#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xrp s ILE 6 N 0.00 3.50 -0.12 0.00 1.10 -0.63 -4.82 121.20 120.23 1xrp s ILE 6 Ca 0.00 1.23 0.02 0.00 -0.51 0.00 0.00 60.65 61.39 1xrp s ILE 6 Cb 0.00 -3.79 0.01 0.00 0.15 0.00 0.00 42.46 38.84 1xrp s ILE 6 CO 0.00 0.18 -0.18 -1.61 -2.11 0.00 0.00 174.94 171.22 1xrp s GLU 7 N -0.07 2.56 0.06 3.50 2.02 -1.26 -1.45 118.70 124.07 1xrp s GLU 7 Ca 0.55 -0.69 0.00 0.00 0.02 0.00 0.00 54.97 54.85 1xrp s GLU 7 Cb -0.34 -2.12 -0.00 0.00 0.10 0.00 0.00 34.13 31.77 1xrp s GLU 7 CO 0.36 -0.04 0.08 -1.71 0.02 0.00 0.00 175.26 173.97 1xrp n ASN 8 N 4.13 -0.22 -3.79 -0.19 5.15 -1.09 -5.03 115.26 114.23 1xrp n ASN 8 Ca -0.19 -1.36 -0.30 0.00 -0.60 0.00 0.00 54.58 52.12 1xrp n ASN 8 Cb 0.51 0.42 -0.14 0.00 -0.53 0.00 0.00 39.78 40.04 1xrp n ASN 8 CO 0.00 0.00 0.00 -0.31 1.40 0.00 0.00 177.26 178.35 1xrp s TYR 9 N -3.95 2.26 -0.01 1.20 4.12 -1.26 -2.96 117.35 116.76 1xrp s TYR 9 Ca 0.06 -2.28 -0.24 0.00 0.02 0.00 0.00 57.07 54.63 1xrp s TYR 9 Cb -0.00 -2.06 -0.05 0.00 -1.52 0.00 0.00 41.96 38.33 1xrp s TYR 9 CO 0.04 -0.85 0.72 0.00 0.02 0.00 0.00 175.55 175.48 1xrp s ALA 10 N 0.97 3.36 -0.57 3.71 0.00 0.22 -4.78 121.76 124.67 1xrp s ALA 10 Ca 0.13 0.20 -0.24 0.00 0.00 0.00 0.00 51.96 52.04 1xrp s ALA 10 Cb -0.20 -2.96 0.04 0.00 0.00 0.00 0.00 23.12 20.00 1xrp s ALA 10 CO -0.12 -0.00 0.96 0.21 0.00 0.00 0.00 175.76 176.80 1xrp s LYS 11 N 0.32 3.30 -0.13 0.00 2.20 -1.26 0.55 119.74 124.73 1xrp s LYS 11 Ca 0.38 -0.32 0.00 0.00 -0.36 0.00 0.00 55.97 55.67 1xrp s LYS 11 Cb -0.19 -4.08 -0.01 0.00 -1.51 0.00 0.00 37.83 32.04 1xrp s LYS 11 CO 0.20 -1.55 -0.15 0.08 -0.36 0.00 0.00 175.35 173.58 1xrp s VAL 12 N 4.03 2.92 -1.37 4.02 1.01 0.47 -4.66 120.40 126.83 1xrp s VAL 12 Ca 0.30 -0.71 -0.11 0.00 0.00 0.00 0.00 61.98 61.46 1xrp s VAL 12 Cb -0.13 -2.21 0.08 0.00 0.00 0.00 0.00 36.38 34.12 1xrp s VAL 12 CO 0.18 0.53 0.58 0.59 0.00 0.00 0.00 175.10 176.98 1xrp n ASN 13 N 3.52 -3.80 0.00 3.32 3.02 -1.26 -1.38 115.26 118.68 1xrp n ASN 13 Ca -0.18 -0.51 0.00 0.00 -0.03 0.00 0.00 54.58 53.86 1xrp n ASN 13 Cb 0.53 -3.13 0.00 0.00 -0.61 0.00 0.00 39.78 36.57 1xrp n ASN 13 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xrp n GLY 14 N -1.25 1.57 3.49 7.41 0.00 -1.26 -5.04 105.19 110.11 1xrp n GLY 14 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 1xrp n GLY 14 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1xrp s ILE 15 N -2.52 2.30 -0.32 -0.61 -4.36 -0.48 -5.10 121.20 110.12 1xrp s ILE 15 Ca 0.00 -2.30 -0.24 0.00 -0.26 0.00 0.00 60.65 57.84 1xrp s ILE 15 Cb 0.00 -2.44 0.00 0.00 1.25 0.00 0.00 42.46 41.28 1xrp s ILE 15 CO 0.00 -0.32 0.84 -0.31 0.24 0.00 0.00 174.94 175.39 1xrp s TYR 16 N -2.60 3.18 -0.20 1.37 1.51 -1.26 -0.39 117.35 118.96 1xrp s TYR 16 Ca 0.31 0.85 -0.04 0.00 -1.01 0.00 0.00 57.07 57.17 1xrp s TYR 16 Cb -0.01 -3.34 -0.02 0.00 -0.11 0.00 0.00 41.96 38.48 1xrp s TYR 16 CO 0.15 -0.63 -0.02 0.42 -1.11 0.00 0.00 175.55 174.36 1xrp s ILE 17 N 3.11 3.70 0.14 2.71 -1.09 0.19 -2.33 121.20 127.64 1xrp s ILE 17 Ca 0.35 -0.40 -0.28 0.00 -2.23 0.00 0.00 60.65 58.09 1xrp s ILE 17 Cb -0.14 -2.67 -0.07 0.00 -1.58 0.00 0.00 42.46 38.01 1xrp s ILE 17 CO 0.14 0.43 0.87 -0.47 -1.23 0.00 0.00 174.94 174.68 1xrp s TYR 18 N 1.08 3.87 0.04 3.97 5.04 -1.26 -0.61 117.35 129.48 1xrp s TYR 18 Ca 0.02 1.72 -0.07 0.00 -2.44 0.00 0.00 57.07 56.30 1xrp s TYR 18 Cb -0.15 -2.92 -0.01 0.00 0.35 0.00 0.00 41.96 39.24 1xrp s TYR 18 CO 0.01 0.36 0.14 1.52 -1.34 0.00 0.00 175.55 176.24 1xrp s TYR 19 N -0.59 0.15 -0.16 4.97 1.13 -1.15 -0.69 117.35 120.99 1xrp s TYR 19 Ca 0.41 -0.43 -0.01 0.00 -1.41 0.00 0.00 57.07 55.62 1xrp s TYR 19 Cb -0.23 -0.10 0.05 0.00 -1.10 0.00 0.00 41.96 40.58 1xrp s TYR 19 CO 0.28 -0.40 -0.01 0.21 -2.51 0.00 0.00 175.55 173.11 1xrp s LYS 20 N -2.71 1.03 -0.29 -3.49 2.20 0.17 -2.66 119.74 113.98 1xrp s LYS 20 Ca -0.04 -0.40 -0.06 0.00 -0.36 0.00 0.00 55.97 55.10 1xrp s LYS 20 Cb -0.00 -1.90 0.01 0.00 -1.51 0.00 0.00 37.83 34.42 1xrp s LYS 20 CO -0.05 -0.49 0.06 -1.17 -0.36 0.00 0.00 175.35 173.34 1xrp s LEU 21 N 1.76 3.75 -0.41 5.43 2.96 -0.53 0.63 118.68 132.27 1xrp s LEU 21 Ca 0.00 -0.70 -0.11 0.00 -0.22 0.00 0.00 54.13 53.10 1xrp s LEU 21 Cb -0.16 -1.86 0.06 0.00 0.50 0.00 0.00 46.19 44.73 1xrp s LEU 21 CO -0.07 -0.18 0.27 0.00 -1.32 0.00 0.00 176.35 175.05 1xrp s LYS 23 N 1.52 4.05 -0.03 0.00 1.02 -1.26 -1.74 119.74 123.29 1xrp s LYS 23 Ca 0.03 1.33 -0.01 0.00 0.02 0.00 0.00 55.97 57.34 1xrp s LYS 23 Cb -0.22 -2.26 -0.04 0.00 -0.52 0.00 0.00 37.83 34.79 1xrp s LYS 23 CO 0.05 -0.22 0.05 0.00 -0.92 0.00 0.00 175.35 174.31 1xrp s ALA 24 N -1.93 3.47 0.00 5.17 0.00 -1.26 -4.91 121.76 122.30 1xrp s ALA 24 Ca 0.63 -0.85 0.00 0.00 0.00 0.00 0.00 51.96 51.74 1xrp s ALA 24 Cb -0.16 -1.54 0.00 0.00 0.00 0.00 0.00 23.12 21.42 1xrp s ALA 24 CO 0.20 0.65 0.14 -2.30 0.00 0.00 0.00 175.76 174.45 1xrp n PRO 25 N 1.54 0.00 -2.09 0.00 -0.02 -1.26 -2.72 135.00 130.45 1xrp n PRO 25 Ca -0.15 0.12 -0.42 0.00 -2.02 0.00 0.00 63.50 61.03 1xrp n PRO 25 Cb 0.53 -0.64 -0.00 0.00 -0.02 0.00 0.00 33.50 33.37 1xrp n PRO 25 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1xrp n GLU 26 N -0.26 3.79 -1.57 -0.52 2.13 -1.26 -4.97 120.64 117.98 1xrp n GLU 26 Ca 0.00 -3.30 -0.52 0.00 0.66 0.00 0.00 57.16 54.00 1xrp n GLU 26 Cb 0.00 -2.88 -0.06 0.00 0.27 0.00 0.00 31.44 28.77 1xrp n GLU 26 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1xrp n GLU 27 N 3.54 0.98 -0.00 5.31 2.13 -1.10 -4.75 120.64 126.74 1xrp n GLU 27 Ca 0.50 0.35 0.01 0.00 0.66 0.00 0.00 57.16 58.69 1xrp n GLU 27 Cb 0.32 -1.92 -0.02 0.00 0.27 0.00 0.00 31.44 30.09 1xrp n GLU 27 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1xrp n LYS 28 N 2.16 1.68 -3.50 5.31 5.02 0.45 -5.03 118.16 124.25 1xrp n LYS 28 Ca 0.18 -0.02 -0.10 0.00 -2.02 0.00 0.00 58.31 56.35 1xrp n LYS 28 Cb 0.19 -0.95 -0.03 0.00 -0.02 0.00 0.00 35.03 34.23 1xrp n LYS 28 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1xrp s ALA 29 N -1.94 -1.80 -0.15 7.82 0.00 -1.21 -5.02 121.76 119.47 1xrp s ALA 29 Ca -0.00 1.03 -0.01 0.00 0.00 0.00 0.00 51.96 52.97 1xrp s ALA 29 Cb 0.02 0.31 -0.01 0.00 0.00 0.00 0.00 23.12 23.43 1xrp s ALA 29 CO 0.11 -0.62 -0.11 0.15 0.00 0.00 0.00 175.76 175.28 1xrp s LYS 30 N -2.80 3.39 -0.20 0.00 1.02 -1.26 -1.29 119.74 118.60 1xrp s LYS 30 Ca 0.02 -0.67 -0.03 0.00 0.02 0.00 0.00 55.97 55.31 1xrp s LYS 30 Cb -0.01 -2.70 -0.01 0.00 -0.52 0.00 0.00 37.83 34.59 1xrp s LYS 30 CO -0.07 0.14 -0.05 -1.17 -0.92 0.00 0.00 175.35 173.28 1xrp s LEU 31 N 0.54 2.90 -0.07 3.17 2.96 0.15 -1.07 118.68 127.26 1xrp s LEU 31 Ca -0.08 -0.36 -0.11 0.00 -0.22 0.00 0.00 54.13 53.37 1xrp s LEU 31 Cb -0.15 -1.73 -0.05 0.00 0.50 0.00 0.00 46.19 44.76 1xrp s LEU 31 CO 0.04 0.02 0.26 -0.32 -1.32 0.00 0.00 176.35 175.03 1xrp s MET 32 N 1.22 3.68 0.07 1.98 -2.45 0.92 0.67 119.30 125.39 1xrp s MET 32 Ca 0.03 0.12 0.09 0.00 -1.25 0.00 0.00 55.69 54.68 1xrp s MET 32 Cb -0.14 -3.21 -0.03 0.00 1.25 0.00 0.00 34.83 32.69 1xrp s MET 32 CO -0.02 0.72 -0.26 0.95 1.05 0.00 0.00 175.02 177.47 1xrp s THR 33 N -1.00 2.08 -0.27 10.11 -4.23 -0.35 -0.13 115.64 121.86 1xrp s THR 33 Ca 0.19 -1.46 0.03 0.00 -1.18 0.00 0.00 61.69 59.26 1xrp s THR 33 Cb -0.14 -1.81 0.07 0.00 1.34 0.00 0.00 72.50 71.96 1xrp s THR 33 CO 0.08 0.26 -0.07 -0.04 -0.54 0.00 0.00 174.62 174.31 1xrp s MET 34 N -1.46 1.98 1.00 3.99 -1.94 0.14 -4.53 119.30 118.48 1xrp s MET 34 Ca 0.11 -1.38 -0.12 0.00 -1.71 0.00 0.00 55.69 52.59 1xrp s MET 34 Cb -0.10 -2.88 0.19 0.00 2.01 0.00 0.00 34.83 34.05 1xrp s MET 34 CO 0.03 -0.65 1.08 -3.38 -0.01 0.00 0.00 175.02 172.09 1xrp s HIS 35 N 1.12 1.94 0.00 -0.03 -3.43 -1.26 -1.36 115.29 112.27 1xrp s HIS 35 Ca -0.05 1.18 0.00 0.00 -0.80 0.00 0.00 55.06 55.40 1xrp s HIS 35 Cb -0.20 -3.19 0.00 0.00 -1.43 0.00 0.00 32.58 27.76 1xrp s HIS 35 CO -0.06 -2.99 0.00 0.41 -2.00 0.00 0.00 174.74 170.10 1xrp n GLY 36 N -0.51 1.79 0.00 -1.38 0.00 -1.18 -3.00 105.19 100.91 1xrp n GLY 36 Ca 0.06 -1.83 0.00 0.00 0.00 0.00 0.00 46.02 44.25 1xrp n GLY 36 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xrp n GLY 37 N 5.00 1.32 3.77 -0.02 0.00 -1.26 -2.81 105.19 111.19 1xrp n GLY 37 Ca 0.00 -0.66 -0.35 0.00 0.00 0.00 0.00 46.02 45.00 1xrp n GLY 37 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1xrp s PRO 38 N 0.00 3.32 0.00 1.61 0.02 -1.26 -4.72 135.00 133.97 1xrp s PRO 38 Ca 0.00 1.64 0.00 0.00 0.02 0.00 0.00 61.00 62.66 1xrp s PRO 38 Cb 0.00 -2.00 0.00 0.00 0.02 0.00 0.00 34.50 32.52 1xrp s PRO 38 CO 0.00 -0.89 0.00 0.41 -0.33 0.00 0.00 177.00 176.19 1xrp n GLY 39 N 0.21 1.00 0.00 0.52 0.00 -1.22 -3.08 105.19 102.62 1xrp n GLY 39 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1xrp n GLY 39 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1xrp n MET 40 N -1.02 0.00 -3.60 1.61 2.81 -1.12 -3.43 117.12 112.36 1xrp n MET 40 Ca 0.00 0.00 -0.06 0.00 -1.81 0.00 0.00 57.70 55.83 1xrp n MET 40 Cb 0.00 0.00 -0.02 0.00 -0.71 0.00 0.00 33.22 32.49 1xrp n MET 40 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 1xrp s SER 41 N -1.00 -0.27 0.50 7.83 1.04 -1.26 -3.13 113.70 117.42 1xrp s SER 41 Ca 0.00 -0.14 0.17 0.00 0.48 0.00 0.00 55.95 56.46 1xrp s SER 41 Cb 0.00 0.38 1.24 0.00 0.10 0.00 0.00 66.02 67.74 1xrp s SER 41 CO 0.00 -0.66 2.11 1.12 0.98 0.00 0.00 173.24 176.79 1xrp h HIS 42 N 2.00 0.00 -0.79 5.02 2.07 -1.97 -3.32 115.15 118.15 1xrp h HIS 42 Ca -0.22 0.00 0.12 0.00 -2.85 0.00 0.00 60.37 57.42 1xrp h HIS 42 Cb 1.23 0.00 -0.13 0.00 2.57 0.00 0.00 27.41 31.08 1xrp h HIS 42 CO 0.30 0.06 -0.32 -0.25 -3.07 0.00 0.00 177.93 174.65 1xrp n ASP 43 N -4.40 -0.54 0.00 3.10 8.00 -1.26 0.08 116.55 121.52 1xrp n ASP 43 Ca -0.03 1.38 0.06 0.00 0.71 0.00 0.00 54.79 56.91 1xrp n ASP 43 Cb 0.14 -0.31 0.32 0.00 -0.02 0.00 0.00 41.12 41.25 1xrp n ASP 43 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xrp n TYR 44 N -5.15 0.00 0.58 1.24 4.11 -1.10 -1.39 117.16 115.45 1xrp n TYR 44 Ca 0.08 0.00 0.09 0.00 -0.00 0.00 0.00 57.90 58.06 1xrp n TYR 44 Cb 0.31 -0.06 0.10 0.00 -0.00 0.00 0.00 39.34 39.69 1xrp n TYR 44 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.86 178.14 1xrp n LEU 45 N -1.06 2.61 0.23 -3.48 4.77 0.11 -4.57 117.00 115.62 1xrp n LEU 45 Ca 0.08 -1.15 0.15 0.00 -0.03 0.00 0.00 56.01 55.06 1xrp n LEU 45 Cb 0.05 -0.05 0.81 0.00 -2.33 0.00 0.00 43.42 41.89 1xrp n LEU 45 CO 0.07 0.50 0.97 -0.07 -1.33 0.00 0.00 177.39 177.52 1xrp h LEU 46 N 3.41 0.00 -1.88 2.23 3.38 -1.27 -1.67 115.31 119.51 1xrp h LEU 46 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1xrp h LEU 46 Cb 0.75 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.50 1xrp h LEU 46 CO 0.00 0.00 -0.04 0.77 0.09 0.00 0.00 178.44 179.26 1xrp h SER 47 N 0.00 0.00 0.76 -0.43 4.64 -1.83 -1.84 113.55 114.86 1xrp h SER 47 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xrp h SER 47 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 1xrp h SER 47 CO 0.00 0.04 0.00 0.18 -0.87 0.00 0.00 176.83 176.18 1xrp n LEU 48 N -3.19 0.56 0.25 5.97 4.32 -0.63 -3.02 117.00 121.26 1xrp n LEU 48 Ca -0.01 0.63 0.13 0.00 -0.02 0.00 0.00 56.01 56.74 1xrp n LEU 48 Cb 0.25 -0.54 0.71 0.00 -1.62 0.00 0.00 43.42 42.22 1xrp n LEU 48 CO 0.26 -0.47 0.98 -0.09 -1.22 0.00 0.00 177.39 176.86 1xrp h ARG 49 N 0.00 0.00 0.00 3.23 2.43 -1.53 -0.77 114.38 117.74 1xrp h ARG 49 Ca 0.00 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.13 1xrp h ARG 49 Cb 0.38 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.93 1xrp h ARG 49 CO 0.00 0.00 -0.21 -0.44 -1.51 0.00 0.00 179.97 177.81 1xrp h ASP 50 N 0.00 0.00 0.20 -3.80 3.45 -1.78 -2.78 116.42 111.71 1xrp h ASP 50 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 1xrp h ASP 50 Cb 0.38 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.15 1xrp h ASP 50 CO 0.00 0.21 0.00 0.23 -1.57 0.00 0.00 179.24 178.11 1xrp n MET 51 N -4.21 0.08 0.21 3.56 2.81 -0.30 -1.56 117.12 117.72 1xrp n MET 51 Ca -0.02 0.50 0.15 0.00 -1.81 0.00 0.00 57.70 56.51 1xrp n MET 51 Cb 0.27 -1.72 0.59 0.00 -0.71 0.00 0.00 33.22 31.64 1xrp n MET 51 CO 0.00 0.00 0.00 1.79 1.51 0.00 0.00 175.97 179.27 1xrp h THR 52 N 0.00 0.00 -0.01 2.03 1.35 -1.41 0.52 112.91 115.39 1xrp h THR 52 Ca 0.00 -0.41 0.00 0.00 -0.55 0.00 0.00 66.41 65.45 1xrp h THR 52 Cb 0.10 1.30 0.00 0.00 -1.73 0.00 0.00 68.15 67.82 1xrp h THR 52 CO 0.00 0.00 -0.02 0.29 -0.25 0.00 0.00 175.52 175.54 1xrp n LYS 53 N -2.71 1.17 -0.16 4.72 5.02 -0.60 -2.68 118.16 122.92 1xrp n LYS 53 Ca 0.01 -0.38 0.05 0.00 -2.02 0.00 0.00 58.31 55.98 1xrp n LYS 53 Cb 0.28 -1.49 0.14 0.00 -0.02 0.00 0.00 35.03 33.94 1xrp n LYS 53 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1xrp n GLU 54 N -0.58 2.70 -1.70 1.97 -0.58 0.12 -4.95 120.64 117.62 1xrp n GLU 54 Ca 0.20 -1.97 -0.00 0.00 -0.42 0.00 0.00 57.16 54.97 1xrp n GLU 54 Cb 0.23 -1.26 -0.00 0.00 -0.57 0.00 0.00 31.44 29.84 1xrp n GLU 54 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1xrp n GLY 55 N 0.50 0.37 3.06 0.62 0.00 -1.09 -4.92 105.19 103.73 1xrp n GLY 55 Ca 0.11 -0.95 -0.32 0.00 0.00 0.00 0.00 46.02 44.86 1xrp n GLY 55 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xrp s ILE 56 N -2.00 2.13 0.09 -0.61 1.01 -0.89 -0.42 121.20 120.51 1xrp s ILE 56 Ca 0.00 -1.59 -0.30 0.00 0.00 0.00 0.00 60.65 58.76 1xrp s ILE 56 Cb 0.00 -2.24 -0.06 0.00 0.01 0.00 0.00 42.46 40.18 1xrp s ILE 56 CO 0.00 -0.01 1.11 -0.89 0.00 0.00 0.00 174.94 175.15 1xrp s THR 57 N 1.12 4.17 -0.12 2.92 2.01 -0.41 -3.05 115.64 122.28 1xrp s THR 57 Ca -0.08 1.66 0.00 0.00 0.31 0.00 0.00 61.69 63.58 1xrp s THR 57 Cb -0.20 -4.06 -0.02 0.00 0.01 0.00 0.00 72.50 68.24 1xrp s THR 57 CO -0.05 0.19 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.24 1xrp s VAL 58 N 0.57 3.01 -0.27 3.82 1.01 -0.71 0.30 120.40 128.13 1xrp s VAL 58 Ca 0.54 -0.68 -0.08 0.00 0.00 0.00 0.00 61.98 61.75 1xrp s VAL 58 Cb -0.27 -2.25 -0.03 0.00 0.00 0.00 0.00 36.38 33.83 1xrp s VAL 58 CO 0.31 0.53 0.11 -0.22 0.00 0.00 0.00 175.10 175.83 1xrp s LEU 59 N 0.26 3.68 0.22 3.92 2.96 0.21 -1.14 118.68 128.78 1xrp s LEU 59 Ca -0.09 -0.26 0.08 0.00 -0.22 0.00 0.00 54.13 53.63 1xrp s LEU 59 Cb -0.16 -1.97 -0.04 0.00 0.50 0.00 0.00 46.19 44.53 1xrp s LEU 59 CO 0.05 -0.08 0.05 -0.36 -1.32 0.00 0.00 176.35 174.70 1xrp s PHE 60 N 1.63 2.89 -0.25 5.38 0.08 0.20 -1.21 117.98 126.71 1xrp s PHE 60 Ca 0.06 -0.14 -0.28 0.00 0.12 0.00 0.00 56.93 56.69 1xrp s PHE 60 Cb -0.16 -1.34 0.16 0.00 -0.57 0.00 0.00 43.02 41.11 1xrp s PHE 60 CO 0.05 0.55 1.21 1.52 -0.10 0.00 0.00 175.22 178.45 1xrp s TYR 61 N -1.99 -0.23 -0.16 0.36 1.13 -1.26 0.42 117.35 115.62 1xrp s TYR 61 Ca 0.30 0.47 -0.23 0.00 -1.41 0.00 0.00 57.07 56.20 1xrp s TYR 61 Cb -0.08 0.45 -0.02 0.00 -1.10 0.00 0.00 41.96 41.21 1xrp s TYR 61 CO 0.21 -0.16 0.72 -0.51 -2.51 0.00 0.00 175.55 173.30 1xrp s ASP 62 N -0.54 6.85 0.94 -0.18 -0.00 0.13 -4.38 116.67 119.49 1xrp s ASP 62 Ca 0.04 1.04 -0.12 0.00 -0.00 0.00 0.00 52.55 53.51 1xrp s ASP 62 Cb -0.03 -2.40 0.15 0.00 -0.00 0.00 0.00 42.92 40.64 1xrp s ASP 62 CO -0.07 -0.29 1.10 -1.10 -0.00 0.00 0.00 175.17 174.81 1xrp s GLN 63 N 1.80 0.92 0.20 8.23 -0.21 -1.26 -4.28 119.66 125.05 1xrp s GLN 63 Ca 0.34 0.59 -0.30 0.00 0.02 0.00 0.00 55.36 56.01 1xrp s GLN 63 Cb -0.16 -1.79 -0.16 0.00 1.00 0.00 0.00 33.01 31.90 1xrp s GLN 63 CO 0.13 -2.41 0.85 1.97 -2.12 0.00 0.00 175.29 173.70 1xrp n PHE 64 N -3.97 0.50 -0.77 0.91 -1.74 -1.26 -0.58 117.46 110.56 1xrp n PHE 64 Ca 0.06 0.84 0.00 0.00 -0.56 0.00 0.00 57.45 57.79 1xrp n PHE 64 Cb 0.57 -2.12 0.00 0.00 1.52 0.00 0.00 39.48 39.44 1xrp n PHE 64 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1xrp n GLY 65 N 1.74 0.08 3.66 4.97 0.00 -0.32 -4.92 105.19 110.39 1xrp n GLY 65 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 1xrp n GLY 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xrp n GLY 67 N 0.92 2.65 0.11 0.00 0.00 -1.18 -1.11 105.19 106.57 1xrp n GLY 67 Ca -0.13 0.34 0.12 0.00 0.00 0.00 0.00 46.02 46.36 1xrp n GLY 67 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xrp n ARG 68 N 8.91 0.37 -2.97 1.61 1.74 -1.26 -4.93 116.66 120.13 1xrp n ARG 68 Ca 0.00 -0.22 -0.32 0.00 -0.77 0.00 0.00 57.85 56.53 1xrp n ARG 68 Cb 0.00 -1.50 -0.06 0.00 -1.02 0.00 0.00 32.46 29.88 1xrp n ARG 68 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1xrp s SER 69 N -2.79 6.80 0.60 0.55 0.01 -0.27 -4.74 113.70 113.86 1xrp s SER 69 Ca 0.16 1.42 -0.13 0.00 1.31 0.00 0.00 55.95 58.71 1xrp s SER 69 Cb 0.18 -2.43 -0.05 0.00 0.21 0.00 0.00 66.02 63.94 1xrp s SER 69 CO 0.63 -0.29 1.02 -1.83 0.41 0.00 0.00 173.24 173.18 1xrp s GLU 70 N -3.18 3.60 -0.18 12.44 -1.05 -0.98 -3.94 118.70 125.41 1xrp s GLU 70 Ca 0.57 0.87 -0.15 0.00 -0.15 0.00 0.00 54.97 56.10 1xrp s GLU 70 Cb -0.10 -2.08 -0.04 0.00 -0.44 0.00 0.00 34.13 31.47 1xrp s GLU 70 CO 0.18 -0.56 0.37 -2.00 0.95 0.00 0.00 175.26 174.20 1xrp s GLU 71 N -4.75 4.23 0.03 -4.83 2.12 -1.26 -1.17 118.70 113.06 1xrp s GLU 71 Ca 0.57 0.20 -0.00 0.00 0.36 0.00 0.00 54.97 56.10 1xrp s GLU 71 Cb -0.11 -3.49 0.01 0.00 0.26 0.00 0.00 34.13 30.80 1xrp s GLU 71 CO 0.46 0.08 0.04 -0.35 -0.54 0.00 0.00 175.26 174.95 1xrp n PRO 72 N 4.06 0.04 -1.89 4.30 -0.04 -1.26 -4.88 135.00 135.32 1xrp n PRO 72 Ca -0.09 -0.06 -0.38 0.00 -0.04 0.00 0.00 63.50 62.93 1xrp n PRO 72 Cb 0.51 -0.04 0.03 0.00 -0.04 0.00 0.00 33.50 33.97 1xrp n PRO 72 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1xrp s ASP 73 N -1.14 5.45 0.48 3.54 2.15 -1.26 -4.87 116.67 121.03 1xrp s ASP 73 Ca 0.02 2.66 0.17 0.00 0.43 0.00 0.00 52.55 55.83 1xrp s ASP 73 Cb -0.00 -2.63 1.18 0.00 -0.30 0.00 0.00 42.92 41.17 1xrp s ASP 73 CO 0.01 -1.44 2.04 1.56 -0.17 0.00 0.00 175.17 177.18 1xrp h GLN 74 N 1.56 0.19 0.00 4.34 4.20 -2.00 0.72 115.11 124.12 1xrp h GLN 74 Ca -0.51 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.19 1xrp h GLN 74 Cb 1.29 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 29.03 1xrp h GLN 74 CO 0.58 0.12 0.00 0.66 -0.67 0.00 0.00 178.83 179.52 1xrp h SER 75 N 0.19 0.00 -0.47 1.46 4.64 -2.04 -0.37 113.55 116.96 1xrp h SER 75 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 1xrp h SER 75 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 1xrp h SER 75 CO -0.03 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.22 1xrp n LYS 76 N -3.07 2.87 -2.59 4.77 5.02 0.25 -4.69 118.16 120.72 1xrp n LYS 76 Ca -0.03 -2.02 -0.43 0.00 -2.02 0.00 0.00 58.31 53.81 1xrp n LYS 76 Cb 0.08 -1.68 0.00 0.00 -0.02 0.00 0.00 35.03 33.41 1xrp n LYS 76 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1xrp n PHE 77 N 0.77 4.36 -4.11 2.13 0.99 -0.15 -4.77 117.46 116.68 1xrp n PHE 77 Ca 0.18 -3.06 -0.09 0.00 -0.00 0.00 0.00 57.45 54.48 1xrp n PHE 77 Cb 0.65 -2.33 -0.09 0.00 -1.00 0.00 0.00 39.48 36.70 1xrp n PHE 77 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.76 177.71 1xrp s THR 78 N 2.36 0.10 -0.01 4.37 -4.23 -1.26 -4.94 115.64 112.03 1xrp s THR 78 Ca 0.46 -1.81 -0.24 0.00 -1.18 0.00 0.00 61.69 58.93 1xrp s THR 78 Cb 0.03 -1.97 -0.19 0.00 1.34 0.00 0.00 72.50 71.71 1xrp s THR 78 CO 0.02 -0.47 1.22 0.40 -0.54 0.00 0.00 174.62 175.25 1xrp h ILE 79 N 2.82 1.43 -0.98 2.99 5.03 -1.99 -2.88 117.51 123.93 1xrp h ILE 79 Ca -0.34 -1.44 0.15 0.00 -0.12 0.00 0.00 64.86 63.11 1xrp h ILE 79 Cb 1.20 2.26 -0.10 0.00 -3.03 0.00 0.00 36.82 37.15 1xrp h ILE 79 CO 0.58 0.40 0.59 0.44 -0.68 0.00 0.00 178.15 179.47 1xrp h ASP 80 N -0.35 0.81 -0.57 1.72 3.45 -1.97 0.67 116.42 120.19 1xrp h ASP 80 Ca 0.00 0.08 -0.06 0.00 0.43 0.00 0.00 57.03 57.48 1xrp h ASP 80 Cb 0.70 -0.08 -0.02 0.00 -0.56 0.00 0.00 39.33 39.37 1xrp h ASP 80 CO 0.02 0.36 0.13 0.22 -1.57 0.00 0.00 179.24 178.40 1xrp h TYR 81 N 0.84 0.98 -0.52 4.55 3.20 -1.85 -2.35 116.97 121.81 1xrp h TYR 81 Ca 0.53 -0.12 -0.00 0.00 3.14 0.00 0.00 58.73 62.27 1xrp h TYR 81 Cb 0.69 -0.27 -0.03 0.00 1.54 0.00 0.00 36.73 38.66 1xrp h TYR 81 CO -0.02 0.84 0.31 0.78 -1.64 0.00 0.00 178.16 178.44 1xrp h GLY 82 N 0.83 0.74 0.97 1.82 0.00 -0.73 -1.69 103.07 105.02 1xrp h GLY 82 Ca 0.18 -0.30 -0.00 0.00 0.00 0.00 0.00 47.33 47.21 1xrp h GLY 82 CO 0.00 0.29 0.16 -2.08 0.00 0.00 0.00 176.54 174.91 1xrp h VAL 83 N 0.71 1.10 -0.03 4.60 2.07 -0.54 -0.69 116.25 123.46 1xrp h VAL 83 Ca 0.19 -0.24 -0.08 0.00 0.82 0.00 0.00 66.70 67.39 1xrp h VAL 83 Cb -0.03 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 1xrp h VAL 83 CO -0.04 0.10 -0.38 -0.33 0.02 0.00 0.00 177.57 176.94 1xrp h GLU 84 N 0.34 0.07 -0.20 1.57 4.39 -1.06 -1.94 114.58 117.75 1xrp h GLU 84 Ca 0.10 -0.03 -0.04 0.00 0.34 0.00 0.00 59.36 59.73 1xrp h GLU 84 Cb 0.02 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.66 1xrp h GLU 84 CO -0.02 0.44 -0.03 1.49 -1.16 0.00 0.00 179.01 179.73 1xrp h GLU 85 N 0.06 0.37 -0.09 2.33 4.81 -0.81 -0.19 114.58 121.05 1xrp h GLU 85 Ca 0.00 -0.13 0.01 0.00 -0.13 0.00 0.00 59.36 59.11 1xrp h GLU 85 Cb 0.70 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.04 1xrp h GLU 85 CO 0.05 0.60 0.01 0.00 -0.73 0.00 0.00 179.01 178.95 1xrp h ALA 86 N 0.76 0.09 -0.69 2.92 0.00 -0.88 -0.41 119.26 121.05 1xrp h ALA 86 Ca 0.05 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1xrp h ALA 86 Cb 0.45 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 1xrp h ALA 86 CO 0.02 -0.45 0.34 1.49 0.00 0.00 0.00 179.25 180.64 1xrp h GLU 87 N 0.05 0.98 -0.36 0.00 4.57 -1.28 0.34 114.58 118.89 1xrp h GLU 87 Ca 0.04 -0.14 -0.06 0.00 -1.18 0.00 0.00 59.36 58.02 1xrp h GLU 87 Cb 0.04 -0.18 -0.02 0.00 -0.16 0.00 0.00 28.75 28.43 1xrp h GLU 87 CO -0.06 0.77 -0.02 0.00 -1.18 0.00 0.00 179.01 178.52 1xrp h ALA 88 N 1.16 1.28 -0.09 2.92 0.00 -0.77 -1.06 119.26 122.72 1xrp h ALA 88 Ca 0.24 -0.23 -0.16 0.00 0.00 0.00 0.00 54.91 54.76 1xrp h ALA 88 Cb 0.11 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 17.75 1xrp h ALA 88 CO -0.03 0.48 -0.57 1.25 0.00 0.00 0.00 179.25 180.38 1xrp h LEU 89 N 0.55 0.65 -0.32 0.00 5.85 -0.61 -0.73 115.31 120.70 1xrp h LEU 89 Ca 0.11 -0.67 0.00 0.00 0.84 0.00 0.00 57.88 58.17 1xrp h LEU 89 Cb 0.39 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 1xrp h LEU 89 CO 0.02 1.22 0.20 -0.09 -0.34 0.00 0.00 178.44 179.44 1xrp h ARG 90 N 0.14 0.42 0.11 1.25 2.43 -0.75 -1.37 114.38 116.60 1xrp h ARG 90 Ca -0.05 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.09 1xrp h ARG 90 Cb 1.23 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.69 1xrp h ARG 90 CO 0.12 0.30 -0.05 1.03 -1.51 0.00 0.00 179.97 179.86 1xrp h SER 91 N 0.42 -0.12 -0.34 -3.80 0.87 -1.22 0.54 113.55 109.89 1xrp h SER 91 Ca 0.11 -0.03 0.05 0.00 -1.23 0.00 0.00 61.79 60.69 1xrp h SER 91 Cb -0.02 0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 61.95 1xrp h SER 91 CO -0.02 -0.05 0.23 0.50 -0.53 0.00 0.00 176.83 176.96 1xrp h LYS 92 N -0.18 0.26 0.00 2.24 3.11 -0.89 0.36 116.57 121.47 1xrp h LYS 92 Ca -0.01 -0.02 -0.35 0.00 -2.81 0.00 0.00 60.65 57.46 1xrp h LYS 92 Cb 0.14 -0.06 -0.06 0.00 -1.00 0.00 0.00 32.23 31.25 1xrp h LYS 92 CO 0.02 0.17 -2.24 1.28 -2.81 0.00 0.00 179.45 175.88 1xrp n LEU 93 N -4.48 0.34 0.00 5.20 4.77 -0.54 -4.68 117.00 117.61 1xrp n LEU 93 Ca 0.04 0.09 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 1xrp n LEU 93 Cb 0.22 0.35 0.00 0.00 -2.33 0.00 0.00 43.42 41.67 1xrp n LEU 93 CO 0.35 0.50 0.05 0.49 -1.33 0.00 0.00 177.39 177.44 1xrp n PHE 94 N -2.84 0.00 0.00 -1.77 3.72 0.19 -5.09 117.46 111.67 1xrp n PHE 94 Ca -0.30 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.10 1xrp n PHE 94 Cb 1.13 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.67 1xrp n PHE 94 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1xrp n GLY 95 N 0.75 3.09 0.95 1.37 0.00 0.13 -2.93 105.19 108.54 1xrp n GLY 95 Ca 0.00 -0.19 0.12 0.00 0.00 0.00 0.00 46.02 45.95 1xrp n GLY 95 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1xrp n ASN 96 N 9.10 2.90 -4.73 1.61 3.02 -1.26 -4.44 115.26 121.46 1xrp n ASN 96 Ca 0.00 -1.91 -0.42 0.00 -0.03 0.00 0.00 54.58 52.22 1xrp n ASN 96 Cb 0.00 -0.13 -0.03 0.00 -0.61 0.00 0.00 39.78 39.01 1xrp n ASN 96 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1xrp s GLU 97 N -1.73 4.39 0.42 3.52 2.12 -1.15 -5.00 118.70 121.26 1xrp s GLU 97 Ca 0.35 2.01 -0.23 0.00 0.36 0.00 0.00 54.97 57.46 1xrp s GLU 97 Cb 0.21 -3.23 -0.09 0.00 0.26 0.00 0.00 34.13 31.28 1xrp s GLU 97 CO 0.31 -0.28 1.03 0.15 -0.54 0.00 0.00 175.26 175.92 1xrp s LYS 98 N 0.30 4.12 0.08 4.30 1.02 -1.26 -4.98 119.74 123.32 1xrp s LYS 98 Ca 0.58 1.42 -0.01 0.00 0.02 0.00 0.00 55.97 57.99 1xrp s LYS 98 Cb -0.35 -2.42 -0.04 0.00 -0.52 0.00 0.00 37.83 34.49 1xrp s LYS 98 CO 0.35 -0.16 -0.00 0.14 -0.92 0.00 0.00 175.35 174.76 1xrp s VAL 99 N -1.78 0.18 0.15 3.17 -7.23 -0.58 -4.75 120.40 109.55 1xrp s VAL 99 Ca 0.60 -1.85 -0.22 0.00 -1.81 0.00 0.00 61.98 58.71 1xrp s VAL 99 Cb -0.19 -1.71 -0.08 0.00 0.56 0.00 0.00 36.38 34.97 1xrp s VAL 99 CO 0.24 -0.81 0.69 -0.36 -0.31 0.00 0.00 175.10 174.55 1xrp s PHE 100 N -3.96 3.80 -0.12 2.82 0.08 -0.24 -1.95 117.98 118.41 1xrp s PHE 100 Ca 0.13 1.44 0.03 0.00 0.12 0.00 0.00 56.93 58.65 1xrp s PHE 100 Cb 0.08 -2.63 0.01 0.00 -0.57 0.00 0.00 43.02 39.91 1xrp s PHE 100 CO -0.06 0.49 -0.23 -1.17 -0.10 0.00 0.00 175.22 174.16 1xrp s LEU 101 N -1.36 2.09 -0.04 -0.37 2.96 -0.83 -0.05 118.68 121.08 1xrp s LEU 101 Ca 0.35 -0.58 0.07 0.00 -0.22 0.00 0.00 54.13 53.75 1xrp s LEU 101 Cb -0.20 -1.42 -0.01 0.00 0.50 0.00 0.00 46.19 45.06 1xrp s LEU 101 CO 0.22 0.11 -0.25 -0.32 -1.32 0.00 0.00 176.35 174.80 1xrp s MET 102 N 0.61 2.31 -0.00 1.98 -2.45 0.81 -1.22 119.30 121.33 1xrp s MET 102 Ca -0.12 -0.90 0.02 0.00 -1.25 0.00 0.00 55.69 53.43 1xrp s MET 102 Cb -0.17 -2.07 -0.01 0.00 1.25 0.00 0.00 34.83 33.84 1xrp s MET 102 CO 0.03 0.46 -0.06 0.20 1.05 0.00 0.00 175.02 176.70 1xrp s GLY 103 N -0.36 0.29 -0.10 2.11 0.00 -0.32 0.23 107.32 109.17 1xrp s GLY 103 Ca 0.03 -0.27 0.02 0.00 0.00 0.00 0.00 44.72 44.50 1xrp s GLY 103 CO 0.01 -0.23 -0.17 -0.45 0.00 0.00 0.00 173.10 172.26 1xrp s SER 104 N -0.21 3.74 1.54 1.64 0.15 -0.46 -2.00 113.70 118.09 1xrp s SER 104 Ca 0.02 -0.36 0.00 0.00 0.70 0.00 0.00 55.95 56.31 1xrp s SER 104 Cb -0.03 -1.28 0.00 0.00 -1.71 0.00 0.00 66.02 63.00 1xrp s SER 104 CO -0.00 0.22 0.00 -0.24 1.20 0.00 0.00 173.24 174.42 1xrp n SER 105 N 3.15 0.00 -0.18 5.45 2.88 -0.62 0.95 113.62 125.24 1xrp n SER 105 Ca -0.18 0.00 0.04 0.00 -1.33 0.00 0.00 58.87 57.41 1xrp n SER 105 Cb 0.52 0.00 0.32 0.00 -0.75 0.00 0.00 64.21 64.31 1xrp n SER 105 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 1xrp h TYR 106 N 0.00 0.80 -0.32 0.66 5.03 -1.84 0.18 116.97 121.48 1xrp h TYR 106 Ca 0.00 0.02 0.05 0.00 2.58 0.00 0.00 58.73 61.38 1xrp h TYR 106 Cb 0.00 -0.27 -0.02 0.00 1.55 0.00 0.00 36.73 38.00 1xrp h TYR 106 CO 0.00 0.46 0.22 0.78 -1.32 0.00 0.00 178.16 178.29 1xrp h GLY 107 N 0.82 0.27 0.75 1.82 0.00 0.67 0.66 103.07 108.07 1xrp h GLY 107 Ca 0.29 -0.09 -0.02 0.00 0.00 0.00 0.00 47.33 47.52 1xrp h GLY 107 CO -0.09 0.07 -0.00 -1.33 0.00 0.00 0.00 176.54 175.19 1xrp h GLY 108 N 0.22 0.18 1.20 4.60 0.00 -0.55 0.86 103.07 109.60 1xrp h GLY 108 Ca 0.14 -0.14 0.02 0.00 0.00 0.00 0.00 47.33 47.35 1xrp h GLY 108 CO -0.03 0.13 0.50 0.00 0.00 0.00 0.00 176.54 177.14 1xrp h ALA 109 N 0.73 1.49 -0.25 3.60 0.00 -0.90 -1.14 119.26 122.80 1xrp h ALA 109 Ca 0.03 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.77 1xrp h ALA 109 Cb 0.36 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1xrp h ALA 109 CO 0.01 0.45 -0.36 1.25 0.00 0.00 0.00 179.25 180.60 1xrp h LEU 110 N 0.99 0.58 -0.68 0.00 5.85 -0.69 -2.56 115.31 118.80 1xrp h LEU 110 Ca 0.29 -0.24 -0.10 0.00 0.84 0.00 0.00 57.88 58.67 1xrp h LEU 110 Cb -0.05 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 40.80 1xrp h LEU 110 CO -0.07 0.89 -0.07 0.00 -0.34 0.00 0.00 178.44 178.85 1xrp h ALA 111 N 1.14 0.88 -0.32 1.25 0.00 0.26 -1.21 119.26 121.26 1xrp h ALA 111 Ca 0.05 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.59 1xrp h ALA 111 Cb 0.84 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1xrp h ALA 111 CO 0.07 0.64 0.03 -0.07 0.00 0.00 0.00 179.25 179.92 1xrp h LEU 112 N 0.85 0.53 -1.27 0.00 3.38 -1.11 -0.14 115.31 117.56 1xrp h LEU 112 Ca 0.14 -0.29 -0.06 0.00 0.09 0.00 0.00 57.88 57.76 1xrp h LEU 112 Cb 0.60 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 1xrp h LEU 112 CO 0.04 0.68 -0.19 0.00 0.09 0.00 0.00 178.44 179.06 1xrp h ALA 113 N 0.86 1.39 0.37 1.53 0.00 -1.39 -0.23 119.26 121.80 1xrp h ALA 113 Ca 0.09 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 1xrp h ALA 113 Cb 0.40 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1xrp h ALA 113 CO 0.01 0.42 -0.18 -0.92 0.00 0.00 0.00 179.25 178.59 1xrp h TYR 114 N 0.24 -0.46 -0.96 0.00 3.20 -0.84 -3.09 116.97 115.07 1xrp h TYR 114 Ca 0.04 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 61.99 1xrp h TYR 114 Cb 0.48 0.15 -0.07 0.00 1.54 0.00 0.00 36.73 38.83 1xrp h TYR 114 CO 0.01 -0.17 0.62 0.00 -1.64 0.00 0.00 178.16 176.98 1xrp h ALA 115 N -0.16 1.52 -0.72 1.82 0.00 -0.59 1.08 119.26 122.21 1xrp h ALA 115 Ca -0.05 -0.01 0.10 0.00 0.00 0.00 0.00 54.91 54.96 1xrp h ALA 115 Cb 0.49 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 17.99 1xrp h ALA 115 CO 0.08 0.30 0.47 0.28 0.00 0.00 0.00 179.25 180.38 1xrp h VAL 116 N 1.03 0.91 0.00 0.00 2.07 -0.98 -0.49 116.25 118.78 1xrp h VAL 116 Ca 0.44 -0.19 -0.30 0.00 0.82 0.00 0.00 66.70 67.47 1xrp h VAL 116 Cb 0.33 0.29 -0.06 0.00 -1.52 0.00 0.00 31.29 30.34 1xrp h VAL 116 CO -0.20 0.10 -2.14 1.17 0.02 0.00 0.00 177.57 176.53 1xrp n LYS 117 N -4.49 0.98 -1.18 1.57 4.81 -0.45 -4.73 118.16 114.68 1xrp n LYS 117 Ca 0.12 0.05 -0.04 0.00 -0.87 0.00 0.00 58.31 57.57 1xrp n LYS 117 Cb 0.37 -1.41 0.13 0.00 0.02 0.00 0.00 35.03 34.14 1xrp n LYS 117 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1xrp n TYR 118 N -2.83 0.91 0.29 5.64 4.01 0.36 -4.76 117.16 120.78 1xrp n TYR 118 Ca -0.31 -1.69 0.17 0.00 -0.16 0.00 0.00 57.90 55.91 1xrp n TYR 118 Cb 0.96 -0.27 0.83 0.00 -0.31 0.00 0.00 39.34 40.55 1xrp n TYR 118 CO 0.00 0.00 0.00 -0.56 -0.46 0.00 0.00 176.86 175.84 1xrp h GLN 119 N 1.43 0.00 0.00 -0.72 3.07 -1.21 -1.26 115.11 116.42 1xrp h GLN 119 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.84 1xrp h GLN 119 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.79 1xrp h GLN 119 CO 0.25 0.00 0.00 -3.47 0.09 0.00 0.00 178.83 175.70 1xrp n ASP 120 N -2.73 0.59 -1.24 0.06 2.03 -1.26 -1.58 116.55 112.41 1xrp n ASP 120 Ca -0.01 0.67 0.12 0.00 0.52 0.00 0.00 54.79 56.09 1xrp n ASP 120 Cb 0.13 -0.79 0.27 0.00 -0.72 0.00 0.00 41.12 40.02 1xrp n ASP 120 CO 0.00 0.00 0.00 1.41 -1.92 0.00 0.00 177.20 176.69 1xrp n HIS 121 N -2.18 0.75 -4.43 -0.67 8.25 -0.47 -4.97 115.22 111.49 1xrp n HIS 121 Ca 0.01 -0.39 -0.25 0.00 -0.26 0.00 0.00 57.72 56.83 1xrp n HIS 121 Cb 0.18 -0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.18 1xrp n HIS 121 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1xrp s LEU 122 N -1.20 2.61 -0.14 2.41 1.43 -0.62 -1.53 118.68 121.63 1xrp s LEU 122 Ca 0.43 -0.92 0.09 0.00 -1.03 0.00 0.00 54.13 52.70 1xrp s LEU 122 Cb 0.24 -1.21 -0.15 0.00 0.03 0.00 0.00 46.19 45.10 1xrp s LEU 122 CO 0.32 0.07 -0.01 0.29 0.23 0.00 0.00 176.35 177.24 1xrp n LYS 123 N -0.29 1.39 -3.45 1.70 5.02 -0.82 -4.80 118.16 116.92 1xrp n LYS 123 Ca -0.08 0.03 -0.13 0.00 -2.02 0.00 0.00 58.31 56.10 1xrp n LYS 123 Cb 0.58 -1.34 -0.03 0.00 -0.02 0.00 0.00 35.03 34.22 1xrp n LYS 123 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1xrp s GLY 124 N -4.95 -0.61 0.01 0.72 0.00 -1.26 -4.05 107.32 97.18 1xrp s GLY 124 Ca -0.12 0.71 0.08 0.00 0.00 0.00 0.00 44.72 45.39 1xrp s GLY 124 CO 0.50 0.36 -0.24 -2.27 0.00 0.00 0.00 173.10 171.45 1xrp s LEU 125 N -2.36 2.10 -0.06 0.66 2.96 0.35 -1.95 118.68 120.37 1xrp s LEU 125 Ca -0.02 -0.48 -0.00 0.00 -0.22 0.00 0.00 54.13 53.41 1xrp s LEU 125 Cb -0.01 -1.18 0.02 0.00 0.50 0.00 0.00 46.19 45.53 1xrp s LEU 125 CO -0.07 0.26 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.55 1xrp s ILE 126 N -0.66 0.51 -0.13 6.68 1.01 -0.36 0.04 121.20 128.30 1xrp s ILE 126 Ca 0.09 -0.04 0.01 0.00 0.00 0.00 0.00 60.65 60.72 1xrp s ILE 126 Cb -0.09 -0.59 0.02 0.00 0.01 0.00 0.00 42.46 41.81 1xrp s ILE 126 CO 0.00 0.25 -0.14 -0.69 0.00 0.00 0.00 174.94 174.36 1xrp s VAL 127 N 1.40 1.48 -0.23 2.92 1.01 0.53 -1.18 120.40 126.34 1xrp s VAL 127 Ca -0.03 -0.60 0.02 0.00 0.00 0.00 0.00 61.98 61.37 1xrp s VAL 127 Cb -0.13 -1.38 0.05 0.00 0.00 0.00 0.00 36.38 34.91 1xrp s VAL 127 CO -0.03 0.44 -0.14 -0.44 0.00 0.00 0.00 175.10 174.93 1xrp s SER 128 N 1.29 3.96 -1.87 3.32 0.01 -0.85 -0.38 113.70 119.18 1xrp s SER 128 Ca -0.00 -1.12 0.00 0.00 1.31 0.00 0.00 55.95 56.13 1xrp s SER 128 Cb -0.14 -1.52 0.00 0.00 0.21 0.00 0.00 66.02 64.57 1xrp s SER 128 CO -0.06 -0.12 0.00 0.61 0.41 0.00 0.00 173.24 174.07 1xrp n GLY 129 N 4.50 0.66 0.86 3.44 0.00 -0.36 -1.59 105.19 112.70 1xrp n GLY 129 Ca -0.17 -0.06 -0.06 0.00 0.00 0.00 0.00 46.02 45.73 1xrp n GLY 129 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xrp n GLY 130 N -0.80 -1.07 3.54 -0.02 0.00 -1.26 -3.15 105.19 102.43 1xrp n GLY 130 Ca -0.22 -1.70 -0.16 0.00 0.00 0.00 0.00 46.02 43.95 1xrp n GLY 130 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1xrp s LEU 131 N 0.00 -0.58 0.00 0.99 2.34 -1.26 -4.64 118.68 115.53 1xrp s LEU 131 Ca 0.17 0.67 0.12 0.00 0.06 0.00 0.00 54.13 55.15 1xrp s LEU 131 Cb -0.00 2.35 -0.11 0.00 -0.56 0.00 0.00 46.19 47.86 1xrp s LEU 131 CO 0.12 -0.52 0.57 -1.54 -1.06 0.00 0.00 176.35 173.92 1xrp n SER 132 N 0.96 0.75 -3.64 1.48 3.41 -1.26 -3.73 113.62 111.58 1xrp n SER 132 Ca -0.16 -0.87 -0.18 0.00 -0.26 0.00 0.00 58.87 57.39 1xrp n SER 132 Cb 0.57 0.89 -0.16 0.00 -0.26 0.00 0.00 64.21 65.26 1xrp n SER 132 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1xrp s SER 133 N -2.05 1.02 0.03 4.04 0.15 -1.26 -0.48 113.70 115.15 1xrp s SER 133 Ca 0.06 0.15 -0.21 0.00 0.70 0.00 0.00 55.95 56.65 1xrp s SER 133 Cb 0.10 0.18 -0.15 0.00 -1.71 0.00 0.00 66.02 64.43 1xrp s SER 133 CO 0.47 -0.26 1.34 0.58 1.20 0.00 0.00 173.24 176.57 1xrp h VAL 134 N 6.38 1.35 -0.84 4.45 2.07 -1.68 -2.28 116.25 125.70 1xrp h VAL 134 Ca -0.13 -1.25 0.15 0.00 0.82 0.00 0.00 66.70 66.28 1xrp h VAL 134 Cb 1.12 1.89 -0.10 0.00 -1.52 0.00 0.00 31.29 32.68 1xrp h VAL 134 CO 0.17 0.36 0.42 -0.65 0.02 0.00 0.00 177.57 177.89 1xrp h PRO 135 N -0.07 0.56 -0.46 1.57 0.11 -1.75 0.48 132.00 132.45 1xrp h PRO 135 Ca 0.02 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 66.00 1xrp h PRO 135 Cb 0.63 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.60 1xrp h PRO 135 CO 0.03 0.37 -0.10 1.25 -0.21 0.00 0.00 178.00 179.34 1xrp h LEU 136 N 0.58 0.82 -0.87 2.35 5.85 -1.92 0.03 115.31 122.15 1xrp h LEU 136 Ca 0.47 -0.25 -0.07 0.00 0.84 0.00 0.00 57.88 58.87 1xrp h LEU 136 Cb 0.69 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 1xrp h LEU 136 CO -0.38 0.94 0.10 0.74 -0.34 0.00 0.00 178.44 179.50 1xrp h THR 137 N 0.75 1.25 -0.03 1.05 2.02 -0.02 -0.15 112.91 117.77 1xrp h THR 137 Ca 0.13 -0.95 -0.01 0.00 0.77 0.00 0.00 66.41 66.35 1xrp h THR 137 Cb 0.60 0.68 -0.00 0.00 -1.74 0.00 0.00 68.15 67.69 1xrp h THR 137 CO 0.04 0.35 -0.02 0.58 0.37 0.00 0.00 175.52 176.84 1xrp h VAL 138 N 0.89 1.33 -0.39 3.16 2.07 0.22 -0.94 116.25 122.59 1xrp h VAL 138 Ca 0.18 -1.00 0.07 0.00 0.82 0.00 0.00 66.70 66.78 1xrp h VAL 138 Cb 0.38 1.93 -0.06 0.00 -1.52 0.00 0.00 31.29 32.02 1xrp h VAL 138 CO 0.01 0.27 -0.00 0.50 0.02 0.00 0.00 177.57 178.36 1xrp h LYS 139 N -0.32 0.10 -0.44 1.57 3.64 -0.78 -0.07 116.57 120.26 1xrp h LYS 139 Ca 0.01 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.35 1xrp h LYS 139 Cb 0.44 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.22 1xrp h LYS 139 CO 0.00 0.06 0.17 0.93 -2.27 0.00 0.00 179.45 178.34 1xrp h GLU 140 N 0.10 0.67 -0.31 1.90 4.39 -1.00 -2.80 114.58 117.52 1xrp h GLU 140 Ca 0.19 -0.13 -0.04 0.00 0.34 0.00 0.00 59.36 59.72 1xrp h GLU 140 Cb 0.27 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.79 1xrp h GLU 140 CO -0.32 0.63 0.02 0.52 -1.16 0.00 0.00 179.01 178.70 1xrp h MET 141 N 0.57 0.47 -0.58 2.33 2.86 -0.62 -2.06 114.93 117.90 1xrp h MET 141 Ca 0.15 -0.09 0.03 0.00 -2.06 0.00 0.00 59.70 57.73 1xrp h MET 141 Cb 0.22 -0.07 -0.04 0.00 0.06 0.00 0.00 31.60 31.76 1xrp h MET 141 CO -0.01 0.48 0.35 -0.91 1.06 0.00 0.00 176.91 177.89 1xrp h ASN 142 N 0.46 0.57 -0.60 1.22 -0.26 -0.77 -0.69 115.58 115.51 1xrp h ASN 142 Ca 0.10 0.00 0.06 0.00 -0.56 0.00 0.00 56.30 55.91 1xrp h ASN 142 Cb 0.27 -0.12 -0.05 0.00 -1.06 0.00 0.00 38.32 37.36 1xrp h ASN 142 CO 0.01 0.40 0.31 -0.09 -1.06 0.00 0.00 177.43 176.99 1xrp h ARG 143 N 0.70 0.55 -0.34 0.81 2.43 -1.19 0.14 114.38 117.48 1xrp h ARG 143 Ca 0.23 -0.03 0.02 0.00 -0.81 0.00 0.00 59.98 59.39 1xrp h ARG 143 Cb 0.02 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.43 1xrp h ARG 143 CO -0.10 0.37 0.23 -0.07 -1.51 0.00 0.00 179.97 178.89 1xrp h LEU 144 N 0.57 0.32 -0.37 3.80 3.38 -0.85 -1.19 115.31 120.96 1xrp h LEU 144 Ca 0.28 -0.01 -0.13 0.00 0.09 0.00 0.00 57.88 58.11 1xrp h LEU 144 Cb 0.21 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1xrp h LEU 144 CO -0.20 0.22 -0.28 0.40 0.09 0.00 0.00 178.44 178.67 1xrp h ILE 145 N 0.37 1.28 0.00 1.22 1.08 0.64 -2.85 117.51 119.25 1xrp h ILE 145 Ca 0.14 -1.44 -0.04 0.00 -0.39 0.00 0.00 64.86 63.13 1xrp h ILE 145 Cb 0.09 1.38 -0.01 0.00 -3.07 0.00 0.00 36.82 35.22 1xrp h ILE 145 CO -0.03 0.48 -0.18 0.44 -0.69 0.00 0.00 178.15 178.17 1xrp h ASP 146 N 0.65 0.00 -0.02 1.72 3.32 -0.00 -1.22 116.42 120.87 1xrp h ASP 146 Ca 0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1xrp h ASP 146 Cb 0.86 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.41 1xrp h ASP 146 CO 0.07 0.18 0.00 -0.62 -1.72 0.00 0.00 179.24 177.15 1xrp n GLU 147 N -3.70 1.31 -2.39 3.56 1.02 -0.67 -4.85 120.64 114.92 1xrp n GLU 147 Ca -0.02 -0.45 -0.31 0.00 -0.02 0.00 0.00 57.16 56.37 1xrp n GLU 147 Cb 0.29 -1.45 -0.02 0.00 -0.02 0.00 0.00 31.44 30.24 1xrp n GLU 147 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1xrp s LEU 148 N -1.89 3.57 0.44 -4.62 2.96 -0.46 -5.01 118.68 113.67 1xrp s LEU 148 Ca 0.40 1.35 -0.25 0.00 -0.22 0.00 0.00 54.13 55.40 1xrp s LEU 148 Cb 0.20 -4.30 -0.08 0.00 0.50 0.00 0.00 46.19 42.50 1xrp s LEU 148 CO 0.32 -0.62 1.40 -2.16 -1.32 0.00 0.00 176.35 173.97 1xrp s PRO 149 N -4.40 3.73 0.01 0.98 0.04 -1.26 -4.61 135.00 129.49 1xrp s PRO 149 Ca 0.55 2.35 -0.03 0.00 0.04 0.00 0.00 61.00 63.91 1xrp s PRO 149 Cb -0.10 -2.66 -0.01 0.00 0.04 0.00 0.00 34.50 31.77 1xrp s PRO 149 CO 0.39 -0.76 0.37 0.00 0.04 0.00 0.00 177.00 177.04 1xrp n ALA 150 N -0.15 -0.06 -0.09 8.56 0.00 -1.26 -1.59 120.51 125.91 1xrp n ALA 150 Ca 0.05 0.08 -0.04 0.00 0.00 0.00 0.00 53.44 53.52 1xrp n ALA 150 Cb 0.42 0.10 -0.03 0.00 0.00 0.00 0.00 19.45 19.94 1xrp n ALA 150 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1xrp h LYS 151 N 0.00 -0.07 -0.90 0.00 3.64 -1.99 0.92 116.57 118.17 1xrp h LYS 151 Ca 0.01 0.00 0.12 0.00 -1.27 0.00 0.00 60.65 59.52 1xrp h LYS 151 Cb 0.04 0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 31.80 1xrp h LYS 151 CO -0.08 -0.04 0.58 1.88 -2.27 0.00 0.00 179.45 179.51 1xrp h TYR 152 N -0.07 0.91 -0.50 1.91 0.99 -1.75 0.18 116.97 118.64 1xrp h TYR 152 Ca 0.04 0.03 -0.06 0.00 2.00 0.00 0.00 58.73 60.73 1xrp h TYR 152 Cb 0.17 -0.29 -0.02 0.00 1.00 0.00 0.00 36.73 37.59 1xrp h TYR 152 CO -0.80 0.37 0.08 -0.09 -0.00 0.00 0.00 178.16 177.71 1xrp h ARG 153 N 0.80 0.83 -0.25 4.88 2.43 -0.31 -1.65 114.38 121.10 1xrp h ARG 153 Ca 0.44 -0.22 -0.18 0.00 -0.81 0.00 0.00 59.98 59.20 1xrp h ARG 153 Cb 0.58 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.03 1xrp h ARG 153 CO -0.20 0.83 -0.57 -0.44 -1.51 0.00 0.00 179.97 178.08 1xrp h ASP 154 N 0.70 0.88 -0.79 -3.80 3.32 0.10 -2.73 116.42 114.09 1xrp h ASP 154 Ca 0.15 -0.48 0.04 0.00 0.02 0.00 0.00 57.03 56.76 1xrp h ASP 154 Cb 0.40 -0.25 -0.05 0.00 0.22 0.00 0.00 39.33 39.65 1xrp h ASP 154 CO 0.01 1.26 0.50 0.00 -1.72 0.00 0.00 179.24 179.29 1xrp h ALA 155 N 0.75 1.04 -0.46 3.45 0.00 -0.54 0.50 119.26 124.00 1xrp h ALA 155 Ca 0.01 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1xrp h ALA 155 Cb 1.16 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 1xrp h ALA 155 CO 0.12 0.30 0.09 0.82 0.00 0.00 0.00 179.25 180.58 1xrp h ILE 156 N 0.97 1.24 0.02 0.00 1.08 -1.25 -1.66 117.51 117.91 1xrp h ILE 156 Ca 0.32 -0.88 -0.00 0.00 -0.39 0.00 0.00 64.86 63.91 1xrp h ILE 156 Cb 0.03 0.92 0.00 0.00 -3.07 0.00 0.00 36.82 34.70 1xrp h ILE 156 CO -0.12 0.31 -0.01 0.11 -0.69 0.00 0.00 178.15 177.75 1xrp h LYS 157 N 0.63 -0.03 0.32 2.37 1.57 -1.08 -0.62 116.57 119.73 1xrp h LYS 157 Ca 0.14 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.91 1xrp h LYS 157 Cb 0.36 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.68 1xrp h LYS 157 CO 0.01 0.45 -0.15 -0.22 -0.57 0.00 0.00 179.45 178.96 1xrp h LYS 158 N -0.51 -0.42 -0.49 3.15 3.64 -0.05 -1.36 116.57 120.53 1xrp h LYS 158 Ca -0.00 0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.38 1xrp h LYS 158 Cb 0.49 0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.38 1xrp h LYS 158 CO 0.00 -0.28 0.19 1.88 -2.27 0.00 0.00 179.45 178.97 1xrp h TYR 159 N -0.55 0.70 -0.39 1.91 0.99 -1.47 -2.35 116.97 115.81 1xrp h TYR 159 Ca -0.04 -0.03 -0.05 0.00 2.00 0.00 0.00 58.73 60.60 1xrp h TYR 159 Cb 0.33 -0.22 -0.01 0.00 1.00 0.00 0.00 36.73 37.83 1xrp h TYR 159 CO 0.10 0.55 0.04 0.78 -0.00 0.00 0.00 178.16 179.63 1xrp h GLY 160 N 0.85 0.71 2.00 3.88 0.00 -1.15 0.39 103.07 109.75 1xrp h GLY 160 Ca 0.17 -0.49 -0.01 0.00 0.00 0.00 0.00 47.33 46.99 1xrp h GLY 160 CO -0.02 0.46 -0.06 1.76 0.00 0.00 0.00 176.54 178.68 1xrp h SER 161 N 0.50 0.00 0.13 0.19 0.02 -0.95 -2.59 113.55 110.86 1xrp h SER 161 Ca 0.12 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 1xrp h SER 161 Cb 0.40 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.94 1xrp h SER 161 CO 0.01 0.06 -1.69 -1.54 -1.14 0.00 0.00 176.83 172.54 1xrp n SER 162 N -3.25 0.27 0.00 3.07 3.41 -0.91 -5.00 113.62 111.21 1xrp n SER 162 Ca -0.00 -0.12 0.00 0.00 -0.26 0.00 0.00 58.87 58.48 1xrp n SER 162 Cb 0.28 1.62 0.00 0.00 -0.26 0.00 0.00 64.21 65.85 1xrp n SER 162 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xrp n GLY 163 N 1.29 0.87 2.61 5.00 0.00 0.11 -4.99 105.19 110.09 1xrp n GLY 163 Ca -0.02 -0.55 -0.38 0.00 0.00 0.00 0.00 46.02 45.07 1xrp n GLY 163 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1xrp n SER 164 N 1.09 7.47 0.23 1.61 7.64 0.41 -4.68 113.62 127.39 1xrp n SER 164 Ca 0.00 -3.46 0.16 0.00 1.01 0.00 0.00 58.87 56.58 1xrp n SER 164 Cb 0.13 -1.23 0.80 0.00 -1.01 0.00 0.00 64.21 62.91 1xrp n SER 164 CO 0.00 0.00 0.00 1.88 -3.01 0.00 0.00 175.04 173.91 1xrp h TYR 165 N 3.93 0.00 0.00 1.43 -1.99 -1.94 0.61 116.97 119.00 1xrp h TYR 165 Ca 0.57 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.30 1xrp h TYR 165 Cb 0.33 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.06 1xrp h TYR 165 CO 1.42 0.00 -0.42 -0.85 -0.00 0.00 0.00 178.16 178.31 1xrp n GLU 166 N -2.60 0.26 -1.55 4.88 0.00 -1.26 -4.46 120.64 115.91 1xrp n GLU 166 Ca -0.01 0.12 -0.42 0.00 0.00 0.00 0.00 57.16 56.84 1xrp n GLU 166 Cb 0.09 -1.71 0.00 0.00 0.00 0.00 0.00 31.44 29.82 1xrp n GLU 166 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.13 175.42 1xrp n ASN 167 N -2.12 0.56 0.21 -1.84 5.15 0.20 -4.85 115.26 112.58 1xrp n ASN 167 Ca 0.04 1.04 0.06 0.00 -0.60 0.00 0.00 54.58 55.12 1xrp n ASN 167 Cb 0.43 -1.25 0.47 0.00 -0.53 0.00 0.00 39.78 38.90 1xrp n ASN 167 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 1xrp h PRO 168 N 1.41 0.00 0.02 1.20 0.13 -1.91 -2.35 132.00 130.49 1xrp h PRO 168 Ca -0.41 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.69 1xrp h PRO 168 Cb 1.36 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.49 1xrp h PRO 168 CO 0.56 0.27 -0.10 0.93 -0.23 0.00 0.00 178.00 179.44 1xrp h GLU 169 N 0.00 0.04 -0.43 0.86 5.08 -1.95 -2.99 114.58 115.19 1xrp h GLU 169 Ca -0.00 -0.06 0.08 0.00 -1.00 0.00 0.00 59.36 58.38 1xrp h GLU 169 Cb 0.54 0.02 -0.08 0.00 0.50 0.00 0.00 28.75 29.73 1xrp h GLU 169 CO 0.04 1.00 -0.06 -0.92 -1.00 0.00 0.00 179.01 178.07 1xrp h TYR 170 N -0.88 -0.13 -0.54 4.33 3.20 -1.84 -0.23 116.97 120.88 1xrp h TYR 170 Ca -0.02 0.04 0.09 0.00 3.14 0.00 0.00 58.73 61.97 1xrp h TYR 170 Cb 1.04 0.12 -0.07 0.00 1.54 0.00 0.00 36.73 39.37 1xrp h TYR 170 CO 0.26 -0.14 0.15 1.96 -1.64 0.00 0.00 178.16 178.75 1xrp h GLN 171 N 0.05 0.30 -0.73 1.82 1.08 -1.53 0.58 115.11 116.68 1xrp h GLN 171 Ca 0.21 -0.02 0.07 0.00 -1.45 0.00 0.00 58.65 57.46 1xrp h GLN 171 Cb 0.32 -0.07 -0.05 0.00 -0.05 0.00 0.00 27.48 27.63 1xrp h GLN 171 CO -0.40 0.20 0.48 1.49 -0.95 0.00 0.00 178.83 179.65 1xrp h GLU 172 N 0.31 0.74 -0.15 1.46 4.81 -0.93 0.90 114.58 121.72 1xrp h GLU 172 Ca 0.27 -0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 59.37 1xrp h GLU 172 Cb 0.34 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.55 1xrp h GLU 172 CO -0.31 0.49 -0.23 0.00 -0.73 0.00 0.00 179.01 178.23 1xrp h ALA 173 N 1.60 0.23 -0.97 2.92 0.00 0.12 -2.54 119.26 120.62 1xrp h ALA 173 Ca 0.32 -0.37 0.08 0.00 0.00 0.00 0.00 54.91 54.94 1xrp h ALA 173 Cb 0.26 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 17.94 1xrp h ALA 173 CO -0.11 0.19 0.62 0.28 0.00 0.00 0.00 179.25 180.24 1xrp h VAL 174 N 0.04 1.03 -0.21 0.00 2.07 0.32 -1.07 116.25 118.44 1xrp h VAL 174 Ca 0.01 -0.36 -0.02 0.00 0.82 0.00 0.00 66.70 67.15 1xrp h VAL 174 Cb 0.80 -0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 1xrp h VAL 174 CO 0.05 0.19 0.06 -1.13 0.02 0.00 0.00 177.57 176.76 1xrp h ASN 175 N 1.06 0.31 0.32 0.57 -0.73 -0.78 -0.88 115.58 115.45 1xrp h ASN 175 Ca 0.44 -0.22 -0.00 0.00 1.87 0.00 0.00 56.30 58.38 1xrp h ASN 175 Cb 0.29 -0.08 -0.02 0.00 0.27 0.00 0.00 38.32 38.78 1xrp h ASN 175 CO -0.19 0.45 -0.29 0.22 -0.37 0.00 0.00 177.43 177.25 1xrp h TYR 176 N 0.16 -0.77 -0.44 0.67 3.20 -0.97 -0.49 116.97 118.33 1xrp h TYR 176 Ca 0.07 0.00 0.09 0.00 3.14 0.00 0.00 58.73 62.02 1xrp h TYR 176 Cb 0.25 0.30 -0.10 0.00 1.54 0.00 0.00 36.73 38.73 1xrp h TYR 176 CO 0.01 -0.42 -0.30 0.35 -1.64 0.00 0.00 178.16 176.15 1xrp h PHE 177 N -0.63 -0.81 -0.09 -3.82 3.04 -1.15 -1.73 116.94 111.75 1xrp h PHE 177 Ca -0.02 0.06 0.04 0.00 3.98 0.00 0.00 57.97 62.03 1xrp h PHE 177 Cb 0.57 0.42 -0.05 0.00 2.56 0.00 0.00 35.95 39.45 1xrp h PHE 177 CO -0.17 -0.36 -0.24 1.88 -2.02 0.00 0.00 178.31 177.40 1xrp h TYR 178 N -0.21 -0.65 0.00 0.41 -1.99 -0.83 0.36 116.97 114.06 1xrp h TYR 178 Ca 0.19 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.95 1xrp h TYR 178 Cb 0.52 0.30 0.00 0.00 2.00 0.00 0.00 36.73 39.55 1xrp h TYR 178 CO -0.53 -0.33 0.00 0.72 -0.00 0.00 0.00 178.16 178.02 1xrp n HIS 179 N -5.37 0.00 -0.03 4.88 8.25 -0.22 -0.01 115.22 122.72 1xrp n HIS 179 Ca -0.03 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.40 1xrp n HIS 179 Cb 0.28 -0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.34 1xrp n HIS 179 CO 0.00 0.00 0.00 0.94 0.64 0.00 0.00 176.34 177.92 1xrp n GLN 180 N -1.00 2.80 0.00 -0.41 -0.06 0.30 -4.31 117.38 114.70 1xrp n GLN 180 Ca 0.07 -0.01 0.00 0.00 -2.00 0.00 0.00 57.00 55.07 1xrp n GLN 180 Cb 0.03 -1.17 0.00 0.00 -4.06 0.00 0.00 30.24 25.05 1xrp n GLN 180 CO 0.00 0.00 0.00 0.72 -0.20 0.00 0.00 177.06 177.58 1xrp n HIS 181 N -2.21 0.00 -0.05 3.69 8.25 0.10 -4.77 115.22 120.23 1xrp n HIS 181 Ca -0.10 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.31 1xrp n HIS 181 Cb 0.68 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.78 1xrp n HIS 181 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1xrp n LEU 182 N -0.41 1.07 -3.68 2.41 7.94 0.99 -1.47 117.00 123.85 1xrp n LEU 182 Ca 0.00 0.22 -0.21 0.00 -1.11 0.00 0.00 56.01 54.90 1xrp n LEU 182 Cb 0.00 -0.64 -0.18 0.00 0.53 0.00 0.00 43.42 43.14 1xrp n LEU 182 CO 0.00 -0.39 -0.35 -0.22 -1.11 0.00 0.00 177.39 175.33 1xrp s LEU 183 N -6.61 0.25 0.00 -1.96 0.20 -0.78 -1.11 118.68 108.66 1xrp s LEU 183 Ca -0.15 -0.05 0.25 0.00 0.69 0.00 0.00 54.13 54.87 1xrp s LEU 183 Cb 0.02 -0.20 0.45 0.00 -0.43 0.00 0.00 46.19 46.03 1xrp s LEU 183 CO 0.23 -0.26 1.38 0.54 -0.29 0.00 0.00 176.35 177.95 1xrp n ARG 184 N 5.27 0.26 -2.78 1.98 1.74 -1.26 -4.14 116.66 117.73 1xrp n ARG 184 Ca -0.04 -0.17 -0.24 0.00 -0.77 0.00 0.00 57.85 56.63 1xrp n ARG 184 Cb 0.50 -1.50 0.02 0.00 -1.02 0.00 0.00 32.46 30.46 1xrp n ARG 184 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1xrp s SER 185 N -2.85 5.74 0.58 0.55 1.04 -1.26 -5.00 113.70 112.50 1xrp s SER 185 Ca 0.14 0.42 -0.09 0.00 0.48 0.00 0.00 55.95 56.90 1xrp s SER 185 Cb 0.18 -1.57 -0.03 0.00 0.10 0.00 0.00 66.02 64.69 1xrp s SER 185 CO 0.67 -0.83 0.95 -0.70 0.98 0.00 0.00 173.24 174.31 1xrp s GLU 186 N -4.70 3.49 -0.50 4.02 2.12 -1.26 -4.61 118.70 117.26 1xrp s GLU 186 Ca 0.50 0.52 -0.17 0.00 0.36 0.00 0.00 54.97 56.18 1xrp s GLU 186 Cb -0.10 -2.18 0.02 0.00 0.26 0.00 0.00 34.13 32.13 1xrp s GLU 186 CO 0.40 -0.50 0.63 -3.47 -0.54 0.00 0.00 175.26 171.78 1xrp n ASP 187 N -2.61 -7.42 -4.65 -1.70 4.64 -1.26 -4.85 116.55 98.69 1xrp n ASP 187 Ca 0.04 0.28 -0.42 0.00 -1.38 0.00 0.00 54.79 53.30 1xrp n ASP 187 Cb 0.55 -4.64 -0.03 0.00 -1.04 0.00 0.00 41.12 35.96 1xrp n ASP 187 CO 0.00 0.00 0.00 0.26 -0.82 0.00 0.00 177.20 176.64 1xrp s TRP 188 N -2.50 1.61 0.56 -0.67 0.52 -1.26 -4.93 118.94 112.26 1xrp s TRP 188 Ca 0.22 -0.03 -0.20 0.00 0.02 0.00 0.00 56.10 56.11 1xrp s TRP 188 Cb -0.05 -4.07 -0.06 0.00 -1.15 0.00 0.00 33.47 28.14 1xrp s TRP 188 CO 0.79 -4.54 1.11 -0.35 0.02 0.00 0.00 176.95 173.98 1xrp n PRO 189 N 7.50 1.23 -0.10 4.98 -0.04 -1.26 -4.78 135.00 142.54 1xrp n PRO 189 Ca 0.20 0.46 0.21 0.00 -0.04 0.00 0.00 63.50 64.33 1xrp n PRO 189 Cb 0.42 -2.29 0.64 0.00 -0.04 0.00 0.00 33.50 32.24 1xrp n PRO 189 CO 0.00 0.00 0.00 -1.35 -0.04 0.00 0.00 175.50 174.11 1xrp h PRO 190 N 0.96 0.12 -0.41 0.54 0.11 -1.99 -0.76 132.00 130.57 1xrp h PRO 190 Ca -0.49 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.58 1xrp h PRO 190 Cb 1.34 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.40 1xrp h PRO 190 CO 0.54 0.08 0.08 0.93 -0.21 0.00 0.00 178.00 179.42 1xrp h GLU 191 N 0.13 0.61 -0.01 1.05 3.07 -1.89 -0.28 114.58 117.26 1xrp h GLU 191 Ca 0.34 -0.11 -0.03 0.00 -0.50 0.00 0.00 59.36 59.06 1xrp h GLU 191 Cb 1.16 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 28.98 1xrp h GLU 191 CO -0.05 0.57 -0.13 0.28 -1.40 0.00 0.00 179.01 178.28 1xrp h VAL 192 N 0.59 1.55 -0.92 3.13 2.07 -1.42 -2.88 116.25 118.37 1xrp h VAL 192 Ca 0.13 -1.80 0.10 0.00 0.82 0.00 0.00 66.70 65.96 1xrp h VAL 192 Cb 0.25 2.71 -0.08 0.00 -1.52 0.00 0.00 31.29 32.65 1xrp h VAL 192 CO -0.00 0.48 0.56 -0.07 0.02 0.00 0.00 177.57 178.56 1xrp h LEU 193 N -0.58 0.82 -0.89 2.57 3.38 -1.25 -0.49 115.31 118.88 1xrp h LEU 193 Ca -0.01 0.05 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 1xrp h LEU 193 Cb 0.86 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.47 1xrp h LEU 193 CO 0.03 0.45 0.20 0.50 0.09 0.00 0.00 178.44 179.71 1xrp h LYS 194 N 0.91 1.02 -0.56 1.13 1.63 -1.09 0.11 116.57 119.72 1xrp h LYS 194 Ca 0.45 -0.21 -0.11 0.00 -0.85 0.00 0.00 60.65 59.93 1xrp h LYS 194 Cb 0.41 -0.15 -0.02 0.00 -0.60 0.00 0.00 32.23 31.87 1xrp h LYS 194 CO -0.25 0.88 -0.09 0.77 -3.45 0.00 0.00 179.45 177.30 1xrp h SER 195 N 0.99 1.04 -0.60 4.20 0.02 -1.07 0.23 113.55 118.36 1xrp h SER 195 Ca 0.22 -0.34 -0.10 0.00 -0.84 0.00 0.00 61.79 60.72 1xrp h SER 195 Cb 0.29 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.52 1xrp h SER 195 CO -0.01 1.14 -0.01 -0.07 -1.14 0.00 0.00 176.83 176.75 1xrp h LEU 196 N 0.93 1.04 -0.53 5.07 3.38 -0.81 -2.03 115.31 122.36 1xrp h LEU 196 Ca 0.15 -0.30 -0.09 0.00 0.09 0.00 0.00 57.88 57.73 1xrp h LEU 196 Cb 0.66 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 1xrp h LEU 196 CO 0.05 1.10 -0.01 -0.08 0.09 0.00 0.00 178.44 179.59 1xrp h GLU 197 N 0.97 0.94 -0.38 1.13 4.81 -0.54 -2.45 114.58 119.07 1xrp h GLU 197 Ca 0.17 -0.30 -0.00 0.00 -0.13 0.00 0.00 59.36 59.09 1xrp h GLU 197 Cb 0.57 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.84 1xrp h GLU 197 CO 0.03 0.96 0.23 1.88 -0.73 0.00 0.00 179.01 181.38 1xrp h TYR 198 N 0.82 0.50 -0.01 0.92 0.05 -0.28 -2.50 116.97 116.46 1xrp h TYR 198 Ca 0.15 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.93 1xrp h TYR 198 Cb 0.54 -0.17 -0.00 0.00 1.01 0.00 0.00 36.73 38.11 1xrp h TYR 198 CO 0.04 0.34 -0.01 0.00 -1.05 0.00 0.00 178.16 177.48 1xrp h ALA 199 N 1.72 0.01 0.00 3.88 0.00 -1.01 -2.35 119.26 121.52 1xrp h ALA 199 Ca 0.14 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1xrp h ALA 199 Cb -0.01 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1xrp h ALA 199 CO -0.03 -0.26 0.00 0.39 0.00 0.00 0.00 179.25 179.36 1xrp n GLU 200 N -4.86 0.15 -0.13 0.00 1.02 -0.96 -3.46 120.64 112.41 1xrp n GLU 200 Ca -0.08 0.53 -0.28 0.00 -0.02 0.00 0.00 57.16 57.31 1xrp n GLU 200 Cb 0.24 -1.89 -0.10 0.00 -0.02 0.00 0.00 31.44 29.66 1xrp n GLU 200 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1xrp n ARG 201 N -2.20 0.58 -0.09 3.49 1.74 -0.96 -5.00 116.66 114.22 1xrp n ARG 201 Ca 0.00 0.35 -0.03 0.00 -0.77 0.00 0.00 57.85 57.40 1xrp n ARG 201 Cb 0.12 -1.56 0.03 0.00 -1.02 0.00 0.00 32.46 30.02 1xrp n ARG 201 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1xrp n ARG 202 N -4.30 -1.43 -0.00 5.56 5.12 -0.89 -5.00 116.66 115.71 1xrp n ARG 202 Ca -0.49 -0.17 0.05 0.00 -1.93 0.00 0.00 57.85 55.31 1xrp n ARG 202 Cb 0.83 -0.17 -0.06 0.00 -1.16 0.00 0.00 32.46 31.90 1xrp n ARG 202 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1xrp n ASN 203 N -3.21 1.37 -0.06 0.55 3.02 -1.26 -4.70 115.26 110.99 1xrp n ASN 203 Ca 0.01 -0.43 -0.09 0.00 -0.03 0.00 0.00 54.58 54.04 1xrp n ASN 203 Cb 0.06 1.18 -0.02 0.00 -0.61 0.00 0.00 39.78 40.39 1xrp n ASN 203 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 1xrp h VAL 204 N 0.00 0.98 -0.48 2.41 2.07 -1.89 -1.97 116.25 117.37 1xrp h VAL 204 Ca 0.00 -0.08 0.03 0.00 0.82 0.00 0.00 66.70 67.47 1xrp h VAL 204 Cb 0.31 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 30.78 1xrp h VAL 204 CO 0.00 0.04 0.27 0.22 0.02 0.00 0.00 177.57 178.12 1xrp h TYR 205 N 0.22 0.51 -0.09 1.57 3.20 -1.78 0.18 116.97 120.78 1xrp h TYR 205 Ca 0.10 0.02 -0.10 0.00 3.14 0.00 0.00 58.73 61.89 1xrp h TYR 205 Cb 0.04 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.14 1xrp h TYR 205 CO -0.10 0.28 -0.38 -0.09 -1.64 0.00 0.00 178.16 176.22 1xrp h ARG 206 N 0.54 0.19 0.08 1.82 2.43 -1.70 0.71 114.38 118.46 1xrp h ARG 206 Ca 0.20 -0.08 -0.27 0.00 -0.81 0.00 0.00 59.98 59.01 1xrp h ARG 206 Cb 0.05 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.58 1xrp h ARG 206 CO -0.11 0.55 -1.44 0.82 -1.51 0.00 0.00 179.97 178.29 1xrp h ILE 207 N 0.17 0.94 0.12 1.20 1.08 -0.97 -3.36 117.51 116.68 1xrp h ILE 207 Ca 0.02 -2.32 -0.28 0.00 -0.39 0.00 0.00 64.86 61.89 1xrp h ILE 207 Cb 0.75 2.55 -0.00 0.00 -3.07 0.00 0.00 36.82 37.05 1xrp h ILE 207 CO 0.06 0.63 -1.44 0.24 -0.69 0.00 0.00 178.15 176.94 1xrp h MET 208 N -0.46 0.25 0.00 2.37 2.86 -0.76 -2.54 114.93 116.65 1xrp h MET 208 Ca -0.33 -0.42 0.00 0.00 -2.06 0.00 0.00 59.70 56.89 1xrp h MET 208 Cb 1.66 0.16 0.00 0.00 0.06 0.00 0.00 31.60 33.47 1xrp h MET 208 CO -0.02 1.20 0.00 -1.71 1.06 0.00 0.00 176.91 177.45 1xrp n ASN 209 N -3.90 0.00 0.00 1.22 5.15 -0.57 -2.04 115.26 115.12 1xrp n ASN 209 Ca -0.25 0.19 0.00 0.00 -0.60 0.00 0.00 54.58 53.92 1xrp n ASN 209 Cb 0.91 -0.29 0.00 0.00 -0.53 0.00 0.00 39.78 39.87 1xrp n ASN 209 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1xrp n GLY 210 N 2.11 0.24 0.27 8.20 0.00 0.14 0.45 105.19 116.60 1xrp n GLY 210 Ca 0.00 -1.36 -0.16 0.00 0.00 0.00 0.00 46.02 44.50 1xrp n GLY 210 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1xrp h PRO 211 N 0.00 -0.61 0.00 1.61 0.11 -1.85 -3.37 132.00 127.90 1xrp h PRO 211 Ca 0.00 0.04 -0.05 0.00 0.11 0.00 0.00 66.00 66.10 1xrp h PRO 211 Cb 0.00 0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.24 1xrp h PRO 211 CO 0.00 -0.41 -0.02 0.27 -0.21 0.00 0.00 178.00 177.64 1xrp n ASN 212 N -5.36 -0.27 -0.23 -2.05 0.23 -1.25 -5.01 115.26 101.31 1xrp n ASN 212 Ca -0.11 -1.35 0.03 0.00 -0.53 0.00 0.00 54.58 52.62 1xrp n ASN 212 Cb 0.27 0.50 0.15 0.00 -2.08 0.00 0.00 39.78 38.62 1xrp n ASN 212 CO 0.00 0.00 0.00 1.56 -0.93 0.00 0.00 177.26 177.89 1xrp h GLN 213 N 0.00 0.35 -0.18 -3.83 1.08 -1.95 -2.17 115.11 108.40 1xrp h GLN 213 Ca -0.05 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.13 1xrp h GLN 213 Cb 0.22 -0.08 0.00 0.00 -0.05 0.00 0.00 27.48 27.57 1xrp h GLN 213 CO 0.07 0.23 0.00 1.97 -0.95 0.00 0.00 178.83 180.15 1xrp n PHE 214 N -5.06 0.22 -3.92 2.96 1.16 -1.26 -4.67 117.46 106.88 1xrp n PHE 214 Ca 0.12 -0.11 -0.31 0.00 -1.87 0.00 0.00 57.45 55.28 1xrp n PHE 214 Cb 0.37 0.00 -0.13 0.00 -1.61 0.00 0.00 39.48 38.11 1xrp n PHE 214 CO 0.00 0.00 0.00 0.99 -1.87 0.00 0.00 176.76 175.88 1xrp s THR 215 N -1.78 2.73 -1.03 1.97 2.01 -0.82 -4.91 115.64 113.82 1xrp s THR 215 Ca 0.34 -3.16 -0.10 0.00 0.31 0.00 0.00 61.69 59.09 1xrp s THR 215 Cb 0.20 -2.88 0.26 0.00 0.01 0.00 0.00 72.50 70.08 1xrp s THR 215 CO 0.29 -0.79 1.00 -0.63 -0.69 0.00 0.00 174.62 173.81 1xrp s ILE 216 N -0.12 5.84 -1.18 1.82 1.01 -1.26 -3.30 121.20 124.01 1xrp s ILE 216 Ca 0.16 -3.18 0.12 0.00 0.00 0.00 0.00 60.65 57.76 1xrp s ILE 216 Cb -0.24 -4.53 0.30 0.00 0.01 0.00 0.00 42.46 37.99 1xrp s ILE 216 CO -0.01 -1.14 1.21 0.35 0.00 0.00 0.00 174.94 175.35 1xrp n THR 217 N 3.04 0.79 -0.04 2.92 -2.24 -0.84 -4.63 114.28 113.28 1xrp n THR 217 Ca 0.21 -0.89 0.00 0.00 -2.27 0.00 0.00 64.05 61.09 1xrp n THR 217 Cb 0.41 0.66 0.00 0.00 -2.10 0.00 0.00 70.33 69.30 1xrp n THR 217 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xrp n GLY 218 N 0.68 -1.70 0.11 3.38 0.00 0.17 -4.87 105.19 102.97 1xrp n GLY 218 Ca 0.12 -1.48 0.12 0.00 0.00 0.00 0.00 46.02 44.78 1xrp n GLY 218 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1xrp n THR 219 N -0.46 0.73 -0.56 2.61 -2.24 -0.87 -2.93 114.28 110.56 1xrp n THR 219 Ca 0.00 0.04 0.09 0.00 -2.27 0.00 0.00 64.05 61.91 1xrp n THR 219 Cb 0.00 -0.94 0.36 0.00 -2.10 0.00 0.00 70.33 67.65 1xrp n THR 219 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 1xrp n ILE 220 N -2.21 1.83 0.26 2.28 -5.35 -1.10 -4.50 119.36 110.57 1xrp n ILE 220 Ca 0.03 -1.16 0.13 0.00 -0.27 0.00 0.00 62.75 61.48 1xrp n ILE 220 Cb 0.30 0.09 0.79 0.00 -1.74 0.00 0.00 39.64 39.08 1xrp n ILE 220 CO 0.00 0.00 0.00 0.07 -1.76 0.00 0.00 176.55 174.86 1xrp h LYS 221 N 4.03 0.00 -0.01 6.28 2.10 -1.78 -2.52 116.57 124.66 1xrp h LYS 221 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1xrp h LYS 221 Cb 1.46 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.79 1xrp h LYS 221 CO 0.24 0.00 -0.30 -0.25 -2.00 0.00 0.00 179.45 177.14 1xrp n ASP 222 N -4.15 1.64 -4.70 7.07 10.43 -1.26 -4.12 116.55 121.48 1xrp n ASP 222 Ca -0.02 -1.32 -0.44 0.00 2.57 0.00 0.00 54.79 55.58 1xrp n ASP 222 Cb 0.13 0.43 -0.03 0.00 1.84 0.00 0.00 41.12 43.50 1xrp n ASP 222 CO 0.00 0.00 0.00 1.87 -1.07 0.00 0.00 177.20 178.00 1xrp n TRP 223 N -0.06 2.47 -3.22 1.24 -0.00 -0.95 -4.87 117.44 112.06 1xrp n TRP 223 Ca 0.07 0.25 0.04 0.00 -0.00 0.00 0.00 57.50 57.85 1xrp n TRP 223 Cb 0.33 -2.57 -0.02 0.00 -0.00 0.00 0.00 31.31 29.06 1xrp n TRP 223 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 177.69 178.03 1xrp s ASP 224 N 0.76 -1.01 -0.25 5.87 3.68 -1.26 -1.90 116.67 122.56 1xrp s ASP 224 Ca 0.73 0.75 0.10 0.00 2.13 0.00 0.00 52.55 56.26 1xrp s ASP 224 Cb -0.60 1.90 0.44 0.00 -1.45 0.00 0.00 42.92 43.21 1xrp s ASP 224 CO 0.41 -0.19 1.27 2.30 0.13 0.00 0.00 175.17 179.09 1xrp n ILE 225 N 5.41 2.35 0.03 4.11 -5.35 0.37 -4.73 119.36 121.54 1xrp n ILE 225 Ca -0.04 -3.34 0.10 0.00 -0.27 0.00 0.00 62.75 59.19 1xrp n ILE 225 Cb 0.52 -0.43 0.53 0.00 -1.74 0.00 0.00 39.64 38.52 1xrp n ILE 225 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1xrp h THR 226 N 1.21 0.97 0.00 7.28 2.02 -1.96 -1.04 112.91 121.38 1xrp h THR 226 Ca 0.11 -0.11 -0.06 0.00 0.77 0.00 0.00 66.41 67.12 1xrp h THR 226 Cb 1.21 0.62 -0.01 0.00 -1.74 0.00 0.00 68.15 68.23 1xrp h THR 226 CO 0.23 0.06 -0.30 -2.24 0.37 0.00 0.00 175.52 173.63 1xrp h ASP 227 N 0.31 0.00 0.32 4.18 2.03 -1.92 -3.32 116.42 118.01 1xrp h ASP 227 Ca 0.17 0.00 -0.32 0.00 -0.73 0.00 0.00 57.03 56.15 1xrp h ASP 227 Cb 0.29 0.00 -0.06 0.00 -0.83 0.00 0.00 39.33 38.73 1xrp h ASP 227 CO -0.04 0.30 -1.95 0.29 -1.03 0.00 0.00 179.24 176.82 1xrp n LYS 228 N -3.30 0.65 0.00 4.15 5.02 -0.48 -4.30 118.16 119.89 1xrp n LYS 228 Ca 0.01 0.19 0.02 0.00 -2.02 0.00 0.00 58.31 56.52 1xrp n LYS 228 Cb 0.55 -1.70 0.11 0.00 -0.02 0.00 0.00 35.03 33.97 1xrp n LYS 228 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 1xrp n ILE 229 N -2.95 1.05 0.94 -0.18 -5.35 -0.67 -1.96 119.36 110.24 1xrp n ILE 229 Ca -0.23 0.26 0.12 0.00 -0.27 0.00 0.00 62.75 62.64 1xrp n ILE 229 Cb 1.09 -1.19 0.56 0.00 -1.74 0.00 0.00 39.64 38.36 1xrp n ILE 229 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1xrp n SER 230 N -1.31 0.00 0.02 7.28 7.64 -1.26 -2.70 113.62 123.28 1xrp n SER 230 Ca 0.02 0.40 0.13 0.00 1.01 0.00 0.00 58.87 60.43 1xrp n SER 230 Cb 0.04 -0.46 0.44 0.00 -1.01 0.00 0.00 64.21 63.21 1xrp n SER 230 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xrp n ALA 231 N -1.46 2.76 -2.11 -0.43 0.00 -0.83 -4.81 120.51 113.62 1xrp n ALA 231 Ca 0.07 -0.18 -0.43 0.00 0.00 0.00 0.00 53.44 52.90 1xrp n ALA 231 Cb 0.28 -1.33 -0.03 0.00 0.00 0.00 0.00 19.45 18.37 1xrp n ALA 231 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1xrp s ILE 232 N -3.03 3.66 -0.41 0.00 1.01 -1.10 -4.89 121.20 116.44 1xrp s ILE 232 Ca 0.12 0.71 0.04 0.00 0.00 0.00 0.00 60.65 61.52 1xrp s ILE 232 Cb 0.17 -3.77 0.45 0.00 0.01 0.00 0.00 42.46 39.33 1xrp s ILE 232 CO 0.61 -0.41 1.43 0.29 0.00 0.00 0.00 174.94 176.86 1xrp n LYS 233 N 7.99 3.35 -4.40 2.79 4.01 -1.26 -4.47 118.16 126.17 1xrp n LYS 233 Ca 0.20 -3.94 -0.24 0.00 -0.51 0.00 0.00 58.31 53.82 1xrp n LYS 233 Cb 0.46 -2.28 -0.11 0.00 -0.51 0.00 0.00 35.03 32.59 1xrp n LYS 233 CO 0.00 0.00 0.00 0.96 -1.11 0.00 0.00 177.40 177.25 1xrp s ILE 234 N -4.71 2.18 0.14 -0.18 -4.36 -1.26 -5.08 121.20 107.93 1xrp s ILE 234 Ca 0.55 -2.09 -0.35 0.00 -0.26 0.00 0.00 60.65 58.50 1xrp s ILE 234 Cb 0.44 -2.07 -0.15 0.00 1.25 0.00 0.00 42.46 41.92 1xrp s ILE 234 CO 0.01 -0.26 1.39 -2.65 0.24 0.00 0.00 174.94 173.66 1xrp n PRO 235 N 0.05 1.53 -4.17 0.37 -0.02 -1.26 -4.74 135.00 126.77 1xrp n PRO 235 Ca -0.11 0.55 -0.18 0.00 -2.02 0.00 0.00 63.50 61.74 1xrp n PRO 235 Cb 0.57 -2.21 -0.16 0.00 -0.02 0.00 0.00 33.50 31.69 1xrp n PRO 235 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1xrp s THR 236 N 0.44 0.48 -0.17 3.45 2.01 -1.26 -0.50 115.64 120.10 1xrp s THR 236 Ca 0.79 -0.16 -0.01 0.00 0.31 0.00 0.00 61.69 62.62 1xrp s THR 236 Cb -0.83 -0.47 -0.01 0.00 0.01 0.00 0.00 72.50 71.20 1xrp s THR 236 CO 0.45 0.18 -0.11 -0.22 -0.69 0.00 0.00 174.62 174.23 1xrp s LEU 237 N 0.50 2.66 -0.16 4.42 2.96 0.11 -0.68 118.68 128.49 1xrp s LEU 237 Ca -0.06 -0.41 0.01 0.00 -0.22 0.00 0.00 54.13 53.44 1xrp s LEU 237 Cb -0.10 -1.63 0.01 0.00 0.50 0.00 0.00 46.19 44.97 1xrp s LEU 237 CO -0.00 0.07 -0.18 -0.63 -1.32 0.00 0.00 176.35 174.28 1xrp s ILE 238 N 0.94 2.36 0.07 6.68 -1.09 0.29 -0.35 121.20 130.10 1xrp s ILE 238 Ca -0.02 -0.87 0.08 0.00 -2.23 0.00 0.00 60.65 57.61 1xrp s ILE 238 Cb -0.15 -1.98 -0.03 0.00 -1.58 0.00 0.00 42.46 38.72 1xrp s ILE 238 CO -0.01 0.53 -0.21 0.42 -1.23 0.00 0.00 174.94 174.44 1xrp s THR 239 N 0.94 1.72 -0.22 2.92 -4.23 0.49 0.64 115.64 117.90 1xrp s THR 239 Ca -0.03 -1.37 -0.21 0.00 -1.18 0.00 0.00 61.69 58.89 1xrp s THR 239 Cb -0.15 -1.52 0.06 0.00 1.34 0.00 0.00 72.50 72.23 1xrp s THR 239 CO -0.03 0.09 0.60 0.54 -0.54 0.00 0.00 174.62 175.28 1xrp s VAL 240 N -0.96 0.00 0.62 2.29 0.11 -0.41 -1.22 120.40 120.83 1xrp s VAL 240 Ca 0.07 -0.01 -0.15 0.00 -2.93 0.00 0.00 61.98 58.96 1xrp s VAL 240 Cb -0.09 -0.84 -0.02 0.00 -1.53 0.00 0.00 36.38 33.89 1xrp s VAL 240 CO 0.03 -0.00 1.07 -0.83 -3.33 0.00 0.00 175.10 172.04 1xrp s GLY 241 N 0.24 2.11 0.19 6.54 0.00 -1.11 -1.11 107.32 114.19 1xrp s GLY 241 Ca -0.01 0.42 -0.12 0.00 0.00 0.00 0.00 44.72 45.02 1xrp s GLY 241 CO 0.01 0.75 1.85 -2.09 0.00 0.00 0.00 173.10 173.62 1xrp h GLU 242 N 0.24 0.88 -0.53 2.90 4.81 0.17 -2.72 114.58 120.33 1xrp h GLU 242 Ca -0.47 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 58.70 1xrp h GLU 242 Cb 1.23 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.41 1xrp h GLU 242 CO 0.56 0.60 0.00 0.66 -0.73 0.00 0.00 179.01 180.10 1xrp n TYR 243 N -4.60 1.34 -1.61 0.92 4.01 -0.40 -4.79 117.16 112.03 1xrp n TYR 243 Ca 0.05 -0.66 -0.48 0.00 -0.16 0.00 0.00 57.90 56.65 1xrp n TYR 243 Cb 0.03 -0.27 -0.04 0.00 -0.31 0.00 0.00 39.34 38.75 1xrp n TYR 243 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 1xrp n ASP 244 N 0.68 1.89 0.26 7.72 4.64 -1.03 -4.18 116.55 126.54 1xrp n ASP 244 Ca 0.24 1.13 0.14 0.00 -1.38 0.00 0.00 54.79 54.92 1xrp n ASP 244 Cb 0.88 -1.28 0.84 0.00 -1.04 0.00 0.00 41.12 40.51 1xrp n ASP 244 CO 0.00 0.00 0.00 1.05 -0.82 0.00 0.00 177.20 177.43 1xrp h GLU 245 N 3.99 0.00 -3.00 -0.67 4.11 -1.58 -1.93 114.58 115.51 1xrp h GLU 245 Ca -0.45 0.00 -0.74 0.00 0.07 0.00 0.00 59.36 58.24 1xrp h GLU 245 Cb 1.32 0.00 -0.32 0.00 0.50 0.00 0.00 28.75 30.24 1xrp h GLU 245 CO 0.74 0.00 0.26 0.28 0.07 0.00 0.00 179.01 180.36 1xrp n VAL 246 N -3.99 4.08 -0.93 -1.06 0.31 -1.26 -4.50 118.33 110.99 1xrp n VAL 246 Ca -0.01 -5.51 -0.31 0.00 -0.01 0.00 0.00 64.34 58.50 1xrp n VAL 246 Cb 0.16 -2.25 0.02 0.00 -0.91 0.00 0.00 33.84 30.86 1xrp n VAL 246 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1xrp n THR 247 N 1.71 0.00 0.18 2.52 -2.24 -0.73 -4.66 114.28 111.07 1xrp n THR 247 Ca 0.25 -0.41 0.12 0.00 -2.27 0.00 0.00 64.05 61.75 1xrp n THR 247 Cb 0.36 0.00 0.65 0.00 -2.10 0.00 0.00 70.33 69.25 1xrp n THR 247 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1xrp h PRO 248 N -0.37 0.00 -0.38 -0.78 0.13 -1.84 -0.33 132.00 128.42 1xrp h PRO 248 Ca -0.35 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.69 1xrp h PRO 248 Cb 1.13 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.24 1xrp h PRO 248 CO 0.27 0.00 -0.13 -0.97 -0.23 0.00 0.00 178.00 176.94 1xrp h ASN 249 N 0.00 0.67 -0.18 1.44 -0.00 -1.98 0.31 115.58 115.85 1xrp h ASN 249 Ca 0.00 -0.20 -0.19 0.00 -0.00 0.00 0.00 56.30 55.91 1xrp h ASN 249 Cb 0.03 -0.18 0.00 0.00 -0.00 0.00 0.00 38.32 38.17 1xrp h ASN 249 CO 0.00 0.83 -0.60 0.58 -0.00 0.00 0.00 177.43 178.24 1xrp h VAL 250 N 0.62 1.29 -0.67 2.57 2.07 -1.33 -2.99 116.25 117.80 1xrp h VAL 250 Ca 0.10 -1.80 -0.06 0.00 0.82 0.00 0.00 66.70 65.76 1xrp h VAL 250 Cb 0.58 1.73 -0.03 0.00 -1.52 0.00 0.00 31.29 32.06 1xrp h VAL 250 CO 0.04 0.58 0.19 0.00 0.02 0.00 0.00 177.57 178.40 1xrp h ALA 251 N 0.73 0.88 -0.29 1.67 0.00 -1.36 -2.97 119.26 117.91 1xrp h ALA 251 Ca -0.00 -0.22 0.07 0.00 0.00 0.00 0.00 54.91 54.75 1xrp h ALA 251 Cb 1.20 -0.26 -0.07 0.00 0.00 0.00 0.00 17.79 18.66 1xrp h ALA 251 CO 0.13 0.57 -0.21 -0.09 0.00 0.00 0.00 179.25 179.65 1xrp h ARG 252 N 0.98 -0.18 -0.53 0.00 2.43 -0.25 0.10 114.38 116.93 1xrp h ARG 252 Ca 0.21 0.01 0.11 0.00 -0.81 0.00 0.00 59.98 59.50 1xrp h ARG 252 Cb 0.32 0.04 -0.09 0.00 -0.42 0.00 0.00 29.97 29.82 1xrp h ARG 252 CO -0.00 -0.12 0.00 0.28 -1.51 0.00 0.00 179.97 178.62 1xrp h VAL 253 N -0.19 0.58 -0.51 0.20 2.07 -1.40 0.36 116.25 117.35 1xrp h VAL 253 Ca 0.15 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.64 1xrp h VAL 253 Cb 0.42 0.45 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 1xrp h VAL 253 CO -0.40 0.02 0.34 0.40 0.02 0.00 0.00 177.57 177.95 1xrp h ILE 254 N 0.12 1.14 -0.75 4.57 2.04 -1.30 -2.73 117.51 120.59 1xrp h ILE 254 Ca 0.27 -0.26 -0.02 0.00 1.00 0.00 0.00 64.86 65.85 1xrp h ILE 254 Cb 0.42 0.39 -0.04 0.00 -0.74 0.00 0.00 36.82 36.85 1xrp h ILE 254 CO -0.45 0.13 0.38 -0.74 0.00 0.00 0.00 178.15 177.48 1xrp h HIS 255 N 0.70 1.04 0.00 1.37 2.76 0.16 -2.51 115.15 118.68 1xrp h HIS 255 Ca 0.19 -0.03 -0.08 0.00 -2.20 0.00 0.00 60.37 58.25 1xrp h HIS 255 Cb -0.07 -0.33 -0.01 0.00 1.55 0.00 0.00 27.41 28.55 1xrp h HIS 255 CO -0.04 0.74 -0.37 0.93 -1.30 0.00 0.00 177.93 177.90 1xrp h GLU 256 N 1.06 0.00 0.11 5.26 5.08 -0.12 -3.23 114.58 122.73 1xrp h GLU 256 Ca 0.26 0.00 -0.30 0.00 -1.00 0.00 0.00 59.36 58.32 1xrp h GLU 256 Cb 0.07 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 1xrp h GLU 256 CO -0.04 0.37 -1.47 0.87 -1.00 0.00 0.00 179.01 177.74 1xrp h LYS 257 N 0.00 0.24 -5.71 2.33 6.56 -1.27 -3.43 116.57 115.29 1xrp h LYS 257 Ca -0.00 -0.42 -0.63 0.00 -1.06 0.00 0.00 60.65 58.54 1xrp h LYS 257 Cb 0.65 0.15 -0.13 0.00 -0.57 0.00 0.00 32.23 32.33 1xrp h LYS 257 CO 0.05 1.12 0.41 0.42 -2.06 0.00 0.00 179.45 179.38 1xrp s ILE 258 N -2.63 4.56 0.19 1.86 1.09 -0.98 -4.35 121.20 120.95 1xrp s ILE 258 Ca -0.08 0.25 -0.32 0.00 -1.10 0.00 0.00 60.65 59.40 1xrp s ILE 258 Cb 0.07 -4.42 -0.11 0.00 -1.06 0.00 0.00 42.46 36.94 1xrp s ILE 258 CO 0.86 -0.90 1.74 0.00 -0.10 0.00 0.00 174.94 176.53 1xrp s ALA 259 N 3.50 3.89 -0.11 9.38 0.00 -1.26 -2.25 121.76 134.92 1xrp s ALA 259 Ca 0.28 1.55 0.00 0.00 0.00 0.00 0.00 51.96 53.79 1xrp s ALA 259 Cb -0.13 -3.71 0.00 0.00 0.00 0.00 0.00 23.12 19.28 1xrp s ALA 259 CO 0.20 -0.98 0.00 0.41 0.00 0.00 0.00 175.76 175.39 1xrp n GLY 260 N 4.02 0.47 3.82 0.00 0.00 -1.26 -4.89 105.19 107.35 1xrp n GLY 260 Ca 0.16 -0.21 -0.33 0.00 0.00 0.00 0.00 46.02 45.64 1xrp n GLY 260 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xrp s SER 261 N -2.23 6.76 -0.14 1.61 1.04 -0.95 -4.59 113.70 115.19 1xrp s SER 261 Ca 0.00 1.73 -0.05 0.00 0.48 0.00 0.00 55.95 58.11 1xrp s SER 261 Cb 0.00 -2.54 -0.04 0.00 0.10 0.00 0.00 66.02 63.54 1xrp s SER 261 CO 0.00 -0.49 0.05 -1.61 0.98 0.00 0.00 173.24 172.17 1xrp s GLU 262 N -3.30 3.57 -0.22 4.02 2.02 0.14 -4.98 118.70 119.95 1xrp s GLU 262 Ca 0.63 -0.34 -0.02 0.00 0.02 0.00 0.00 54.97 55.26 1xrp s GLU 262 Cb -0.11 -3.06 0.01 0.00 0.10 0.00 0.00 34.13 31.07 1xrp s GLU 262 CO 0.17 0.49 -0.10 -1.17 0.02 0.00 0.00 175.26 174.67 1xrp s LEU 263 N -0.25 2.74 -0.18 1.80 2.96 -1.26 0.10 118.68 124.60 1xrp s LEU 263 Ca 0.08 -0.62 0.01 0.00 -0.22 0.00 0.00 54.13 53.37 1xrp s LEU 263 Cb -0.12 -1.63 0.02 0.00 0.50 0.00 0.00 46.19 44.95 1xrp s LEU 263 CO 0.02 -0.05 -0.19 -1.00 -1.32 0.00 0.00 176.35 173.81 1xrp s HIS 264 N 1.37 2.78 -0.45 5.38 3.76 0.21 -4.98 115.29 123.36 1xrp s HIS 264 Ca 0.04 -1.51 -0.12 0.00 -0.15 0.00 0.00 55.06 53.31 1xrp s HIS 264 Cb -0.15 -1.92 0.08 0.00 1.11 0.00 0.00 32.58 31.71 1xrp s HIS 264 CO -0.07 -0.74 0.32 0.08 -0.85 0.00 0.00 174.74 173.49 1xrp s VAL 265 N 1.20 4.68 -0.18 -0.90 1.01 -1.26 -1.29 120.40 123.66 1xrp s VAL 265 Ca 0.03 -1.27 -0.29 0.00 0.00 0.00 0.00 61.98 60.44 1xrp s VAL 265 Cb -0.14 -3.84 -0.03 0.00 0.00 0.00 0.00 36.38 32.38 1xrp s VAL 265 CO -0.10 -0.55 1.51 -0.36 0.00 0.00 0.00 175.10 175.60 1xrp s PHE 266 N 1.52 2.31 0.47 5.22 0.40 -0.26 -4.80 117.98 122.85 1xrp s PHE 266 Ca 0.03 0.61 -0.22 0.00 -0.60 0.00 0.00 56.93 56.75 1xrp s PHE 266 Cb -0.24 -3.85 -0.07 0.00 0.51 0.00 0.00 43.02 39.37 1xrp s PHE 266 CO 0.04 -2.72 1.12 1.03 0.70 0.00 0.00 175.22 175.39 1xrp s ARG 267 N 4.20 3.74 0.00 0.44 1.81 -1.26 -0.25 118.95 127.63 1xrp s ARG 267 Ca 0.66 1.63 0.00 0.00 -1.72 0.00 0.00 55.73 56.30 1xrp s ARG 267 Cb -0.25 -2.29 0.00 0.00 -0.45 0.00 0.00 34.95 31.96 1xrp s ARG 267 CO 0.25 -0.53 0.00 -0.25 -0.68 0.00 0.00 175.30 174.09 1xrp n ASP 268 N -0.67 0.00 -4.96 0.23 9.92 -1.26 -4.86 116.55 114.95 1xrp n ASP 268 Ca 0.08 0.00 -0.19 0.00 -0.53 0.00 0.00 54.79 54.15 1xrp n ASP 268 Cb 0.50 -1.46 0.00 0.00 -0.64 0.00 0.00 41.12 39.51 1xrp n ASP 268 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1xrp n SER 270 N -1.78 0.00 0.10 0.00 3.41 -1.26 -1.27 113.62 112.81 1xrp n SER 270 Ca 0.07 0.00 -0.04 0.00 -0.26 0.00 0.00 58.87 58.63 1xrp n SER 270 Cb 0.61 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.54 1xrp n SER 270 CO 0.00 0.00 0.00 -0.74 -0.16 0.00 0.00 175.04 174.14 1xrp h HIS 271 N 0.00 -0.26 0.00 7.33 2.76 -1.00 -2.93 115.15 121.04 1xrp h HIS 271 Ca 0.00 -0.01 -0.70 0.00 -2.20 0.00 0.00 60.37 57.47 1xrp h HIS 271 Cb 0.00 0.09 -0.02 0.00 1.55 0.00 0.00 27.41 29.02 1xrp h HIS 271 CO 0.00 -0.16 3.27 1.28 -1.30 0.00 0.00 177.93 181.01 1xrp n LEU 272 N -3.56 7.18 0.30 0.26 4.77 -0.27 -4.68 117.00 120.99 1xrp n LEU 272 Ca -0.04 -4.15 0.19 0.00 -0.03 0.00 0.00 56.01 51.98 1xrp n LEU 272 Cb 0.11 -1.62 0.87 0.00 -2.33 0.00 0.00 43.42 40.45 1xrp n LEU 272 CO 0.09 1.27 1.05 0.71 -1.33 0.00 0.00 177.39 179.18 1xrp h THR 273 N 3.80 0.08 0.00 -5.08 1.35 -1.87 -2.47 112.91 108.72 1xrp h THR 273 Ca 0.63 -0.36 0.00 0.00 -0.55 0.00 0.00 66.41 66.13 1xrp h THR 273 Cb 0.56 1.33 0.00 0.00 -1.73 0.00 0.00 68.15 68.31 1xrp h THR 273 CO 1.87 0.02 0.00 1.15 -0.25 0.00 0.00 175.52 178.31 1xrp n MET 274 N -3.16 0.19 -0.04 4.72 0.00 -1.26 -1.40 117.12 116.17 1xrp n MET 274 Ca -0.01 0.15 -0.05 0.00 0.00 0.00 0.00 57.70 57.80 1xrp n MET 274 Cb 0.22 -1.50 -0.05 0.00 0.00 0.00 0.00 33.22 31.89 1xrp n MET 274 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 175.97 176.88 1xrp n TRP 275 N -1.32 0.00 -0.01 3.17 7.02 -0.94 -3.82 117.44 121.55 1xrp n TRP 275 Ca 0.07 0.00 -0.15 0.00 -1.02 0.00 0.00 57.50 56.40 1xrp n TRP 275 Cb 0.13 -0.35 -0.04 0.00 -2.42 0.00 0.00 31.31 28.63 1xrp n TRP 275 CO 0.00 0.00 0.00 0.93 -2.02 0.00 0.00 177.69 176.60 1xrp h GLU 276 N 0.00 0.70 -2.07 -0.99 5.08 -1.45 -3.35 114.58 112.50 1xrp h GLU 276 Ca -0.20 -0.56 -0.53 0.00 -1.00 0.00 0.00 59.36 57.07 1xrp h GLU 276 Cb 1.40 0.11 -0.40 0.00 0.50 0.00 0.00 28.75 30.36 1xrp h GLU 276 CO -0.01 1.18 -1.02 -3.47 -1.00 0.00 0.00 179.01 174.69 1xrp n ASP 277 N -3.91 1.65 -0.04 1.42 2.03 -0.49 -4.97 116.55 112.23 1xrp n ASP 277 Ca -0.06 -3.11 -0.08 0.00 0.52 0.00 0.00 54.79 52.05 1xrp n ASP 277 Cb 0.73 -0.62 -0.02 0.00 -0.72 0.00 0.00 41.12 40.50 1xrp n ASP 277 CO 0.00 0.00 0.00 -0.09 -1.92 0.00 0.00 177.20 175.19 1xrp h ARG 278 N 3.31 -0.21 0.48 -0.67 2.43 -1.68 0.27 114.38 118.31 1xrp h ARG 278 Ca 0.11 0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.27 1xrp h ARG 278 Cb 0.83 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.44 1xrp h ARG 278 CO 0.58 -0.14 -0.23 0.93 -1.51 0.00 0.00 179.97 179.60 1xrp h GLU 279 N -0.22 -0.62 -0.32 0.20 3.07 -1.93 -1.31 114.58 113.45 1xrp h GLU 279 Ca 0.13 0.04 -0.02 0.00 -0.50 0.00 0.00 59.36 59.02 1xrp h GLU 279 Cb 0.42 0.14 -0.02 0.00 -0.84 0.00 0.00 28.75 28.46 1xrp h GLU 279 CO -0.36 -0.41 0.12 0.78 -1.40 0.00 0.00 179.01 177.74 1xrp h GLY 280 N -0.65 0.47 0.55 -3.84 0.00 -1.92 -0.64 103.07 97.03 1xrp h GLY 280 Ca -0.07 -0.22 -0.02 0.00 0.00 0.00 0.00 47.33 47.03 1xrp h GLY 280 CO 0.11 0.21 -0.20 -1.82 0.00 0.00 0.00 176.54 174.84 1xrp h TYR 281 N 0.44 -0.51 -0.63 5.60 3.20 -0.30 -2.24 116.97 122.53 1xrp h TYR 281 Ca 0.11 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.02 1xrp h TYR 281 Cb 0.10 0.17 -0.04 0.00 1.54 0.00 0.00 36.73 38.51 1xrp h TYR 281 CO 0.00 -0.20 0.42 -0.91 -1.64 0.00 0.00 178.16 175.83 1xrp h ASN 282 N -1.01 0.58 -0.27 -2.11 -0.26 -1.16 -1.09 115.58 110.25 1xrp h ASN 282 Ca -0.06 -0.00 -0.04 0.00 -0.56 0.00 0.00 56.30 55.65 1xrp h ASN 282 Cb 0.54 -0.13 -0.01 0.00 -1.06 0.00 0.00 38.32 37.67 1xrp h ASN 282 CO 0.09 0.38 0.02 0.50 -1.06 0.00 0.00 177.43 177.37 1xrp h LYS 283 N 0.66 0.46 -0.75 0.81 3.64 -1.13 -1.06 116.57 119.20 1xrp h LYS 283 Ca 0.27 -0.13 -0.04 0.00 -1.27 0.00 0.00 60.65 59.48 1xrp h LYS 283 Cb 0.22 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.96 1xrp h LYS 283 CO -0.08 0.60 0.32 1.25 -2.27 0.00 0.00 179.45 179.27 1xrp h LEU 284 N 0.26 1.02 -0.35 5.20 5.85 -0.72 -0.29 115.31 126.27 1xrp h LEU 284 Ca 0.08 -0.16 -0.14 0.00 0.84 0.00 0.00 57.88 58.50 1xrp h LEU 284 Cb 0.38 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 1xrp h LEU 284 CO 0.01 0.90 -0.33 -0.07 -0.34 0.00 0.00 178.44 178.61 1xrp h LEU 285 N 1.08 0.90 -0.73 2.25 4.07 -1.15 -2.32 115.31 119.41 1xrp h LEU 285 Ca 0.25 -0.46 -0.13 0.00 0.08 0.00 0.00 57.88 57.62 1xrp h LEU 285 Cb 0.18 -0.25 -0.01 0.00 1.08 0.00 0.00 40.66 41.65 1xrp h LEU 285 CO -0.03 1.18 -0.46 0.77 -1.08 0.00 0.00 178.44 178.82 1xrp h SER 286 N 0.64 0.44 -0.31 -0.43 4.64 -1.05 -1.14 113.55 116.34 1xrp h SER 286 Ca 0.06 -0.21 -0.04 0.00 -0.47 0.00 0.00 61.79 61.13 1xrp h SER 286 Cb 0.91 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.87 1xrp h SER 286 CO 0.08 0.84 0.04 -0.78 -0.87 0.00 0.00 176.83 176.14 1xrp h ASP 287 N 0.33 0.51 -0.26 4.97 -0.00 -1.01 -1.41 116.42 119.56 1xrp h ASP 287 Ca 0.02 -0.27 -0.01 0.00 -0.00 0.00 0.00 57.03 56.77 1xrp h ASP 287 Cb 0.94 -0.14 -0.01 0.00 -0.00 0.00 0.00 39.33 40.12 1xrp h ASP 287 CO 0.08 0.66 0.13 0.15 -0.00 0.00 0.00 179.24 180.26 1xrp h PHE 288 N 0.35 0.36 0.49 0.28 3.57 -1.31 -2.18 116.94 118.49 1xrp h PHE 288 Ca 0.09 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.56 1xrp h PHE 288 Cb 0.37 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 38.99 1xrp h PHE 288 CO 0.03 0.33 -0.29 0.82 -2.23 0.00 0.00 178.31 176.96 1xrp h ILE 289 N 0.29 0.39 0.00 1.41 1.08 -1.13 -2.51 117.51 117.05 1xrp h ILE 289 Ca 0.09 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.56 1xrp h ILE 289 Cb 0.10 0.39 0.00 0.00 -3.07 0.00 0.00 36.82 34.24 1xrp h ILE 289 CO -0.01 0.00 0.00 -0.07 -0.69 0.00 0.00 178.15 177.38 1xrp h LEU 290 N -0.74 0.00 -0.10 1.44 3.38 -1.28 -1.05 115.31 116.96 1xrp h LEU 290 Ca -0.06 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 1xrp h LEU 290 Cb 0.60 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 1xrp h LEU 290 CO 0.06 0.00 -0.18 0.11 0.09 0.00 0.00 178.44 178.53 1xrp h LYS 291 N 0.00 0.00 -1.00 1.13 1.57 -0.94 -3.32 116.57 114.01 1xrp h LYS 291 Ca 0.00 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.23 1xrp h LYS 291 Cb 0.12 0.00 -0.43 0.00 0.08 0.00 0.00 32.23 32.01 1xrp h LYS 291 CO 0.00 0.18 -0.80 0.72 -0.57 0.00 0.00 179.45 178.97 1xrp n HIS 292 N -3.15 2.92 1.21 -1.35 8.25 -0.40 -5.10 115.22 117.59 1xrp n HIS 292 Ca 0.03 -2.53 0.10 0.00 -0.26 0.00 0.00 57.72 55.06 1xrp n HIS 292 Cb 0.59 -0.25 0.58 0.00 1.12 0.00 0.00 29.99 32.02 1xrp n HIS 292 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26