#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ris n ILE 4 N 0.00 0.09 -3.80 1.53 5.41 -1.26 -5.06 119.36 116.27 2ris n ILE 4 Ca 0.00 -0.02 -0.36 0.00 1.00 0.00 0.00 62.75 63.36 2ris n ILE 4 Cb 0.00 -1.44 -0.07 0.00 -0.71 0.00 0.00 39.64 37.43 2ris n ILE 4 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 2ris s PHE 5 N -2.03 3.52 0.17 1.39 0.08 -1.26 -4.62 117.98 115.23 2ris s PHE 5 Ca -0.02 0.47 -0.30 0.00 0.12 0.00 0.00 56.93 57.20 2ris s PHE 5 Cb 0.01 -2.05 -0.07 0.00 -0.57 0.00 0.00 43.02 40.34 2ris s PHE 5 CO 0.03 0.55 1.06 0.99 -0.10 0.00 0.00 175.22 177.74 2ris s THR 6 N -0.44 4.02 0.49 0.64 2.01 0.50 -5.01 115.64 117.85 2ris s THR 6 Ca 0.13 1.75 -0.24 0.00 0.31 0.00 0.00 61.69 63.64 2ris s THR 6 Cb -0.12 -4.12 -0.07 0.00 0.01 0.00 0.00 72.50 68.21 2ris s THR 6 CO 0.02 0.30 1.34 -2.65 -0.69 0.00 0.00 174.62 172.94 2ris n PRO 7 N 2.41 1.88 -0.27 4.92 -0.02 -1.26 -4.75 135.00 137.90 2ris n PRO 7 Ca 0.02 0.68 0.01 0.00 -2.02 0.00 0.00 63.50 62.19 2ris n PRO 7 Cb 0.47 -2.52 0.14 0.00 -0.02 0.00 0.00 33.50 31.57 2ris n PRO 7 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 2ris h ILE 8 N 1.80 0.95 -0.53 4.25 2.04 -1.94 -1.32 117.51 122.75 2ris h ILE 8 Ca -0.50 -0.27 -0.05 0.00 1.00 0.00 0.00 64.86 65.04 2ris h ILE 8 Cb 1.29 0.10 -0.02 0.00 -0.74 0.00 0.00 36.82 37.45 2ris h ILE 8 CO 0.59 0.14 0.12 -0.33 0.00 0.00 0.00 178.15 178.66 2ris h GLU 9 N 0.78 0.82 -0.50 2.37 5.08 -2.00 0.15 114.58 121.28 2ris h GLU 9 Ca 0.36 -0.17 -0.12 0.00 -1.00 0.00 0.00 59.36 58.42 2ris h GLU 9 Cb 0.27 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 2ris h GLU 9 CO -0.22 0.75 -0.17 0.93 -1.00 0.00 0.00 179.01 179.30 2ris h GLU 10 N 0.79 0.99 -0.64 2.33 4.39 -1.74 -2.68 114.58 118.02 2ris h GLU 10 Ca 0.17 -0.40 -0.02 0.00 0.34 0.00 0.00 59.36 59.45 2ris h GLU 10 Cb 0.31 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.88 2ris h GLU 10 CO 0.00 1.08 0.33 0.00 -1.16 0.00 0.00 179.01 179.26 2ris h ALA 11 N 0.88 0.82 -0.72 3.43 0.00 -0.54 -2.29 119.26 120.84 2ris h ALA 11 Ca 0.12 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2ris h ALA 11 Cb 0.75 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 2ris h ALA 11 CO 0.06 0.36 0.37 -0.07 0.00 0.00 0.00 179.25 179.97 2ris h LEU 12 N 0.88 0.91 -0.57 0.00 3.38 -0.65 -0.16 115.31 119.10 2ris h LEU 12 Ca 0.22 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 58.05 2ris h LEU 12 Cb 0.08 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 2ris h LEU 12 CO -0.03 0.76 0.15 -0.33 0.09 0.00 0.00 178.44 179.08 2ris h GLU 13 N 1.01 0.90 -0.23 1.13 4.39 -1.17 0.21 114.58 120.82 2ris h GLU 13 Ca 0.25 -0.21 0.01 0.00 0.34 0.00 0.00 59.36 59.76 2ris h GLU 13 Cb 0.07 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.58 2ris h GLU 13 CO -0.04 0.83 0.12 0.00 -1.16 0.00 0.00 179.01 178.76 2ris h ALA 14 N 1.03 0.28 -0.48 3.43 0.00 -0.84 -2.04 119.26 120.64 2ris h ALA 14 Ca 0.18 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 2ris h ALA 14 Cb 0.32 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2ris h ALA 14 CO -0.00 -0.28 0.30 -0.92 0.00 0.00 0.00 179.25 178.34 2ris h TYR 15 N 0.26 0.63 -0.61 0.00 3.20 -0.80 -1.51 116.97 118.13 2ris h TYR 15 Ca 0.09 0.00 0.11 0.00 3.14 0.00 0.00 58.73 62.07 2ris h TYR 15 Cb 0.01 -0.21 -0.04 0.00 1.54 0.00 0.00 36.73 38.04 2ris h TYR 15 CO -0.09 0.43 0.41 -0.22 -1.64 0.00 0.00 178.16 177.05 2ris h LYS 16 N 0.64 0.37 -0.42 1.82 3.64 -0.36 -1.56 116.57 120.70 2ris h LYS 16 Ca 0.17 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 2ris h LYS 16 Cb -0.02 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.71 2ris h LYS 16 CO -0.03 0.25 0.00 -1.71 -2.27 0.00 0.00 179.45 175.68 2ris n ASN 17 N -4.47 2.02 0.00 4.20 2.85 -0.68 -4.90 115.26 114.28 2ris n ASN 17 Ca 0.10 -2.08 0.00 0.00 -0.11 0.00 0.00 54.58 52.49 2ris n ASN 17 Cb 0.40 -0.29 0.00 0.00 1.24 0.00 0.00 39.78 41.13 2ris n ASN 17 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2ris n GLY 18 N 0.88 0.43 3.85 8.20 0.00 -0.58 -5.05 105.19 112.92 2ris n GLY 18 Ca 0.11 -0.80 -0.32 0.00 0.00 0.00 0.00 46.02 45.02 2ris n GLY 18 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ris s GLU 19 N -1.46 3.96 0.62 1.61 2.02 -0.65 -4.94 118.70 119.86 2ris s GLU 19 Ca 0.00 0.82 -0.15 0.00 0.02 0.00 0.00 54.97 55.66 2ris s GLU 19 Cb 0.00 -2.25 -0.02 0.00 0.10 0.00 0.00 34.13 31.96 2ris s GLU 19 CO 0.00 -0.11 1.08 -0.06 0.02 0.00 0.00 175.26 176.19 2ris s PHE 20 N -2.39 2.86 0.07 1.61 0.40 -1.26 -4.34 117.98 114.94 2ris s PHE 20 Ca 0.57 1.52 0.09 0.00 -0.60 0.00 0.00 56.93 58.51 2ris s PHE 20 Cb -0.10 -3.06 -0.03 0.00 0.51 0.00 0.00 43.02 40.34 2ris s PHE 20 CO 0.26 -1.33 -0.24 -0.51 0.70 0.00 0.00 175.22 174.11 2ris s LEU 21 N -4.69 2.35 -0.19 -0.37 1.43 0.14 -4.36 118.68 112.99 2ris s LEU 21 Ca 0.64 -0.60 -0.18 0.00 -1.03 0.00 0.00 54.13 52.96 2ris s LEU 21 Cb -0.17 -1.34 -0.03 0.00 0.03 0.00 0.00 46.19 44.67 2ris s LEU 21 CO 0.40 0.23 0.51 -0.63 0.23 0.00 0.00 176.35 177.08 2ris s ILE 22 N -0.93 5.12 -0.15 -0.59 1.01 -0.18 -0.84 121.20 124.62 2ris s ILE 22 Ca 0.14 0.95 0.02 0.00 0.00 0.00 0.00 60.65 61.75 2ris s ILE 22 Cb -0.10 -3.83 0.01 0.00 0.01 0.00 0.00 42.46 38.55 2ris s ILE 22 CO 0.05 0.20 -0.21 -0.69 0.00 0.00 0.00 174.94 174.29 2ris s VAL 23 N 1.51 2.03 0.30 2.92 1.01 0.20 -0.93 120.40 127.44 2ris s VAL 23 Ca 0.24 -0.94 0.08 0.00 0.00 0.00 0.00 61.98 61.36 2ris s VAL 23 Cb -0.15 -1.81 -0.04 0.00 0.00 0.00 0.00 36.38 34.38 2ris s VAL 23 CO 0.10 0.54 0.19 -0.04 0.00 0.00 0.00 175.10 175.88 2ris s MET 24 N 1.02 2.63 0.02 2.72 1.00 -0.57 -2.05 119.30 124.08 2ris s MET 24 Ca -0.02 -1.31 -0.24 0.00 0.00 0.00 0.00 55.69 54.12 2ris s MET 24 Cb -0.14 -2.38 -0.17 0.00 0.00 0.00 0.00 34.83 32.13 2ris s MET 24 CO -0.06 0.22 1.41 -0.44 0.00 0.00 0.00 175.02 176.15 2ris h ASP 25 N 1.48 0.06 0.00 3.03 3.32 -1.89 0.14 116.42 122.57 2ris h ASP 25 Ca -0.45 -0.35 0.00 0.00 0.02 0.00 0.00 57.03 56.24 2ris h ASP 25 Cb 1.25 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.78 2ris h ASP 25 CO 0.60 0.40 0.00 -0.90 -1.72 0.00 0.00 179.24 177.63 2ris n ASP 26 N -4.87 0.00 -0.06 6.45 3.85 -1.26 -1.63 116.55 119.02 2ris n ASP 26 Ca -0.07 0.00 0.15 0.00 -0.71 0.00 0.00 54.79 54.15 2ris n ASP 26 Cb 0.20 0.00 0.74 0.00 -1.35 0.00 0.00 41.12 40.71 2ris n ASP 26 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 2ris n GLU 27 N 0.00 0.68 -1.85 0.11 1.02 -1.26 -4.86 120.64 114.48 2ris n GLU 27 Ca 0.00 -0.12 -0.41 0.00 -0.02 0.00 0.00 57.16 56.61 2ris n GLU 27 Cb 0.00 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 29.91 2ris n GLU 27 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2ris s ASP 28 N -2.40 6.45 0.55 1.62 2.15 -1.26 -4.88 116.67 118.91 2ris s ASP 28 Ca 0.33 2.91 0.30 0.00 0.43 0.00 0.00 52.55 56.53 2ris s ASP 28 Cb 0.21 -2.64 1.63 0.00 -0.30 0.00 0.00 42.92 41.82 2ris s ASP 28 CO 0.44 -0.83 2.14 0.03 -0.17 0.00 0.00 175.17 176.78 2ris h ARG 29 N 4.19 0.00 -0.00 4.34 3.08 -2.01 -2.70 114.38 121.28 2ris h ARG 29 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.57 2ris h ARG 29 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.28 2ris h ARG 29 CO 0.73 0.07 -0.21 0.39 -1.07 0.00 0.00 179.97 179.89 2ris n GLU 30 N -3.57 0.58 -1.86 0.04 1.02 -1.26 -2.37 120.64 113.23 2ris n GLU 30 Ca -0.02 -0.27 -0.39 0.00 -0.02 0.00 0.00 57.16 56.47 2ris n GLU 30 Cb 0.19 -1.49 0.03 0.00 -0.02 0.00 0.00 31.44 30.15 2ris n GLU 30 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 2ris s ASN 31 N -2.60 5.56 -0.02 1.62 0.01 -1.02 -4.78 114.94 113.71 2ris s ASN 31 Ca 0.23 2.74 -0.06 0.00 -0.71 0.00 0.00 52.86 55.06 2ris s ASN 31 Cb 0.19 -2.64 -0.04 0.00 0.41 0.00 0.00 41.25 39.17 2ris s ASN 31 CO 0.53 -1.37 0.23 -1.61 -1.51 0.00 0.00 177.10 173.37 2ris s GLU 32 N -2.75 3.53 -0.07 -0.60 2.02 -1.26 -2.11 118.70 117.47 2ris s GLU 32 Ca 0.67 -0.13 -0.03 0.00 0.02 0.00 0.00 54.97 55.51 2ris s GLU 32 Cb -0.40 -3.10 -0.04 0.00 0.10 0.00 0.00 34.13 30.69 2ris s GLU 32 CO 0.48 0.68 0.08 0.20 0.02 0.00 0.00 175.26 176.72 2ris s GLY 33 N -1.63 2.03 -0.00 -1.39 0.00 -0.50 -4.68 107.32 101.15 2ris s GLY 33 Ca 0.25 -0.77 0.04 0.00 0.00 0.00 0.00 44.72 44.24 2ris s GLY 33 CO 0.15 -0.57 -0.10 0.99 0.00 0.00 0.00 173.10 173.57 2ris s ASP 34 N -1.28 4.41 -0.00 1.64 1.01 -0.87 -1.40 116.67 120.18 2ris s ASP 34 Ca 0.18 -0.19 -0.27 0.00 0.71 0.00 0.00 52.55 52.98 2ris s ASP 34 Cb -0.12 -0.97 -0.04 0.00 1.01 0.00 0.00 42.92 42.80 2ris s ASP 34 CO 0.08 0.29 0.85 -0.76 0.21 0.00 0.00 175.17 175.83 2ris s LEU 35 N -1.31 4.38 -0.03 1.23 1.43 -0.08 -0.63 118.68 123.69 2ris s LEU 35 Ca 0.16 1.48 0.03 0.00 -1.03 0.00 0.00 54.13 54.76 2ris s LEU 35 Cb -0.11 -3.35 0.00 0.00 0.03 0.00 0.00 46.19 42.77 2ris s LEU 35 CO 0.06 -0.14 -0.10 -0.63 0.23 0.00 0.00 176.35 175.77 2ris s ILE 36 N 0.63 0.86 0.23 -0.59 1.01 -0.02 -2.07 121.20 121.25 2ris s ILE 36 Ca 0.44 -0.40 -0.03 0.00 0.00 0.00 0.00 60.65 60.67 2ris s ILE 36 Cb -0.20 -0.76 -0.03 0.00 0.01 0.00 0.00 42.46 41.48 2ris s ILE 36 CO 0.24 0.27 0.24 0.00 0.00 0.00 0.00 174.94 175.68 2ris s MET 37 N 0.21 1.37 0.14 2.79 0.23 -0.78 -0.68 119.30 122.57 2ris s MET 37 Ca -0.04 -1.60 -0.31 0.00 -1.03 0.00 0.00 55.69 52.71 2ris s MET 37 Cb -0.09 0.33 -0.09 0.00 -1.53 0.00 0.00 34.83 33.45 2ris s MET 37 CO 0.01 -0.49 1.50 0.00 -2.03 0.00 0.00 175.02 174.01 2ris s ALA 38 N -4.00 3.70 0.25 3.16 0.00 -1.26 -1.18 121.76 122.44 2ris s ALA 38 Ca 0.35 1.26 -0.04 0.00 0.00 0.00 0.00 51.96 53.53 2ris s ALA 38 Cb 0.04 -3.59 0.37 0.00 0.00 0.00 0.00 23.12 19.94 2ris s ALA 38 CO 0.13 -0.73 1.85 0.00 0.00 0.00 0.00 175.76 177.01 2ris h ALA 39 N 6.89 1.24 0.00 0.00 0.00 -1.67 -2.39 119.26 123.33 2ris h ALA 39 Ca -0.42 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2ris h ALA 39 Cb 1.21 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2ris h ALA 39 CO 0.90 0.27 0.00 -0.85 0.00 0.00 0.00 179.25 179.57 2ris n GLU 40 N -4.62 0.12 0.00 0.00 0.28 -1.26 -3.01 120.64 112.15 2ris n GLU 40 Ca 0.14 0.36 0.06 0.00 -0.16 0.00 0.00 57.16 57.55 2ris n GLU 40 Cb 0.21 -1.73 -0.01 0.00 1.43 0.00 0.00 31.44 31.34 2ris n GLU 40 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 2ris n LEU 41 N -1.95 1.32 -4.65 -1.84 4.77 -0.91 -4.87 117.00 108.88 2ris n LEU 41 Ca 0.03 -0.74 -0.43 0.00 -0.03 0.00 0.00 56.01 54.84 2ris n LEU 41 Cb 0.21 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.27 2ris n LEU 41 CO 0.17 0.26 1.15 -0.51 -1.33 0.00 0.00 177.39 177.13 2ris s ILE 42 N -1.64 4.14 0.56 -0.08 -1.16 -1.16 -4.98 121.20 116.87 2ris s ILE 42 Ca 0.10 1.34 -0.00 0.00 -0.51 0.00 0.00 60.65 61.58 2ris s ILE 42 Cb 0.10 -3.97 0.03 0.00 0.61 0.00 0.00 42.46 39.23 2ris s ILE 42 CO 0.33 -0.23 0.80 0.42 -2.81 0.00 0.00 174.94 173.45 2ris s THR 43 N 3.93 2.80 0.22 4.00 -4.23 -1.26 -4.72 115.64 116.37 2ris s THR 43 Ca 0.58 -0.57 -0.11 0.00 -1.18 0.00 0.00 61.69 60.41 2ris s THR 43 Cb -0.22 -3.07 0.22 0.00 1.34 0.00 0.00 72.50 70.77 2ris s THR 43 CO 0.19 -0.05 1.65 -0.61 -0.54 0.00 0.00 174.62 175.25 2ris h GLN 44 N 0.00 0.07 -0.50 3.99 -0.00 -1.88 0.37 115.11 117.15 2ris h GLN 44 Ca -0.43 -0.00 -0.06 0.00 -0.00 0.00 0.00 58.65 58.16 2ris h GLN 44 Cb 1.29 -0.01 -0.02 0.00 0.00 0.00 0.00 27.48 28.74 2ris h GLN 44 CO 0.54 0.04 0.08 0.93 0.00 0.00 0.00 178.83 180.42 2ris h GLU 45 N 0.07 0.84 -0.18 1.69 3.07 -1.94 -0.00 114.58 118.11 2ris h GLU 45 Ca 0.33 -0.23 -0.12 0.00 -0.50 0.00 0.00 59.36 58.84 2ris h GLU 45 Cb 0.53 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.33 2ris h GLU 45 CO -0.59 0.83 -0.39 0.87 -1.40 0.00 0.00 179.01 178.33 2ris h LYS 46 N 0.71 0.42 -0.45 2.33 1.57 -1.81 -1.12 116.57 118.22 2ris h LYS 46 Ca 0.15 -0.20 -0.10 0.00 -1.87 0.00 0.00 60.65 58.63 2ris h LYS 46 Cb 0.40 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 2ris h LYS 46 CO 0.01 0.75 -0.12 1.98 -0.57 0.00 0.00 179.45 181.50 2ris h MET 47 N 0.35 0.88 -0.66 3.15 4.05 -0.71 -0.38 114.93 121.60 2ris h MET 47 Ca 0.03 -0.34 0.06 0.00 -0.28 0.00 0.00 59.70 59.17 2ris h MET 47 Cb 0.85 -0.05 -0.06 0.00 -0.80 0.00 0.00 31.60 31.54 2ris h MET 47 CO 0.07 0.98 0.36 0.00 0.23 0.00 0.00 176.91 178.55 2ris h ALA 48 N 0.87 0.88 -0.03 0.39 0.00 -0.69 -0.12 119.26 120.57 2ris h ALA 48 Ca 0.11 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2ris h ALA 48 Cb 0.66 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 2ris h ALA 48 CO 0.05 0.03 0.01 0.35 0.00 0.00 0.00 179.25 179.69 2ris h PHE 49 N 0.67 0.05 -0.30 0.00 3.57 -1.04 -0.36 116.94 119.54 2ris h PHE 49 Ca 0.30 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.85 2ris h PHE 49 Cb 0.19 -0.02 -0.06 0.00 2.79 0.00 0.00 35.95 38.86 2ris h PHE 49 CO -0.08 0.21 -0.08 1.25 -2.23 0.00 0.00 178.31 177.37 2ris h LEU 50 N -0.11 -0.30 -0.55 0.59 5.85 -0.74 -2.41 115.31 117.64 2ris h LEU 50 Ca 0.01 0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.77 2ris h LEU 50 Cb 0.17 0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 2ris h LEU 50 CO -0.00 -0.11 0.13 0.58 -0.34 0.00 0.00 178.44 178.70 2ris h VAL 51 N -0.01 1.25 -0.99 1.05 2.07 -0.94 -2.42 116.25 116.26 2ris h VAL 51 Ca 0.15 -0.89 0.11 0.00 0.82 0.00 0.00 66.70 66.88 2ris h VAL 51 Cb 0.23 0.77 -0.08 0.00 -1.52 0.00 0.00 31.29 30.69 2ris h VAL 51 CO -0.31 0.33 0.63 -0.09 0.02 0.00 0.00 177.57 178.14 2ris h ARG 52 N 0.79 0.97 -0.43 1.57 9.65 -0.59 -2.87 114.38 123.47 2ris h ARG 52 Ca 0.17 -0.06 0.00 0.00 -1.10 0.00 0.00 59.98 58.99 2ris h ARG 52 Cb 0.35 -0.22 0.00 0.00 -1.39 0.00 0.00 29.97 28.72 2ris h ARG 52 CO 0.00 0.64 0.00 0.66 2.80 0.00 0.00 179.97 184.07 2ris n TYR 53 N -4.59 0.64 -4.51 2.20 4.02 -0.97 -5.01 117.16 108.95 2ris n TYR 53 Ca 0.18 -0.53 -0.25 0.00 -0.01 0.00 0.00 57.90 57.29 2ris n TYR 53 Cb 0.33 -0.05 -0.07 0.00 -0.02 0.00 0.00 39.34 39.54 2ris n TYR 53 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 2ris n SER 54 N 0.69 1.59 0.32 7.72 3.41 -0.92 -1.69 113.62 124.73 2ris n SER 54 Ca 0.15 -3.03 0.21 0.00 -0.26 0.00 0.00 58.87 55.94 2ris n SER 54 Cb 0.51 0.85 1.05 0.00 -0.26 0.00 0.00 64.21 66.36 2ris n SER 54 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2ris h SER 55 N 1.45 0.00 0.00 4.04 4.64 -1.55 -3.44 113.55 118.68 2ris h SER 55 Ca -0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 2ris h SER 55 Cb 1.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 2ris h SER 55 CO 0.50 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 177.08 2ris n GLY 56 N -0.79 2.18 3.18 -0.77 0.00 -1.26 -4.93 105.19 102.80 2ris n GLY 56 Ca -0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 2ris n GLY 56 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2ris n TYR 57 N -2.00 4.09 -2.77 1.61 9.36 -1.26 -4.95 117.16 121.24 2ris n TYR 57 Ca 0.00 -2.97 -0.42 0.00 3.32 0.00 0.00 57.90 57.83 2ris n TYR 57 Cb 0.00 -2.41 -0.03 0.00 -0.63 0.00 0.00 39.34 36.27 2ris n TYR 57 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 2ris s VAL 58 N 2.76 4.82 0.15 2.97 1.01 -1.26 -4.82 120.40 126.04 2ris s VAL 58 Ca 0.47 1.88 0.09 0.00 0.00 0.00 0.00 61.98 64.42 2ris s VAL 58 Cb 0.07 -4.24 -0.04 0.00 0.00 0.00 0.00 36.38 32.16 2ris s VAL 58 CO 0.00 0.01 -0.13 0.00 0.00 0.00 0.00 175.10 174.98 2ris s VAL 60 N -1.48 1.72 0.15 0.00 1.01 0.12 -0.91 120.40 121.01 2ris s VAL 60 Ca 0.22 -2.73 -0.34 0.00 0.00 0.00 0.00 61.98 59.13 2ris s VAL 60 Cb -0.10 -2.20 -0.14 0.00 0.00 0.00 0.00 36.38 33.94 2ris s VAL 60 CO 0.13 -0.86 1.60 -2.65 0.00 0.00 0.00 175.10 173.32 2ris n PRO 61 N 3.46 2.18 -4.17 2.72 -0.02 -1.09 -1.50 135.00 136.58 2ris n PRO 61 Ca 0.07 0.79 -0.13 0.00 -2.02 0.00 0.00 63.50 62.20 2ris n PRO 61 Cb 0.34 -2.56 -0.11 0.00 -0.02 0.00 0.00 33.50 31.15 2ris n PRO 61 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2ris s LEU 62 N 1.10 2.42 0.67 2.45 1.43 0.42 -0.87 118.68 126.29 2ris s LEU 62 Ca 0.79 -0.84 -0.16 0.00 -1.03 0.00 0.00 54.13 52.89 2ris s LEU 62 Cb -0.67 -0.24 0.00 0.00 0.03 0.00 0.00 46.19 45.31 2ris s LEU 62 CO 0.38 -0.30 1.19 -0.94 0.23 0.00 0.00 176.35 176.91 2ris s SER 63 N -2.52 4.73 0.30 2.29 1.04 -1.20 -0.25 113.70 118.09 2ris s SER 63 Ca 0.06 2.30 0.05 0.00 0.48 0.00 0.00 55.95 58.83 2ris s SER 63 Cb -0.02 -2.59 0.68 0.00 0.10 0.00 0.00 66.02 64.20 2ris s SER 63 CO -0.01 -1.90 1.80 -0.33 0.98 0.00 0.00 173.24 173.79 2ris h GLU 64 N 0.19 0.82 -0.35 4.02 5.08 -1.79 -1.06 114.58 121.49 2ris h GLU 64 Ca -0.48 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 57.83 2ris h GLU 64 Cb 1.29 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 30.33 2ris h GLU 64 CO 0.52 0.54 0.23 1.49 -1.00 0.00 0.00 179.01 180.79 2ris h GLU 65 N 0.84 0.45 -0.27 2.33 4.81 -1.91 -0.17 114.58 120.66 2ris h GLU 65 Ca 0.54 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.70 2ris h GLU 65 Cb 0.75 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.01 2ris h GLU 65 CO -0.33 0.30 -0.02 -0.09 -0.73 0.00 0.00 179.01 178.14 2ris h ARG 66 N 0.46 0.50 -0.85 1.92 9.65 -1.78 -1.51 114.38 122.77 2ris h ARG 66 Ca 0.13 -0.17 0.04 0.00 -1.10 0.00 0.00 59.98 58.88 2ris h ARG 66 Cb -0.05 -0.04 -0.05 0.00 -1.39 0.00 0.00 29.97 28.44 2ris h ARG 66 CO -0.03 0.67 0.54 0.00 2.80 0.00 0.00 179.97 183.95 2ris h ALA 67 N 0.81 1.13 -0.37 2.80 0.00 -1.08 -0.93 119.26 121.61 2ris h ALA 67 Ca 0.07 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.98 2ris h ALA 67 Cb 0.46 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 2ris h ALA 67 CO 0.02 0.35 0.20 -0.91 0.00 0.00 0.00 179.25 178.91 2ris h ASN 68 N 1.04 0.31 -0.81 0.00 2.35 -0.85 -0.69 115.58 116.93 2ris h ASN 68 Ca 0.35 0.01 0.04 0.00 -0.55 0.00 0.00 56.30 56.15 2ris h ASN 68 Cb 0.05 -0.05 -0.05 0.00 0.05 0.00 0.00 38.32 38.32 2ris h ASN 68 CO -0.13 0.23 0.53 -0.61 -1.65 0.00 0.00 177.43 175.80 2ris h GLN 69 N 0.41 0.94 -0.10 0.81 4.15 -0.64 -2.01 115.11 118.66 2ris h GLN 69 Ca 0.15 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.51 2ris h GLN 69 Cb 0.03 -0.21 0.00 0.00 0.21 0.00 0.00 27.48 27.51 2ris h GLN 69 CO -0.08 0.62 0.00 1.28 -1.93 0.00 0.00 178.83 178.72 2ris n LEU 70 N -4.46 1.20 -3.61 -2.39 4.77 -0.41 -4.45 117.00 107.64 2ris n LEU 70 Ca 0.11 -0.49 -0.21 0.00 -0.03 0.00 0.00 56.01 55.39 2ris n LEU 70 Cb 0.14 -0.06 0.04 0.00 -2.33 0.00 0.00 43.42 41.21 2ris n LEU 70 CO 0.34 0.24 -0.04 -0.62 -1.33 0.00 0.00 177.39 175.99 2ris n GLU 71 N -0.00 -4.41 -3.75 3.23 1.02 -0.76 -4.41 120.64 111.56 2ris n GLU 71 Ca 0.16 0.66 -0.33 0.00 -0.02 0.00 0.00 57.16 57.63 2ris n GLU 71 Cb 0.26 -5.22 -0.09 0.00 -0.02 0.00 0.00 31.44 26.38 2ris n GLU 71 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2ris s LEU 72 N -6.47 5.21 0.69 -4.62 1.43 -0.34 -5.04 118.68 109.55 2ris s LEU 72 Ca 0.10 -3.59 -0.11 0.00 -1.03 0.00 0.00 54.13 49.51 2ris s LEU 72 Cb -0.03 -1.80 0.01 0.00 0.03 0.00 0.00 46.19 44.40 2ris s LEU 72 CO 0.80 -0.18 1.06 -2.16 0.23 0.00 0.00 176.35 176.10 2ris s PRO 73 N -1.12 2.91 0.38 1.29 0.04 -1.26 -4.64 135.00 132.60 2ris s PRO 73 Ca 0.24 0.99 -0.25 0.00 0.04 0.00 0.00 61.00 62.02 2ris s PRO 73 Cb -0.10 -1.99 -0.12 0.00 0.04 0.00 0.00 34.50 32.34 2ris s PRO 73 CO -0.11 -1.12 0.93 -2.30 0.04 0.00 0.00 177.00 174.44 2ris n PRO 74 N -3.08 1.22 -0.27 0.56 -0.02 -1.26 -1.46 135.00 130.67 2ris n PRO 74 Ca 0.08 0.43 -0.02 0.00 -2.02 0.00 0.00 63.50 61.97 2ris n PRO 74 Cb 0.53 -1.89 0.15 0.00 -0.02 0.00 0.00 33.50 32.28 2ris n PRO 74 CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 2ris h MET 75 N 1.56 1.13 -5.91 -0.52 4.05 -1.08 -3.41 114.93 110.74 2ris h MET 75 Ca -0.42 -0.12 -0.57 0.00 -0.28 0.00 0.00 59.70 58.31 2ris h MET 75 Cb 1.35 -0.22 -0.06 0.00 -0.80 0.00 0.00 31.60 31.86 2ris h MET 75 CO 0.57 0.82 -0.37 -1.17 0.23 0.00 0.00 176.91 176.99 2ris s LEU 76 N -9.82 2.88 -0.40 3.39 0.20 -1.26 -4.86 118.68 108.81 2ris s LEU 76 Ca -0.12 -1.15 0.03 0.00 0.69 0.00 0.00 54.13 53.58 2ris s LEU 76 Cb 0.17 -1.36 0.16 0.00 -0.43 0.00 0.00 46.19 44.73 2ris s LEU 76 CO 0.81 -0.89 0.38 0.00 -0.29 0.00 0.00 176.35 176.37 2ris s ALA 77 N -2.69 0.05 0.00 5.97 0.00 -1.26 -5.13 121.76 118.70 2ris s ALA 77 Ca 0.36 -1.44 0.00 0.00 0.00 0.00 0.00 51.96 50.89 2ris s ALA 77 Cb -0.01 -1.95 0.00 0.00 0.00 0.00 0.00 23.12 21.17 2ris s ALA 77 CO 0.21 -2.11 0.00 0.41 0.00 0.00 0.00 175.76 174.27 2ris n GLY 84 N 3.70 -1.62 3.69 0.00 0.00 -1.26 -5.22 105.19 104.47 2ris n GLY 84 Ca 0.17 -1.34 -0.42 0.00 0.00 0.00 0.00 46.02 44.43 2ris n GLY 84 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ris s THR 85 N -2.58 3.42 -1.22 2.61 2.01 -1.26 -4.93 115.64 113.69 2ris s THR 85 Ca 0.00 0.81 -0.11 0.00 0.31 0.00 0.00 61.69 62.71 2ris s THR 85 Cb 0.00 -3.52 0.19 0.00 0.01 0.00 0.00 72.50 69.18 2ris s THR 85 CO 0.00 -0.01 1.61 0.00 -0.69 0.00 0.00 174.62 175.53 2ris n ALA 86 N 5.59 4.64 -1.77 7.40 0.00 -1.26 -5.00 120.51 130.11 2ris n ALA 86 Ca 0.15 -4.35 -0.40 0.00 0.00 0.00 0.00 53.44 48.84 2ris n ALA 86 Cb 0.42 -2.93 -0.03 0.00 0.00 0.00 0.00 19.45 16.92 2ris n ALA 86 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2ris s TYR 87 N 0.51 3.26 0.48 0.00 1.51 -1.26 -1.06 117.35 120.79 2ris s TYR 87 Ca 0.40 1.56 0.08 0.00 -1.01 0.00 0.00 57.07 58.09 2ris s TYR 87 Cb 0.03 -3.46 0.04 0.00 -0.11 0.00 0.00 41.96 38.45 2ris s TYR 87 CO 0.01 -1.23 0.66 0.95 -1.11 0.00 0.00 175.55 174.82 2ris s THR 88 N -1.21 2.71 0.35 -0.71 -4.23 -0.63 -0.66 115.64 111.25 2ris s THR 88 Ca 0.49 -0.97 -0.27 0.00 -1.18 0.00 0.00 61.69 59.76 2ris s THR 88 Cb -0.35 -2.74 -0.12 0.00 1.34 0.00 0.00 72.50 70.63 2ris s THR 88 CO 0.45 0.00 1.13 0.00 -0.54 0.00 0.00 174.62 175.66 2ris n ILE 89 N -2.02 2.13 -1.57 2.99 3.06 -0.54 -4.33 119.36 119.08 2ris n ILE 89 Ca 0.10 -0.50 -0.30 0.00 -2.50 0.00 0.00 62.75 59.55 2ris n ILE 89 Cb 0.60 -1.28 0.09 0.00 0.54 0.00 0.00 39.64 39.59 2ris n ILE 89 CO 0.00 0.00 0.00 0.42 -2.50 0.00 0.00 176.55 174.47 2ris s THR 90 N -1.13 3.14 0.12 9.51 -4.23 -1.26 -4.60 115.64 117.19 2ris s THR 90 Ca 0.59 0.37 -0.21 0.00 -1.18 0.00 0.00 61.69 61.26 2ris s THR 90 Cb -0.61 -3.13 0.06 0.00 1.34 0.00 0.00 72.50 70.16 2ris s THR 90 CO 0.60 -0.49 0.53 0.00 -0.54 0.00 0.00 174.62 174.73 2ris s ASP 92 N -2.58 1.89 0.07 0.00 -0.00 -0.00 -1.82 116.67 114.23 2ris s ASP 92 Ca 0.00 -0.35 -0.31 0.00 -0.00 0.00 0.00 52.55 51.90 2ris s ASP 92 Cb -0.00 -0.19 -0.06 0.00 -0.00 0.00 0.00 42.92 42.67 2ris s ASP 92 CO -0.10 0.16 1.31 0.12 -0.00 0.00 0.00 175.17 176.66 2ris s PHE 93 N -0.51 3.24 -0.02 4.23 5.36 -1.26 0.35 117.98 129.37 2ris s PHE 93 Ca 0.05 1.06 -0.24 0.00 -0.96 0.00 0.00 56.93 56.85 2ris s PHE 93 Cb -0.07 -3.57 -0.18 0.00 -0.34 0.00 0.00 43.02 38.87 2ris s PHE 93 CO 0.00 -1.95 1.16 0.00 -1.46 0.00 0.00 175.22 172.97 2ris h ALA 94 N 7.03 -0.22 -1.97 11.12 0.00 -1.29 -3.37 119.26 130.56 2ris h ALA 94 Ca -0.41 -0.21 -0.57 0.00 0.00 0.00 0.00 54.91 53.72 2ris h ALA 94 Cb 1.20 0.08 -0.06 0.00 0.00 0.00 0.00 17.79 19.02 2ris h ALA 94 CO 0.85 -0.39 0.90 -2.00 0.00 0.00 0.00 179.25 178.62 2ris s GLU 95 N -4.23 4.02 0.00 0.00 2.12 -1.26 -2.99 118.70 116.36 2ris s GLU 95 Ca -0.14 1.19 0.00 0.00 0.36 0.00 0.00 54.97 56.38 2ris s GLU 95 Cb 0.02 -3.80 0.00 0.00 0.26 0.00 0.00 34.13 30.61 2ris s GLU 95 CO 0.57 -0.98 0.00 0.41 -0.54 0.00 0.00 175.26 174.72 2ris n GLY 96 N 4.04 0.51 3.75 -1.50 0.00 -1.26 -5.08 105.19 105.64 2ris n GLY 96 Ca 0.13 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.89 2ris n GLY 96 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ris s THR 97 N -2.01 4.21 0.00 2.61 -4.23 -1.16 -4.89 115.64 110.17 2ris s THR 97 Ca 0.00 -1.25 0.00 0.00 -1.18 0.00 0.00 61.69 59.26 2ris s THR 97 Cb 0.00 -3.16 0.00 0.00 1.34 0.00 0.00 72.50 70.68 2ris s THR 97 CO 0.00 -0.14 0.00 0.35 -0.54 0.00 0.00 174.62 174.29 2ris n THR 98 N -0.37 0.00 0.22 3.99 -2.24 -1.26 -4.88 114.28 109.73 2ris n THR 98 Ca -0.09 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.81 2ris n THR 98 Cb 0.55 -0.55 0.30 0.00 -2.10 0.00 0.00 70.33 68.53 2ris n THR 98 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 2ris h THR 99 N 0.00 0.23 0.00 4.28 1.35 -1.99 -3.47 112.91 113.30 2ris h THR 99 Ca 0.00 -1.12 0.00 0.00 -0.55 0.00 0.00 66.41 64.74 2ris h THR 99 Cb 0.00 1.93 0.00 0.00 -1.73 0.00 0.00 68.15 68.35 2ris h THR 99 CO 0.00 0.12 0.00 0.61 -0.25 0.00 0.00 175.52 176.00 2ris n GLY 100 N 0.76 2.65 0.06 5.82 0.00 -1.26 -4.74 105.19 108.47 2ris n GLY 100 Ca 0.02 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.16 2ris n GLY 100 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2ris n ILE 101 N -0.43 0.31 -1.25 -0.61 0.13 -1.26 -3.47 119.36 112.78 2ris n ILE 101 Ca 0.00 -0.45 -0.35 0.00 -1.10 0.00 0.00 62.75 60.86 2ris n ILE 101 Cb 0.00 -0.08 0.10 0.00 -0.84 0.00 0.00 39.64 38.82 2ris n ILE 101 CO 0.00 0.00 0.00 -1.54 2.80 0.00 0.00 176.55 177.81 2ris n SER 102 N -2.35 0.46 -0.27 9.51 3.41 -1.26 -4.67 113.62 118.45 2ris n SER 102 Ca -0.01 0.62 0.04 0.00 -0.26 0.00 0.00 58.87 59.27 2ris n SER 102 Cb 0.52 -1.42 0.17 0.00 -0.26 0.00 0.00 64.21 63.22 2ris n SER 102 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ris h ALA 103 N -0.51 1.12 -0.20 7.33 0.00 -1.92 0.64 119.26 125.73 2ris h ALA 103 Ca -0.47 0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.54 2ris h ALA 103 Cb 1.32 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 19.02 2ris h ALA 103 CO 0.46 -0.03 -0.01 1.25 0.00 0.00 0.00 179.25 180.92 2ris h HIS 104 N 0.65 -0.02 -0.16 0.00 -0.00 -1.90 -0.86 115.15 112.85 2ris h HIS 104 Ca 0.40 0.02 -0.05 0.00 -0.00 0.00 0.00 60.37 60.73 2ris h HIS 104 Cb 0.46 0.04 -0.00 0.00 -0.00 0.00 0.00 27.41 27.91 2ris h HIS 104 CO -0.09 -0.04 -0.11 -0.44 -0.00 0.00 0.00 177.93 177.25 2ris h ASP 105 N 0.05 0.37 -0.81 3.26 5.19 -1.66 -0.76 116.42 122.07 2ris h ASP 105 Ca 0.09 -0.44 -0.01 0.00 -0.62 0.00 0.00 57.03 56.06 2ris h ASP 105 Cb 0.12 -0.10 -0.04 0.00 0.18 0.00 0.00 39.33 39.49 2ris h ASP 105 CO -0.17 0.73 0.47 0.03 -3.12 0.00 0.00 179.24 177.18 2ris h ARG 106 N 0.01 1.11 -0.35 3.56 3.08 -0.87 0.64 114.38 121.56 2ris h ARG 106 Ca 0.03 -0.11 -0.03 0.00 0.07 0.00 0.00 59.98 59.94 2ris h ARG 106 Cb 0.60 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 30.41 2ris h ARG 106 CO 0.03 0.79 0.11 0.00 -1.07 0.00 0.00 179.97 179.83 2ris h ALA 107 N 1.39 0.46 -0.56 0.04 0.00 -1.08 -1.00 119.26 118.52 2ris h ALA 107 Ca 0.29 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2ris h ALA 107 Cb -0.02 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 2ris h ALA 107 CO -0.05 0.10 0.27 1.25 0.00 0.00 0.00 179.25 180.82 2ris h LEU 108 N 0.41 0.73 -0.47 0.00 5.85 -0.60 -0.36 115.31 120.87 2ris h LEU 108 Ca 0.11 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 2ris h LEU 108 Cb 0.25 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 2ris h LEU 108 CO -0.00 0.66 0.25 0.74 -0.34 0.00 0.00 178.44 179.74 2ris h THR 109 N 0.75 1.17 -0.15 1.05 2.02 -0.81 -0.85 112.91 116.09 2ris h THR 109 Ca 0.19 -0.45 0.00 0.00 0.77 0.00 0.00 66.41 66.93 2ris h THR 109 Cb 0.12 0.61 -0.01 0.00 -1.74 0.00 0.00 68.15 67.14 2ris h THR 109 CO -0.02 0.18 0.09 0.74 0.37 0.00 0.00 175.52 176.88 2ris h THR 110 N 0.61 1.02 -0.96 3.16 2.02 -0.72 -0.14 112.91 117.90 2ris h THR 110 Ca 0.16 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.28 2ris h THR 110 Cb 0.07 0.82 -0.05 0.00 -1.74 0.00 0.00 68.15 67.25 2ris h THR 110 CO -0.03 0.03 0.61 0.03 0.37 0.00 0.00 175.52 176.54 2ris h ARG 111 N 0.19 1.29 -0.30 6.66 3.08 -0.97 -2.47 114.38 121.86 2ris h ARG 111 Ca 0.06 -0.10 -0.07 0.00 0.07 0.00 0.00 59.98 59.94 2ris h ARG 111 Cb -0.01 -0.28 -0.02 0.00 0.08 0.00 0.00 29.97 29.74 2ris h ARG 111 CO -0.02 0.88 -0.12 0.77 -1.07 0.00 0.00 179.97 180.40 2ris h SER 112 N 1.32 0.50 0.26 7.04 0.02 -0.57 -1.22 113.55 120.90 2ris h SER 112 Ca 0.35 -0.13 -0.06 0.00 -0.84 0.00 0.00 61.79 61.11 2ris h SER 112 Cb -0.11 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.29 2ris h SER 112 CO -0.07 0.66 -0.27 -0.07 -1.14 0.00 0.00 176.83 175.93 2ris h LEU 113 N 0.47 0.03 0.02 5.07 3.38 -0.57 -2.81 115.31 120.90 2ris h LEU 113 Ca 0.09 -0.01 -0.22 0.00 0.09 0.00 0.00 57.88 57.82 2ris h LEU 113 Cb 0.50 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 2ris h LEU 113 CO 0.03 0.31 -1.05 0.00 0.09 0.00 0.00 178.44 177.82 2ris h ALA 114 N 1.69 0.30 -2.29 1.53 0.00 -1.12 -3.46 119.26 115.91 2ris h ALA 114 Ca 0.00 -0.90 -0.54 0.00 0.00 0.00 0.00 54.91 53.47 2ris h ALA 114 Cb 0.50 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.18 2ris h ALA 114 CO 0.04 1.17 1.18 1.21 0.00 0.00 0.00 179.25 182.85 2ris s ASN 115 N -6.82 6.48 0.43 0.00 3.04 -0.54 -4.87 114.94 112.67 2ris s ASN 115 Ca -0.00 2.41 0.30 0.00 0.04 0.00 0.00 52.86 55.61 2ris s ASN 115 Cb 0.09 -2.53 1.50 0.00 -1.54 0.00 0.00 41.25 38.78 2ris s ASN 115 CO 0.83 -1.06 1.91 1.55 -3.04 0.00 0.00 177.10 177.29 2ris h PRO 116 N 10.40 0.00 0.00 0.43 0.13 -1.89 -1.64 132.00 139.43 2ris h PRO 116 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2ris h PRO 116 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2ris h PRO 116 CO 0.95 0.00 -0.30 0.09 -0.23 0.00 0.00 178.00 178.51 2ris n ASN 117 N -2.58 0.39 -4.76 1.44 5.03 -1.26 -4.91 115.26 108.60 2ris n ASN 117 Ca -0.01 0.15 -0.38 0.00 0.87 0.00 0.00 54.58 55.21 2ris n ASN 117 Cb 0.12 -0.13 0.01 0.00 -1.02 0.00 0.00 39.78 38.76 2ris n ASN 117 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 2ris s SER 118 N -3.34 5.86 0.20 6.41 0.01 -0.62 -5.04 113.70 117.19 2ris s SER 118 Ca 0.11 2.61 0.11 0.00 1.31 0.00 0.00 55.95 60.09 2ris s SER 118 Cb 0.17 -2.63 -0.04 0.00 0.21 0.00 0.00 66.02 63.73 2ris s SER 118 CO 0.63 -1.15 -0.22 -0.54 0.41 0.00 0.00 173.24 172.37 2ris s LYS 119 N -2.63 1.58 0.29 12.44 1.02 -1.26 -4.98 119.74 126.20 2ris s LYS 119 Ca 0.64 -1.51 0.04 0.00 0.02 0.00 0.00 55.97 55.16 2ris s LYS 119 Cb -0.36 -1.87 0.69 0.00 -0.52 0.00 0.00 37.83 35.76 2ris s LYS 119 CO 0.45 0.40 1.75 -1.35 -0.92 0.00 0.00 175.35 175.68 2ris h PRO 120 N 3.12 0.63 0.00 -1.68 0.11 -1.78 -0.90 132.00 131.50 2ris h PRO 120 Ca -0.46 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2ris h PRO 120 Cb 1.21 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2ris h PRO 120 CO 0.49 0.42 0.00 0.00 -0.21 0.00 0.00 178.00 178.70 2ris n GLN 121 N -4.85 0.11 0.05 1.05 0.00 -1.26 -2.66 117.38 109.81 2ris n GLN 121 Ca 0.22 0.19 0.12 0.00 0.00 0.00 0.00 57.00 57.53 2ris n GLN 121 Cb 0.56 -1.50 0.49 0.00 0.00 0.00 0.00 30.24 29.78 2ris n GLN 121 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 2ris n ASP 122 N -1.40 0.36 -4.50 2.61 8.00 -0.34 -4.83 116.55 116.45 2ris n ASP 122 Ca 0.06 0.55 -0.33 0.00 0.71 0.00 0.00 54.79 55.78 2ris n ASP 122 Cb 0.15 -0.64 -0.12 0.00 -0.02 0.00 0.00 41.12 40.49 2ris n ASP 122 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2ris s PHE 123 N -3.07 2.74 -0.08 1.24 0.40 -1.09 -0.77 117.98 117.35 2ris s PHE 123 Ca 0.11 -0.13 -0.15 0.00 -0.60 0.00 0.00 56.93 56.15 2ris s PHE 123 Cb 0.14 -1.61 -0.05 0.00 0.51 0.00 0.00 43.02 42.01 2ris s PHE 123 CO 0.49 0.24 0.39 0.42 0.70 0.00 0.00 175.22 177.46 2ris s ILE 124 N -0.81 5.17 -0.02 0.64 1.01 0.15 -4.88 121.20 122.46 2ris s ILE 124 Ca 0.13 0.77 0.03 0.00 0.00 0.00 0.00 60.65 61.58 2ris s ILE 124 Cb -0.11 -3.71 -0.00 0.00 0.01 0.00 0.00 42.46 38.65 2ris s ILE 124 CO 0.02 0.45 -0.11 -0.54 0.00 0.00 0.00 174.94 174.77 2ris s LYS 125 N -0.16 1.10 1.09 2.79 1.02 -1.26 -0.82 119.74 123.50 2ris s LYS 125 Ca 0.22 -0.38 -0.15 0.00 0.02 0.00 0.00 55.97 55.68 2ris s LYS 125 Cb -0.15 -1.02 0.23 0.00 -0.52 0.00 0.00 37.83 36.37 2ris s LYS 125 CO 0.10 0.17 1.09 -1.25 -0.92 0.00 0.00 175.35 174.54 2ris s PRO 126 N 0.06 -0.30 0.00 -1.68 0.04 -1.26 -5.07 135.00 126.78 2ris s PRO 126 Ca -0.01 0.31 0.00 0.00 0.04 0.00 0.00 61.00 61.34 2ris s PRO 126 Cb -0.08 -1.67 0.00 0.00 0.04 0.00 0.00 34.50 32.79 2ris s PRO 126 CO 0.01 -3.18 0.00 0.41 0.04 0.00 0.00 177.00 174.28 2ris n GLY 127 N -0.91 4.36 0.00 0.56 0.00 -1.11 -4.55 105.19 103.54 2ris n GLY 127 Ca 0.08 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.52 2ris n GLY 127 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2ris n HIS 128 N 0.00 0.00 -4.45 1.61 8.25 -1.08 -4.41 115.22 115.14 2ris n HIS 128 Ca 0.00 -0.06 -0.34 0.00 -0.26 0.00 0.00 57.72 57.06 2ris n HIS 128 Cb 0.00 -0.01 -0.10 0.00 1.12 0.00 0.00 29.99 31.00 2ris n HIS 128 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2ris s ILE 129 N -0.13 3.99 -0.69 1.59 1.09 -0.76 -4.88 121.20 121.42 2ris s ILE 129 Ca 0.00 -0.47 -0.09 0.00 -1.10 0.00 0.00 60.65 58.99 2ris s ILE 129 Cb 0.00 -2.69 0.18 0.00 -1.06 0.00 0.00 42.46 38.89 2ris s ILE 129 CO 0.00 0.53 0.57 -0.76 -0.10 0.00 0.00 174.94 175.18 2ris s LEU 130 N -1.08 6.02 0.50 2.97 1.43 -1.14 -1.81 118.68 125.57 2ris s LEU 130 Ca 0.15 -2.59 -0.21 0.00 -1.03 0.00 0.00 54.13 50.45 2ris s LEU 130 Cb -0.11 -2.05 -0.07 0.00 0.03 0.00 0.00 46.19 43.99 2ris s LEU 130 CO 0.04 -0.53 1.13 -2.84 0.23 0.00 0.00 176.35 174.39 2ris s PRO 131 N 0.34 3.60 0.03 1.29 0.02 -1.26 -0.70 135.00 138.31 2ris s PRO 131 Ca 0.15 1.66 0.06 0.00 0.02 0.00 0.00 61.00 62.89 2ris s PRO 131 Cb -0.17 -2.21 -0.02 0.00 0.02 0.00 0.00 34.50 32.12 2ris s PRO 131 CO -0.05 -0.66 -0.19 -0.51 -0.33 0.00 0.00 177.00 175.26 2ris s LEU 132 N -3.39 2.13 -0.40 -5.54 1.43 -0.56 -1.60 118.68 110.74 2ris s LEU 132 Ca 0.68 -0.46 -0.16 0.00 -1.03 0.00 0.00 54.13 53.16 2ris s LEU 132 Cb -0.25 -0.90 0.01 0.00 0.03 0.00 0.00 46.19 45.08 2ris s LEU 132 CO 0.30 0.16 0.37 -0.13 0.23 0.00 0.00 176.35 177.28 2ris s ARG 133 N -0.96 3.15 0.12 1.70 0.52 -0.22 -0.44 118.95 122.83 2ris s ARG 133 Ca 0.06 -0.78 -0.30 0.00 -0.52 0.00 0.00 55.73 54.19 2ris s ARG 133 Cb -0.08 -3.94 -0.06 0.00 0.52 0.00 0.00 34.95 31.39 2ris s ARG 133 CO 0.01 -0.75 0.98 0.00 0.02 0.00 0.00 175.30 175.56 2ris s ALA 134 N 1.95 3.26 0.43 2.13 0.00 0.65 -4.67 121.76 125.51 2ris s ALA 134 Ca 0.09 0.61 -0.24 0.00 0.00 0.00 0.00 51.96 52.43 2ris s ALA 134 Cb -0.18 -3.29 -0.08 0.00 0.00 0.00 0.00 23.12 19.57 2ris s ALA 134 CO 0.12 -0.05 1.14 0.14 0.00 0.00 0.00 175.76 177.11 2ris s VAL 135 N -0.02 3.26 0.30 0.00 -7.23 -1.26 -2.39 120.40 113.07 2ris s VAL 135 Ca 0.47 0.97 -0.29 0.00 -1.81 0.00 0.00 61.98 61.33 2ris s VAL 135 Cb -0.24 -3.51 -0.13 0.00 0.56 0.00 0.00 36.38 33.07 2ris s VAL 135 CO 0.30 0.01 1.34 -2.65 -0.31 0.00 0.00 175.10 173.80 2ris n PRO 136 N -0.27 2.09 0.00 4.82 -0.02 -1.26 -0.99 135.00 139.37 2ris n PRO 136 Ca 0.06 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 2ris n PRO 136 Cb 0.48 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 2ris n PRO 136 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ris n GLY 137 N 1.38 1.70 7.00 -1.23 0.00 -1.26 -4.75 105.19 108.03 2ris n GLY 137 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 2ris n GLY 137 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2ris n LEU 138 N 0.00 0.00 0.10 0.99 4.77 -0.16 -1.62 117.00 121.07 2ris n LEU 138 Ca 0.00 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.09 2ris n LEU 138 Cb 0.00 0.00 0.45 0.00 -2.33 0.00 0.00 43.42 41.54 2ris n LEU 138 CO 0.00 0.00 0.83 0.18 -1.33 0.00 0.00 177.39 177.07 2ris n LEU 139 N 0.00 0.52 0.12 2.23 4.77 -1.25 -1.13 117.00 122.26 2ris n LEU 139 Ca 0.00 0.62 0.13 0.00 -0.03 0.00 0.00 56.01 56.73 2ris n LEU 139 Cb 0.00 -0.55 0.40 0.00 -2.33 0.00 0.00 43.42 40.94 2ris n LEU 139 CO 0.00 -0.48 0.88 0.11 -1.33 0.00 0.00 177.39 176.57 2ris h LYS 140 N 0.00 0.00 0.00 3.23 1.57 -1.70 -3.36 116.57 116.31 2ris h LYS 140 Ca 0.00 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.57 2ris h LYS 140 Cb 0.35 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.62 2ris h LYS 140 CO 0.00 0.00 -1.78 1.17 -0.57 0.00 0.00 179.45 178.27 2ris n LYS 141 N -2.35 0.34 -3.71 3.15 3.00 -0.33 -5.02 118.16 113.24 2ris n LYS 141 Ca 0.05 0.08 -0.12 0.00 -0.00 0.00 0.00 58.31 58.32 2ris n LYS 141 Cb 0.41 -1.26 -0.13 0.00 0.00 0.00 0.00 35.03 34.05 2ris n LYS 141 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.40 177.90 2ris s ARG 142 N -2.27 0.21 -0.24 1.64 3.52 -0.29 -5.04 118.95 116.48 2ris s ARG 142 Ca -0.18 0.60 -0.00 0.00 -0.13 0.00 0.00 55.73 56.01 2ris s ARG 142 Cb 0.05 -0.09 0.18 0.00 -1.56 0.00 0.00 34.95 33.52 2ris s ARG 142 CO 0.31 -0.19 1.93 0.54 -0.81 0.00 0.00 175.30 177.08 2ris n ARG 143 N 4.47 1.61 -2.09 5.12 1.74 -1.26 -3.88 116.66 122.38 2ris n ARG 143 Ca -0.21 -1.22 -0.31 0.00 -0.77 0.00 0.00 57.85 55.34 2ris n ARG 143 Cb 0.52 -1.48 -0.00 0.00 -1.02 0.00 0.00 32.46 30.48 2ris n ARG 143 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2ris s GLY 144 N 0.51 1.77 0.52 -0.13 0.00 -1.26 -4.92 107.32 103.80 2ris s GLY 144 Ca 0.24 -0.05 0.26 0.00 0.00 0.00 0.00 44.72 45.17 2ris s GLY 144 CO 0.00 0.21 2.08 0.45 0.00 0.00 0.00 173.10 175.84 2ris h HIS 145 N 0.09 0.00 0.16 1.90 3.86 -1.99 -0.42 115.15 118.75 2ris h HIS 145 Ca -0.45 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 58.75 2ris h HIS 145 Cb 1.19 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.66 2ris h HIS 145 CO 0.65 0.12 -0.08 1.15 0.86 0.00 0.00 177.93 180.63 2ris h THR 146 N 0.00 0.91 -0.49 2.45 2.02 -1.96 -1.45 112.91 114.40 2ris h THR 146 Ca -0.00 -0.30 -0.06 0.00 0.77 0.00 0.00 66.41 66.83 2ris h THR 146 Cb 0.30 1.10 -0.02 0.00 -1.74 0.00 0.00 68.15 67.79 2ris h THR 146 CO 0.02 0.07 0.06 -0.33 0.37 0.00 0.00 175.52 175.71 2ris h GLU 147 N -0.35 0.77 -0.58 6.66 3.07 -1.74 -2.67 114.58 119.74 2ris h GLU 147 Ca -0.02 -0.17 0.04 0.00 -0.50 0.00 0.00 59.36 58.70 2ris h GLU 147 Cb 0.28 -0.11 -0.04 0.00 -0.84 0.00 0.00 28.75 28.04 2ris h GLU 147 CO 0.04 0.74 0.33 0.00 -1.40 0.00 0.00 179.01 178.71 2ris h ALA 148 N 1.34 0.76 -0.16 3.43 0.00 -0.88 0.16 119.26 123.91 2ris h ALA 148 Ca 0.15 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 2ris h ALA 148 Cb 0.35 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2ris h ALA 148 CO 0.01 0.03 0.08 0.00 0.00 0.00 0.00 179.25 179.37 2ris h ALA 149 N 1.28 0.20 -0.27 0.00 0.00 -0.97 0.13 119.26 119.63 2ris h ALA 149 Ca 0.25 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.97 2ris h ALA 149 Cb 0.08 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2ris h ALA 149 CO -0.13 -0.25 -0.31 0.28 0.00 0.00 0.00 179.25 178.85 2ris h VAL 150 N 0.13 1.28 -0.35 0.00 2.07 -1.30 -2.10 116.25 115.99 2ris h VAL 150 Ca 0.05 -1.40 -0.01 0.00 0.82 0.00 0.00 66.70 66.16 2ris h VAL 150 Cb 0.11 1.41 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 2ris h VAL 150 CO -0.01 0.45 0.18 -0.61 0.02 0.00 0.00 177.57 177.60 2ris h GLN 151 N 0.48 0.49 -0.42 1.57 5.75 -0.38 -1.16 115.11 121.45 2ris h GLN 151 Ca 0.06 -0.06 0.02 0.00 -0.15 0.00 0.00 58.65 58.52 2ris h GLN 151 Cb 0.78 -0.09 -0.03 0.00 1.07 0.00 0.00 27.48 29.20 2ris h GLN 151 CO 0.06 0.42 0.23 -0.07 -2.65 0.00 0.00 178.83 176.82 2ris h LEU 152 N 0.43 0.35 -0.55 -2.39 3.38 -0.55 0.14 115.31 116.12 2ris h LEU 152 Ca 0.12 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 2ris h LEU 152 Cb 0.08 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 2ris h LEU 152 CO -0.02 0.25 0.23 0.28 0.09 0.00 0.00 178.44 179.28 2ris h SER 153 N 0.46 0.76 -0.16 -0.43 0.02 -1.25 -1.11 113.55 111.83 2ris h SER 153 Ca 0.17 -0.16 -0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2ris h SER 153 Cb 0.04 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.38 2ris h SER 153 CO -0.10 0.71 0.10 0.74 -1.14 0.00 0.00 176.83 177.14 2ris h THR 154 N 0.75 1.06 0.00 -2.27 2.02 -0.88 0.07 112.91 113.67 2ris h THR 154 Ca 0.19 -0.15 -0.03 0.00 0.77 0.00 0.00 66.41 67.19 2ris h THR 154 Cb 0.18 0.87 -0.00 0.00 -1.74 0.00 0.00 68.15 67.46 2ris h THR 154 CO -0.02 0.06 -0.14 -0.07 0.37 0.00 0.00 175.52 175.72 2ris h LEU 155 N 0.20 0.00 -0.15 2.58 3.38 -0.79 -1.49 115.31 119.05 2ris h LEU 155 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2ris h LEU 155 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2ris h LEU 155 CO -0.01 0.14 -0.01 0.00 0.09 0.00 0.00 178.44 178.65 2ris n ALA 156 N -2.51 2.66 -1.08 1.53 0.00 -0.44 -4.90 120.51 115.78 2ris n ALA 156 Ca -0.03 -0.23 -0.03 0.00 0.00 0.00 0.00 53.44 53.16 2ris n ALA 156 Cb 0.21 -1.46 -0.01 0.00 0.00 0.00 0.00 19.45 18.19 2ris n ALA 156 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ris n GLY 157 N 1.07 0.59 3.98 0.00 0.00 -0.56 -4.86 105.19 105.41 2ris n GLY 157 Ca 0.22 -0.73 -0.20 0.00 0.00 0.00 0.00 46.02 45.31 2ris n GLY 157 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ris s LEU 158 N -0.59 3.32 0.42 0.99 1.43 -0.03 -5.02 118.68 119.20 2ris s LEU 158 Ca 0.00 -0.71 -0.26 0.00 -1.03 0.00 0.00 54.13 52.13 2ris s LEU 158 Cb 0.00 -2.05 -0.10 0.00 0.03 0.00 0.00 46.19 44.08 2ris s LEU 158 CO 0.00 -0.97 1.34 0.00 0.23 0.00 0.00 176.35 176.95 2ris n GLN 159 N -1.92 2.11 -1.18 1.70 1.13 -1.26 -4.25 117.38 113.72 2ris n GLN 159 Ca 0.09 0.75 -0.37 0.00 -1.94 0.00 0.00 57.00 55.52 2ris n GLN 159 Cb 0.61 -2.48 -0.03 0.00 0.11 0.00 0.00 30.24 28.44 2ris n GLN 159 CO 0.00 0.00 0.00 -0.35 -1.44 0.00 0.00 177.06 175.27 2ris n PRO 160 N 0.05 2.09 -3.70 -1.09 -0.04 -1.26 -4.58 135.00 126.47 2ris n PRO 160 Ca 0.05 -1.93 -0.11 0.00 -0.04 0.00 0.00 63.50 61.48 2ris n PRO 160 Cb 0.40 -2.87 -0.10 0.00 -0.04 0.00 0.00 33.50 30.89 2ris n PRO 160 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2ris s ALA 161 N 4.02 -1.10 0.42 0.55 0.00 -1.26 -3.22 121.76 121.17 2ris s ALA 161 Ca 0.52 1.49 0.04 0.00 0.00 0.00 0.00 51.96 54.01 2ris s ALA 161 Cb 0.14 -0.89 -0.02 0.00 0.00 0.00 0.00 23.12 22.34 2ris s ALA 161 CO 0.02 -0.25 0.15 0.20 0.00 0.00 0.00 175.76 175.88 2ris s GLY 162 N 1.06 2.70 -0.04 0.00 0.00 -0.05 -2.26 107.32 108.74 2ris s GLY 162 Ca -0.07 -1.17 -0.03 0.00 0.00 0.00 0.00 44.72 43.45 2ris s GLY 162 CO -0.09 -1.82 0.09 0.54 0.00 0.00 0.00 173.10 171.82 2ris s VAL 163 N -3.18 -0.01 0.02 1.40 0.11 -0.32 -2.68 120.40 115.73 2ris s VAL 163 Ca 0.23 0.05 -0.05 0.00 -2.93 0.00 0.00 61.98 59.28 2ris s VAL 163 Cb 0.02 -0.14 -0.01 0.00 -1.53 0.00 0.00 36.38 34.71 2ris s VAL 163 CO 0.15 0.02 0.08 0.27 -3.33 0.00 0.00 175.10 172.29 2ris s ILE 164 N 0.33 0.11 -0.02 7.04 -4.36 -0.09 -1.87 121.20 122.34 2ris s ILE 164 Ca -0.02 -0.89 -0.28 0.00 -0.26 0.00 0.00 60.65 59.19 2ris s ILE 164 Cb -0.04 -0.54 0.09 0.00 1.25 0.00 0.00 42.46 43.23 2ris s ILE 164 CO -0.01 -0.49 0.80 0.00 0.24 0.00 0.00 174.94 175.47 2ris s GLU 166 N -2.32 4.47 0.23 0.00 8.01 -1.26 -0.90 118.70 126.94 2ris s GLU 166 Ca -0.01 1.17 -0.30 0.00 0.01 0.00 0.00 54.97 55.83 2ris s GLU 166 Cb -0.01 -3.48 -0.10 0.00 -4.31 0.00 0.00 34.13 26.24 2ris s GLU 166 CO -0.03 -0.06 1.44 -0.51 0.01 0.00 0.00 175.26 176.11 2ris s LEU 167 N 1.15 4.39 0.03 1.80 1.43 -0.49 -1.53 118.68 125.46 2ris s LEU 167 Ca 0.45 2.63 0.05 0.00 -1.03 0.00 0.00 54.13 56.23 2ris s LEU 167 Cb -0.19 -3.62 -0.02 0.00 0.03 0.00 0.00 46.19 42.39 2ris s LEU 167 CO 0.22 -0.70 -0.15 0.68 0.23 0.00 0.00 176.35 176.63 2ris s VAL 168 N 0.16 1.17 0.18 -1.59 -7.23 -0.68 -1.73 120.40 110.67 2ris s VAL 168 Ca 0.60 -0.92 -0.30 0.00 -1.81 0.00 0.00 61.98 59.55 2ris s VAL 168 Cb -0.41 -1.03 -0.08 0.00 0.56 0.00 0.00 36.38 35.42 2ris s VAL 168 CO 0.41 0.10 1.17 -0.13 -0.31 0.00 0.00 175.10 176.35 2ris s ARG 169 N -0.94 4.52 0.36 4.82 0.52 0.63 -4.71 118.95 124.15 2ris s ARG 169 Ca 0.03 1.83 0.05 0.00 -0.52 0.00 0.00 55.73 57.13 2ris s ARG 169 Cb -0.07 -3.25 0.69 0.00 0.52 0.00 0.00 34.95 32.84 2ris s ARG 169 CO 0.01 -0.05 1.95 -0.44 0.02 0.00 0.00 175.30 176.79 2ris h ASP 170 N 5.22 0.50 -0.75 0.23 3.32 -1.96 -0.53 116.42 122.45 2ris h ASP 170 Ca -0.44 -0.06 -0.06 0.00 0.02 0.00 0.00 57.03 56.49 2ris h ASP 170 Cb 1.21 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 40.60 2ris h ASP 170 CO 0.74 0.48 0.24 -0.33 -1.72 0.00 0.00 179.24 178.65 2ris h GLU 171 N 0.55 1.17 0.00 3.56 3.07 -1.96 -3.39 114.58 117.57 2ris h GLU 171 Ca 0.13 -0.25 0.00 0.00 -0.50 0.00 0.00 59.36 58.74 2ris h GLU 171 Cb 0.16 -0.17 0.00 0.00 -0.84 0.00 0.00 28.75 27.90 2ris h GLU 171 CO -0.01 0.99 0.00 -0.40 -1.40 0.00 0.00 179.01 178.19 2ris n ASP 172 N -4.25 0.00 0.00 1.42 5.68 -1.22 -5.03 116.55 113.15 2ris n ASP 172 Ca 0.06 -1.00 0.00 0.00 -0.50 0.00 0.00 54.79 53.35 2ris n ASP 172 Cb 0.23 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.21 2ris n ASP 172 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2ris n GLY 173 N 0.00 0.64 3.78 6.12 0.00 -0.21 -5.00 105.19 110.52 2ris n GLY 173 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 2ris n GLY 173 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ris s LEU 174 N 0.00 4.15 0.47 0.99 1.43 -1.26 -4.57 118.68 119.89 2ris s LEU 174 Ca 0.00 2.15 -0.23 0.00 -1.03 0.00 0.00 54.13 55.02 2ris s LEU 174 Cb 0.00 -4.14 -0.07 0.00 0.03 0.00 0.00 46.19 42.01 2ris s LEU 174 CO 0.00 -0.58 1.22 -0.04 0.23 0.00 0.00 176.35 177.18 2ris s MET 175 N -2.44 3.66 -0.21 1.70 -1.94 -1.26 -0.26 119.30 118.54 2ris s MET 175 Ca 0.58 1.92 -0.29 0.00 -1.71 0.00 0.00 55.69 56.19 2ris s MET 175 Cb -0.25 -2.42 -0.00 0.00 2.01 0.00 0.00 34.83 34.16 2ris s MET 175 CO 0.32 -0.68 1.17 -1.64 -0.01 0.00 0.00 175.02 174.18 2ris s MET 176 N -2.68 4.21 0.98 2.03 1.00 -0.70 -4.79 119.30 119.34 2ris s MET 176 Ca 0.64 1.48 -0.17 0.00 0.00 0.00 0.00 55.69 57.65 2ris s MET 176 Cb -0.32 -3.73 0.23 0.00 0.00 0.00 0.00 34.83 31.01 2ris s MET 176 CO 0.39 -0.72 1.24 0.54 0.00 0.00 0.00 175.02 176.47 2ris n ARG 177 N 6.58 -1.52 -0.14 2.03 3.00 -1.26 -1.41 116.66 123.94 2ris n ARG 177 Ca 0.13 -1.93 -0.03 0.00 -0.01 0.00 0.00 57.85 56.01 2ris n ARG 177 Cb 0.46 -1.35 0.05 0.00 0.00 0.00 0.00 32.46 31.61 2ris n ARG 177 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 2ris h LEU 178 N 0.00 -0.05 -0.48 0.55 5.85 -1.04 -0.87 115.31 119.27 2ris h LEU 178 Ca -0.41 0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.42 2ris h LEU 178 Cb 1.15 0.13 -0.03 0.00 0.37 0.00 0.00 40.66 42.28 2ris h LEU 178 CO 0.29 0.01 0.29 0.44 -0.34 0.00 0.00 178.44 179.13 2ris h ASP 179 N 0.19 0.48 -0.27 1.25 3.45 -1.91 0.11 116.42 119.72 2ris h ASP 179 Ca 0.23 0.00 -0.06 0.00 0.43 0.00 0.00 57.03 57.63 2ris h ASP 179 Cb 0.30 -0.10 -0.02 0.00 -0.56 0.00 0.00 39.33 38.95 2ris h ASP 179 CO -0.32 0.34 -0.00 0.44 -1.57 0.00 0.00 179.24 178.13 2ris h ASP 180 N 0.59 0.56 -0.58 6.45 3.45 -1.81 -1.94 116.42 123.14 2ris h ASP 180 Ca 0.19 -0.11 -0.10 0.00 0.43 0.00 0.00 57.03 57.44 2ris h ASP 180 Cb 0.00 -0.15 -0.02 0.00 -0.56 0.00 0.00 39.33 38.60 2ris h ASP 180 CO -0.08 0.63 -0.02 0.00 -1.57 0.00 0.00 179.24 178.21 2ris h ILE 182 N 0.95 1.03 -0.62 0.00 1.08 -0.50 0.14 117.51 119.58 2ris h ILE 182 Ca 0.17 -0.19 -0.07 0.00 -0.39 0.00 0.00 64.86 64.38 2ris h ILE 182 Cb 0.57 0.43 -0.02 0.00 -3.07 0.00 0.00 36.82 34.72 2ris h ILE 182 CO 0.03 0.10 0.12 -0.61 -0.69 0.00 0.00 178.15 177.10 2ris h GLN 183 N 0.55 1.02 -0.46 2.37 4.15 -1.08 -1.19 115.11 120.48 2ris h GLN 183 Ca 0.20 -0.26 -0.06 0.00 0.77 0.00 0.00 58.65 59.30 2ris h GLN 183 Cb 0.04 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 27.59 2ris h GLN 183 CO -0.10 0.94 0.07 0.35 -1.93 0.00 0.00 178.83 178.16 2ris h PHE 184 N 0.93 0.81 -0.52 3.99 3.57 -0.59 -0.91 116.94 124.22 2ris h PHE 184 Ca 0.19 -0.12 0.01 0.00 3.53 0.00 0.00 57.97 61.59 2ris h PHE 184 Cb 0.41 -0.22 -0.03 0.00 2.79 0.00 0.00 35.95 38.90 2ris h PHE 184 CO 0.03 0.77 0.33 0.78 -2.23 0.00 0.00 178.31 177.99 2ris h GLY 185 N 0.62 0.74 0.92 2.40 0.00 -0.53 -1.20 103.07 106.03 2ris h GLY 185 Ca 0.14 -0.26 -0.03 0.00 0.00 0.00 0.00 47.33 47.18 2ris h GLY 185 CO 0.01 0.24 0.10 0.50 0.00 0.00 0.00 176.54 177.38 2ris h LYS 186 N 0.67 0.59 -0.66 4.80 1.57 -1.07 0.21 116.57 122.68 2ris h LYS 186 Ca 0.20 -0.14 -0.03 0.00 -1.87 0.00 0.00 60.65 58.81 2ris h LYS 186 Cb -0.03 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.17 2ris h LYS 186 CO -0.07 0.62 0.29 -0.22 -0.57 0.00 0.00 179.45 179.51 2ris h LYS 187 N 0.45 0.97 -0.02 3.15 3.64 -0.96 -3.21 116.57 120.60 2ris h LYS 187 Ca 0.12 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 2ris h LYS 187 Cb 0.29 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 2ris h LYS 187 CO 0.00 0.79 -0.04 0.72 -2.27 0.00 0.00 179.45 178.66 2ris n HIS 188 N -4.44 0.00 -3.21 1.91 8.25 -0.47 -4.98 115.22 112.28 2ris n HIS 188 Ca 0.05 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.36 2ris n HIS 188 Cb 0.15 0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.33 2ris n HIS 188 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2ris n GLY 189 N 1.16 -0.22 3.32 -1.41 0.00 0.48 -5.03 105.19 103.49 2ris n GLY 189 Ca 0.12 0.01 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 2ris n GLY 189 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ris s ILE 190 N -3.28 2.74 0.51 -0.61 1.01 0.19 -5.03 121.20 116.72 2ris s ILE 190 Ca 0.10 -0.77 -0.19 0.00 0.00 0.00 0.00 60.65 59.80 2ris s ILE 190 Cb -0.05 -2.13 -0.08 0.00 0.01 0.00 0.00 42.46 40.22 2ris s ILE 190 CO 0.59 0.53 1.03 -0.54 0.00 0.00 0.00 174.94 176.55 2ris s LYS 191 N 0.40 3.76 -0.08 2.79 1.02 -1.26 -4.45 119.74 121.93 2ris s LYS 191 Ca -0.12 1.25 0.05 0.00 0.02 0.00 0.00 55.97 57.17 2ris s LYS 191 Cb -0.16 -2.10 -0.01 0.00 -0.52 0.00 0.00 37.83 35.04 2ris s LYS 191 CO 0.06 -0.45 -0.24 0.42 -0.92 0.00 0.00 175.35 174.22 2ris s ILE 192 N -2.18 2.12 0.32 2.17 -1.09 -1.26 -1.02 121.20 120.26 2ris s ILE 192 Ca 0.65 -1.02 0.03 0.00 -2.23 0.00 0.00 60.65 58.08 2ris s ILE 192 Cb -0.15 -1.79 -0.05 0.00 -1.58 0.00 0.00 42.46 38.90 2ris s ILE 192 CO 0.24 0.56 0.09 0.27 -1.23 0.00 0.00 174.94 174.88 2ris s ILE 193 N 0.08 0.80 0.09 2.92 -4.36 -0.11 -0.37 121.20 120.26 2ris s ILE 193 Ca -0.11 -2.00 0.04 0.00 -0.26 0.00 0.00 60.65 58.32 2ris s ILE 193 Cb -0.16 -2.63 -0.03 0.00 1.25 0.00 0.00 42.46 40.89 2ris s ILE 193 CO 0.06 0.00 -0.10 0.54 0.24 0.00 0.00 174.94 175.68 2ris s ASN 194 N -3.45 1.42 0.18 4.36 4.22 -1.26 -1.51 114.94 118.91 2ris s ASN 194 Ca 0.34 -0.77 -0.12 0.00 -2.14 0.00 0.00 52.86 50.17 2ris s ASN 194 Cb 0.07 0.01 0.10 0.00 1.28 0.00 0.00 41.25 42.70 2ris s ASN 194 CO 0.15 -0.24 1.78 0.40 -2.04 0.00 0.00 177.10 177.15 2ris h ILE 195 N 3.70 1.21 -0.67 0.54 1.08 -0.17 -1.45 117.51 121.75 2ris h ILE 195 Ca -0.37 -0.57 0.08 0.00 -0.39 0.00 0.00 64.86 63.60 2ris h ILE 195 Cb 1.19 0.41 -0.06 0.00 -3.07 0.00 0.00 36.82 35.29 2ris h ILE 195 CO 0.51 0.24 0.34 -1.13 -0.69 0.00 0.00 178.15 177.42 2ris h ASN 196 N 0.88 0.47 -0.79 1.72 -1.24 -1.59 0.17 115.58 115.20 2ris h ASN 196 Ca 0.22 0.05 0.03 0.00 0.71 0.00 0.00 56.30 57.31 2ris h ASN 196 Cb 0.08 -0.04 -0.05 0.00 0.73 0.00 0.00 38.32 39.05 2ris h ASN 196 CO -0.03 0.29 0.50 -0.61 -1.29 0.00 0.00 177.43 176.29 2ris h GLN 197 N 0.61 0.96 -0.47 6.67 4.15 -1.74 -0.47 115.11 124.83 2ris h GLN 197 Ca 0.32 -0.06 -0.13 0.00 0.77 0.00 0.00 58.65 59.55 2ris h GLN 197 Cb 0.28 -0.22 -0.01 0.00 0.21 0.00 0.00 27.48 27.74 2ris h GLN 197 CO -0.23 0.64 -0.20 1.25 -1.93 0.00 0.00 178.83 178.36 2ris h LEU 198 N 0.99 0.98 -0.76 -2.39 5.85 -0.20 -2.34 115.31 117.45 2ris h LEU 198 Ca 0.31 -0.39 -0.04 0.00 0.84 0.00 0.00 57.88 58.60 2ris h LEU 198 Cb -0.00 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.72 2ris h LEU 198 CO -0.11 1.16 0.31 0.58 -0.34 0.00 0.00 178.44 180.04 2ris h VAL 199 N 0.81 1.25 -0.69 1.05 2.07 -0.35 -1.93 116.25 118.46 2ris h VAL 199 Ca 0.11 -0.79 0.04 0.00 0.82 0.00 0.00 66.70 66.88 2ris h VAL 199 Cb 0.77 0.35 -0.05 0.00 -1.52 0.00 0.00 31.29 30.85 2ris h VAL 199 CO 0.06 0.32 0.42 -0.33 0.02 0.00 0.00 177.57 178.06 2ris h GLU 200 N 1.09 0.78 -0.17 1.57 5.08 -0.97 -1.63 114.58 120.33 2ris h GLU 200 Ca 0.25 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.56 2ris h GLU 200 Cb 0.20 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 2ris h GLU 200 CO -0.02 0.52 0.09 -0.92 -1.00 0.00 0.00 179.01 177.67 2ris h TYR 201 N 0.80 0.24 0.00 4.33 3.20 -0.97 -2.84 116.97 121.74 2ris h TYR 201 Ca 0.28 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.15 2ris h TYR 201 Cb 0.07 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.26 2ris h TYR 201 CO -0.05 0.25 0.00 0.44 -1.64 0.00 0.00 178.16 177.16 2ris n ILE 202 N -4.90 0.25 -3.49 1.81 -5.35 -0.77 -4.85 119.36 102.05 2ris n ILE 202 Ca -0.04 0.06 -0.21 0.00 -0.27 0.00 0.00 62.75 62.29 2ris n ILE 202 Cb 0.08 -0.63 -0.01 0.00 -1.74 0.00 0.00 39.64 37.34 2ris n ILE 202 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 2ris s SER 203 N -2.89 5.04 0.00 7.28 0.01 -0.63 -5.09 113.70 117.42 2ris s SER 203 Ca 0.15 -0.83 0.00 0.00 1.31 0.00 0.00 55.95 56.59 2ris s SER 203 Cb 0.17 -0.25 0.00 0.00 0.21 0.00 0.00 66.02 66.14 2ris s SER 203 CO 0.44 -0.86 0.00 0.29 0.41 0.00 0.00 173.24 173.53