57.74 1d5x h LEU 174 Cb 1.37 0.37 -0.40 0.00 0.37 0.00 0.00 40.66 42.37 1d5x h LEU 174 CO 0.57 -0.20 -0.74 -0.31 -0.34 0.00 0.00 178.44 177.43 1d5x s TYR 175 N -6.17 2.80 0.93 1.25 1.51 -1.26 -4.37 117.35 112.04 1d5x s TYR 175 Ca -0.14 -2.39 -0.14 0.00 -1.01 0.00 0.00 57.07 53.40 1d5x s TYR 175 Cb 0.21 -2.33 0.21 0.00 -0.11 0.00 0.00 41.96 39.95 1d5x s TYR 175 CO 0.75 -0.91 1.27 -0.85 -1.11 0.00 0.00 175.55 174.70 1d5x n GLU 176 N 4.53 -1.08 -0.23 -0.62 0.28 -0.33 -4.80 120.64 118.39 1d5x n GLU 176 Ca 0.00 -2.17 -0.08 0.00 -0.16 0.00 0.00 57.16 54.76 1d5x n GLU 176 Cb 0.42 -1.24 0.03 0.00 1.43 0.00 0.00 31.44 32.09 1d5x n GLU 176 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 177.13 177.32 1d5x h PHE 177 N -1.56 1.03 0.00 -1.84 3.57 -1.97 -3.36 116.94 112.81 1d5x h PHE 177 Ca -0.41 -0.11 -0.04 0.00 3.53 0.00 0.00 57.97 60.94 1d5x h PHE 177 Cb 1.19 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 39.62 1d5x h PHE 177 CO 0.00 0.85 -0.50 -0.97 -2.23 0.00 0.00 178.31 175.46 1d5x h ASN 178 N 0.92 0.00 0.00 0.41 -1.24 -1.94 -0.94 115.58 112.79 1d5x h ASN 178 Ca 0.20 -0.15 0.00 0.00 0.71 0.00 0.00 56.30 57.07 1d5x h ASN 178 Cb 0.32 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.37 1d5x h ASN 178 CO -0.00 0.84 0.00 -3.20 -1.29 0.00 0.00 177.43 173.78 1d5x n ASN 179 N -4.62 0.10 -3.84 1.15 5.15 -1.26 -2.35 115.26 109.59 1d5x n ASN 179 Ca -0.10 0.00 -0.13 0.00 -0.60 0.00 0.00 54.58 53.74 1d5x n ASN 179 Cb 0.29 0.00 -0.15 0.00 -0.53 0.00 0.00 39.78 39.40 1d5x n ASN 179 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 1d5x s SER 180 N 1.03 0.09 0.00 1.20 1.04 -1.26 -1.18 113.70 114.62 1d5x s SER 180 Ca 0.00 0.00 0.01 0.00 0.48 0.00 0.00 55.95 56.44 1d5x s SER 180 Cb 0.00 -0.04 0.03 0.00 0.10 0.00 0.00 66.02 66.11 1d5x s SER 180 CO 0.00 -0.04 0.28 -2.65 0.98 0.00 0.00 173.24 171.81 1d5x n PRO 181 N 3.46 0.23 -4.29 4.02 -0.02 -1.26 -4.58 135.00 132.55 1d5x n PRO 181 Ca -0.18 0.00 -0.20 0.00 -2.02 0.00 0.00 63.50 61.11 1d5x n PRO 181 Cb 0.56 -1.04 -0.13 0.00 -0.02 0.00 0.00 33.50 32.88 1d5x n PRO 181 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 1d5x s TYR 182 N -2.00 1.27 0.00 6.00 1.51 -1.26 -3.88 117.35 118.99 1d5x s TYR 182 Ca 0.01 -0.40 0.00 0.00 -1.01 0.00 0.00 57.07 55.67 1d5x s TYR 182 Cb 0.00 -0.74 0.00 0.00 -0.11 0.00 0.00 41.96 41.12 1d5x s TYR 182 CO 0.01 0.05 0.16 -1.91 -1.11 0.00 0.00 175.55 172.75 1d5x n GLU 183 N 1.63 0.00 -4.33 -0.62 4.07 0.14 -4.49 120.64 117.04 1d5x n GLU 183 Ca -0.19 0.26 -0.26 0.00 -0.06 0.00 0.00 57.16 56.91 1d5x n GLU 183 Cb 0.54 -0.87 -0.10 0.00 -0.06 0.00 0.00 31.44 30.96 1d5x n GLU 183 CO 0.00 0.00 0.00 0.95 -0.06 0.00 0.00 177.13 178.02 1d5x s THR 184 N -0.85 2.98 -0.13 6.31 -4.23 -1.19 0.48 115.64 119.02 1d5x s THR 184 Ca 0.00 -1.83 -0.25 0.00 -1.18 0.00 0.00 61.69 58.43 1d5x s THR 184 Cb 0.00 -2.49 0.06 0.00 1.34 0.00 0.00 72.50 71.41 1d5x s THR 184 CO 0.00 -0.17 0.62 -0.83 -0.54 0.00 0.00 174.62 173.70 1d5x s GLY 185 N -2.95 -0.48 -0.19 3.99 0.00 -1.26 -1.61 107.32 104.82 1d5x s GLY 185 Ca 0.25 1.40 -0.14 0.00 0.00 0.00 0.00 44.72 46.23 1d5x s GLY 185 CO 0.15 1.10 0.48 -2.52 0.00 0.00 0.00 173.10 172.31 1d5x s TYR 186 N -0.56 -0.63 -0.23 1.90 -0.85 -0.34 -2.29 117.35 114.34 1d5x s TYR 186 Ca -0.07 1.40 -0.10 0.00 -0.52 0.00 0.00 57.07 57.79 1d5x s TYR 186 Cb -0.03 0.28 -0.05 0.00 0.38 0.00 0.00 41.96 42.54 1d5x s TYR 186 CO 0.05 -0.33 0.14 -1.50 -1.52 0.00 0.00 175.55 172.40 1d5x s ILE 187 N 0.92 5.25 0.09 -3.49 2.07 -0.94 -1.56 121.20 123.53 1d5x s ILE 187 Ca -0.05 0.14 0.10 0.00 -1.41 0.00 0.00 60.65 59.43 1d5x s ILE 187 Cb -0.06 -3.44 -0.03 0.00 0.13 0.00 0.00 42.46 39.06 1d5x s ILE 187 CO -0.08 0.36 -0.26 -1.59 -1.91 0.00 0.00 174.94 171.47 1d5x s LYS 188 N 0.99 1.63 -0.08 3.50 -2.85 0.11 -0.75 119.74 122.29 1d5x s LYS 188 Ca 0.07 -1.22 0.01 0.00 -1.00 0.00 0.00 55.97 53.83 1d5x s LYS 188 Cb -0.13 -1.96 -0.03 0.00 -2.06 0.00 0.00 37.83 33.65 1d5x s LYS 188 CO 0.04 0.48 -0.09 -0.06 0.10 0.00 0.00 175.35 175.82 1d5x s PHE 189 N -0.95 2.88 -0.08 1.78 0.40 0.17 -0.61 117.98 121.58 1d5x s PHE 189 Ca 0.13 -0.13 0.04 0.00 -0.60 0.00 0.00 56.93 56.37 1d5x s PHE 189 Cb -0.10 -1.73 0.00 0.00 0.51 0.00 0.00 43.02 41.70 1d5x s PHE 189 CO 0.05 0.20 -0.20 0.42 0.70 0.00 0.00 175.22 176.38 1d5x s ILE 190 N -0.53 1.71 -0.34 0.64 1.01 0.46 -1.93 121.20 122.22 1d5x s ILE 190 Ca 0.08 -0.83 0.01 0.00 0.00 0.00 0.00 60.65 59.91 1d5x s ILE 190 Cb -0.12 -1.49 0.14 0.00 0.01 0.00 0.00 42.46 41.00 1d5x s ILE 190 CO 0.02 0.48 0.30 -0.70 0.00 0.00 0.00 174.94 175.04 1d5x s GLU 191 N 0.34 0.50 0.00 2.79 2.12 0.24 -1.13 118.70 123.56 1d5x s GLU 191 Ca -0.14 -0.76 0.00 0.00 0.36 0.00 0.00 54.97 54.43 1d5x s GLU 191 Cb -0.16 -0.87 0.00 0.00 0.26 0.00 0.00 34.13 33.36 1d5x s GLU 191 CO 0.06 -1.14 0.00 0.09 -0.54 0.00 0.00 175.26 173.73 1d5x n ASN 192 N 4.55 0.00 0.11 -1.70 3.02 -1.26 -0.61 115.26 119.37 1d5x n ASN 192 Ca 0.07 0.00 -0.11 0.00 -0.03 0.00 0.00 54.58 54.50 1d5x n ASN 192 Cb 0.43 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.53 1d5x n ASN 192 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1d5x h GLU 193 N 0.00 -0.33 -7.13 3.52 5.08 -2.02 -3.46 114.58 110.25 1d5x h GLU 193 Ca 0.00 0.02 -0.46 0.00 -1.00 0.00 0.00 59.36 57.92 1d5x h GLU 193 Cb 0.00 0.07 0.01 0.00 0.50 0.00 0.00 28.75 29.34 1d5x h GLU 193 CO 0.00 0.03 0.37 1.21 -1.00 0.00 0.00 179.01 179.62 1d5x s ASN 194 N -5.25 6.53 -0.30 1.42 3.84 0.22 -2.95 114.94 118.44 1d5x s ASN 194 Ca -0.13 1.73 -0.10 0.00 0.21 0.00 0.00 52.86 54.57 1d5x s ASN 194 Cb 0.01 -2.53 0.17 0.00 -0.55 0.00 0.00 41.25 38.34 1d5x s ASN 194 CO 0.47 -0.65 0.83 -0.94 -2.79 0.00 0.00 177.10 174.02 1d5x s SER 195 N -2.51 -0.88 0.23 -4.21 1.04 -1.26 -0.59 113.70 105.53 1d5x s SER 195 Ca 0.62 0.87 0.08 0.00 0.48 0.00 0.00 55.95 58.00 1d5x s SER 195 Cb -0.12 1.87 -0.05 0.00 0.10 0.00 0.00 66.02 67.82 1d5x s SER 195 CO 0.24 -0.17 -0.12 0.72 0.98 0.00 0.00 173.24 174.89 1d5x s PHE 196 N 2.76 1.82 0.15 5.02 -0.12 -0.81 -3.05 117.98 123.74 1d5x s PHE 196 Ca 0.03 -0.59 -0.01 0.00 -0.05 0.00 0.00 56.93 56.31 1d5x s PHE 196 Cb -0.11 -0.90 -0.04 0.00 -0.63 0.00 0.00 43.02 41.35 1d5x s PHE 196 CO -0.17 0.37 0.07 1.67 -0.05 0.00 0.00 175.22 177.11 1d5x s TRP 197 N -2.95 0.93 0.04 3.49 1.48 -1.26 0.46 118.94 121.13 1d5x s TRP 197 Ca 0.25 -1.27 0.05 0.00 -1.06 0.00 0.00 56.10 54.07 1d5x s TRP 197 Cb 0.00 -0.50 -0.02 0.00 -1.16 0.00 0.00 33.47 31.79 1d5x s TRP 197 CO 0.09 -0.55 -0.13 0.71 -4.06 0.00 0.00 176.95 173.01 1d5x s TYR 198 N -4.07 1.17 -0.57 1.66 4.12 0.07 -4.97 117.35 114.76 1d5x s TYR 198 Ca 0.27 -0.35 -0.26 0.00 0.02 0.00 0.00 57.07 56.76 1d5x s TYR 198 Cb 0.07 -0.70 0.04 0.00 -1.52 0.00 0.00 41.96 39.85 1d5x s TYR 198 CO 0.04 0.03 1.04 0.34 0.02 0.00 0.00 175.55 177.02 1d5x s ASP 199 N -1.10 6.36 0.00 2.29 -1.08 -1.26 -2.22 116.67 119.66 1d5x s ASP 199 Ca 0.01 -0.22 0.07 0.00 -0.52 0.00 0.00 52.55 51.89 1d5x s ASP 199 Cb -0.08 -2.48 0.42 0.00 -1.46 0.00 0.00 42.92 39.32 1d5x s ASP 199 CO 0.01 -1.35 1.07 0.80 0.52 0.00 0.00 175.17 176.23 1d5x n MET 200 N 7.88 0.77 -4.40 4.34 0.00 -0.97 -4.83 117.12 119.91 1d5x n MET 200 Ca 0.04 0.00 -0.28 0.00 -0.00 0.00 0.00 57.70 57.46 1d5x n MET 200 Cb 0.48 -1.14 -0.13 0.00 0.00 0.00 0.00 33.22 32.43 1d5x n MET 200 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 175.97 174.33 1d5x s MET 201 N -2.00 1.43 0.54 2.12 -1.94 -1.26 -4.91 119.30 113.29 1d5x s MET 201 Ca 0.11 -1.40 -0.19 0.00 -1.71 0.00 0.00 55.69 52.49 1d5x s MET 201 Cb 0.05 -1.86 -0.06 0.00 2.01 0.00 0.00 34.83 34.97 1d5x s MET 201 CO 0.08 0.43 1.13 -1.25 -0.01 0.00 0.00 175.02 175.39 1d5x s PRO 202 N -2.26 3.36 0.56 2.03 0.04 -1.26 -4.86 135.00 132.61 1d5x s PRO 202 Ca 0.16 1.60 -0.17 0.00 0.04 0.00 0.00 61.00 62.63 1d5x s PRO 202 Cb -0.09 -2.01 -0.05 0.00 0.04 0.00 0.00 34.50 32.39 1d5x s PRO 202 CO 0.07 -0.84 1.05 0.00 0.04 0.00 0.00 177.00 177.32 1d5x s ALA 203 N -1.79 2.79 0.26 8.56 0.00 -1.26 -4.59 121.76 125.73 1d5x s ALA 203 Ca 0.72 0.44 -0.30 0.00 0.00 0.00 0.00 51.96 52.82 1d5x s ALA 203 Cb -0.24 -3.23 -0.13 0.00 0.00 0.00 0.00 23.12 19.52 1d5x s ALA 203 CO 0.27 -0.64 1.33 -2.30 0.00 0.00 0.00 175.76 174.42 1d5x n PRO 204 N -1.71 1.94 0.00 0.00 -0.02 -1.26 -4.68 135.00 129.27 1d5x n PRO 204 Ca 0.09 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.26 1d5x n PRO 204 Cb 0.53 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 1d5x n PRO 204 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1d5x n GLY 205 N 1.78 2.79 0.08 -1.23 0.00 -1.21 -4.91 105.19 102.48 1d5x n GLY 205 Ca 0.10 -1.17 0.14 0.00 0.00 0.00 0.00 46.02 45.10 1d5x n GLY 205 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1d5x n ASP 206 N 0.00 0.32 -3.79 1.61 2.03 -1.26 -1.10 116.55 114.36 1d5x n ASP 206 Ca 0.00 -0.46 -0.10 0.00 0.52 0.00 0.00 54.79 54.75 1d5x n ASP 206 Cb 0.00 -0.13 -0.07 0.00 -0.72 0.00 0.00 41.12 40.20 1d5x n ASP 206 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1d5x s LYS 207 N -2.49 0.84 -0.18 -0.67 1.02 -1.26 -3.83 119.74 113.17 1d5x s LYS 207 Ca 0.29 -0.74 0.01 0.00 0.02 0.00 0.00 55.97 55.55 1d5x s LYS 207 Cb 0.20 0.36 0.03 0.00 -0.52 0.00 0.00 37.83 37.89 1d5x s LYS 207 CO 0.47 -0.28 -0.17 0.12 -0.92 0.00 0.00 175.35 174.57 1d5x s PHE 208 N -3.28 2.67 -0.70 3.18 5.36 -1.26 -4.94 117.98 119.00 1d5x s PHE 208 Ca 0.00 -1.63 -0.20 0.00 -0.96 0.00 0.00 56.93 54.14 1d5x s PHE 208 Cb 0.02 -1.83 0.10 0.00 -0.34 0.00 0.00 43.02 40.97 1d5x s PHE 208 CO -0.08 -0.78 0.92 0.34 -1.46 0.00 0.00 175.22 174.16 1d5x s ASP 209 N 1.32 6.29 0.23 6.13 2.15 -1.26 -4.90 116.67 126.63 1d5x s ASP 209 Ca 0.03 -1.39 -0.06 0.00 0.43 0.00 0.00 52.55 51.56 1d5x s ASP 209 Cb -0.14 -2.38 0.31 0.00 -0.30 0.00 0.00 42.92 40.42 1d5x s ASP 209 CO -0.11 -1.25 1.83 1.56 -0.17 0.00 0.00 175.17 177.03 1d5x h GLN 210 N 9.26 0.83 -0.16 4.34 4.20 -1.98 -2.24 115.11 129.36 1d5x h GLN 210 Ca -0.18 -0.05 0.03 0.00 0.06 0.00 0.00 58.65 58.51 1d5x h GLN 210 Cb 1.06 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 28.63 1d5x h GLN 210 CO 1.13 0.55 -0.03 1.03 -0.67 0.00 0.00 178.83 180.84 1d5x h SER 211 N 0.85 -0.13 -0.19 1.46 0.87 -1.99 -0.50 113.55 113.94 1d5x h SER 211 Ca 0.35 0.04 -0.10 0.00 -1.23 0.00 0.00 61.79 60.86 1d5x h SER 211 Cb 0.21 0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.24 1d5x h SER 211 CO -0.19 -0.04 -0.21 0.11 -0.53 0.00 0.00 176.83 175.97 1d5x h LYS 212 N 0.01 0.63 -0.13 2.24 1.79 -1.91 -2.32 116.57 116.87 1d5x h LYS 212 Ca 0.08 -0.24 -0.04 0.00 -2.18 0.00 0.00 60.65 58.27 1d5x h LYS 212 Cb 0.11 -0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 30.72 1d5x h LYS 212 CO -0.15 0.80 -0.06 -0.92 -1.08 0.00 0.00 179.45 178.04 1d5x h TYR 213 N 0.56 0.32 0.00 -1.35 3.20 -1.14 -2.85 116.97 115.70 1d5x h TYR 213 Ca 0.08 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 61.88 1d5x h TYR 213 Cb 0.67 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 38.87 1d5x h TYR 213 CO 0.03 0.60 0.00 -0.07 -1.64 0.00 0.00 178.16 177.08 1d5x h LEU 214 N -0.06 0.00 -2.23 2.82 4.07 -0.93 -2.80 115.31 116.17 1d5x h LEU 214 Ca 0.03 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.98 1d5x h LEU 214 Cb 0.52 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.26 1d5x h LEU 214 CO 0.02 0.00 -0.03 -0.03 -1.08 0.00 0.00 178.44 177.32 1d5x h MET 215 N 0.00 0.00 -0.56 1.13 4.05 -1.17 -2.09 114.93 116.29 1d5x h MET 215 Ca 0.00 0.00 0.16 0.00 -0.28 0.00 0.00 59.70 59.58 1d5x h MET 215 Cb 0.18 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 30.96 1d5x h MET 215 CO 0.00 0.03 0.40 0.00 0.23 0.00 0.00 176.91 177.58 1d5x h MET 216 N 0.00 0.02 0.00 0.39 -0.00 -1.66 0.26 114.93 113.94 1d5x h MET 216 Ca -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 1d5x h MET 216 Cb 0.08 -0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.67 1d5x h MET 216 CO 0.00 0.01 0.00 0.66 -0.00 0.00 0.00 176.91 177.59 1d5x n TYR 217 N -4.38 0.00 0.38 -0.10 0.53 -0.79 -4.12 117.16 108.68 1d5x n TYR 217 Ca 0.10 0.00 0.13 0.00 -1.02 0.00 0.00 57.90 57.12 1d5x n TYR 217 Cb 0.62 0.00 0.39 0.00 -1.03 0.00 0.00 39.34 39.32 1d5x n TYR 217 CO 0.00 0.00 0.00 -2.95 -1.02 0.00 0.00 176.86 172.89 1d5x h ASN 218 N 0.00 0.00 -0.01 7.72 -1.07 -0.65 -3.01 115.58 118.56 1d5x h ASN 218 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.37 1d5x h ASN 218 Cb 0.00 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.25 1d5x h ASN 218 CO 0.00 0.00 0.00 -0.90 0.07 0.00 0.00 177.43 176.60 1d5x n ASP 219 N -2.73 0.11 -2.78 6.14 5.75 -1.26 -1.54 116.55 120.25 1d5x n ASP 219 Ca 0.03 -1.39 -0.18 0.00 -0.01 0.00 0.00 54.79 53.25 1d5x n ASP 219 Cb 0.41 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.50 1d5x n ASP 219 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1d5x n ASN 220 N -0.74 -4.66 -4.56 -1.12 5.15 -1.14 -4.86 115.26 103.32 1d5x n ASN 220 Ca 0.15 -0.08 -0.52 0.00 -0.60 0.00 0.00 54.58 53.53 1d5x n ASN 220 Cb 0.09 -3.87 -0.06 0.00 -0.53 0.00 0.00 39.78 35.41 1d5x n ASN 220 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 1d5x n LYS 221 N -3.32 0.87 -4.38 1.20 4.76 -1.26 -4.90 118.16 111.12 1d5x n LYS 221 Ca -0.12 0.31 -0.21 0.00 -2.87 0.00 0.00 58.31 55.42 1d5x n LYS 221 Cb 0.61 -1.87 -0.10 0.00 -1.84 0.00 0.00 35.03 31.83 1d5x n LYS 221 CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 1d5x s MET 222 N 0.10 1.44 0.16 1.97 -1.94 -1.26 -1.53 119.30 118.24 1d5x s MET 222 Ca 0.82 -1.63 -0.03 0.00 -1.71 0.00 0.00 55.69 53.14 1d5x s MET 222 Cb -0.99 -1.35 -0.03 0.00 2.01 0.00 0.00 34.83 34.47 1d5x s MET 222 CO 0.51 0.24 0.13 0.14 -0.01 0.00 0.00 175.02 176.02 1d5x s VAL 223 N -2.73 0.06 -0.18 -6.03 -7.23 0.34 -4.83 120.40 99.79 1d5x s VAL 223 Ca 0.24 -1.85 -0.20 0.00 -1.81 0.00 0.00 61.98 58.37 1d5x s VAL 223 Cb -0.03 -2.16 -0.03 0.00 0.56 0.00 0.00 36.38 34.72 1d5x s VAL 223 CO 0.09 -0.28 0.58 -0.62 -0.31 0.00 0.00 175.10 174.56 1d5x s ASP 224 N -3.07 6.65 0.00 4.85 2.15 -1.26 -0.46 116.67 125.53 1d5x s ASP 224 Ca 0.28 0.79 0.09 0.00 0.43 0.00 0.00 52.55 54.14 1d5x s ASP 224 Cb 0.06 -2.32 0.48 0.00 -0.30 0.00 0.00 42.92 40.84 1d5x s ASP 224 CO 0.05 -0.21 1.18 -1.54 -0.17 0.00 0.00 175.17 174.48 1d5x n SER 225 N 4.76 0.00 0.01 -0.34 3.41 0.61 -2.32 113.62 119.76 1d5x n SER 225 Ca -0.03 0.12 0.08 0.00 -0.26 0.00 0.00 58.87 58.78 1d5x n SER 225 Cb 0.50 -0.27 -0.12 0.00 -0.26 0.00 0.00 64.21 64.06 1d5x n SER 225 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1d5x n LYS 226 N -1.27 0.65 -0.01 4.33 4.81 -1.26 -4.59 118.16 120.81 1d5x n LYS 226 Ca 0.05 -0.07 0.02 0.00 -0.87 0.00 0.00 58.31 57.44 1d5x n LYS 226 Cb 0.07 -1.62 -0.07 0.00 0.02 0.00 0.00 35.03 33.44 1d5x n LYS 226 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1d5x n ASP 227 N -2.46 2.98 -4.74 3.14 8.00 -0.98 -5.03 116.55 117.46 1d5x n ASP 227 Ca -0.07 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.02 1d5x n ASP 227 Cb 0.65 1.20 -0.03 0.00 -0.02 0.00 0.00 41.12 42.91 1d5x n ASP 227 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1d5x s VAL 228 N -2.49 3.51 0.01 2.53 0.11 -0.98 -4.60 120.40 118.49 1d5x s VAL 228 Ca -0.03 1.25 0.07 0.00 -2.93 0.00 0.00 61.98 60.34 1d5x s VAL 228 Cb 0.05 -3.80 -0.02 0.00 -1.53 0.00 0.00 36.38 31.08 1d5x s VAL 228 CO 0.36 0.19 -0.22 -0.75 -3.33 0.00 0.00 175.10 171.35 1d5x s LYS 229 N -0.15 1.67 0.02 1.54 2.20 -0.28 -4.65 119.74 120.08 1d5x s LYS 229 Ca 0.54 -0.86 0.05 0.00 -0.36 0.00 0.00 55.97 55.34 1d5x s LYS 229 Cb -0.33 -1.69 -0.03 0.00 -1.51 0.00 0.00 37.83 34.27 1d5x s LYS 229 CO 0.37 0.45 -0.11 0.42 -0.36 0.00 0.00 175.35 176.12 1d5x s ILE 230 N -0.62 3.31 -0.03 5.43 -1.09 -1.01 -0.40 121.20 126.79 1d5x s ILE 230 Ca 0.09 -0.94 0.01 0.00 -2.23 0.00 0.00 60.65 57.58 1d5x s ILE 230 Cb -0.09 -2.42 0.02 0.00 -1.58 0.00 0.00 42.46 38.39 1d5x s ILE 230 CO 0.00 0.37 -0.02 -1.61 -1.23 0.00 0.00 174.94 172.45 1d5x s GLU 231 N -1.43 0.47 -0.15 2.79 2.02 0.22 -3.36 118.70 119.28 1d5x s GLU 231 Ca 0.16 -0.01 -0.00 0.00 0.02 0.00 0.00 54.97 55.14 1d5x s GLU 231 Cb -0.11 -0.57 -0.01 0.00 0.10 0.00 0.00 34.13 33.54 1d5x s GLU 231 CO 0.07 -0.09 -0.13 0.08 0.02 0.00 0.00 175.26 175.21 1d5x s VAL 232 N 0.83 2.91 -0.19 2.63 1.01 -1.08 0.04 120.40 126.55 1d5x s VAL 232 Ca -0.09 -0.70 -0.00 0.00 0.00 0.00 0.00 61.98 61.19 1d5x s VAL 232 Cb -0.12 -2.23 0.01 0.00 0.00 0.00 0.00 36.38 34.04 1d5x s VAL 232 CO -0.01 0.51 -0.15 -0.31 0.00 0.00 0.00 175.10 175.14 1d5x s TYR 233 N 0.62 2.84 0.16 5.22 1.51 -0.60 0.23 117.35 127.32 1d5x s TYR 233 Ca -0.08 -1.44 0.08 0.00 -1.01 0.00 0.00 57.07 54.62 1d5x s TYR 233 Cb -0.16 -1.98 -0.04 0.00 -0.11 0.00 0.00 41.96 39.68 1d5x s TYR 233 CO 0.03 -0.73 -0.17 -0.51 -1.11 0.00 0.00 175.55 173.05 1d5x s LEU 234 N 1.35 2.44 -0.25 -1.29 1.02 -0.12 -1.19 118.68 120.63 1d5x s LEU 234 Ca 0.05 -0.87 -0.01 0.00 0.02 0.00 0.00 54.13 53.32 1d5x s LEU 234 Cb -0.13 -0.78 0.08 0.00 0.02 0.00 0.00 46.19 45.37 1d5x s LEU 234 CO -0.10 -0.06 0.04 -0.89 0.02 0.00 0.00 176.35 175.36 1d5x s THR 235 N -2.13 0.95 0.54 5.49 2.01 -0.63 0.56 115.64 122.42 1d5x s THR 235 Ca 0.15 -1.10 -0.22 0.00 0.31 0.00 0.00 61.69 60.83 1d5x s THR 235 Cb -0.05 -1.51 -0.05 0.00 0.01 0.00 0.00 72.50 70.89 1d5x s THR 235 CO 0.06 -0.39 1.34 0.42 -0.69 0.00 0.00 174.62 175.37 1d5x s THR 236 N 1.63 2.16 -0.23 -0.82 -4.23 -1.26 0.28 115.64 113.16 1d5x s THR 236 Ca 0.03 0.12 -0.29 0.00 -1.18 0.00 0.00 61.69 60.37 1d5x s THR 236 Cb -0.18 -3.06 -0.02 0.00 1.34 0.00 0.00 72.50 70.59 1d5x s THR 236 CO -0.14 -0.00 1.46 -1.59 -0.54 0.00 0.00 174.62 173.81 1d5x s LYS 237 N -2.88 3.92 0.00 3.99 -2.85 -1.25 -4.46 119.74 116.21 1d5x s LYS 237 Ca 0.71 1.55 0.32 0.00 -1.00 0.00 0.00 55.97 57.54 1d5x s LYS 237 Cb -0.40 -3.94 1.89 0.00 -2.06 0.00 0.00 37.83 33.33 1d5x s LYS 237 CO 0.47 -1.13 2.22 1.17 0.10 0.00 0.00 175.35 178.17