#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1isp s HIS 3 N 0.00 2.91 0.75 4.31 3.76 -1.26 -5.01 115.29 120.75 1isp s HIS 3 Ca 0.00 1.38 -0.14 0.00 -0.15 0.00 0.00 55.06 56.15 1isp s HIS 3 Cb 0.00 -3.72 0.05 0.00 1.11 0.00 0.00 32.58 30.02 1isp s HIS 3 CO 0.00 -2.08 1.18 -0.80 -0.85 0.00 0.00 174.74 172.19 1isp s ASN 4 N -0.53 4.18 0.55 1.40 0.01 -1.26 -4.97 114.94 114.32 1isp s ASN 4 Ca 0.52 2.25 -0.21 0.00 -0.71 0.00 0.00 52.86 54.70 1isp s ASN 4 Cb -0.40 -2.58 -0.05 0.00 0.41 0.00 0.00 41.25 38.63 1isp s ASN 4 CO 0.53 -2.27 1.23 -2.65 -1.51 0.00 0.00 177.10 172.43 1isp n PRO 5 N -2.93 1.46 -4.62 -0.60 -0.02 -1.26 -4.66 135.00 122.37 1isp n PRO 5 Ca 0.12 0.54 -0.33 0.00 -2.02 0.00 0.00 63.50 61.81 1isp n PRO 5 Cb 0.51 -2.42 -0.14 0.00 -0.02 0.00 0.00 33.50 31.43 1isp n PRO 5 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1isp s VAL 6 N -1.34 3.35 -0.21 -1.45 1.01 -0.36 -0.84 120.40 120.57 1isp s VAL 6 Ca 0.72 -0.55 -0.05 0.00 0.00 0.00 0.00 61.98 62.10 1isp s VAL 6 Cb -0.43 -2.43 -0.02 0.00 0.00 0.00 0.00 36.38 33.49 1isp s VAL 6 CO 0.49 0.51 -0.00 -0.69 0.00 0.00 0.00 175.10 175.41 1isp s VAL 7 N 0.38 3.86 -0.13 2.92 1.01 0.05 -0.75 120.40 127.74 1isp s VAL 7 Ca -0.08 -0.34 -0.04 0.00 0.00 0.00 0.00 61.98 61.52 1isp s VAL 7 Cb -0.15 -2.76 -0.03 0.00 0.00 0.00 0.00 36.38 33.44 1isp s VAL 7 CO 0.04 0.41 0.02 -0.04 0.00 0.00 0.00 175.10 175.54 1isp s MET 8 N 1.19 3.42 -0.23 2.72 -1.94 0.26 -1.87 119.30 122.84 1isp s MET 8 Ca 0.03 -0.39 0.01 0.00 -1.71 0.00 0.00 55.69 53.63 1isp s MET 8 Cb -0.14 -2.96 0.06 0.00 2.01 0.00 0.00 34.83 33.80 1isp s MET 8 CO 0.01 0.50 -0.07 0.08 -0.01 0.00 0.00 175.02 175.53 1isp s VAL 9 N -0.31 1.63 0.82 -6.03 1.01 0.25 -1.83 120.40 115.94 1isp s VAL 9 Ca 0.07 -1.23 -0.12 0.00 0.00 0.00 0.00 61.98 60.70 1isp s VAL 9 Cb -0.12 -1.84 0.09 0.00 0.00 0.00 0.00 36.38 34.51 1isp s VAL 9 CO 0.02 -0.04 1.19 -1.38 0.00 0.00 0.00 175.10 174.89 1isp s HIS 10 N 1.36 2.85 0.18 5.22 -3.43 -1.26 -0.83 115.29 119.38 1isp s HIS 10 Ca -0.05 0.72 0.02 0.00 -0.80 0.00 0.00 55.06 54.95 1isp s HIS 10 Cb -0.19 -3.54 0.03 0.00 -1.43 0.00 0.00 32.58 27.46 1isp s HIS 10 CO -0.06 -1.85 0.25 0.41 -2.00 0.00 0.00 174.74 171.48 1isp n GLY 11 N -3.32 1.56 3.71 -1.38 0.00 -1.19 -3.15 105.19 101.41 1isp n GLY 11 Ca 0.08 -2.10 -0.42 0.00 0.00 0.00 0.00 46.02 43.58 1isp n GLY 11 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1isp s ILE 12 N -0.24 2.71 0.00 -0.61 1.01 -1.26 -0.81 121.20 122.00 1isp s ILE 12 Ca 0.18 0.44 0.00 0.00 0.00 0.00 0.00 60.65 61.27 1isp s ILE 12 Cb -0.01 -3.28 0.00 0.00 0.01 0.00 0.00 42.46 39.18 1isp s ILE 12 CO 0.12 0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.69 1isp n GLY 13 N 3.83 0.60 0.00 6.18 0.00 -1.26 -5.00 105.19 109.54 1isp n GLY 13 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1isp n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1isp n GLY 14 N -1.93 -0.53 3.59 -0.02 0.00 0.01 -5.12 105.19 101.20 1isp n GLY 14 Ca 0.00 -1.72 -0.09 0.00 0.00 0.00 0.00 46.02 44.21 1isp n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1isp s ALA 15 N -3.69 -1.56 0.51 4.61 0.00 -1.26 -4.89 121.76 115.48 1isp s ALA 15 Ca 0.00 0.36 0.17 0.00 0.00 0.00 0.00 51.96 52.48 1isp s ALA 15 Cb 0.00 0.74 1.25 0.00 0.00 0.00 0.00 23.12 25.11 1isp s ALA 15 CO 0.00 -0.86 2.12 0.66 0.00 0.00 0.00 175.76 177.68 1isp h SER 16 N 2.00 0.05 0.61 0.00 4.64 -1.90 -0.79 113.55 118.15 1isp h SER 16 Ca -0.26 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 1isp h SER 16 Cb 1.27 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 1isp h SER 16 CO 0.31 0.03 0.00 2.22 -0.87 0.00 0.00 176.83 178.52 1isp n PHE 17 N -4.51 0.04 0.27 4.77 1.16 -1.26 -2.31 117.46 115.62 1isp n PHE 17 Ca -0.00 0.01 0.17 0.00 -1.87 0.00 0.00 57.45 55.76 1isp n PHE 17 Cb 0.17 -0.52 0.92 0.00 -1.61 0.00 0.00 39.48 38.43 1isp n PHE 17 CO 0.00 0.00 0.00 -0.91 -1.87 0.00 0.00 176.76 173.98 1isp h ASN 18 N 0.00 0.00 -0.50 5.98 -0.26 -1.55 -1.73 115.58 117.52 1isp h ASN 18 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 1isp h ASN 18 Cb 0.30 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.56 1isp h ASN 18 CO 0.00 0.00 0.00 0.49 -1.06 0.00 0.00 177.43 176.86 1isp n PHE 19 N -3.69 0.82 -0.14 1.19 3.72 -0.98 -4.41 117.46 113.97 1isp n PHE 19 Ca -0.01 -0.37 0.04 0.00 -0.05 0.00 0.00 57.45 57.06 1isp n PHE 19 Cb 0.20 -0.06 0.35 0.00 -0.94 0.00 0.00 39.48 39.02 1isp n PHE 19 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1isp h ALA 20 N 3.86 1.65 -0.37 4.37 0.00 -1.51 0.18 119.26 127.43 1isp h ALA 20 Ca 0.00 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.74 1isp h ALA 20 Cb 0.83 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1isp h ALA 20 CO 0.06 0.28 -0.30 0.78 0.00 0.00 0.00 179.25 180.07 1isp h GLY 21 N 0.77 0.93 1.26 0.00 0.00 -1.79 -1.41 103.07 102.82 1isp h GLY 21 Ca 0.26 -0.92 -0.15 0.00 0.00 0.00 0.00 47.33 46.52 1isp h GLY 21 CO -0.07 0.83 -0.41 -2.22 0.00 0.00 0.00 176.54 174.67 1isp h ILE 22 N 0.65 1.28 0.05 2.60 2.04 -1.55 0.00 117.51 122.59 1isp h ILE 22 Ca 0.07 -1.59 -0.00 0.00 1.00 0.00 0.00 64.86 64.34 1isp h ILE 22 Cb 0.88 1.46 0.00 0.00 -0.74 0.00 0.00 36.82 38.43 1isp h ILE 22 CO 0.08 0.52 -0.02 0.11 0.00 0.00 0.00 178.15 178.83 1isp h LYS 23 N 0.66 -0.06 -0.71 2.37 1.57 -0.66 -0.27 116.57 119.46 1isp h LYS 23 Ca 0.05 0.00 0.04 0.00 -1.87 0.00 0.00 60.65 58.88 1isp h LYS 23 Cb 0.98 0.01 -0.05 0.00 0.08 0.00 0.00 32.23 33.25 1isp h LYS 23 CO 0.09 -0.03 0.43 1.03 -0.57 0.00 0.00 179.45 180.41 1isp h SER 24 N -0.08 0.68 -0.10 0.86 0.87 -1.09 -0.80 113.55 113.89 1isp h SER 24 Ca -0.01 0.01 0.01 0.00 -1.23 0.00 0.00 61.79 60.58 1isp h SER 24 Cb 0.07 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 61.88 1isp h SER 24 CO 0.01 0.46 0.02 0.22 -0.53 0.00 0.00 176.83 177.01 1isp h TYR 25 N 0.82 0.03 -0.21 2.24 3.20 -0.72 -1.68 116.97 120.66 1isp h TYR 25 Ca 0.30 0.01 -0.11 0.00 3.14 0.00 0.00 58.73 62.06 1isp h TYR 25 Cb 0.10 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.35 1isp h TYR 25 CO -0.05 0.01 -0.36 -0.07 -1.64 0.00 0.00 178.16 176.05 1isp h LEU 26 N 0.06 0.48 -0.84 2.82 3.38 -0.52 -1.05 115.31 119.64 1isp h LEU 26 Ca 0.04 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 1isp h LEU 26 Cb 0.04 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.61 1isp h LEU 26 CO -0.06 0.80 0.46 0.58 0.09 0.00 0.00 178.44 180.31 1isp h VAL 27 N 0.39 1.25 -0.05 1.22 2.07 -1.02 -0.62 116.25 119.48 1isp h VAL 27 Ca 0.04 -0.62 0.01 0.00 0.82 0.00 0.00 66.70 66.95 1isp h VAL 27 Cb 0.81 0.12 -0.00 0.00 -1.52 0.00 0.00 31.29 30.70 1isp h VAL 27 CO 0.07 0.28 0.04 0.77 0.02 0.00 0.00 177.57 178.75 1isp h SER 28 N 1.18 0.00 -0.71 0.57 4.64 -0.25 -1.91 113.55 117.07 1isp h SER 28 Ca 0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 1isp h SER 28 Cb 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 1isp h SER 28 CO -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.91 1isp n GLN 29 N -4.17 2.69 0.00 4.77 1.13 -0.39 -4.94 117.38 116.47 1isp n GLN 29 Ca -0.02 -2.61 0.00 0.00 -1.94 0.00 0.00 57.00 52.43 1isp n GLN 29 Cb 0.14 -1.57 0.00 0.00 0.11 0.00 0.00 30.24 28.93 1isp n GLN 29 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1isp n GLY 30 N 1.66 0.68 3.79 1.08 0.00 -0.72 -5.05 105.19 106.63 1isp n GLY 30 Ca 0.24 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.92 1isp n GLY 30 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1isp s TRP 31 N -2.00 2.92 -0.03 1.61 0.51 -0.38 -4.99 118.94 116.58 1isp s TRP 31 Ca 0.00 1.57 -0.29 0.00 -2.12 0.00 0.00 56.10 55.25 1isp s TRP 31 Cb 0.00 -3.12 -0.03 0.00 -0.81 0.00 0.00 33.47 29.52 1isp s TRP 31 CO 0.00 -1.01 0.96 -1.12 -0.51 0.00 0.00 176.95 175.27 1isp s SER 32 N -1.96 7.31 0.34 2.95 0.01 -1.26 -4.25 113.70 116.83 1isp s SER 32 Ca 0.68 1.59 0.08 0.00 1.31 0.00 0.00 55.95 59.61 1isp s SER 32 Cb -0.18 -2.55 0.80 0.00 0.21 0.00 0.00 66.02 64.30 1isp s SER 32 CO 0.22 -0.29 1.82 -0.09 0.41 0.00 0.00 173.24 175.31 1isp h ARG 33 N 6.86 0.69 -0.00 12.44 2.43 -1.95 -1.25 114.38 133.60 1isp h ARG 33 Ca -0.39 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.74 1isp h ARG 33 Cb 1.20 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.60 1isp h ARG 33 CO 0.77 0.46 -0.03 -0.25 -1.51 0.00 0.00 179.97 179.41 1isp n ASP 34 N -4.65 0.26 -0.88 -3.80 8.00 -1.26 -2.58 116.55 111.65 1isp n ASP 34 Ca 0.21 -0.70 0.06 0.00 0.71 0.00 0.00 54.79 55.06 1isp n ASP 34 Cb 0.55 -0.09 0.23 0.00 -0.02 0.00 0.00 41.12 41.79 1isp n ASP 34 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1isp n LYS 35 N -0.96 2.52 -3.97 -1.24 4.76 -0.48 -4.88 118.16 113.92 1isp n LYS 35 Ca 0.18 -2.89 -0.34 0.00 -2.87 0.00 0.00 58.31 52.39 1isp n LYS 35 Cb 0.21 -1.81 -0.14 0.00 -1.84 0.00 0.00 35.03 31.45 1isp n LYS 35 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1isp s LEU 36 N -2.93 2.88 0.17 -0.35 1.43 -1.07 -1.22 118.68 117.60 1isp s LEU 36 Ca 0.42 -0.64 0.09 0.00 -1.03 0.00 0.00 54.13 52.97 1isp s LEU 36 Cb 0.35 -1.66 -0.04 0.00 0.03 0.00 0.00 46.19 44.87 1isp s LEU 36 CO 0.06 -0.06 -0.20 -0.31 0.23 0.00 0.00 176.35 176.08 1isp s TYR 37 N 1.38 1.94 -0.05 0.29 2.02 0.07 -4.99 117.35 118.01 1isp s TYR 37 Ca 0.03 -0.44 -0.02 0.00 -0.37 0.00 0.00 57.07 56.27 1isp s TYR 37 Cb -0.15 -0.96 0.04 0.00 -0.40 0.00 0.00 41.96 40.49 1isp s TYR 37 CO -0.06 0.38 0.11 0.00 -1.57 0.00 0.00 175.55 174.41 1isp s ALA 38 N -1.97 -0.13 0.64 3.71 0.00 -1.26 -0.58 121.76 122.17 1isp s ALA 38 Ca 0.17 0.54 -0.11 0.00 0.00 0.00 0.00 51.96 52.56 1isp s ALA 38 Cb -0.06 -0.44 -0.03 0.00 0.00 0.00 0.00 23.12 22.60 1isp s ALA 38 CO 0.07 -0.20 1.04 0.54 0.00 0.00 0.00 175.76 177.22 1isp s VAL 39 N 1.30 4.43 -0.09 0.00 0.11 -0.76 -4.88 120.40 120.50 1isp s VAL 39 Ca -0.07 0.79 0.01 0.00 -2.93 0.00 0.00 61.98 59.78 1isp s VAL 39 Cb -0.12 -3.75 0.02 0.00 -1.53 0.00 0.00 36.38 31.00 1isp s VAL 39 CO -0.05 -1.03 -0.13 -1.81 -3.33 0.00 0.00 175.10 168.75 1isp s ASP 40 N -4.16 2.14 -0.06 3.54 1.01 -1.26 -3.95 116.67 113.92 1isp s ASP 40 Ca 0.56 -0.35 -0.13 0.00 0.71 0.00 0.00 52.55 53.34 1isp s ASP 40 Cb -0.11 -0.94 -0.05 0.00 1.01 0.00 0.00 42.92 42.83 1isp s ASP 40 CO 0.54 -0.00 0.32 -0.36 0.21 0.00 0.00 175.17 175.87 1isp s PHE 41 N 1.01 3.64 -0.22 4.23 0.08 -1.26 -4.99 117.98 120.48 1isp s PHE 41 Ca -0.07 0.80 0.17 0.00 0.12 0.00 0.00 56.93 57.94 1isp s PHE 41 Cb -0.15 -2.21 0.12 0.00 -0.57 0.00 0.00 43.02 40.22 1isp s PHE 41 CO -0.01 0.59 1.47 0.11 -0.10 0.00 0.00 175.22 177.28 1isp h TRP 42 N 5.16 0.00 -3.52 0.36 5.08 -2.00 -3.44 115.95 117.59 1isp h TRP 42 Ca -0.51 0.00 -0.58 0.00 1.08 0.00 0.00 58.89 58.89 1isp h TRP 42 Cb 1.21 0.00 -0.09 0.00 -3.00 0.00 0.00 29.16 27.28 1isp h TRP 42 CO 0.70 0.39 0.78 0.34 -1.28 0.00 0.00 178.44 179.37 1isp s ASP 43 N -6.39 6.51 0.25 0.11 2.15 -1.26 -4.89 116.67 113.15 1isp s ASP 43 Ca 0.05 0.16 0.21 0.00 0.43 0.00 0.00 52.55 53.40 1isp s ASP 43 Cb 0.07 -2.50 0.98 0.00 -0.30 0.00 0.00 42.92 41.16 1isp s ASP 43 CO 0.73 -1.23 1.64 0.29 -0.17 0.00 0.00 175.17 176.42 1isp n LYS 44 N 7.70 0.15 0.00 4.34 4.76 -1.26 -1.66 118.16 132.19 1isp n LYS 44 Ca 0.08 0.50 0.11 0.00 -2.87 0.00 0.00 58.31 56.13 1isp n LYS 44 Cb 0.49 -1.86 0.04 0.00 -1.84 0.00 0.00 35.03 31.86 1isp n LYS 44 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 1isp n THR 45 N -2.16 0.03 -2.24 -0.18 -2.24 -1.26 -3.98 114.28 102.25 1isp n THR 45 Ca 0.01 -0.05 -0.14 0.00 -2.27 0.00 0.00 64.05 61.60 1isp n THR 45 Cb 0.14 0.57 -0.01 0.00 -2.10 0.00 0.00 70.33 68.93 1isp n THR 45 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1isp n GLY 46 N 1.47 -0.15 3.75 3.38 0.00 -0.67 -4.94 105.19 108.03 1isp n GLY 46 Ca 0.04 -0.30 -0.33 0.00 0.00 0.00 0.00 46.02 45.44 1isp n GLY 46 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1isp s THR 47 N -2.70 2.96 0.21 2.61 -4.23 -1.26 -4.83 115.64 108.41 1isp s THR 47 Ca 0.00 0.41 -0.07 0.00 -1.18 0.00 0.00 61.69 60.85 1isp s THR 47 Cb 0.00 -2.89 0.12 0.00 1.34 0.00 0.00 72.50 71.07 1isp s THR 47 CO 0.00 -0.31 1.73 0.78 -0.54 0.00 0.00 174.62 176.27 1isp h ASN 48 N -0.46 1.04 0.87 3.99 2.35 -1.94 -0.48 115.58 120.95 1isp h ASN 48 Ca -0.46 -0.22 -0.05 0.00 -0.55 0.00 0.00 56.30 55.01 1isp h ASN 48 Cb 1.25 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 39.34 1isp h ASN 48 CO 0.51 1.01 -0.26 0.10 -1.65 0.00 0.00 177.43 177.14 1isp h TYR 49 N 1.04 0.00 0.12 1.19 -0.00 -1.99 0.14 116.97 117.48 1isp h TYR 49 Ca 0.22 0.00 -0.34 0.00 0.00 0.00 0.00 58.73 58.61 1isp h TYR 49 Cb 0.38 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.10 1isp h TYR 49 CO 0.03 0.26 -1.78 -0.91 -0.00 0.00 0.00 178.16 175.76 1isp h ASN 50 N 0.00 0.39 0.40 0.10 2.35 -1.92 -3.40 115.58 113.51 1isp h ASN 50 Ca -0.00 -0.70 -0.31 0.00 -0.55 0.00 0.00 56.30 54.73 1isp h ASN 50 Cb 0.76 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.98 1isp h ASN 50 CO 0.03 1.61 -1.67 0.78 -1.65 0.00 0.00 177.43 176.53 1isp h ASN 51 N 0.07 0.28 -0.51 5.81 4.21 -0.98 -3.32 115.58 121.13 1isp h ASN 51 Ca -0.34 -0.48 0.09 0.00 1.21 0.00 0.00 56.30 56.78 1isp h ASN 51 Cb 2.04 -0.09 -0.10 0.00 -1.12 0.00 0.00 38.32 39.05 1isp h ASN 51 CO 0.13 1.41 -0.39 1.23 -1.29 0.00 0.00 177.43 178.52 1isp h GLY 52 N 2.08 -0.37 1.73 2.83 0.00 -0.90 -0.16 103.07 108.28 1isp h GLY 52 Ca -0.29 0.51 -0.04 0.00 0.00 0.00 0.00 47.33 47.51 1isp h GLY 52 CO 0.12 -0.18 -0.03 -2.55 0.00 0.00 0.00 176.54 173.90 1isp h PRO 53 N -0.24 0.34 -0.37 4.80 0.11 -1.77 0.98 132.00 135.85 1isp h PRO 53 Ca 0.18 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 66.21 1isp h PRO 53 Cb 0.56 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.60 1isp h PRO 53 CO -0.64 0.39 0.15 0.28 -0.21 0.00 0.00 178.00 177.98 1isp h VAL 54 N 0.33 1.19 -0.51 3.15 2.07 -1.48 -1.88 116.25 119.11 1isp h VAL 54 Ca 0.07 -0.56 -0.01 0.00 0.82 0.00 0.00 66.70 67.02 1isp h VAL 54 Cb 0.27 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 30.89 1isp h VAL 54 CO 0.01 0.20 0.30 0.25 0.02 0.00 0.00 177.57 178.35 1isp h LEU 55 N 0.45 0.63 -0.35 2.57 5.85 -0.50 -0.41 115.31 123.55 1isp h LEU 55 Ca 0.12 -0.07 0.05 0.00 0.84 0.00 0.00 57.88 58.82 1isp h LEU 55 Cb 0.17 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.00 1isp h LEU 55 CO -0.01 0.52 0.07 -1.28 -0.34 0.00 0.00 178.44 177.40 1isp h SER 56 N 0.69 0.01 -0.58 1.25 0.87 -0.67 0.12 113.55 115.24 1isp h SER 56 Ca 0.18 0.06 -0.05 0.00 -1.23 0.00 0.00 61.79 60.75 1isp h SER 56 Cb 0.02 0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.03 1isp h SER 56 CO -0.03 0.04 0.16 -0.09 -0.53 0.00 0.00 176.83 176.38 1isp h ARG 57 N 0.19 0.92 -0.45 2.24 2.43 -1.10 -1.49 114.38 117.11 1isp h ARG 57 Ca 0.16 -0.21 -0.04 0.00 -0.81 0.00 0.00 59.98 59.08 1isp h ARG 57 Cb 0.18 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.59 1isp h ARG 57 CO -0.21 0.84 0.14 0.35 -1.51 0.00 0.00 179.97 179.57 1isp h PHE 58 N 0.83 0.74 -0.76 2.20 3.57 -0.82 -1.44 116.94 121.26 1isp h PHE 58 Ca 0.18 -0.08 0.01 0.00 3.53 0.00 0.00 57.97 61.62 1isp h PHE 58 Cb 0.32 -0.21 -0.04 0.00 2.79 0.00 0.00 35.95 38.81 1isp h PHE 58 CO 0.02 0.66 0.50 0.28 -2.23 0.00 0.00 178.31 177.54 1isp h VAL 59 N 0.60 1.18 -0.17 1.41 2.07 -0.66 -1.11 116.25 119.58 1isp h VAL 59 Ca 0.15 -0.35 -0.07 0.00 0.82 0.00 0.00 66.70 67.25 1isp h VAL 59 Cb 0.27 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.11 1isp h VAL 59 CO -0.00 0.18 -0.23 -0.61 0.02 0.00 0.00 177.57 176.94 1isp h GLN 60 N 1.01 0.30 -0.49 1.57 5.75 -0.99 0.20 115.11 122.45 1isp h GLN 60 Ca 0.28 -0.09 -0.01 0.00 -0.15 0.00 0.00 58.65 58.68 1isp h GLN 60 Cb -0.09 -0.03 -0.02 0.00 1.07 0.00 0.00 27.48 28.41 1isp h GLN 60 CO -0.07 0.51 0.28 -0.22 -2.65 0.00 0.00 178.83 176.69 1isp h LYS 61 N 0.27 0.68 -0.52 1.69 3.64 -0.73 0.43 116.57 122.03 1isp h LYS 61 Ca 0.05 -0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 59.32 1isp h LYS 61 Cb 0.55 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.21 1isp h LYS 61 CO 0.04 0.52 0.20 0.28 -2.27 0.00 0.00 179.45 178.22 1isp h VAL 62 N 0.66 1.22 -0.56 2.00 2.07 -0.56 0.09 116.25 121.16 1isp h VAL 62 Ca 0.18 -0.69 -0.02 0.00 0.82 0.00 0.00 66.70 66.99 1isp h VAL 62 Cb 0.03 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 30.47 1isp h VAL 62 CO -0.03 0.26 0.29 -0.07 0.02 0.00 0.00 177.57 178.04 1isp h LEU 63 N 0.71 0.72 -0.75 2.57 3.38 -0.75 -0.17 115.31 121.01 1isp h LEU 63 Ca 0.17 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 1isp h LEU 63 Cb 0.21 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 1isp h LEU 63 CO -0.01 0.63 0.12 0.44 0.09 0.00 0.00 178.44 179.71 1isp h ASP 64 N 0.76 1.02 0.31 -0.43 3.32 -0.69 -0.13 116.42 120.58 1isp h ASP 64 Ca 0.20 -0.23 -0.18 0.00 0.02 0.00 0.00 57.03 56.84 1isp h ASP 64 Cb 0.08 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 1isp h ASP 64 CO -0.03 1.00 -0.72 -0.08 -1.72 0.00 0.00 179.24 177.69 1isp h GLU 65 N 1.01 0.36 0.00 3.56 4.81 -0.73 -3.31 114.58 120.27 1isp h GLU 65 Ca 0.20 -0.29 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 1isp h GLU 65 Cb 0.41 0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.85 1isp h GLU 65 CO 0.01 0.93 -1.18 0.25 -0.73 0.00 0.00 179.01 178.29 1isp n THR 66 N -3.83 0.33 -0.97 0.32 -2.24 -0.10 -4.96 114.28 102.84 1isp n THR 66 Ca -0.04 -0.42 0.00 0.00 -2.27 0.00 0.00 64.05 61.32 1isp n THR 66 Cb 0.70 -0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.86 1isp n THR 66 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1isp n GLY 67 N 1.27 0.40 3.81 3.38 0.00 -0.07 -5.03 105.19 108.95 1isp n GLY 67 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1isp n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1isp s ALA 68 N -1.92 2.75 0.09 4.61 0.00 -1.22 -4.97 121.76 121.10 1isp s ALA 68 Ca 0.00 0.32 0.04 0.00 0.00 0.00 0.00 51.96 52.32 1isp s ALA 68 Cb 0.00 -3.21 -0.24 0.00 0.00 0.00 0.00 23.12 19.67 1isp s ALA 68 CO 0.00 -0.86 1.16 0.87 0.00 0.00 0.00 175.76 176.93 1isp h LYS 69 N 0.24 0.09 -3.85 0.00 1.79 -1.96 -3.45 116.57 109.43 1isp h LYS 69 Ca -0.46 -0.15 -0.12 0.00 -2.18 0.00 0.00 60.65 57.73 1isp h LYS 69 Cb 1.22 0.06 -0.17 0.00 -1.58 0.00 0.00 32.23 31.75 1isp h LYS 69 CO 0.57 1.02 -0.53 0.15 -1.08 0.00 0.00 179.45 179.59 1isp s LYS 70 N -2.68 0.61 0.28 3.15 1.02 -1.26 -4.74 119.74 116.12 1isp s LYS 70 Ca -0.02 -0.82 0.07 0.00 0.02 0.00 0.00 55.97 55.22 1isp s LYS 70 Cb 0.09 0.24 -0.03 0.00 -0.52 0.00 0.00 37.83 37.60 1isp s LYS 70 CO 0.84 -0.15 0.26 0.14 -0.92 0.00 0.00 175.35 175.52 1isp s VAL 71 N -2.86 4.21 0.12 3.17 -7.23 -0.03 -4.34 120.40 113.44 1isp s VAL 71 Ca -0.03 -1.32 0.02 0.00 -1.81 0.00 0.00 61.98 58.84 1isp s VAL 71 Cb 0.00 -3.38 -0.04 0.00 0.56 0.00 0.00 36.38 33.53 1isp s VAL 71 CO -0.06 -0.28 0.23 -1.81 -0.31 0.00 0.00 175.10 172.87 1isp s ASP 72 N -3.93 6.18 -0.04 4.85 1.01 -0.02 -0.85 116.67 123.88 1isp s ASP 72 Ca 0.36 0.15 0.05 0.00 0.71 0.00 0.00 52.55 53.82 1isp s ASP 72 Cb -0.07 -1.84 -0.01 0.00 1.01 0.00 0.00 42.92 42.01 1isp s ASP 72 CO 0.26 0.10 -0.18 -0.63 0.21 0.00 0.00 175.17 174.93 1isp s ILE 73 N -1.64 1.51 -0.20 0.77 1.01 0.25 -0.77 121.20 122.13 1isp s ILE 73 Ca 0.34 -0.77 -0.02 0.00 0.00 0.00 0.00 60.65 60.20 1isp s ILE 73 Cb -0.12 -1.29 0.00 0.00 0.01 0.00 0.00 42.46 41.07 1isp s ILE 73 CO 0.27 0.43 -0.11 -0.69 0.00 0.00 0.00 174.94 174.84 1isp s VAL 74 N -0.07 2.84 -0.04 2.92 1.01 -0.78 0.00 120.40 126.28 1isp s VAL 74 Ca -0.02 -0.68 0.03 0.00 0.00 0.00 0.00 61.98 61.32 1isp s VAL 74 Cb -0.11 -2.25 0.00 0.00 0.00 0.00 0.00 36.38 34.02 1isp s VAL 74 CO 0.02 0.47 -0.13 0.00 0.00 0.00 0.00 175.10 175.46 1isp s ALA 75 N 1.33 1.20 -0.12 5.51 0.00 0.02 -0.58 121.76 129.12 1isp s ALA 75 Ca 0.04 -0.51 -0.03 0.00 0.00 0.00 0.00 51.96 51.46 1isp s ALA 75 Cb -0.14 -0.42 -0.03 0.00 0.00 0.00 0.00 23.12 22.53 1isp s ALA 75 CO -0.06 0.21 0.01 -1.58 0.00 0.00 0.00 175.76 174.33 1isp s HIS 76 N 0.13 3.17 0.00 0.00 5.65 -0.02 -0.19 115.29 124.04 1isp s HIS 76 Ca -0.04 0.10 0.00 0.00 0.25 0.00 0.00 55.06 55.37 1isp s HIS 76 Cb -0.10 -1.88 0.00 0.00 -1.18 0.00 0.00 32.58 29.42 1isp s HIS 76 CO 0.01 0.33 0.00 -1.13 -0.65 0.00 0.00 174.74 173.30 1isp n SER 77 N 2.65 0.00 0.33 9.88 3.41 -0.47 -0.45 113.62 128.96 1isp n SER 77 Ca -0.18 0.00 0.22 0.00 -0.26 0.00 0.00 58.87 58.64 1isp n SER 77 Cb 0.53 0.00 1.14 0.00 -0.26 0.00 0.00 64.21 65.62 1isp n SER 77 CO 0.00 0.00 0.00 -0.03 -0.16 0.00 0.00 175.04 174.85 1isp h MET 78 N 0.00 0.00 -0.34 4.33 1.85 -1.85 -0.43 114.93 118.50 1isp h MET 78 Ca 0.00 0.00 0.09 0.00 -0.61 0.00 0.00 59.70 59.18 1isp h MET 78 Cb 0.00 0.00 -0.01 0.00 0.43 0.00 0.00 31.60 32.02 1isp h MET 78 CO 0.00 0.00 0.24 0.78 -0.40 0.00 0.00 176.91 177.53 1isp h GLY 79 N 0.24 0.03 1.00 1.39 0.00 -0.71 -0.27 103.07 104.75 1isp h GLY 79 Ca -0.00 -0.01 -0.11 0.00 0.00 0.00 0.00 47.33 47.21 1isp h GLY 79 CO 0.00 0.01 -0.19 -1.33 0.00 0.00 0.00 176.54 175.03 1isp h GLY 80 N 0.02 0.86 0.98 4.60 0.00 -1.24 0.19 103.07 108.47 1isp h GLY 80 Ca 0.16 -0.78 -0.01 0.00 0.00 0.00 0.00 47.33 46.71 1isp h GLY 80 CO -0.01 0.71 0.27 0.00 0.00 0.00 0.00 176.54 177.51 1isp h ALA 81 N 0.80 0.60 -0.83 3.60 0.00 -1.36 -1.41 119.26 120.67 1isp h ALA 81 Ca 0.08 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1isp h ALA 81 Cb 0.74 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 1isp h ALA 81 CO 0.06 0.12 0.40 -0.91 0.00 0.00 0.00 179.25 178.92 1isp h ASN 82 N 0.63 1.07 -0.21 0.00 -0.26 -0.87 -0.66 115.58 115.28 1isp h ASN 82 Ca 0.17 -0.12 -0.02 0.00 -0.56 0.00 0.00 56.30 55.77 1isp h ASN 82 Cb 0.03 -0.27 -0.01 0.00 -1.06 0.00 0.00 38.32 37.01 1isp h ASN 82 CO -0.03 0.90 0.06 0.74 -1.06 0.00 0.00 177.43 178.04 1isp h THR 83 N 1.17 1.20 -0.50 2.81 2.02 -0.75 -1.11 112.91 117.76 1isp h THR 83 Ca 0.29 -0.64 -0.03 0.00 0.77 0.00 0.00 66.41 66.80 1isp h THR 83 Cb 0.11 1.22 -0.02 0.00 -1.74 0.00 0.00 68.15 67.71 1isp h THR 83 CO -0.04 0.20 0.19 -0.07 0.37 0.00 0.00 175.52 176.18 1isp h LEU 84 N 0.17 0.65 -0.51 2.58 3.38 -0.95 -1.79 115.31 118.84 1isp h LEU 84 Ca 0.07 -0.08 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1isp h LEU 84 Cb 0.26 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 1isp h LEU 84 CO -0.00 0.59 0.06 0.22 0.09 0.00 0.00 178.44 179.40 1isp h TYR 85 N 0.71 0.92 -0.64 1.13 5.03 -0.89 0.15 116.97 123.39 1isp h TYR 85 Ca 0.17 -0.14 0.09 0.00 2.58 0.00 0.00 58.73 61.43 1isp h TYR 85 Cb 0.15 -0.25 -0.07 0.00 1.55 0.00 0.00 36.73 38.11 1isp h TYR 85 CO 0.01 0.84 0.28 -0.92 -1.32 0.00 0.00 178.16 177.05 1isp h TYR 86 N 0.73 0.49 -0.20 -3.82 3.20 -0.83 0.19 116.97 116.74 1isp h TYR 86 Ca 0.15 0.03 -0.09 0.00 3.14 0.00 0.00 58.73 61.97 1isp h TYR 86 Cb 0.43 -0.13 -0.00 0.00 1.54 0.00 0.00 36.73 38.58 1isp h TYR 86 CO 0.03 0.16 -0.21 0.82 -1.64 0.00 0.00 178.16 177.32 1isp h ILE 87 N 0.49 1.33 0.03 1.81 2.04 -1.05 -1.85 117.51 120.31 1isp h ILE 87 Ca 0.32 -1.38 -0.00 0.00 1.00 0.00 0.00 64.86 64.80 1isp h ILE 87 Cb 0.35 1.77 0.00 0.00 -0.74 0.00 0.00 36.82 38.20 1isp h ILE 87 CO -0.28 0.42 -0.01 0.50 0.00 0.00 0.00 178.15 178.78 1isp h LYS 88 N 0.17 -0.04 0.00 2.37 3.64 -0.41 -3.34 116.57 118.96 1isp h LYS 88 Ca 0.03 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.28 1isp h LYS 88 Cb 0.76 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.56 1isp h LYS 88 CO 0.05 0.59 -2.02 0.09 -2.27 0.00 0.00 179.45 175.90 1isp n ASN 89 N -4.79 0.61 0.00 4.20 4.13 0.66 -4.99 115.26 115.07 1isp n ASN 89 Ca -0.09 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.17 1isp n ASN 89 Cb 0.32 1.50 0.00 0.00 -1.54 0.00 0.00 39.78 40.06 1isp n ASN 89 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1isp n LEU 90 N -2.36 0.00 -1.34 3.41 4.77 -0.97 -5.03 117.00 115.47 1isp n LEU 90 Ca -0.14 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 55.93 1isp n LEU 90 Cb 0.73 0.00 0.31 0.00 -2.33 0.00 0.00 43.42 42.14 1isp n LEU 90 CO 0.39 0.00 0.78 -0.90 -1.33 0.00 0.00 177.39 176.33 1isp n ASP 91 N 0.00 4.47 0.00 -1.43 5.75 -1.20 -4.60 116.55 119.54 1isp n ASP 91 Ca 0.00 -2.61 0.12 0.00 -0.01 0.00 0.00 54.79 52.29 1isp n ASP 91 Cb 0.00 -0.54 0.59 0.00 -1.03 0.00 0.00 41.12 40.14 1isp n ASP 91 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1isp n GLY 92 N 0.55 -1.26 0.29 6.12 0.00 -0.74 -4.25 105.19 105.91 1isp n GLY 92 Ca 0.23 -0.10 0.17 0.00 0.00 0.00 0.00 46.02 46.32 1isp n GLY 92 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1isp h GLY 93 N 4.30 0.00 -0.33 -0.02 0.00 -1.79 -1.29 103.07 103.94 1isp h GLY 93 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 1isp h GLY 93 CO 0.00 0.00 -0.16 1.16 0.00 0.00 0.00 176.54 177.54 1isp n ASN 94 N -3.39 1.74 -0.29 0.19 2.04 -1.26 -0.64 115.26 113.66 1isp n ASN 94 Ca -0.02 -2.85 0.03 0.00 -0.44 0.00 0.00 54.58 51.30 1isp n ASN 94 Cb 0.18 -0.38 0.04 0.00 -2.53 0.00 0.00 39.78 37.09 1isp n ASN 94 CO 0.00 0.00 0.00 0.29 -0.44 0.00 0.00 177.26 177.11 1isp n LYS 95 N -1.05 0.58 -4.70 -3.83 5.02 -0.50 -4.84 118.16 108.84 1isp n LYS 95 Ca 0.12 -1.10 -0.24 0.00 -2.02 0.00 0.00 58.31 55.07 1isp n LYS 95 Cb 0.66 -1.14 -0.15 0.00 -0.02 0.00 0.00 35.03 34.38 1isp n LYS 95 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1isp s VAL 96 N -0.65 1.20 -0.04 -0.18 1.01 -1.18 -0.85 120.40 119.70 1isp s VAL 96 Ca 0.09 -0.62 -0.06 0.00 0.00 0.00 0.00 61.98 61.39 1isp s VAL 96 Cb 0.06 -1.02 -0.02 0.00 0.00 0.00 0.00 36.38 35.40 1isp s VAL 96 CO 0.09 0.35 -0.12 0.00 0.00 0.00 0.00 175.10 175.41 1isp n ALA 97 N 2.95 1.46 -2.81 5.51 0.00 -0.03 -4.72 120.51 122.87 1isp n ALA 97 Ca -0.16 -0.35 -0.34 0.00 0.00 0.00 0.00 53.44 52.59 1isp n ALA 97 Cb 0.54 0.06 -0.12 0.00 0.00 0.00 0.00 19.45 19.94 1isp n ALA 97 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1isp s ASN 98 N -5.26 4.65 -0.12 0.00 0.01 -1.26 -1.70 114.94 111.26 1isp s ASN 98 Ca -0.10 -0.10 0.03 0.00 -0.71 0.00 0.00 52.86 51.98 1isp s ASN 98 Cb 0.01 -1.50 0.01 0.00 0.41 0.00 0.00 41.25 40.18 1isp s ASN 98 CO 0.15 0.26 -0.22 -0.69 -1.51 0.00 0.00 177.10 175.08 1isp s VAL 99 N -0.16 2.00 -0.15 1.60 1.01 0.35 -0.58 120.40 124.46 1isp s VAL 99 Ca 0.02 -0.96 0.01 0.00 0.00 0.00 0.00 61.98 61.05 1isp s VAL 99 Cb -0.13 -1.76 0.01 0.00 0.00 0.00 0.00 36.38 34.50 1isp s VAL 99 CO 0.03 0.54 -0.19 -0.69 0.00 0.00 0.00 175.10 174.79 1isp s VAL 100 N 0.62 2.29 0.09 2.92 1.01 0.10 -1.00 120.40 126.42 1isp s VAL 100 Ca -0.12 -0.89 0.06 0.00 0.00 0.00 0.00 61.98 61.02 1isp s VAL 100 Cb -0.17 -1.94 -0.04 0.00 0.00 0.00 0.00 36.38 34.23 1isp s VAL 100 CO 0.03 0.53 -0.06 0.42 0.00 0.00 0.00 175.10 176.02 1isp s THR 101 N 0.89 3.62 -0.26 3.92 -4.23 -0.36 -0.80 115.64 118.42 1isp s THR 101 Ca -0.05 -1.11 0.02 0.00 -1.18 0.00 0.00 61.69 59.38 1isp s THR 101 Cb -0.15 -2.69 0.06 0.00 1.34 0.00 0.00 72.50 71.07 1isp s THR 101 CO -0.03 0.15 -0.08 -0.76 -0.54 0.00 0.00 174.62 173.37 1isp s LEU 102 N -2.13 3.33 -1.46 4.79 1.43 0.73 -1.01 118.68 124.37 1isp s LEU 102 Ca 0.22 -1.42 -0.10 0.00 -1.03 0.00 0.00 54.13 51.80 1isp s LEU 102 Cb -0.11 -1.45 0.06 0.00 0.03 0.00 0.00 46.19 44.71 1isp s LEU 102 CO 0.14 -0.22 0.78 0.61 0.23 0.00 0.00 176.35 177.89 1isp n GLY 103 N 4.48 -0.51 3.77 -3.19 0.00 -0.06 -1.37 105.19 108.31 1isp n GLY 103 Ca -0.12 0.16 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 1isp n GLY 103 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1isp s GLY 104 N -3.00 2.91 -0.68 -0.02 0.00 -1.26 -3.30 107.32 101.97 1isp s GLY 104 Ca 0.50 1.27 -0.07 0.00 0.00 0.00 0.00 44.72 46.42 1isp s GLY 104 CO 0.62 1.96 3.15 0.00 0.00 0.00 0.00 173.10 178.83 1isp n ALA 105 N 1.01 6.78 -0.12 3.20 0.00 -0.45 -3.28 120.51 127.64 1isp n ALA 105 Ca 0.01 -2.78 -0.11 0.00 0.00 0.00 0.00 53.44 50.57 1isp n ALA 105 Cb 0.42 -2.64 0.02 0.00 0.00 0.00 0.00 19.45 17.25 1isp n ALA 105 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1isp h ASN 106 N 3.74 0.94 0.05 0.00 2.35 -1.55 -2.45 115.58 118.66 1isp h ASN 106 Ca 0.48 -0.38 0.00 0.00 -0.55 0.00 0.00 56.30 55.85 1isp h ASN 106 Cb 0.90 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 39.01 1isp h ASN 106 CO 0.92 1.15 0.00 0.54 -1.65 0.00 0.00 177.43 178.39 1isp n ARG 107 N -4.09 0.65 0.18 0.81 1.74 -0.30 -1.03 116.66 114.61 1isp n ARG 107 Ca -0.01 0.01 0.14 0.00 -0.77 0.00 0.00 57.85 57.22 1isp n ARG 107 Cb 0.48 -1.50 0.59 0.00 -1.02 0.00 0.00 32.46 31.01 1isp n ARG 107 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 1isp h LEU 108 N 0.00 0.00 0.00 0.55 3.38 -1.72 -3.33 115.31 114.18 1isp h LEU 108 Ca 0.00 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.78 1isp h LEU 108 Cb 0.03 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 1isp h LEU 108 CO 0.00 0.00 -1.51 0.41 0.09 0.00 0.00 178.44 177.43 1isp n THR 109 N -2.47 1.01 -3.47 0.22 -1.04 -0.20 -5.10 114.28 103.23 1isp n THR 109 Ca 0.01 -0.09 -0.13 0.00 -2.04 0.00 0.00 64.05 61.80 1isp n THR 109 Cb 0.21 -1.80 -0.03 0.00 -1.82 0.00 0.00 70.33 66.89 1isp n THR 109 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 1isp s THR 110 N -2.35 0.01 -2.72 12.58 -1.32 -0.97 -5.02 115.64 115.86 1isp s THR 110 Ca -0.20 -0.08 0.23 0.00 -1.21 0.00 0.00 61.69 60.43 1isp s THR 110 Cb 0.07 -1.01 0.29 0.00 -1.51 0.00 0.00 72.50 70.34 1isp s THR 110 CO 0.27 -0.05 1.31 0.61 -2.21 0.00 0.00 174.62 174.56 1isp n GLY 111 N -0.05 1.32 3.60 6.08 0.00 -1.26 -3.40 105.19 111.47 1isp n GLY 111 Ca -0.17 -0.70 -0.33 0.00 0.00 0.00 0.00 46.02 44.81 1isp n GLY 111 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1isp s LYS 112 N -1.74 2.69 -0.83 1.61 2.36 -1.26 0.05 119.74 122.62 1isp s LYS 112 Ca 0.33 -0.61 -0.25 0.00 -2.55 0.00 0.00 55.97 52.88 1isp s LYS 112 Cb 0.21 -2.57 -0.03 0.00 -1.05 0.00 0.00 37.83 34.38 1isp s LYS 112 CO 0.30 0.64 1.88 0.00 1.55 0.00 0.00 175.35 179.73 1isp s ALA 113 N -0.91 1.88 0.17 3.13 0.00 -0.38 -4.78 121.76 120.88 1isp s ALA 113 Ca 0.15 -1.31 -0.32 0.00 0.00 0.00 0.00 51.96 50.48 1isp s ALA 113 Cb -0.11 -4.48 -0.11 0.00 0.00 0.00 0.00 23.12 18.42 1isp s ALA 113 CO 0.04 -4.47 1.67 -0.51 0.00 0.00 0.00 175.76 172.49 1isp s LEU 114 N 9.44 4.37 0.48 0.00 1.43 -1.26 -4.88 118.68 128.26 1isp s LEU 114 Ca 0.67 2.73 0.27 0.00 -1.03 0.00 0.00 54.13 56.77 1isp s LEU 114 Cb -0.08 -3.59 1.06 0.00 0.03 0.00 0.00 46.19 43.61 1isp s LEU 114 CO 0.05 -0.91 1.88 1.55 0.23 0.00 0.00 176.35 179.15 1isp h PRO 115 N 7.09 0.00 0.00 1.29 0.13 -1.92 -3.40 132.00 135.19 1isp h PRO 115 Ca -0.43 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.72 1isp h PRO 115 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 1isp h PRO 115 CO 0.94 0.13 -0.03 0.41 -0.23 0.00 0.00 178.00 179.22 1isp n GLY 116 N 0.14 -1.97 0.27 1.56 0.00 -1.26 -0.93 105.19 103.00 1isp n GLY 116 Ca 0.00 -1.38 0.02 0.00 0.00 0.00 0.00 46.02 44.67 1isp n GLY 116 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1isp n THR 117 N -0.77 0.92 -2.30 2.61 -2.24 0.19 -4.93 114.28 107.77 1isp n THR 117 Ca 0.00 -0.96 -0.43 0.00 -2.27 0.00 0.00 64.05 60.40 1isp n THR 117 Cb 0.04 0.55 -0.02 0.00 -2.10 0.00 0.00 70.33 68.80 1isp n THR 117 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1isp s ASP 118 N -0.95 6.80 0.01 3.42 -1.08 -1.25 -4.89 116.67 118.74 1isp s ASP 118 Ca 0.10 1.77 0.15 0.00 -0.52 0.00 0.00 52.55 54.05 1isp s ASP 118 Cb 0.05 -2.54 0.63 0.00 -1.46 0.00 0.00 42.92 39.61 1isp s ASP 118 CO 0.07 -0.87 1.47 -0.81 0.52 0.00 0.00 175.17 175.55 1isp n PRO 119 N 6.89 0.01 -0.00 4.34 -0.04 -1.26 -2.63 135.00 142.31 1isp n PRO 119 Ca 0.15 0.26 0.07 0.00 -0.04 0.00 0.00 63.50 63.95 1isp n PRO 119 Cb 0.45 -1.52 -0.09 0.00 -0.04 0.00 0.00 33.50 32.29 1isp n PRO 119 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1isp n ASN 120 N -1.54 0.93 -3.65 3.54 3.02 -1.26 -4.99 115.26 111.30 1isp n ASN 120 Ca 0.03 -0.61 -0.05 0.00 -0.03 0.00 0.00 54.58 53.93 1isp n ASN 120 Cb 0.17 1.19 -0.07 0.00 -0.61 0.00 0.00 39.78 40.46 1isp n ASN 120 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1isp s GLN 121 N -2.55 0.51 0.49 3.52 2.00 -1.08 -5.15 119.66 117.40 1isp s GLN 121 Ca 0.02 1.23 -0.20 0.00 -2.00 0.00 0.00 55.36 54.41 1isp s GLN 121 Cb 0.11 0.50 -0.08 0.00 0.80 0.00 0.00 33.01 34.33 1isp s GLN 121 CO 0.60 -0.20 1.05 0.15 -0.50 0.00 0.00 175.29 176.39 1isp s LYS 122 N 2.44 3.77 0.30 1.67 1.02 -1.26 -4.36 119.74 123.31 1isp s LYS 122 Ca -0.06 1.41 -0.30 0.00 0.02 0.00 0.00 55.97 57.05 1isp s LYS 122 Cb -0.10 -2.12 -0.11 0.00 -0.52 0.00 0.00 37.83 34.98 1isp s LYS 122 CO -0.17 -0.47 1.55 0.42 -0.92 0.00 0.00 175.35 175.77 1isp s ILE 123 N -1.92 2.16 -0.10 2.17 1.01 -0.10 -5.00 121.20 119.41 1isp s ILE 123 Ca 0.67 0.14 -0.03 0.00 0.00 0.00 0.00 60.65 61.43 1isp s ILE 123 Cb -0.18 -3.09 -0.03 0.00 0.01 0.00 0.00 42.46 39.17 1isp s ILE 123 CO 0.22 0.02 0.03 -0.76 0.00 0.00 0.00 174.94 174.45 1isp s LEU 124 N -0.71 3.74 -0.02 2.97 1.43 -0.69 -4.64 118.68 120.77 1isp s LEU 124 Ca 0.61 0.20 0.05 0.00 -1.03 0.00 0.00 54.13 53.96 1isp s LEU 124 Cb -0.47 -1.88 -0.01 0.00 0.03 0.00 0.00 46.19 43.87 1isp s LEU 124 CO 0.49 0.37 -0.16 -0.31 0.23 0.00 0.00 176.35 176.96 1isp s TYR 125 N -0.80 1.49 -0.18 0.29 1.51 -0.31 -0.50 117.35 118.85 1isp s TYR 125 Ca 0.12 -0.30 0.01 0.00 -1.01 0.00 0.00 57.07 55.89 1isp s TYR 125 Cb -0.12 -0.97 0.04 0.00 -0.11 0.00 0.00 41.96 40.80 1isp s TYR 125 CO 0.02 -0.04 -0.11 0.99 -1.11 0.00 0.00 175.55 175.31 1isp s THR 126 N -0.33 1.57 -0.35 -0.71 2.01 -0.17 -1.37 115.64 116.29 1isp s THR 126 Ca 0.05 -0.88 -0.11 0.00 0.31 0.00 0.00 61.69 61.06 1isp s THR 126 Cb -0.07 -1.62 0.02 0.00 0.01 0.00 0.00 72.50 70.84 1isp s THR 126 CO -0.00 0.23 0.19 -0.55 -0.69 0.00 0.00 174.62 173.80 1isp s SER 127 N 1.44 5.68 -0.17 3.53 0.15 0.48 -1.22 113.70 123.59 1isp s SER 127 Ca 0.00 -0.85 -0.07 0.00 0.70 0.00 0.00 55.95 55.73 1isp s SER 127 Cb -0.15 -2.02 -0.04 0.00 -1.71 0.00 0.00 66.02 62.10 1isp s SER 127 CO -0.09 -0.33 0.08 -0.63 1.20 0.00 0.00 173.24 173.48 1isp s ILE 128 N 1.57 4.98 0.07 6.45 1.01 -0.18 -0.48 121.20 134.63 1isp s ILE 128 Ca 0.03 0.03 -0.15 0.00 0.00 0.00 0.00 60.65 60.56 1isp s ILE 128 Cb -0.19 -3.23 0.02 0.00 0.01 0.00 0.00 42.46 39.08 1isp s ILE 128 CO 0.07 0.49 0.34 -0.72 0.00 0.00 0.00 174.94 175.11 1isp s TYR 129 N 0.06 -0.13 -0.07 3.97 -0.85 -0.59 -0.88 117.35 118.86 1isp s TYR 129 Ca 0.07 -0.07 0.04 0.00 -0.52 0.00 0.00 57.07 56.58 1isp s TYR 129 Cb -0.12 0.14 -0.02 0.00 0.38 0.00 0.00 41.96 42.35 1isp s TYR 129 CO 0.00 -0.58 -0.18 0.45 -1.52 0.00 0.00 175.55 173.72 1isp s SER 130 N -2.35 3.62 0.12 -0.18 0.15 -1.26 -0.87 113.70 112.94 1isp s SER 130 Ca -0.02 -0.36 0.15 0.00 0.70 0.00 0.00 55.95 56.42 1isp s SER 130 Cb 0.01 -1.04 0.68 0.00 -1.71 0.00 0.00 66.02 63.95 1isp s SER 130 CO -0.06 0.26 1.47 -1.54 1.20 0.00 0.00 173.24 174.56 1isp n SER 131 N 2.89 0.27 -0.40 5.45 3.41 -0.23 -1.34 113.62 123.67 1isp n SER 131 Ca -0.18 0.58 0.14 0.00 -0.26 0.00 0.00 58.87 59.16 1isp n SER 131 Cb 0.52 -0.63 0.58 0.00 -0.26 0.00 0.00 64.21 64.41 1isp n SER 131 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1isp n ALA 132 N -1.62 2.62 -2.23 7.33 0.00 -1.26 -4.89 120.51 120.46 1isp n ALA 132 Ca 0.02 -0.41 -0.43 0.00 0.00 0.00 0.00 53.44 52.62 1isp n ALA 132 Cb 0.13 -1.21 -0.02 0.00 0.00 0.00 0.00 19.45 18.35 1isp n ALA 132 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1isp s ASP 133 N -2.04 6.75 0.00 0.00 -1.08 -0.45 -4.74 116.67 115.11 1isp s ASP 133 Ca 0.38 1.84 0.18 0.00 -0.52 0.00 0.00 52.55 54.44 1isp s ASP 133 Cb 0.21 -2.54 0.50 0.00 -1.46 0.00 0.00 42.92 39.64 1isp s ASP 133 CO 0.35 -0.91 1.42 0.23 0.52 0.00 0.00 175.17 176.77 1isp n MET 134 N 6.99 2.71 -0.06 4.34 2.81 -1.26 -4.53 117.12 128.13 1isp n MET 134 Ca 0.16 -2.39 -0.11 0.00 -1.81 0.00 0.00 57.70 53.55 1isp n MET 134 Cb 0.44 -1.46 -0.04 0.00 -0.71 0.00 0.00 33.22 31.45 1isp n MET 134 CO 0.00 0.00 0.00 -0.89 1.51 0.00 0.00 175.97 176.59 1isp n ILE 135 N 1.23 0.63 -3.91 2.02 5.41 -1.26 -4.90 119.36 118.58 1isp n ILE 135 Ca 0.19 -0.18 -0.35 0.00 1.00 0.00 0.00 62.75 63.41 1isp n ILE 135 Cb 0.55 -1.43 -0.14 0.00 -0.71 0.00 0.00 39.64 37.91 1isp n ILE 135 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 1isp s VAL 136 N -2.21 3.06 0.48 1.39 1.01 -1.26 -5.10 120.40 117.76 1isp s VAL 136 Ca -0.16 -1.17 -0.24 0.00 0.00 0.00 0.00 61.98 60.41 1isp s VAL 136 Cb 0.05 -2.66 -0.07 0.00 0.00 0.00 0.00 36.38 33.70 1isp s VAL 136 CO 0.22 0.03 1.40 0.23 0.00 0.00 0.00 175.10 176.98 1isp n MET 137 N 4.67 2.07 0.09 2.72 2.81 -1.26 -4.82 117.12 123.40 1isp n MET 137 Ca -0.15 0.74 0.05 0.00 -1.81 0.00 0.00 57.70 56.54 1isp n MET 137 Cb 0.45 -2.60 0.49 0.00 -0.71 0.00 0.00 33.22 30.84 1isp n MET 137 CO 0.00 0.00 0.00 -0.91 1.51 0.00 0.00 175.97 176.57 1isp h ASN 138 N 2.02 0.31 0.14 7.83 -0.26 -1.88 -0.97 115.58 122.77 1isp h ASN 138 Ca -0.51 -0.01 -0.01 0.00 -0.56 0.00 0.00 56.30 55.21 1isp h ASN 138 Cb 1.28 -0.08 -0.00 0.00 -1.06 0.00 0.00 38.32 38.46 1isp h ASN 138 CO 0.60 0.24 -0.07 0.10 -1.06 0.00 0.00 177.43 177.24 1isp h TYR 139 N 0.37 0.00 0.00 1.19 -0.00 -1.95 -0.56 116.97 116.02 1isp h TYR 139 Ca 0.10 0.00 -0.01 0.00 0.00 0.00 0.00 58.73 58.81 1isp h TYR 139 Cb -0.01 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 36.71 1isp h TYR 139 CO 0.00 0.07 -0.06 -0.07 -0.00 0.00 0.00 178.16 178.10 1isp h LEU 140 N 0.00 0.00 0.01 0.10 3.38 -1.48 -3.28 115.31 114.03 1isp h LEU 140 Ca -0.00 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.68 1isp h LEU 140 Cb 0.16 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.86 1isp h LEU 140 CO 0.01 0.06 -1.70 0.28 0.09 0.00 0.00 178.44 177.18 1isp h SER 141 N 0.00 0.02 -2.75 -0.43 0.02 -1.09 -0.49 113.55 108.83 1isp h SER 141 Ca -0.00 -0.05 -0.52 0.00 -0.84 0.00 0.00 61.79 60.37 1isp h SER 141 Cb 0.81 -0.01 0.04 0.00 0.14 0.00 0.00 62.40 63.39 1isp h SER 141 CO 0.01 1.05 0.94 -0.13 -1.14 0.00 0.00 176.83 177.56 1isp s ARG 142 N -2.60 4.19 -0.09 3.45 0.52 -1.00 -4.77 118.95 118.65 1isp s ARG 142 Ca -0.05 2.44 0.02 0.00 -0.52 0.00 0.00 55.73 57.62 1isp s ARG 142 Cb 0.08 -3.22 -0.02 0.00 0.52 0.00 0.00 34.95 32.32 1isp s ARG 142 CO 0.82 -0.67 -0.16 -0.51 0.02 0.00 0.00 175.30 174.80 1isp s LEU 143 N 1.44 2.57 -0.04 2.53 1.43 -1.26 -4.85 118.68 120.49 1isp s LEU 143 Ca 0.72 -0.33 -0.30 0.00 -1.03 0.00 0.00 54.13 53.20 1isp s LEU 143 Cb -0.45 -1.54 -0.07 0.00 0.03 0.00 0.00 46.19 44.16 1isp s LEU 143 CO 0.32 0.24 1.89 -1.81 0.23 0.00 0.00 176.35 177.21 1isp s ASP 144 N -0.08 6.37 0.00 2.29 1.01 0.11 -1.72 116.67 124.65 1isp s ASP 144 Ca -0.03 2.37 0.00 0.00 0.71 0.00 0.00 52.55 55.60 1isp s ASP 144 Cb -0.14 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.26 1isp s ASP 144 CO 0.04 -1.15 0.00 0.61 0.21 0.00 0.00 175.17 174.87 1isp n GLY 145 N 4.60 1.30 3.90 0.21 0.00 -1.26 -1.25 105.19 112.69 1isp n GLY 145 Ca 0.20 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 1isp n GLY 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1isp s ALA 146 N -2.31 2.91 -0.70 4.61 0.00 -0.70 -0.62 121.76 124.94 1isp s ALA 146 Ca 0.00 -0.54 -0.27 0.00 0.00 0.00 0.00 51.96 51.15 1isp s ALA 146 Cb 0.00 -2.91 0.03 0.00 0.00 0.00 0.00 23.12 20.24 1isp s ALA 146 CO 0.00 -1.26 1.27 0.50 0.00 0.00 0.00 175.76 176.27 1isp s ARG 147 N -5.36 3.25 -0.29 0.00 3.52 -0.47 -4.85 118.95 114.74 1isp s ARG 147 Ca 0.59 -0.11 -0.19 0.00 -0.13 0.00 0.00 55.73 55.89 1isp s ARG 147 Cb -0.11 -4.15 -0.02 0.00 -1.56 0.00 0.00 34.95 29.12 1isp s ARG 147 CO 0.49 -2.06 0.55 -0.80 -0.81 0.00 0.00 175.30 172.67 1isp s ASN 148 N 3.66 6.43 -0.20 -2.12 0.01 -1.26 -0.39 114.94 121.07 1isp s ASN 148 Ca 0.37 0.40 0.01 0.00 -0.71 0.00 0.00 52.86 52.93 1isp s ASN 148 Cb -0.08 -2.29 0.04 0.00 0.41 0.00 0.00 41.25 39.33 1isp s ASN 148 CO 0.17 -0.38 -0.10 -0.69 -1.51 0.00 0.00 177.10 174.59 1isp s VAL 149 N 2.42 1.64 -0.19 1.60 1.01 0.37 -4.96 120.40 122.29 1isp s VAL 149 Ca 0.22 -1.02 -0.14 0.00 0.00 0.00 0.00 61.98 61.04 1isp s VAL 149 Cb -0.15 -1.72 -0.04 0.00 0.00 0.00 0.00 36.38 34.46 1isp s VAL 149 CO 0.11 0.16 0.29 -1.58 0.00 0.00 0.00 175.10 174.08 1isp s GLN 150 N 1.39 4.19 0.48 2.72 0.74 -1.26 -1.54 119.66 126.39 1isp s GLN 150 Ca -0.01 0.04 0.04 0.00 0.05 0.00 0.00 55.36 55.48 1isp s GLN 150 Cb -0.16 -3.49 -0.02 0.00 1.10 0.00 0.00 33.01 30.44 1isp s GLN 150 CO -0.08 0.11 0.13 0.96 -0.55 0.00 0.00 175.29 175.86 1isp s ILE 151 N 0.87 1.62 0.08 -2.34 -4.36 -0.05 -4.98 121.20 112.03 1isp s ILE 151 Ca 0.15 -1.83 0.04 0.00 -0.26 0.00 0.00 60.65 58.76 1isp s ILE 151 Cb -0.14 -2.45 -0.03 0.00 1.25 0.00 0.00 42.46 41.10 1isp s ILE 151 CO 0.05 0.00 -0.12 -1.00 0.24 0.00 0.00 174.94 174.11 1isp s HIS 152 N -2.78 1.11 0.00 1.37 3.76 -1.26 -1.06 115.29 116.43 1isp s HIS 152 Ca 0.23 -0.51 0.00 0.00 -0.15 0.00 0.00 55.06 54.63 1isp s HIS 152 Cb 0.02 -0.62 0.00 0.00 1.11 0.00 0.00 32.58 33.09 1isp s HIS 152 CO 0.13 0.03 0.00 0.41 -0.85 0.00 0.00 174.74 174.46 1isp n GLY 153 N 1.10 0.56 3.17 -2.22 0.00 -1.26 -4.95 105.19 101.60 1isp n GLY 153 Ca -0.20 -0.08 -0.30 0.00 0.00 0.00 0.00 46.02 45.44 1isp n GLY 153 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1isp s VAL 154 N -2.00 1.80 0.72 1.61 1.01 -1.26 -5.03 120.40 117.25 1isp s VAL 154 Ca 0.00 -0.88 -0.06 0.00 0.00 0.00 0.00 61.98 61.05 1isp s VAL 154 Cb 0.00 -1.57 0.09 0.00 0.00 0.00 0.00 36.38 34.90 1isp s VAL 154 CO 0.00 0.50 1.02 -0.83 0.00 0.00 0.00 175.10 175.79 1isp s GLY 155 N 0.34 1.74 0.09 4.51 0.00 -1.26 -4.06 107.32 108.67 1isp s GLY 155 Ca -0.15 -1.20 -0.25 0.00 0.00 0.00 0.00 44.72 43.12 1isp s GLY 155 CO 0.07 -0.72 1.70 0.84 0.00 0.00 0.00 173.10 174.99 1isp h HIS 156 N -0.63 -0.26 -0.01 1.90 2.76 -1.94 -0.52 115.15 116.44 1isp h HIS 156 Ca -0.42 -0.00 -0.12 0.00 -2.20 0.00 0.00 60.37 57.63 1isp h HIS 156 Cb 1.29 0.10 -0.02 0.00 1.55 0.00 0.00 27.41 30.33 1isp h HIS 156 CO 0.02 -0.16 -0.56 0.82 -1.30 0.00 0.00 177.93 176.76 1isp h ILE 157 N -0.24 1.40 0.00 6.26 1.08 -2.00 -2.87 117.51 121.13 1isp h ILE 157 Ca -0.00 -1.91 0.00 0.00 -0.39 0.00 0.00 64.86 62.56 1isp h ILE 157 Cb 0.21 2.01 0.00 0.00 -3.07 0.00 0.00 36.82 35.98 1isp h ILE 157 CO -0.01 0.55 0.00 1.23 -0.69 0.00 0.00 178.15 179.23 1isp h GLY 158 N 1.63 0.00 1.41 5.37 0.00 -1.58 -2.10 103.07 107.80 1isp h GLY 158 Ca -0.00 0.00 0.03 0.00 0.00 0.00 0.00 47.33 47.36 1isp h GLY 158 CO 0.07 0.00 0.26 1.41 0.00 0.00 0.00 176.54 178.29 1isp h LEU 159 N 0.00 0.00 0.00 3.11 3.38 -0.91 -0.93 115.31 119.96 1isp h LEU 159 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1isp h LEU 159 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1isp h LEU 159 CO 0.00 0.00 -0.11 0.18 0.09 0.00 0.00 178.44 178.60 1isp n LEU 160 N -3.30 0.13 -2.89 1.67 4.77 -0.79 -4.07 117.00 112.53 1isp n LEU 160 Ca 0.00 0.39 -0.14 0.00 -0.03 0.00 0.00 56.01 56.23 1isp n LEU 160 Cb 0.36 -0.44 -0.00 0.00 -2.33 0.00 0.00 43.42 41.01 1isp n LEU 160 CO 0.20 0.02 -0.14 -1.22 -1.33 0.00 0.00 177.39 174.93 1isp n TYR 161 N -1.52 0.96 -4.45 -1.77 4.02 -0.36 -4.15 117.16 109.89 1isp n TYR 161 Ca 0.07 -3.30 -0.25 0.00 -0.01 0.00 0.00 57.90 54.41 1isp n TYR 161 Cb 0.34 -0.39 -0.17 0.00 -0.02 0.00 0.00 39.34 39.11 1isp n TYR 161 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 1isp s SER 162 N -2.86 1.85 0.28 7.72 0.15 -1.17 -4.99 113.70 114.68 1isp s SER 162 Ca 0.34 -0.30 -0.02 0.00 0.70 0.00 0.00 55.95 56.68 1isp s SER 162 Cb 0.40 -0.83 0.39 0.00 -1.71 0.00 0.00 66.02 64.27 1isp s SER 162 CO -0.03 0.00 1.84 0.77 1.20 0.00 0.00 173.24 177.02 1isp h SER 163 N 7.20 0.81 0.08 5.45 4.64 -1.95 0.28 113.55 130.06 1isp h SER 163 Ca -0.31 -0.13 -0.13 0.00 -0.47 0.00 0.00 61.79 60.75 1isp h SER 163 Cb 1.18 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 63.05 1isp h SER 163 CO 0.46 0.77 -0.46 1.56 -0.87 0.00 0.00 176.83 178.29 1isp h GLN 164 N 0.85 0.46 -0.33 4.77 4.20 -1.99 -1.95 115.11 121.13 1isp h GLN 164 Ca 0.19 -0.25 -0.06 0.00 0.06 0.00 0.00 58.65 58.59 1isp h GLN 164 Cb 0.25 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 1isp h GLN 164 CO -0.01 0.82 -0.04 0.28 -0.67 0.00 0.00 178.83 179.21 1isp h VAL 165 N 0.37 1.27 -0.36 -0.54 2.07 -1.75 -2.24 116.25 115.07 1isp h VAL 165 Ca 0.02 -1.06 0.06 0.00 0.82 0.00 0.00 66.70 66.55 1isp h VAL 165 Cb 0.95 1.29 -0.06 0.00 -1.52 0.00 0.00 31.29 31.95 1isp h VAL 165 CO 0.08 0.34 0.01 0.78 0.02 0.00 0.00 177.57 178.81 1isp h ASN 166 N 0.41 -0.12 -0.88 0.57 2.35 -0.71 0.15 115.58 117.35 1isp h ASN 166 Ca 0.09 0.08 0.05 0.00 -0.55 0.00 0.00 56.30 55.97 1isp h ASN 166 Cb 0.52 0.14 -0.06 0.00 0.05 0.00 0.00 38.32 38.97 1isp h ASN 166 CO 0.03 -0.03 0.56 0.28 -1.65 0.00 0.00 177.43 176.62 1isp h SER 167 N 0.11 0.90 0.20 5.81 0.02 -1.26 -1.56 113.55 117.78 1isp h SER 167 Ca 0.17 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.99 1isp h SER 167 Cb 0.23 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.57 1isp h SER 167 CO -0.28 0.60 -0.53 -0.07 -1.14 0.00 0.00 176.83 175.41 1isp h LEU 168 N 1.05 0.40 -0.49 5.07 3.38 -0.67 -1.82 115.31 122.23 1isp h LEU 168 Ca 0.37 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 58.11 1isp h LEU 168 Cb 0.09 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1isp h LEU 168 CO -0.14 0.85 0.23 0.40 0.09 0.00 0.00 178.44 179.87 1isp h ILE 169 N 0.28 1.19 -0.84 1.22 2.04 -0.18 -1.23 117.51 120.00 1isp h ILE 169 Ca 0.01 -0.55 0.01 0.00 1.00 0.00 0.00 64.86 65.32 1isp h ILE 169 Cb 1.02 0.65 -0.04 0.00 -0.74 0.00 0.00 36.82 37.71 1isp h ILE 169 CO 0.09 0.22 0.55 0.50 0.00 0.00 0.00 178.15 179.50 1isp h LYS 170 N 0.65 1.11 -0.51 2.37 3.64 -1.06 0.15 116.57 122.92 1isp h LYS 170 Ca 0.17 -0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.45 1isp h LYS 170 Cb 0.12 -0.25 -0.02 0.00 -0.41 0.00 0.00 32.23 31.67 1isp h LYS 170 CO -0.02 0.74 0.23 0.93 -2.27 0.00 0.00 179.45 179.06 1isp h GLU 171 N 1.14 0.75 -0.49 1.90 5.08 -1.07 -1.44 114.58 120.44 1isp h GLU 171 Ca 0.31 -0.12 -0.12 0.00 -1.00 0.00 0.00 59.36 58.42 1isp h GLU 171 Cb -0.12 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 28.99 1isp h GLU 171 CO -0.06 0.64 -0.16 0.78 -1.00 0.00 0.00 179.01 179.21 1isp h GLY 172 N 0.68 1.06 2.00 -3.84 0.00 -0.60 0.16 103.07 102.54 1isp h GLY 172 Ca 0.17 -0.91 -0.01 0.00 0.00 0.00 0.00 47.33 46.58 1isp h GLY 172 CO -0.02 0.83 -0.06 1.41 0.00 0.00 0.00 176.54 178.69 1isp h LEU 173 N 0.84 0.00 -1.83 3.11 3.38 -0.53 -0.29 115.31 119.98 1isp h LEU 173 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1isp h LEU 173 Cb 0.73 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.48 1isp h LEU 173 CO 0.06 0.06 0.00 0.59 0.09 0.00 0.00 178.44 179.24 1isp n ASN 174 N -3.24 2.71 0.00 -0.43 3.02 -0.56 -4.88 115.26 111.88 1isp n ASN 174 Ca -0.00 -2.22 0.00 0.00 -0.03 0.00 0.00 54.58 52.33 1isp n ASN 174 Cb 0.29 -0.41 0.00 0.00 -0.61 0.00 0.00 39.78 39.04 1isp n ASN 174 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1isp n GLY 175 N 0.76 0.90 0.28 7.41 0.00 -0.12 -4.98 105.19 109.44 1isp n GLY 175 Ca 0.14 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.29 1isp n GLY 175 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1isp n GLY 176 N -1.96 -0.39 3.65 -0.02 0.00 0.54 -4.87 105.19 102.15 1isp n GLY 176 Ca 0.00 -0.33 -0.30 0.00 0.00 0.00 0.00 46.02 45.39 1isp n GLY 176 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1isp s GLY 177 N -1.88 1.63 0.21 -0.02 0.00 -1.26 -4.81 107.32 101.19 1isp s GLY 177 Ca 0.39 -1.08 0.01 0.00 0.00 0.00 0.00 44.72 44.04 1isp s GLY 177 CO 0.32 -0.18 0.06 1.20 0.00 0.00 0.00 173.10 174.50 1isp s GLN 178 N -5.57 1.25 -0.39 2.90 -0.21 -0.49 -4.63 119.66 112.54 1isp s GLN 178 Ca 0.72 -1.65 0.06 0.00 0.02 0.00 0.00 55.36 54.52 1isp s GLN 178 Cb -0.07 -0.22 0.17 0.00 1.00 0.00 0.00 33.01 33.90 1isp s GLN 178 CO 0.55 -0.23 0.55 1.21 -2.12 0.00 0.00 175.29 175.26 1isp s ASN 179 N -3.24 -0.76 0.00 5.90 3.04 -1.10 -1.16 114.94 117.63 1isp s ASN 179 Ca 0.31 -0.89 0.25 0.00 0.04 0.00 0.00 52.86 52.58 1isp s ASN 179 Cb 0.07 1.57 0.51 0.00 -1.54 0.00 0.00 41.25 41.86 1isp s ASN 179 CO 0.09 -0.21 1.44 0.35 -3.04 0.00 0.00 177.10 175.73