#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o5a s ILE 17 N 0.00 5.20 0.00 1.39 -1.09 -0.46 -3.94 121.20 122.30 1o5a s ILE 17 Ca 0.00 0.80 0.00 0.00 -2.23 0.00 0.00 60.65 59.22 1o5a s ILE 17 Cb 0.00 -3.76 0.00 0.00 -1.58 0.00 0.00 42.46 37.12 1o5a s ILE 17 CO 0.00 0.28 0.00 0.61 -1.23 0.00 0.00 174.94 174.60 1o5a n GLY 18 N 3.64 -0.59 4.18 6.18 0.00 -1.26 -2.57 105.19 114.77 1o5a n GLY 18 Ca -0.08 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 44.82 1o5a n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o5a n GLY 19 N 0.00 -2.09 3.28 -0.02 0.00 -1.26 -4.87 105.19 100.23 1o5a n GLY 19 Ca 0.00 -1.64 -0.15 0.00 0.00 0.00 0.00 46.02 44.23 1o5a n GLY 19 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1o5a s GLU 20 N -0.12 1.17 0.20 1.61 8.01 -0.40 -4.96 118.70 124.21 1o5a s GLU 20 Ca 0.00 -1.55 -0.15 0.00 0.01 0.00 0.00 54.97 53.27 1o5a s GLU 20 Cb 0.00 -0.53 -0.08 0.00 -4.31 0.00 0.00 34.13 29.21 1o5a s GLU 20 CO 0.00 -0.04 0.62 -0.06 0.01 0.00 0.00 175.26 175.79 1o5a s PHE 21 N -3.44 3.57 0.00 1.61 0.40 -1.26 -1.64 117.98 117.22 1o5a s PHE 21 Ca 0.23 1.15 0.00 0.00 -0.60 0.00 0.00 56.93 57.71 1o5a s PHE 21 Cb 0.05 -2.45 0.00 0.00 0.51 0.00 0.00 43.02 41.13 1o5a s PHE 21 CO 0.04 0.35 0.00 0.25 0.70 0.00 0.00 175.22 176.56 1o5a n THR 22 N 0.55 0.00 -4.33 0.64 -2.24 -0.02 -4.89 114.28 103.99 1o5a n THR 22 Ca -0.03 0.00 -0.18 0.00 -2.27 0.00 0.00 64.05 61.58 1o5a n THR 22 Cb 0.52 0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.65 1o5a n THR 22 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1o5a s THR 23 N -1.70 1.59 0.59 4.28 -4.23 -1.26 -4.31 115.64 110.59 1o5a s THR 23 Ca 0.00 -2.17 0.35 0.00 -1.18 0.00 0.00 61.69 58.69 1o5a s THR 23 Cb 0.00 -2.02 0.38 0.00 1.34 0.00 0.00 72.50 72.20 1o5a s THR 23 CO 0.00 -0.62 2.28 -0.29 -0.54 0.00 0.00 174.62 175.45 1o5a h ILE 24 N 2.60 0.33 0.00 2.99 6.09 -1.88 -1.51 117.51 126.12 1o5a h ILE 24 Ca -0.38 -0.07 -0.00 0.00 -1.37 0.00 0.00 64.86 63.04 1o5a h ILE 24 Cb 1.21 1.05 -0.00 0.00 0.47 0.00 0.00 36.82 39.55 1o5a h ILE 24 CO 0.63 0.01 -0.01 -0.33 -3.07 0.00 0.00 178.15 175.38 1o5a h GLU 25 N 0.00 0.00 -0.01 2.19 3.07 -1.87 0.70 114.58 118.67 1o5a h GLU 25 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1o5a h GLU 25 Cb 0.05 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.96 1o5a h GLU 25 CO 0.00 0.01 -0.27 0.09 -1.40 0.00 0.00 179.01 177.43 1o5a n ASN 26 N -3.13 1.15 -2.89 1.42 3.02 -0.57 -4.35 115.26 109.91 1o5a n ASN 26 Ca -0.02 -0.98 -0.12 0.00 -0.03 0.00 0.00 54.58 53.43 1o5a n ASN 26 Cb 0.15 0.17 0.03 0.00 -0.61 0.00 0.00 39.78 39.52 1o5a n ASN 26 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1o5a n GLN 27 N -0.56 1.05 0.00 3.52 1.13 0.15 -5.02 117.38 117.66 1o5a n GLN 27 Ca 0.12 -2.77 0.06 0.00 -1.94 0.00 0.00 57.00 52.47 1o5a n GLN 27 Cb 0.36 -1.19 0.30 0.00 0.11 0.00 0.00 30.24 29.82 1o5a n GLN 27 CO 0.00 0.00 0.00 -0.35 -1.44 0.00 0.00 177.06 175.27 1o5a n PRO 28 N 0.09 0.16 0.00 -1.09 -0.04 -0.63 -1.06 135.00 132.43 1o5a n PRO 28 Ca 0.13 0.18 0.11 0.00 -0.04 0.00 0.00 63.50 63.88 1o5a n PRO 28 Cb 0.73 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.76 1o5a n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1o5a n TRP 29 N -1.30 0.00 -2.11 0.54 2.14 -1.21 -1.25 117.44 114.25 1o5a n TRP 29 Ca 0.05 0.00 -0.41 0.00 2.07 0.00 0.00 57.50 59.21 1o5a n TRP 29 Cb 0.10 -0.11 -0.03 0.00 -0.81 0.00 0.00 31.31 30.46 1o5a n TRP 29 CO 0.00 0.00 0.00 0.12 2.07 0.00 0.00 177.69 179.88 1o5a s PHE 30 N -2.95 3.13 -0.02 -2.67 2.19 -0.22 -1.06 117.98 116.37 1o5a s PHE 30 Ca 0.11 1.14 0.08 0.00 0.33 0.00 0.00 56.93 58.58 1o5a s PHE 30 Cb 0.17 -3.71 -0.02 0.00 -1.31 0.00 0.00 43.02 38.14 1o5a s PHE 30 CO 0.77 -2.27 -0.26 0.00 1.83 0.00 0.00 175.22 175.29 1o5a s ALA 31 N -0.04 2.13 -0.20 11.12 0.00 -0.63 -4.39 121.76 129.75 1o5a s ALA 31 Ca 0.57 -1.10 -0.03 0.00 0.00 0.00 0.00 51.96 51.40 1o5a s ALA 31 Cb -0.39 -0.55 -0.01 0.00 0.00 0.00 0.00 23.12 22.17 1o5a s ALA 31 CO 0.42 0.52 -0.05 0.00 0.00 0.00 0.00 175.76 176.65 1o5a s ALA 32 N -0.58 2.84 -0.12 0.00 0.00 -0.74 -1.02 121.76 122.14 1o5a s ALA 32 Ca 0.09 -1.06 -0.01 0.00 0.00 0.00 0.00 51.96 50.98 1o5a s ALA 32 Cb -0.10 -1.63 -0.02 0.00 0.00 0.00 0.00 23.12 21.37 1o5a s ALA 32 CO -0.01 -0.21 -0.08 0.42 0.00 0.00 0.00 175.76 175.88 1o5a s ILE 33 N 1.11 3.53 0.27 0.00 1.01 -0.52 -1.50 121.20 125.10 1o5a s ILE 33 Ca 0.01 -0.50 0.06 0.00 0.00 0.00 0.00 60.65 60.23 1o5a s ILE 33 Cb -0.15 -2.50 -0.06 0.00 0.01 0.00 0.00 42.46 39.77 1o5a s ILE 33 CO -0.00 0.53 -0.06 -0.31 0.00 0.00 0.00 174.94 175.09 1o5a s TYR 34 N 0.06 1.89 -0.02 3.97 2.02 -0.53 -0.42 117.35 124.33 1o5a s TYR 34 Ca -0.02 -0.70 0.07 0.00 -0.37 0.00 0.00 57.07 56.04 1o5a s TYR 34 Cb -0.14 -1.06 -0.02 0.00 -0.40 0.00 0.00 41.96 40.34 1o5a s TYR 34 CO 0.03 0.26 -0.23 0.50 -1.57 0.00 0.00 175.55 174.55 1o5a s ARG 35 N -3.73 1.86 0.18 -0.62 3.52 0.11 -1.55 118.95 118.72 1o5a s ARG 35 Ca 0.29 -0.82 -0.11 0.00 -0.13 0.00 0.00 55.73 54.96 1o5a s ARG 35 Cb 0.03 -1.79 -0.07 0.00 -1.56 0.00 0.00 34.95 31.56 1o5a s ARG 35 CO 0.11 0.49 0.53 1.03 -0.81 0.00 0.00 175.30 176.65 1o5a s ARG 36 N -0.53 3.85 0.26 5.12 0.52 -0.08 -0.10 118.95 128.00 1o5a s ARG 36 Ca 0.09 0.33 0.09 0.00 -0.52 0.00 0.00 55.73 55.71 1o5a s ARG 36 Cb -0.09 -2.79 -0.05 0.00 0.52 0.00 0.00 34.95 32.54 1o5a s ARG 36 CO -0.01 0.40 -0.13 -1.01 0.02 0.00 0.00 175.30 174.58 1o5a s HIS 37 N -1.65 2.02 -0.97 -0.53 3.76 -0.16 -4.95 115.29 112.81 1o5a s HIS 37 Ca 0.42 -0.54 -0.17 0.00 -0.15 0.00 0.00 55.06 54.62 1o5a s HIS 37 Cb -0.13 -1.01 0.15 0.00 1.11 0.00 0.00 32.58 32.69 1o5a s HIS 37 CO 0.20 0.45 1.16 1.03 -0.85 0.00 0.00 174.74 176.73 1o5a s ARG 37 N -3.63 3.69 0.60 1.40 0.52 -1.26 -4.34 118.95 115.93 1o5a s ARG 37 Ca 0.28 -1.97 0.32 0.00 -0.52 0.00 0.00 55.73 53.83 1o5a s ARG 37 Cb -0.00 -4.91 1.90 0.00 0.52 0.00 0.00 34.95 32.46 1o5a s ARG 37 CO 0.12 -1.73 2.27 0.78 0.02 0.00 0.00 175.30 176.75 1o5a h GLY 37 N 10.06 0.00 -2.20 -3.53 0.00 -2.03 -3.53 103.07 101.84 1o5a h GLY 37 Ca 0.18 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 47.02 1o5a h GLY 37 CO 1.11 0.00 0.10 -1.35 0.00 0.00 0.00 176.54 176.40 1o5a s SER 37 N -6.04 6.34 -0.04 0.19 1.04 -1.26 -5.06 113.70 108.87 1o5a s SER 37 Ca -0.05 0.98 0.06 0.00 0.48 0.00 0.00 55.95 57.41 1o5a s SER 37 Cb 0.15 -2.26 -0.01 0.00 0.10 0.00 0.00 66.02 63.99 1o5a s SER 37 CO 0.53 -0.51 -0.21 0.68 0.98 0.00 0.00 173.24 174.71 1o5a s VAL 38 N -2.61 1.72 0.21 5.02 -7.23 -1.26 -0.98 120.40 115.28 1o5a s VAL 38 Ca 0.48 -0.90 0.11 0.00 -1.81 0.00 0.00 61.98 59.87 1o5a s VAL 38 Cb -0.10 -1.46 -0.05 0.00 0.56 0.00 0.00 36.38 35.33 1o5a s VAL 38 CO 0.40 0.49 -0.22 0.42 -0.31 0.00 0.00 175.10 175.88 1o5a s THR 39 N -0.18 2.31 0.34 5.32 -4.23 0.85 -4.86 115.64 115.19 1o5a s THR 39 Ca -0.00 -2.12 -0.27 0.00 -1.18 0.00 0.00 61.69 58.12 1o5a s THR 39 Cb -0.11 -2.13 -0.09 0.00 1.34 0.00 0.00 72.50 71.50 1o5a s THR 39 CO 0.02 -0.22 1.07 -0.47 -0.54 0.00 0.00 174.62 174.48 1o5a s TYR 40 N -1.95 3.44 0.00 3.99 5.04 -1.26 0.04 117.35 126.65 1o5a s TYR 40 Ca 0.22 1.68 -0.02 0.00 -2.44 0.00 0.00 57.07 56.51 1o5a s TYR 40 Cb -0.07 -3.19 -0.01 0.00 0.35 0.00 0.00 41.96 39.04 1o5a s TYR 40 CO 0.11 -0.55 -0.05 0.28 -1.34 0.00 0.00 175.55 174.00 1o5a n VAL 41 N 0.58 0.52 -3.97 3.14 0.31 0.44 -4.82 118.33 114.53 1o5a n VAL 41 Ca 0.02 0.23 -0.11 0.00 -0.01 0.00 0.00 64.34 64.47 1o5a n VAL 41 Cb 0.47 -1.44 -0.03 0.00 -0.91 0.00 0.00 33.84 31.94 1o5a n VAL 41 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1o5a s GLY 43 N -3.10 1.80 0.26 0.00 0.00 -0.50 -1.44 107.32 104.34 1o5a s GLY 43 Ca 0.22 -1.54 -0.20 0.00 0.00 0.00 0.00 44.72 43.21 1o5a s GLY 43 CO 0.13 -1.14 0.95 -0.32 0.00 0.00 0.00 173.10 172.72 1o5a s GLY 44 N -4.56 0.23 0.01 0.20 0.00 -0.19 -3.63 107.32 99.37 1o5a s GLY 44 Ca 0.61 -0.51 -0.01 0.00 0.00 0.00 0.00 44.72 44.81 1o5a s GLY 44 CO 0.41 1.47 0.01 -0.56 0.00 0.00 0.00 173.10 174.42 1o5a s SER 45 N -3.30 0.12 -0.25 1.64 0.01 -0.19 -1.60 113.70 110.13 1o5a s SER 45 Ca 0.20 -0.27 -0.21 0.00 1.31 0.00 0.00 55.95 56.98 1o5a s SER 45 Cb -0.04 0.09 -0.02 0.00 0.21 0.00 0.00 66.02 66.27 1o5a s SER 45 CO 0.08 -0.20 0.68 -0.22 0.41 0.00 0.00 173.24 173.99 1o5a s LEU 46 N -0.89 4.07 -0.24 2.44 2.96 -0.22 -0.70 118.68 126.09 1o5a s LEU 46 Ca -0.10 0.79 0.07 0.00 -0.22 0.00 0.00 54.13 54.67 1o5a s LEU 46 Cb -0.06 -2.94 -0.20 0.00 0.50 0.00 0.00 46.19 43.49 1o5a s LEU 46 CO -0.00 -0.41 -0.12 0.23 -1.32 0.00 0.00 176.35 174.73 1o5a n MET 47 N 5.79 0.66 -4.13 1.98 2.81 -0.30 -1.41 117.12 122.52 1o5a n MET 47 Ca 0.01 0.10 -0.11 0.00 -1.81 0.00 0.00 57.70 55.90 1o5a n MET 47 Cb 0.49 -1.53 -0.09 0.00 -0.71 0.00 0.00 33.22 31.38 1o5a n MET 47 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 1o5a s SER 48 N -6.21 0.12 0.32 7.83 1.04 -1.19 -4.58 113.70 111.03 1o5a s SER 48 Ca -0.27 -1.21 0.09 0.00 0.48 0.00 0.00 55.95 55.04 1o5a s SER 48 Cb 0.08 0.41 0.89 0.00 0.10 0.00 0.00 66.02 67.50 1o5a s SER 48 CO 0.68 -0.89 1.71 -0.65 0.98 0.00 0.00 173.24 175.07 1o5a h PRO 49 N 2.58 0.47 -0.19 4.02 0.11 -1.95 -2.32 132.00 134.72 1o5a h PRO 49 Ca -0.33 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.75 1o5a h PRO 49 Cb 1.24 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1o5a h PRO 49 CO 0.50 0.31 0.00 0.00 -0.21 0.00 0.00 178.00 178.60 1o5a s TRP 51 N -1.31 1.79 -0.00 0.00 0.52 -0.87 -1.56 118.94 117.51 1o5a s TRP 51 Ca 0.25 -0.66 0.05 0.00 0.02 0.00 0.00 56.10 55.76 1o5a s TRP 51 Cb 0.16 -1.25 -0.03 0.00 -1.15 0.00 0.00 33.47 31.20 1o5a s TRP 51 CO 0.23 -0.29 -0.15 0.08 0.02 0.00 0.00 176.95 176.84 1o5a s VAL 52 N 0.46 3.03 -0.04 4.03 1.01 -0.30 -1.15 120.40 127.43 1o5a s VAL 52 Ca -0.14 -0.92 0.06 0.00 0.00 0.00 0.00 61.98 60.98 1o5a s VAL 52 Cb -0.16 -2.24 -0.02 0.00 0.00 0.00 0.00 36.38 33.96 1o5a s VAL 52 CO 0.05 0.46 -0.21 -0.51 0.00 0.00 0.00 175.10 174.88 1o5a s ILE 53 N -0.85 2.44 0.00 2.22 2.07 0.12 -1.09 121.20 126.11 1o5a s ILE 53 Ca 0.14 -0.96 0.00 0.00 -1.41 0.00 0.00 60.65 58.42 1o5a s ILE 53 Cb -0.11 -1.90 0.00 0.00 0.13 0.00 0.00 42.46 40.59 1o5a s ILE 53 CO 0.04 0.58 0.00 -0.24 -1.91 0.00 0.00 174.94 173.41 1o5a n SER 54 N 2.46 0.00 -4.43 4.50 2.88 -0.34 -1.03 113.62 117.66 1o5a n SER 54 Ca -0.17 0.00 -0.33 0.00 -1.33 0.00 0.00 58.87 57.04 1o5a n SER 54 Cb 0.52 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.84 1o5a n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1o5a s ALA 55 N -1.61 2.71 0.35 -1.46 0.00 -1.26 -0.66 121.76 119.83 1o5a s ALA 55 Ca 0.00 -0.90 0.06 0.00 0.00 0.00 0.00 51.96 51.12 1o5a s ALA 55 Cb 0.00 -1.20 0.73 0.00 0.00 0.00 0.00 23.12 22.65 1o5a s ALA 55 CO 0.00 0.35 1.93 1.15 0.00 0.00 0.00 175.76 179.19 1o5a h THR 56 N 5.01 0.99 0.00 0.00 2.02 -1.74 -1.79 112.91 117.41 1o5a h THR 56 Ca -0.33 -0.27 0.00 0.00 0.77 0.00 0.00 66.41 66.58 1o5a h THR 56 Cb 1.19 0.14 0.00 0.00 -1.74 0.00 0.00 68.15 67.74 1o5a h THR 56 CO 0.55 0.14 0.00 1.12 0.37 0.00 0.00 175.52 177.70 1o5a h HIS 57 N 0.78 0.00 0.00 3.16 2.07 -1.92 -0.69 115.15 118.55 1o5a h HIS 57 Ca 0.35 0.00 -0.10 0.00 -2.85 0.00 0.00 60.37 57.77 1o5a h HIS 57 Cb 0.35 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.32 1o5a h HIS 57 CO -0.00 0.00 -0.46 0.00 -3.07 0.00 0.00 177.93 174.40 1o5a n PHE 59 N -3.67 0.00 -0.24 0.00 3.72 -0.60 -4.77 117.46 111.91 1o5a n PHE 59 Ca -0.01 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.45 1o5a n PHE 59 Cb 0.54 -0.47 0.13 0.00 -0.94 0.00 0.00 39.48 38.73 1o5a n PHE 59 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 1o5a n ILE 60 N -2.27 -0.28 1.66 4.37 2.08 -0.37 -0.32 119.36 124.24 1o5a n ILE 60 Ca -0.13 1.50 0.15 0.00 0.56 0.00 0.00 62.75 64.82 1o5a n ILE 60 Cb 0.70 -2.11 0.73 0.00 -0.75 0.00 0.00 39.64 38.21 1o5a n ILE 60 CO 0.00 0.00 0.00 0.47 0.56 0.00 0.00 176.55 177.58 1o5a n ASP 60 N -5.01 0.47 -2.93 4.38 10.43 -1.26 -4.28 116.55 118.35 1o5a n ASP 60 Ca 0.12 -0.90 -0.14 0.00 2.57 0.00 0.00 54.79 56.44 1o5a n ASP 60 Cb 0.39 -0.04 0.02 0.00 1.84 0.00 0.00 41.12 43.33 1o5a n ASP 60 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1o5a n TYR 60 N -0.76 -1.76 -0.27 1.24 4.19 0.57 -5.02 117.16 115.34 1o5a n TYR 60 Ca 0.19 -2.73 0.00 0.00 3.31 0.00 0.00 57.90 58.67 1o5a n TYR 60 Cb 0.23 0.75 0.00 0.00 0.49 0.00 0.00 39.34 40.80 1o5a n TYR 60 CO 0.00 0.00 0.00 -0.35 0.91 0.00 0.00 176.86 177.42 1o5a n PRO 60 N 0.81 0.81 -3.26 2.98 -0.04 -1.07 -4.72 135.00 130.51 1o5a n PRO 60 Ca 0.14 0.00 -0.46 0.00 -0.04 0.00 0.00 63.50 63.14 1o5a n PRO 60 Cb 0.64 -1.09 -0.02 0.00 -0.04 0.00 0.00 33.50 32.99 1o5a n PRO 60 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1o5a s LYS 61 N 0.35 3.62 0.33 0.54 -0.14 -1.26 -4.93 119.74 118.26 1o5a s LYS 61 Ca 0.00 -2.36 0.13 0.00 -1.36 0.00 0.00 55.97 52.38 1o5a s LYS 61 Cb 0.00 -4.52 1.02 0.00 -1.68 0.00 0.00 37.83 32.65 1o5a s LYS 61 CO 0.00 -1.38 1.69 1.57 -0.76 0.00 0.00 175.35 176.47 1o5a h LYS 62 N 7.94 0.41 -0.02 1.68 2.10 -1.92 -0.79 116.57 125.97 1o5a h LYS 62 Ca 0.12 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.75 1o5a h LYS 62 Cb 1.03 -0.09 -0.00 0.00 -0.90 0.00 0.00 32.23 32.27 1o5a h LYS 62 CO 0.82 0.27 0.14 0.93 -2.00 0.00 0.00 179.45 179.60 1o5a h GLU 62 N 0.42 0.00 -0.63 0.07 3.07 -1.92 -1.64 114.58 113.95 1o5a h GLU 62 Ca 0.70 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.56 1o5a h GLU 62 Cb 1.52 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.43 1o5a h GLU 62 CO -0.56 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 176.80 1o5a n ASP 63 N -3.10 3.64 -4.67 1.42 9.92 -0.30 -4.92 116.55 118.54 1o5a n ASP 63 Ca -0.02 -2.15 -0.29 0.00 -0.53 0.00 0.00 54.79 51.80 1o5a n ASP 63 Cb 0.20 -0.46 -0.08 0.00 -0.64 0.00 0.00 41.12 40.14 1o5a n ASP 63 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 1o5a s TYR 64 N -1.41 2.93 -0.00 1.24 1.51 -0.62 -0.90 117.35 120.10 1o5a s TYR 64 Ca 0.42 -0.06 0.04 0.00 -1.01 0.00 0.00 57.07 56.46 1o5a s TYR 64 Cb 0.24 -1.50 -0.01 0.00 -0.11 0.00 0.00 41.96 40.58 1o5a s TYR 64 CO 0.25 0.48 -0.14 0.42 -1.11 0.00 0.00 175.55 175.46 1o5a s ILE 65 N -1.36 1.08 -0.04 2.71 -1.09 -0.59 -4.31 121.20 117.59 1o5a s ILE 65 Ca 0.25 -0.64 0.07 0.00 -2.23 0.00 0.00 60.65 58.10 1o5a s ILE 65 Cb -0.11 -0.91 -0.01 0.00 -1.58 0.00 0.00 42.46 39.84 1o5a s ILE 65 CO 0.18 0.26 -0.24 -0.69 -1.23 0.00 0.00 174.94 173.21 1o5a s VAL 66 N -0.40 1.95 0.01 2.92 1.01 -0.83 -1.45 120.40 123.62 1o5a s VAL 66 Ca 0.05 -1.03 0.06 0.00 0.00 0.00 0.00 61.98 61.06 1o5a s VAL 66 Cb -0.06 -1.64 -0.02 0.00 0.00 0.00 0.00 36.38 34.67 1o5a s VAL 66 CO -0.00 0.55 -0.19 -0.31 0.00 0.00 0.00 175.10 175.15 1o5a s TYR 67 N -0.33 1.66 0.18 5.22 2.02 -0.56 0.07 117.35 125.61 1o5a s TYR 67 Ca 0.02 -0.33 0.10 0.00 -0.37 0.00 0.00 57.07 56.48 1o5a s TYR 67 Cb -0.12 -1.03 -0.04 0.00 -0.40 0.00 0.00 41.96 40.37 1o5a s TYR 67 CO 0.02 0.02 -0.20 -0.51 -1.57 0.00 0.00 175.55 173.30 1o5a s LEU 68 N -0.73 2.44 -0.57 -1.29 1.43 -0.41 -1.79 118.68 117.75 1o5a s LEU 68 Ca 0.07 -0.86 0.00 0.00 -1.03 0.00 0.00 54.13 52.30 1o5a s LEU 68 Cb -0.08 -0.96 0.00 0.00 0.03 0.00 0.00 46.19 45.19 1o5a s LEU 68 CO 0.00 0.02 0.00 0.61 0.23 0.00 0.00 176.35 177.22 1o5a n GLY 69 N 0.28 0.27 3.52 -3.19 0.00 -1.25 -0.97 105.19 103.85 1o5a n GLY 69 Ca -0.13 -0.65 -0.35 0.00 0.00 0.00 0.00 46.02 44.88 1o5a n GLY 69 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1o5a s ARG 70 N -3.93 3.76 -0.01 1.61 0.52 -1.26 -3.92 118.95 115.73 1o5a s ARG 70 Ca 0.00 -0.44 0.22 0.00 -0.52 0.00 0.00 55.73 54.99 1o5a s ARG 70 Cb 0.00 -3.21 -0.30 0.00 0.52 0.00 0.00 34.95 31.96 1o5a s ARG 70 CO 0.00 0.04 0.57 0.43 0.02 0.00 0.00 175.30 176.36 1o5a n SER 71 N 4.22 0.15 -4.38 0.23 7.64 -1.26 -4.58 113.62 115.64 1o5a n SER 71 Ca -0.16 -0.04 -0.26 0.00 1.01 0.00 0.00 58.87 59.41 1o5a n SER 71 Cb 0.52 1.77 -0.12 0.00 -1.01 0.00 0.00 64.21 65.37 1o5a n SER 71 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1o5a s ARG 72 N -3.46 1.39 -0.02 1.43 0.52 -1.26 -1.92 118.95 115.62 1o5a s ARG 72 Ca -0.06 -1.42 -0.23 0.00 -0.52 0.00 0.00 55.73 53.49 1o5a s ARG 72 Cb 0.14 -1.67 -0.17 0.00 0.52 0.00 0.00 34.95 33.77 1o5a s ARG 72 CO 0.89 0.37 1.08 1.25 0.02 0.00 0.00 175.30 178.91 1o5a h LEU 73 N 3.43 -0.20 -1.27 2.53 5.85 -1.02 -3.40 115.31 121.23 1o5a h LEU 73 Ca -0.46 -0.32 0.00 0.00 0.84 0.00 0.00 57.88 57.94 1o5a h LEU 73 Cb 1.20 0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.28 1o5a h LEU 73 CO 0.46 0.27 0.00 0.59 -0.34 0.00 0.00 178.44 179.42 1o5a n ASN 74 N -4.98 1.50 -4.79 1.25 3.02 -1.26 -5.00 115.26 105.00 1o5a n ASN 74 Ca -0.08 -1.26 -0.22 0.00 -0.03 0.00 0.00 54.58 52.98 1o5a n ASN 74 Cb 0.26 -0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.38 1o5a n ASN 74 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1o5a s SER 75 N -0.49 4.96 0.46 6.41 0.01 -1.26 -5.11 113.70 118.68 1o5a s SER 75 Ca 0.07 -0.64 -0.02 0.00 1.31 0.00 0.00 55.95 56.66 1o5a s SER 75 Cb 0.05 -0.84 -0.02 0.00 0.21 0.00 0.00 66.02 65.42 1o5a s SER 75 CO 0.07 -0.32 0.72 0.20 0.41 0.00 0.00 173.24 174.32 1o5a s ASN 76 N -3.91 6.00 0.04 2.44 -0.87 -1.26 -4.62 114.94 112.76 1o5a s ASN 76 Ca 0.39 0.57 0.08 0.00 -1.57 0.00 0.00 52.86 52.33 1o5a s ASN 76 Cb -0.04 -1.86 -0.03 0.00 -0.02 0.00 0.00 41.25 39.30 1o5a s ASN 76 CO 0.24 -0.65 -0.22 -0.89 -2.57 0.00 0.00 177.10 173.01 1o5a s THR 77 N -2.63 1.81 0.17 1.60 2.01 -1.26 -4.90 115.64 112.45 1o5a s THR 77 Ca 0.47 -1.25 -0.30 0.00 0.31 0.00 0.00 61.69 60.92 1o5a s THR 77 Cb -0.10 -1.57 -0.07 0.00 0.01 0.00 0.00 72.50 70.77 1o5a s THR 77 CO 0.41 0.26 1.08 -1.58 -0.69 0.00 0.00 174.62 174.10 1o5a s GLN 78 N -1.18 4.61 0.00 4.92 2.00 -1.26 -2.77 119.66 125.99 1o5a s GLN 78 Ca 0.09 1.68 0.00 0.00 -2.00 0.00 0.00 55.36 55.13 1o5a s GLN 78 Cb -0.09 -3.29 0.00 0.00 0.80 0.00 0.00 33.01 30.43 1o5a s GLN 78 CO 0.02 0.11 0.00 0.41 -0.50 0.00 0.00 175.29 175.32 1o5a n GLY 79 N 2.04 2.36 3.65 2.59 0.00 -1.26 -5.03 105.19 109.54 1o5a n GLY 79 Ca 0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 1o5a n GLY 79 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1o5a n GLU 80 N -1.93 0.15 -4.90 1.61 0.28 -1.11 -4.80 120.64 109.94 1o5a n GLU 80 Ca 0.00 0.12 -0.26 0.00 -0.16 0.00 0.00 57.16 56.86 1o5a n GLU 80 Cb 0.00 -2.34 -0.16 0.00 1.43 0.00 0.00 31.44 30.37 1o5a n GLU 80 CO 0.00 0.00 0.00 -1.64 -0.16 0.00 0.00 177.13 175.33 1o5a s MET 81 N -3.96 1.62 -0.08 3.44 -1.94 -0.15 -4.96 119.30 113.27 1o5a s MET 81 Ca 0.71 -0.66 -0.00 0.00 -1.71 0.00 0.00 55.69 54.03 1o5a s MET 81 Cb -0.29 -1.51 -0.03 0.00 2.01 0.00 0.00 34.83 35.01 1o5a s MET 81 CO 0.53 0.36 -0.05 0.21 -0.01 0.00 0.00 175.02 176.05 1o5a s LYS 82 N -0.29 2.90 0.09 2.03 2.20 -1.26 -1.29 119.74 124.13 1o5a s LYS 82 Ca 0.04 -0.51 0.01 0.00 -0.36 0.00 0.00 55.97 55.14 1o5a s LYS 82 Cb -0.09 -2.67 -0.04 0.00 -1.51 0.00 0.00 37.83 33.52 1o5a s LYS 82 CO 0.00 0.63 -0.05 -0.06 -0.36 0.00 0.00 175.35 175.51 1o5a s PHE 83 N -0.70 0.83 0.24 4.03 0.08 0.11 -4.59 117.98 117.98 1o5a s PHE 83 Ca 0.11 -0.97 0.07 0.00 0.12 0.00 0.00 56.93 56.26 1o5a s PHE 83 Cb -0.11 -0.50 -0.04 0.00 -0.57 0.00 0.00 43.02 41.80 1o5a s PHE 83 CO 0.02 -0.22 0.14 -1.21 -0.10 0.00 0.00 175.22 173.85 1o5a s GLU 84 N -3.87 2.79 -0.43 0.44 8.01 -0.15 -1.96 118.70 123.52 1o5a s GLU 84 Ca 0.12 -1.10 -0.16 0.00 0.01 0.00 0.00 54.97 53.84 1o5a s GLU 84 Cb 0.06 -2.49 0.03 0.00 -4.31 0.00 0.00 34.13 27.42 1o5a s GLU 84 CO -0.05 0.41 0.39 0.08 0.01 0.00 0.00 175.26 176.10 1o5a s VAL 85 N -2.10 5.17 -0.06 2.63 1.01 -1.26 -1.21 120.40 124.58 1o5a s VAL 85 Ca 0.32 -0.63 -0.24 0.00 0.00 0.00 0.00 61.98 61.42 1o5a s VAL 85 Cb -0.08 -4.04 -0.25 0.00 0.00 0.00 0.00 36.38 32.01 1o5a s VAL 85 CO 0.24 -0.44 0.97 -0.08 0.00 0.00 0.00 175.10 175.79 1o5a h GLU 86 N 8.72 0.20 -4.96 2.72 4.81 -0.32 -3.43 114.58 122.31 1o5a h GLU 86 Ca -0.27 -0.24 -0.43 0.00 -0.13 0.00 0.00 59.36 58.28 1o5a h GLU 86 Cb 1.11 0.08 -0.29 0.00 0.63 0.00 0.00 28.75 30.28 1o5a h GLU 86 CO 0.80 1.01 -0.79 -0.80 -0.73 0.00 0.00 179.01 178.50 1o5a s ASN 87 N -6.47 1.32 -0.24 1.04 0.01 -1.06 -4.93 114.94 104.61 1o5a s ASN 87 Ca -0.16 -0.20 0.01 0.00 -0.71 0.00 0.00 52.86 51.80 1o5a s ASN 87 Cb 0.01 -0.16 0.06 0.00 0.41 0.00 0.00 41.25 41.57 1o5a s ASN 87 CO 0.76 0.14 -0.06 -0.22 -1.51 0.00 0.00 177.10 176.20 1o5a s LEU 88 N -0.24 2.74 -0.27 0.60 2.96 -1.26 -0.06 118.68 123.15 1o5a s LEU 88 Ca 0.04 -1.23 -0.05 0.00 -0.22 0.00 0.00 54.13 52.67 1o5a s LEU 88 Cb -0.05 -1.24 0.01 0.00 0.50 0.00 0.00 46.19 45.41 1o5a s LEU 88 CO -0.00 -0.23 0.03 -0.63 -1.32 0.00 0.00 176.35 174.19 1o5a s ILE 89 N 1.34 3.63 0.35 6.68 1.01 0.67 -4.99 121.20 129.90 1o5a s ILE 89 Ca -0.06 -0.70 0.06 0.00 0.00 0.00 0.00 60.65 59.95 1o5a s ILE 89 Cb -0.19 -2.82 -0.01 0.00 0.01 0.00 0.00 42.46 39.45 1o5a s ILE 89 CO -0.06 0.19 0.50 -0.76 0.00 0.00 0.00 174.94 174.80 1o5a s LEU 90 N 1.46 3.91 -0.22 2.97 1.43 -1.26 -0.82 118.68 126.15 1o5a s LEU 90 Ca 0.03 -0.18 -0.17 0.00 -1.03 0.00 0.00 54.13 52.78 1o5a s LEU 90 Cb -0.16 -2.77 -0.03 0.00 0.03 0.00 0.00 46.19 43.25 1o5a s LEU 90 CO -0.00 -0.49 0.48 -2.28 0.23 0.00 0.00 176.35 174.29 1o5a s HIS 91 N -2.22 3.33 -0.11 0.29 5.65 -1.24 -4.96 115.29 116.02 1o5a s HIS 91 Ca 0.46 0.67 -0.30 0.00 0.25 0.00 0.00 55.06 56.15 1o5a s HIS 91 Cb -0.10 -2.65 -0.02 0.00 -1.18 0.00 0.00 32.58 28.64 1o5a s HIS 91 CO 0.32 -0.15 1.15 -1.59 -0.65 0.00 0.00 174.74 173.82 1o5a s LYS 92 N 1.80 4.33 0.00 2.88 0.00 -1.26 -1.48 119.74 126.01 1o5a s LYS 92 Ca 0.21 1.57 0.00 0.00 0.00 0.00 0.00 55.97 57.75 1o5a s LYS 92 Cb -0.15 -3.61 0.00 0.00 0.00 0.00 0.00 37.83 34.07 1o5a s LYS 92 CO 0.09 -0.50 0.00 -0.25 0.00 0.00 0.00 175.35 174.70 1o5a n ASP 93 N 5.59 0.00 -4.77 0.03 8.00 -1.26 -5.08 116.55 119.07 1o5a n ASP 93 Ca 0.11 0.00 -0.40 0.00 0.71 0.00 0.00 54.79 55.21 1o5a n ASP 93 Cb 0.46 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.54 1o5a n ASP 93 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1o5a s TYR 94 N -2.00 3.16 -0.02 1.24 5.04 -0.55 -4.56 117.35 119.65 1o5a s TYR 94 Ca 0.00 1.52 -0.07 0.00 -2.44 0.00 0.00 57.07 56.08 1o5a s TYR 94 Cb 0.00 -3.51 0.01 0.00 0.35 0.00 0.00 41.96 38.81 1o5a s TYR 94 CO 0.00 -1.42 0.16 -1.12 -1.34 0.00 0.00 175.55 171.83 1o5a s SER 95 N -0.78 -0.06 0.05 4.32 0.01 -0.39 -4.92 113.70 111.93 1o5a s SER 95 Ca 0.51 0.00 0.06 0.00 1.31 0.00 0.00 55.95 57.83 1o5a s SER 95 Cb -0.35 0.27 -0.03 0.00 0.21 0.00 0.00 66.02 66.12 1o5a s SER 95 CO 0.46 -0.27 -0.18 0.00 0.41 0.00 0.00 173.24 173.66 1o5a s ALA 96 N -0.88 1.54 0.00 1.44 0.00 -1.26 0.64 121.76 123.24 1o5a s ALA 96 Ca -0.10 -1.00 0.00 0.00 0.00 0.00 0.00 51.96 50.87 1o5a s ALA 96 Cb -0.05 -0.27 0.00 0.00 0.00 0.00 0.00 23.12 22.80 1o5a s ALA 96 CO 0.01 0.32 0.00 -0.40 0.00 0.00 0.00 175.76 175.70 1o5a n ASP 97 N 1.76 0.20 -4.77 0.00 5.75 0.27 -4.98 116.55 114.78 1o5a n ASP 97 Ca -0.18 0.00 -0.39 0.00 -0.01 0.00 0.00 54.79 54.21 1o5a n ASP 97 Cb 0.54 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.60 1o5a n ASP 97 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 1o5a s THR 97 N -0.73 3.14 0.00 2.12 -1.32 -1.26 -4.10 115.64 113.50 1o5a s THR 97 Ca 0.00 1.05 0.00 0.00 -1.21 0.00 0.00 61.69 61.53 1o5a s THR 97 Cb 0.00 -3.63 0.00 0.00 -1.51 0.00 0.00 72.50 67.36 1o5a s THR 97 CO 0.00 0.17 0.00 0.18 -2.21 0.00 0.00 174.62 172.76 1o5a n LEU 97 N 0.52 0.00 -4.86 9.08 4.77 -1.26 -4.89 117.00 120.37 1o5a n LEU 97 Ca 0.02 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.69 1o5a n LEU 97 Cb 0.45 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.54 1o5a n LEU 97 CO 0.53 0.00 0.71 0.00 -1.33 0.00 0.00 177.39 177.30 1o5a s ALA 98 N 0.00 3.09 -0.08 -1.18 0.00 -1.26 -4.77 121.76 117.56 1o5a s ALA 98 Ca 0.00 -0.02 0.02 0.00 0.00 0.00 0.00 51.96 51.96 1o5a s ALA 98 Cb 0.00 -3.09 0.01 0.00 0.00 0.00 0.00 23.12 20.05 1o5a s ALA 98 CO 0.00 -0.57 -0.14 -1.01 0.00 0.00 0.00 175.76 174.04 1o5a s HIS 99 N -3.04 1.72 -0.07 0.00 3.76 -1.26 -0.57 115.29 115.83 1o5a s HIS 99 Ca 0.56 -0.70 -0.00 0.00 -0.15 0.00 0.00 55.06 54.77 1o5a s HIS 99 Cb -0.11 -1.24 -0.03 0.00 1.11 0.00 0.00 32.58 32.31 1o5a s HIS 99 CO 0.48 -0.35 -0.04 -1.01 -0.85 0.00 0.00 174.74 172.97 1o5a s HIS 100 N 0.73 3.03 -1.27 1.40 3.76 0.21 -4.54 115.29 118.60 1o5a s HIS 100 Ca -0.13 0.09 -0.02 0.00 -0.15 0.00 0.00 55.06 54.85 1o5a s HIS 100 Cb -0.16 -1.74 -0.01 0.00 1.11 0.00 0.00 32.58 31.79 1o5a s HIS 100 CO 0.03 0.39 0.74 0.09 -0.85 0.00 0.00 174.74 175.14 1o5a n ASN 101 N 2.15 -1.86 -4.20 1.40 3.02 -1.26 -1.27 115.26 113.25 1o5a n ASN 101 Ca -0.18 -0.81 -0.43 0.00 -0.03 0.00 0.00 54.58 53.13 1o5a n ASN 101 Cb 0.53 -4.17 0.00 0.00 -0.61 0.00 0.00 39.78 35.53 1o5a n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1o5a n ASP 102 N -3.05 5.24 -3.88 6.41 2.03 -1.26 -4.54 116.55 117.51 1o5a n ASP 102 Ca -0.27 -3.05 -0.11 0.00 0.52 0.00 0.00 54.79 51.87 1o5a n ASP 102 Cb 0.67 -1.51 -0.11 0.00 -0.72 0.00 0.00 41.12 39.45 1o5a n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1o5a s ILE 103 N 0.75 0.06 0.08 5.18 2.07 -1.26 -4.25 121.20 123.83 1o5a s ILE 103 Ca 0.40 -0.50 -0.14 0.00 -1.41 0.00 0.00 60.65 59.00 1o5a s ILE 103 Cb 0.02 -0.31 0.02 0.00 0.13 0.00 0.00 42.46 42.33 1o5a s ILE 103 CO 0.00 -0.28 0.33 0.00 -1.91 0.00 0.00 174.94 173.09 1o5a s ALA 104 N -0.91 -0.71 -0.02 1.50 0.00 0.17 -3.62 121.76 118.16 1o5a s ALA 104 Ca -0.10 -0.11 0.06 0.00 0.00 0.00 0.00 51.96 51.81 1o5a s ALA 104 Cb -0.06 0.49 -0.02 0.00 0.00 0.00 0.00 23.12 23.54 1o5a s ALA 104 CO 0.01 -0.52 -0.21 -0.51 0.00 0.00 0.00 175.76 174.52 1o5a s LEU 105 N -2.50 2.03 -0.09 0.00 1.43 -0.00 -1.20 118.68 118.36 1o5a s LEU 105 Ca 0.00 -0.39 0.02 0.00 -1.03 0.00 0.00 54.13 52.72 1o5a s LEU 105 Cb 0.01 -1.12 0.02 0.00 0.03 0.00 0.00 46.19 45.13 1o5a s LEU 105 CO -0.08 0.26 -0.13 -0.76 0.23 0.00 0.00 176.35 175.87 1o5a s LEU 106 N -0.45 1.61 -0.20 1.79 1.02 -0.25 -0.24 118.68 121.97 1o5a s LEU 106 Ca 0.07 -0.35 -0.12 0.00 0.02 0.00 0.00 54.13 53.75 1o5a s LEU 106 Cb -0.09 -0.94 -0.05 0.00 0.02 0.00 0.00 46.19 45.13 1o5a s LEU 106 CO -0.00 0.01 0.21 -0.75 0.02 0.00 0.00 176.35 175.83 1o5a s LYS 107 N 0.94 4.18 0.13 1.70 2.20 0.91 -1.15 119.74 128.65 1o5a s LYS 107 Ca -0.09 -0.11 0.04 0.00 -0.36 0.00 0.00 55.97 55.46 1o5a s LYS 107 Cb -0.15 -3.47 -0.04 0.00 -1.51 0.00 0.00 37.83 32.67 1o5a s LYS 107 CO 0.00 0.18 0.14 0.96 -0.36 0.00 0.00 175.35 176.27 1o5a s ILE 108 N 0.68 4.63 -0.08 5.43 -4.36 -0.60 0.44 121.20 127.34 1o5a s ILE 108 Ca 0.11 -0.91 -0.07 0.00 -0.26 0.00 0.00 60.65 59.52 1o5a s ILE 108 Cb -0.13 -3.32 0.02 0.00 1.25 0.00 0.00 42.46 40.29 1o5a s ILE 108 CO 0.02 -0.02 0.21 -0.60 0.24 0.00 0.00 174.94 174.79 1o5a s ARG 109 N -2.86 0.23 0.61 0.37 3.52 -0.35 -4.69 118.95 115.78 1o5a s ARG 109 Ca 0.31 0.31 0.00 0.00 -0.13 0.00 0.00 55.73 56.22 1o5a s ARG 109 Cb -0.11 0.08 0.06 0.00 -1.56 0.00 0.00 34.95 33.43 1o5a s ARG 109 CO 0.24 -0.05 0.85 -1.54 -0.81 0.00 0.00 175.30 174.00 1o5a s SER 110 N 0.25 4.97 0.62 -2.12 1.04 0.14 -0.97 113.70 117.63 1o5a s SER 110 Ca -0.01 -0.11 0.42 0.00 0.48 0.00 0.00 55.95 56.73 1o5a s SER 110 Cb -0.03 -0.60 2.22 0.00 0.10 0.00 0.00 66.02 67.71 1o5a s SER 110 CO -0.01 -1.39 2.27 0.07 0.98 0.00 0.00 173.24 175.17 1o5a h LYS 110 N -0.14 0.00 -0.04 4.02 2.10 -1.90 0.29 116.57 120.90 1o5a h LYS 110 Ca -0.40 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.25 1o5a h LYS 110 Cb 1.29 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.62 1o5a h LYS 110 CO 0.49 0.00 0.00 0.39 -2.00 0.00 0.00 179.45 178.33 1o5a n GLU 110 N -3.00 1.97 -0.79 0.07 4.71 -1.26 -4.94 120.64 117.41 1o5a n GLU 110 Ca -0.02 -1.41 0.00 0.00 -0.01 0.00 0.00 57.16 55.71 1o5a n GLU 110 Cb 0.09 -1.47 0.00 0.00 -1.01 0.00 0.00 31.44 29.05 1o5a n GLU 110 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1o5a n GLY 110 N 1.26 0.80 3.71 0.62 0.00 0.10 -5.08 105.19 106.61 1o5a n GLY 110 Ca 0.17 -0.59 -0.29 0.00 0.00 0.00 0.00 46.02 45.31 1o5a n GLY 110 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1o5a s ARG 110 N -1.74 2.12 0.27 1.61 1.70 -1.25 -4.71 118.95 116.94 1o5a s ARG 110 Ca 0.00 -2.13 0.04 0.00 -0.47 0.00 0.00 55.73 53.17 1o5a s ARG 110 Cb 0.00 -1.72 0.04 0.00 -0.57 0.00 0.00 34.95 32.70 1o5a s ARG 110 CO 0.00 -0.21 0.32 0.00 -1.08 0.00 0.00 175.30 174.33 1o5a n ALA 112 N -2.62 1.03 -2.35 0.00 0.00 -0.51 -4.89 120.51 111.16 1o5a n ALA 112 Ca -0.07 -0.01 -0.31 0.00 0.00 0.00 0.00 53.44 53.05 1o5a n ALA 112 Cb 0.28 -2.31 -0.15 0.00 0.00 0.00 0.00 19.45 17.28 1o5a n ALA 112 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1o5a s GLN 113 N -3.36 2.01 0.22 0.00 -1.52 -1.26 -4.86 119.66 110.89 1o5a s GLN 113 Ca 0.82 -0.99 -0.30 0.00 -1.95 0.00 0.00 55.36 52.94 1o5a s GLN 113 Cb -0.38 -2.06 -0.08 0.00 -0.22 0.00 0.00 33.01 30.27 1o5a s GLN 113 CO 0.41 0.54 1.10 -2.14 -0.25 0.00 0.00 175.29 174.95 1o5a s PRO 114 N -0.97 4.61 0.09 2.91 0.02 -1.26 -4.82 135.00 135.59 1o5a s PRO 114 Ca 0.11 1.75 -0.01 0.00 0.02 0.00 0.00 61.00 62.87 1o5a s PRO 114 Cb -0.10 -3.24 0.00 0.00 0.02 0.00 0.00 34.50 31.18 1o5a s PRO 114 CO 0.01 0.13 0.14 -1.13 -0.33 0.00 0.00 177.00 175.82 1o5a n SER 115 N 1.94 -0.39 0.00 2.53 3.41 -0.77 -4.95 113.62 115.39 1o5a n SER 115 Ca 0.01 -1.46 0.14 0.00 -0.26 0.00 0.00 58.87 57.29 1o5a n SER 115 Cb 0.46 0.71 0.64 0.00 -0.26 0.00 0.00 64.21 65.76 1o5a n SER 115 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1o5a n ARG 116 N -0.14 0.16 0.00 4.33 1.85 -1.26 -3.15 116.66 118.44 1o5a n ARG 116 Ca -0.00 0.02 0.04 0.00 -1.00 0.00 0.00 57.85 56.91 1o5a n ARG 116 Cb 0.15 -1.50 -0.00 0.00 -1.05 0.00 0.00 32.46 30.06 1o5a n ARG 116 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 1o5a n THR 117 N -1.42 0.00 -3.85 8.89 -2.24 -1.26 -4.55 114.28 109.85 1o5a n THR 117 Ca 0.09 -0.41 -0.27 0.00 -2.27 0.00 0.00 64.05 61.19 1o5a n THR 117 Cb 0.29 1.10 -0.17 0.00 -2.10 0.00 0.00 70.33 69.45 1o5a n THR 117 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1o5a s ILE 118 N -1.24 0.89 0.07 2.28 1.01 -1.19 -3.89 121.20 119.13 1o5a s ILE 118 Ca 0.07 -0.49 -0.07 0.00 0.00 0.00 0.00 60.65 60.16 1o5a s ILE 118 Cb 0.07 -1.12 -0.01 0.00 0.01 0.00 0.00 42.46 41.41 1o5a s ILE 118 CO 0.22 0.10 0.14 -1.58 0.00 0.00 0.00 174.94 173.81 1o5a s GLN 119 N 1.73 0.74 0.44 2.79 2.00 -0.38 -1.85 119.66 125.13 1o5a s GLN 119 Ca 0.01 -0.92 0.00 0.00 -2.00 0.00 0.00 55.36 52.45 1o5a s GLN 119 Cb -0.15 0.29 -0.01 0.00 0.80 0.00 0.00 33.01 33.95 1o5a s GLN 119 CO -0.07 -0.21 0.67 0.95 -0.50 0.00 0.00 175.29 176.12 1o5a s THR 120 N -3.47 4.11 0.26 -0.34 -4.23 -1.26 -3.28 115.64 107.43 1o5a s THR 120 Ca 0.02 -0.46 0.08 0.00 -1.18 0.00 0.00 61.69 60.15 1o5a s THR 120 Cb 0.04 -3.52 -0.04 0.00 1.34 0.00 0.00 72.50 70.31 1o5a s THR 120 CO -0.09 -0.37 0.10 -0.51 -0.54 0.00 0.00 174.62 173.21 1o5a s ILE 121 N -2.55 3.95 0.23 2.99 1.10 -0.50 -4.84 121.20 121.58 1o5a s ILE 121 Ca 0.48 -1.65 -0.10 0.00 -0.51 0.00 0.00 60.65 58.87 1o5a s ILE 121 Cb -0.10 -3.13 -0.07 0.00 0.15 0.00 0.00 42.46 39.31 1o5a s ILE 121 CO 0.38 -0.36 0.55 0.00 -2.11 0.00 0.00 174.94 173.41 1o5a s LEU 123 N -2.83 4.30 1.02 0.00 2.01 -1.26 -0.31 118.68 121.61 1o5a s LEU 123 Ca 0.47 0.79 -0.13 0.00 0.01 0.00 0.00 54.13 55.27 1o5a s LEU 123 Cb -0.11 -3.20 0.20 0.00 0.01 0.00 0.00 46.19 43.09 1o5a s LEU 123 CO 0.21 0.10 1.11 -2.16 1.01 0.00 0.00 176.35 176.61 1o5a s PRO 124 N -2.24 0.23 0.41 1.29 0.04 -1.26 -4.87 135.00 128.60 1o5a s PRO 124 Ca 0.38 0.36 -0.01 0.00 0.04 0.00 0.00 61.00 61.77 1o5a s PRO 124 Cb -0.13 -1.73 -0.02 0.00 0.04 0.00 0.00 34.50 32.66 1o5a s PRO 124 CO 0.20 -2.83 0.64 -1.54 0.04 0.00 0.00 177.00 173.51 1o5a s SER 125 N -3.62 6.13 -0.14 6.66 1.04 -1.26 -4.95 113.70 117.56 1o5a s SER 125 Ca 0.66 0.50 -0.33 0.00 0.48 0.00 0.00 55.95 57.26 1o5a s SER 125 Cb -0.17 -1.91 -0.16 0.00 0.10 0.00 0.00 66.02 63.88 1o5a s SER 125 CO 0.57 -0.50 0.99 0.23 0.98 0.00 0.00 173.24 175.51 1o5a n MET 126 N -1.99 0.00 -1.05 4.02 2.81 -1.26 -0.90 117.12 118.75 1o5a n MET 126 Ca -0.02 0.00 -0.02 0.00 -1.81 0.00 0.00 57.70 55.85 1o5a n MET 126 Cb 0.56 -1.18 -0.01 0.00 -0.71 0.00 0.00 33.22 31.88 1o5a n MET 126 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 1o5a n TYR 127 N 1.86 -0.89 -3.47 2.03 4.01 -0.68 -4.91 117.16 115.12 1o5a n TYR 127 Ca 0.19 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.56 1o5a n TYR 127 Cb 0.02 -1.24 -0.07 0.00 -0.31 0.00 0.00 39.34 37.74 1o5a n TYR 127 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 1o5a s ASN 128 N -1.17 6.47 0.16 7.72 2.47 -0.08 -4.97 114.94 125.55 1o5a s ASN 128 Ca 0.00 0.55 0.01 0.00 0.42 0.00 0.00 52.86 53.85 1o5a s ASN 128 Cb 0.00 -2.21 -0.04 0.00 -1.45 0.00 0.00 41.25 37.55 1o5a s ASN 128 CO 0.00 0.04 0.00 -1.81 -3.72 0.00 0.00 177.10 171.61 1o5a s ASP 129 N 0.65 1.08 0.70 -4.21 1.01 -1.26 -4.47 116.67 110.16 1o5a s ASP 129 Ca 0.19 -1.16 -0.11 0.00 0.71 0.00 0.00 52.55 52.17 1o5a s ASP 129 Cb -0.14 0.14 0.01 0.00 1.01 0.00 0.00 42.92 43.94 1o5a s ASP 129 CO 0.06 -0.58 1.07 -2.84 0.21 0.00 0.00 175.17 173.08 1o5a s PRO 130 N -3.93 2.91 0.59 8.23 0.02 -1.26 -5.04 135.00 136.53 1o5a s PRO 130 Ca 0.23 0.75 -0.14 0.00 0.02 0.00 0.00 61.00 61.86 1o5a s PRO 130 Cb 0.06 -2.00 -0.05 0.00 0.02 0.00 0.00 34.50 32.53 1o5a s PRO 130 CO 0.03 -1.06 1.02 -0.65 -0.33 0.00 0.00 177.00 176.01 1o5a s GLN 131 N -5.16 3.57 0.66 5.54 -1.52 -1.26 -4.97 119.66 116.51 1o5a s GLN 131 Ca 0.58 0.93 -0.18 0.00 -1.95 0.00 0.00 55.36 54.74 1o5a s GLN 131 Cb -0.13 -2.08 -0.01 0.00 -0.22 0.00 0.00 33.01 30.58 1o5a s GLN 131 CO 0.54 -0.59 1.27 -0.59 -0.25 0.00 0.00 175.29 175.66 1o5a s PHE 132 N -2.85 2.11 0.00 0.91 -0.71 -1.26 -2.45 117.98 113.74 1o5a s PHE 132 Ca 0.58 1.51 0.00 0.00 -1.04 0.00 0.00 56.93 57.98 1o5a s PHE 132 Cb -0.12 -3.62 0.00 0.00 -1.21 0.00 0.00 43.02 38.07 1o5a s PHE 132 CO 0.43 -2.77 0.00 0.41 -1.34 0.00 0.00 175.22 171.96 1o5a n GLY 133 N 0.75 2.49 3.72 1.99 0.00 0.11 -4.96 105.19 109.30 1o5a n GLY 133 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 1o5a n GLY 133 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1o5a n THR 134 N -0.06 2.44 -3.62 2.61 -1.04 -1.02 -4.57 114.28 109.01 1o5a n THR 134 Ca 0.00 -0.50 -0.37 0.00 -2.04 0.00 0.00 64.05 61.14 1o5a n THR 134 Cb 0.00 -1.64 -0.07 0.00 -1.82 0.00 0.00 70.33 66.80 1o5a n THR 134 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 1o5a s SER 135 N -0.45 6.50 0.24 8.00 0.01 -1.26 -1.12 113.70 125.62 1o5a s SER 135 Ca 0.59 0.59 0.04 0.00 1.31 0.00 0.00 55.95 58.48 1o5a s SER 135 Cb -0.51 -2.17 -0.05 0.00 0.21 0.00 0.00 66.02 63.50 1o5a s SER 135 CO 0.59 0.23 -0.01 0.00 0.41 0.00 0.00 173.24 174.46 1o5a s GLU 137 N -3.84 1.46 0.13 0.00 -1.05 -0.02 -0.61 118.70 114.78 1o5a s GLU 137 Ca 0.29 -1.42 0.07 0.00 -0.15 0.00 0.00 54.97 53.75 1o5a s GLU 137 Cb 0.05 -1.88 -0.04 0.00 -0.44 0.00 0.00 34.13 31.82 1o5a s GLU 137 CO 0.09 0.43 -0.16 0.96 0.95 0.00 0.00 175.26 177.53 1o5a s ILE 138 N -1.32 1.51 0.06 1.83 -4.36 -0.76 -1.21 121.20 116.95 1o5a s ILE 138 Ca 0.17 -1.77 -0.04 0.00 -0.26 0.00 0.00 60.65 58.74 1o5a s ILE 138 Cb -0.09 -1.63 -0.02 0.00 1.25 0.00 0.00 42.46 41.97 1o5a s ILE 138 CO 0.08 -0.36 0.07 0.42 0.24 0.00 0.00 174.94 175.38 1o5a s THR 139 N -2.06 0.18 0.00 8.37 -4.23 -1.25 -1.81 115.64 114.84 1o5a s THR 139 Ca 0.11 -1.47 0.00 0.00 -1.18 0.00 0.00 61.69 59.15 1o5a s THR 139 Cb -0.05 -1.35 0.00 0.00 1.34 0.00 0.00 72.50 72.43 1o5a s THR 139 CO 0.04 -0.81 0.00 0.61 -0.54 0.00 0.00 174.62 173.92 1o5a n GLY 140 N 0.15 0.33 1.21 3.99 0.00 -0.59 -4.57 105.19 105.72 1o5a n GLY 140 Ca -0.15 -1.21 0.04 0.00 0.00 0.00 0.00 46.02 44.70 1o5a n GLY 140 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1o5a n PHE 141 N -0.95 1.32 -1.51 1.61 3.72 -1.26 -2.34 117.46 118.05 1o5a n PHE 141 Ca 0.00 -1.03 -0.30 0.00 -0.05 0.00 0.00 57.45 56.08 1o5a n PHE 141 Cb 0.00 -0.42 0.19 0.00 -0.94 0.00 0.00 39.48 38.30 1o5a n PHE 141 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1o5a s GLY 142 N -1.77 1.64 0.74 1.37 0.00 -1.24 -4.01 107.32 104.05 1o5a s GLY 142 Ca 0.46 -0.88 -0.16 0.00 0.00 0.00 0.00 44.72 44.14 1o5a s GLY 142 CO 0.09 -0.15 0.68 0.28 0.00 0.00 0.00 173.10 174.00 1o5a n LYS 143 N -4.10 0.31 -0.01 2.90 5.02 0.05 -2.44 118.16 119.90 1o5a n LYS 143 Ca 0.11 0.15 0.10 0.00 -2.02 0.00 0.00 58.31 56.66 1o5a n LYS 143 Cb 0.59 -1.97 -0.15 0.00 -0.02 0.00 0.00 35.03 33.48 1o5a n LYS 143 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1o5a n GLU 144 N -1.26 0.59 -3.76 1.97 1.02 -1.25 0.14 120.64 118.09 1o5a n GLU 144 Ca 0.11 -0.15 -0.13 0.00 -0.02 0.00 0.00 57.16 56.97 1o5a n GLU 144 Cb 0.50 -1.48 -0.11 0.00 -0.02 0.00 0.00 31.44 30.34 1o5a n GLU 144 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1o5a s ALA 145 N -3.32 -0.78 0.42 0.62 0.00 -1.26 -4.44 121.76 112.99 1o5a s ALA 145 Ca -0.05 0.86 0.12 0.00 0.00 0.00 0.00 51.96 52.89 1o5a s ALA 145 Cb 0.13 -0.49 0.97 0.00 0.00 0.00 0.00 23.12 23.74 1o5a s ALA 145 CO 0.84 -0.16 1.97 0.77 0.00 0.00 0.00 175.76 179.19 1o5a h SER 146 N 5.53 0.43 0.73 0.00 0.02 -1.91 -1.35 113.55 117.00 1o5a h SER 146 Ca -0.26 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.69 1o5a h SER 146 Cb 1.19 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.65 1o5a h SER 146 CO 0.31 0.26 0.00 0.35 -1.14 0.00 0.00 176.83 176.61 1o5a n THR 147 N -4.48 0.27 -1.50 -2.27 -2.24 -1.26 -4.89 114.28 97.92 1o5a n THR 147 Ca 0.10 0.07 -0.32 0.00 -2.27 0.00 0.00 64.05 61.63 1o5a n THR 147 Cb 0.35 -0.65 0.07 0.00 -2.10 0.00 0.00 70.33 68.01 1o5a n THR 147 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1o5a s ASP 148 N -2.86 4.71 0.00 3.42 1.01 -0.51 -4.95 116.67 117.49 1o5a s ASP 148 Ca 0.16 1.97 0.00 0.00 0.71 0.00 0.00 52.55 55.38 1o5a s ASP 148 Cb 0.16 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.55 1o5a s ASP 148 CO 0.43 -1.90 0.68 0.00 0.21 0.00 0.00 175.17 174.59 1o5a n TYR 149 N -2.94 0.00 -4.34 4.23 4.11 -1.26 -5.01 117.16 111.95 1o5a n TYR 149 Ca 0.10 -0.21 -0.20 0.00 -0.00 0.00 0.00 57.90 57.59 1o5a n TYR 149 Cb 0.52 -0.02 -0.11 0.00 -0.00 0.00 0.00 39.34 39.73 1o5a n TYR 149 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.86 176.35 1o5a s LEU 150 N -0.42 2.49 0.16 -3.48 2.01 -1.26 -5.16 118.68 113.02 1o5a s LEU 150 Ca 0.00 -0.93 0.04 0.00 0.01 0.00 0.00 54.13 53.24 1o5a s LEU 150 Cb 0.00 -0.77 -0.04 0.00 0.01 0.00 0.00 46.19 45.40 1o5a s LEU 150 CO 0.00 -0.09 0.21 -0.31 1.01 0.00 0.00 176.35 177.17 1o5a s TYR 151 N -2.46 3.32 0.81 0.29 2.02 -1.26 -4.71 117.35 115.36 1o5a s TYR 151 Ca 0.19 0.05 -0.11 0.00 -0.37 0.00 0.00 57.07 56.83 1o5a s TYR 151 Cb -0.04 -1.59 0.08 0.00 -0.40 0.00 0.00 41.96 40.02 1o5a s TYR 151 CO 0.07 0.52 1.12 -1.25 -1.57 0.00 0.00 175.55 174.44 1o5a s PRO 152 N -3.19 1.86 0.01 -1.71 0.04 -1.26 -4.95 135.00 125.81 1o5a s PRO 152 Ca 0.33 1.37 0.17 0.00 0.04 0.00 0.00 61.00 62.90 1o5a s PRO 152 Cb -0.10 -1.84 -0.17 0.00 0.04 0.00 0.00 34.50 32.43 1o5a s PRO 152 CO 0.26 -1.97 0.71 0.39 0.04 0.00 0.00 177.00 176.43 1o5a n GLU 153 N -3.62 0.63 -3.90 4.56 -0.58 -1.26 -4.66 120.64 111.81 1o5a n GLU 153 Ca 0.10 0.19 -0.34 0.00 -0.42 0.00 0.00 57.16 56.69 1o5a n GLU 153 Cb 0.52 -1.76 -0.05 0.00 -0.57 0.00 0.00 31.44 29.58 1o5a n GLU 153 CO 0.00 0.00 0.00 -1.14 -0.48 0.00 0.00 177.13 175.51 1o5a s GLN 154 N -2.86 3.43 0.46 3.49 2.00 -1.26 -0.44 119.66 124.47 1o5a s GLN 154 Ca -0.04 -0.27 -0.23 0.00 -2.00 0.00 0.00 55.36 52.81 1o5a s GLN 154 Cb 0.09 -3.12 -0.07 0.00 0.80 0.00 0.00 33.01 30.71 1o5a s GLN 154 CO 0.82 0.70 1.22 -1.17 -0.50 0.00 0.00 175.29 176.36 1o5a s LEU 155 N -1.67 4.04 0.22 3.68 2.96 -0.81 -4.88 118.68 122.22 1o5a s LEU 155 Ca 0.24 2.44 0.06 0.00 -0.22 0.00 0.00 54.13 56.64 1o5a s LEU 155 Cb -0.12 -4.17 -0.05 0.00 0.50 0.00 0.00 46.19 42.35 1o5a s LEU 155 CO 0.14 -0.98 -0.09 -0.54 -1.32 0.00 0.00 176.35 173.56 1o5a s LYS 156 N -2.61 1.36 0.10 1.98 1.02 -0.99 -0.84 119.74 119.75 1o5a s LYS 156 Ca 0.63 -1.64 -0.09 0.00 0.02 0.00 0.00 55.97 54.89 1o5a s LYS 156 Cb -0.32 -0.97 -0.00 0.00 -0.52 0.00 0.00 37.83 36.02 1o5a s LYS 156 CO 0.39 0.08 0.22 1.41 -0.92 0.00 0.00 175.35 176.53 1o5a s MET 157 N -3.72 0.91 0.29 1.68 -2.45 -0.65 -1.55 119.30 113.80 1o5a s MET 157 Ca 0.25 -0.99 -0.20 0.00 -1.25 0.00 0.00 55.69 53.50 1o5a s MET 157 Cb 0.02 0.35 0.02 0.00 1.25 0.00 0.00 34.83 36.48 1o5a s MET 157 CO 0.08 -0.30 0.71 -0.08 1.05 0.00 0.00 175.02 176.47 1o5a s THR 158 N -3.88 0.00 -0.08 10.11 -1.32 -0.75 -1.27 115.64 118.45 1o5a s THR 158 Ca 0.07 -1.02 0.04 0.00 -1.21 0.00 0.00 61.69 59.57 1o5a s THR 158 Cb 0.04 -2.07 -0.01 0.00 -1.51 0.00 0.00 72.50 68.96 1o5a s THR 158 CO -0.09 0.00 -0.21 -0.69 -2.21 0.00 0.00 174.62 171.42 1o5a s VAL 159 N -3.82 2.36 0.11 5.08 1.01 -1.26 -1.83 120.40 122.05 1o5a s VAL 159 Ca 0.12 -0.94 0.02 0.00 0.00 0.00 0.00 61.98 61.18 1o5a s VAL 159 Cb -0.06 -1.90 -0.04 0.00 0.00 0.00 0.00 36.38 34.38 1o5a s VAL 159 CO 0.07 0.56 -0.07 0.54 0.00 0.00 0.00 175.10 176.21 1o5a s VAL 160 N -0.01 0.81 -0.01 2.92 0.11 0.22 -4.87 120.40 119.57 1o5a s VAL 160 Ca -0.07 -1.97 0.04 0.00 -2.93 0.00 0.00 61.98 57.05 1o5a s VAL 160 Cb -0.15 -1.75 -0.03 0.00 -1.53 0.00 0.00 36.38 32.92 1o5a s VAL 160 CO 0.05 -0.82 -0.11 -0.54 -3.33 0.00 0.00 175.10 170.35 1o5a s LYS 161 N -3.82 2.45 0.25 1.54 1.02 -0.27 -0.30 119.74 120.61 1o5a s LYS 161 Ca 0.14 -0.76 -0.30 0.00 0.02 0.00 0.00 55.97 55.07 1o5a s LYS 161 Cb 0.05 -2.41 -0.09 0.00 -0.52 0.00 0.00 37.83 34.85 1o5a s LYS 161 CO -0.03 0.60 1.30 -0.51 -0.92 0.00 0.00 175.35 175.79 1o5a s LEU 162 N -1.20 4.43 0.38 3.17 1.43 -0.27 -1.09 118.68 125.53 1o5a s LEU 162 Ca 0.15 2.49 0.08 0.00 -1.03 0.00 0.00 54.13 55.82 1o5a s LEU 162 Cb -0.11 -3.62 -0.06 0.00 0.03 0.00 0.00 46.19 42.43 1o5a s LEU 162 CO 0.05 -0.50 0.04 0.27 0.23 0.00 0.00 176.35 176.44 1o5a s ILE 163 N -0.41 2.33 0.66 -0.59 -4.36 -0.51 0.09 121.20 118.42 1o5a s ILE 163 Ca 0.53 -1.93 -0.09 0.00 -0.26 0.00 0.00 60.65 58.90 1o5a s ILE 163 Cb -0.37 -2.89 0.01 0.00 1.25 0.00 0.00 42.46 40.46 1o5a s ILE 163 CO 0.43 -0.09 1.02 -0.94 0.24 0.00 0.00 174.94 175.60 1o5a s SER 164 N -3.75 5.52 0.20 4.36 1.04 -1.26 -4.52 113.70 115.30 1o5a s SER 164 Ca 0.36 0.98 -0.02 0.00 0.48 0.00 0.00 55.95 57.76 1o5a s SER 164 Cb 0.04 -1.86 0.15 0.00 0.10 0.00 0.00 66.02 64.45 1o5a s SER 164 CO 0.20 -1.22 1.53 0.45 0.98 0.00 0.00 173.24 175.17 1o5a h HIS 165 N -0.46 0.64 -0.52 5.02 -0.00 -1.97 -0.89 115.15 116.96 1o5a h HIS 165 Ca -0.45 -0.22 0.03 0.00 -0.00 0.00 0.00 60.37 59.73 1o5a h HIS 165 Cb 1.25 -0.12 -0.04 0.00 -0.00 0.00 0.00 27.41 28.50 1o5a h HIS 165 CO 0.49 0.93 0.30 -0.09 -0.00 0.00 0.00 177.93 179.57 1o5a h ARG 166 N 0.40 0.59 -0.37 2.45 9.65 -1.95 0.19 114.38 125.34 1o5a h ARG 166 Ca 0.01 -0.04 -0.08 0.00 -1.10 0.00 0.00 59.98 58.78 1o5a h ARG 166 Cb 1.05 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 29.49 1o5a h ARG 166 CO 0.10 0.39 -0.09 1.49 2.80 0.00 0.00 179.97 184.65 1o5a h GLU 167 N 0.60 0.71 -0.18 0.20 4.81 -1.89 -3.20 114.58 115.64 1o5a h GLU 167 Ca 0.21 -0.27 -0.12 0.00 -0.13 0.00 0.00 59.36 59.05 1o5a h GLU 167 Cb 0.04 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 1o5a h GLU 167 CO -0.10 0.87 -0.40 0.00 -0.73 0.00 0.00 179.01 178.64 1o5a n GLN 169 N -4.03 2.10 -2.60 0.00 6.02 0.62 -1.83 117.38 117.66 1o5a n GLN 169 Ca -0.01 -0.93 -0.40 0.00 -0.01 0.00 0.00 57.00 55.64 1o5a n GLN 169 Cb 0.49 -1.70 -0.05 0.00 1.02 0.00 0.00 30.24 30.00 1o5a n GLN 169 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1o5a s GLN 170 N -1.48 4.74 0.40 -1.09 -0.21 -1.18 -3.94 119.66 116.89 1o5a s GLN 170 Ca 0.16 1.66 0.19 0.00 0.02 0.00 0.00 55.36 57.39 1o5a s GLN 170 Cb 0.12 -3.23 1.13 0.00 1.00 0.00 0.00 33.01 32.03 1o5a s GLN 170 CO 0.05 0.35 1.74 -1.00 -2.12 0.00 0.00 175.29 174.31 1o5a h PRO 170 N 4.00 0.35 -0.14 2.91 0.13 -1.92 0.20 132.00 137.53 1o5a h PRO 170 Ca -0.46 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1o5a h PRO 170 Cb 1.21 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1o5a h PRO 170 CO 0.67 0.23 0.00 -2.39 -0.23 0.00 0.00 178.00 176.29 1o5a n HIS 170 N -4.67 0.16 0.00 1.56 1.44 -1.26 -4.24 115.22 108.21 1o5a n HIS 170 Ca 0.27 -0.08 0.00 0.00 -2.01 0.00 0.00 57.72 55.91 1o5a n HIS 170 Cb 0.95 -0.00 0.00 0.00 0.12 0.00 0.00 29.99 31.06 1o5a n HIS 170 CO 0.00 0.00 0.00 0.66 -2.81 0.00 0.00 176.34 174.19 1o5a n TYR 171 N -0.16 0.00 -0.03 -1.40 4.02 0.67 -4.89 117.16 115.38 1o5a n TYR 171 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.93 1o5a n TYR 171 Cb 0.10 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.42 1o5a n TYR 171 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1o5a n TYR 172 N 0.00 0.00 -3.29 -0.72 4.01 -0.76 -4.93 117.16 111.47 1o5a n TYR 172 Ca 0.00 -0.27 0.00 0.00 -0.16 0.00 0.00 57.90 57.47 1o5a n TYR 172 Cb 0.00 -0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.00 1o5a n TYR 172 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1o5a n GLY 173 N -0.27 2.01 0.00 2.72 0.00 -1.01 -1.68 105.19 106.95 1o5a n GLY 173 Ca 0.00 -0.41 0.09 0.00 0.00 0.00 0.00 46.02 45.71 1o5a n GLY 173 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1o5a n SER 174 N -0.94 0.00 0.20 1.61 3.41 -1.26 -3.46 113.62 113.17 1o5a n SER 174 Ca 0.00 -1.21 0.06 0.00 -0.26 0.00 0.00 58.87 57.46 1o5a n SER 174 Cb 0.00 0.00 0.53 0.00 -0.26 0.00 0.00 64.21 64.48 1o5a n SER 174 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1o5a h GLU 175 N 0.00 0.09 -5.97 4.33 4.39 -1.72 -3.39 114.58 112.30 1o5a h GLU 175 Ca 0.00 -0.01 -0.56 0.00 0.34 0.00 0.00 59.36 59.12 1o5a h GLU 175 Cb 0.00 -0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 28.57 1o5a h GLU 175 CO 0.00 0.16 0.02 0.08 -1.16 0.00 0.00 179.01 178.11 1o5a s VAL 176 N -4.90 5.06 0.35 3.13 1.01 -1.22 -4.92 120.40 118.90 1o5a s VAL 176 Ca -0.05 1.30 0.02 0.00 0.00 0.00 0.00 61.98 63.25 1o5a s VAL 176 Cb 0.16 -3.97 0.02 0.00 0.00 0.00 0.00 36.38 32.60 1o5a s VAL 176 CO 0.70 0.29 0.20 0.35 0.00 0.00 0.00 175.10 176.64 1o5a n THR 177 N 3.60 0.00 0.49 3.92 -2.24 -1.26 -4.96 114.28 113.84 1o5a n THR 177 Ca -0.03 -1.43 0.13 0.00 -2.27 0.00 0.00 64.05 60.45 1o5a n THR 177 Cb 0.51 -0.09 0.44 0.00 -2.10 0.00 0.00 70.33 69.10 1o5a n THR 177 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1o5a h THR 178 N 0.73 0.00 -0.50 4.28 1.35 -1.97 -2.81 112.91 113.99 1o5a h THR 178 Ca -0.23 -0.42 0.00 0.00 -0.55 0.00 0.00 66.41 65.21 1o5a h THR 178 Cb 0.81 1.31 0.00 0.00 -1.73 0.00 0.00 68.15 68.54 1o5a h THR 178 CO 0.37 0.00 0.00 0.29 -0.25 0.00 0.00 175.52 175.93 1o5a n LYS 179 N -2.35 2.25 -4.44 4.72 5.02 -1.26 -4.87 118.16 117.23 1o5a n LYS 179 Ca 0.04 -1.82 -0.22 0.00 -2.02 0.00 0.00 58.31 54.29 1o5a n LYS 179 Cb 0.35 -1.43 -0.10 0.00 -0.02 0.00 0.00 35.03 33.83 1o5a n LYS 179 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1o5a s MET 180 N -1.38 1.58 0.05 1.97 -1.94 -1.06 -1.40 119.30 117.12 1o5a s MET 180 Ca 0.34 -1.81 0.02 0.00 -1.71 0.00 0.00 55.69 52.52 1o5a s MET 180 Cb 0.18 -1.15 -0.03 0.00 2.01 0.00 0.00 34.83 35.85 1o5a s MET 180 CO 0.22 0.01 -0.07 -0.51 -0.01 0.00 0.00 175.02 174.66 1o5a s LEU 181 N -3.46 2.29 0.01 -0.03 1.43 -0.03 -4.68 118.68 114.20 1o5a s LEU 181 Ca 0.31 -0.61 0.08 0.00 -1.03 0.00 0.00 54.13 52.87 1o5a s LEU 181 Cb 0.04 -0.13 -0.02 0.00 0.03 0.00 0.00 46.19 46.12 1o5a s LEU 181 CO 0.13 -0.25 -0.24 0.00 0.23 0.00 0.00 176.35 176.21 1o5a s ALA 183 N -0.65 -0.34 0.28 0.00 0.00 -0.77 -1.43 121.76 118.84 1o5a s ALA 183 Ca 0.10 0.38 -0.13 0.00 0.00 0.00 0.00 51.96 52.31 1o5a s ALA 183 Cb -0.09 -0.22 0.01 0.00 0.00 0.00 0.00 23.12 22.81 1o5a s ALA 183 CO 0.00 -0.07 0.54 0.00 0.00 0.00 0.00 175.76 176.24 1o5a s ALA 184 N 0.03 -0.26 -0.16 0.00 0.00 -0.25 -1.26 121.76 119.86 1o5a s ALA 184 Ca -0.00 -0.89 -0.12 0.00 0.00 0.00 0.00 51.96 50.94 1o5a s ALA 184 Cb -0.01 1.01 -0.05 0.00 0.00 0.00 0.00 23.12 24.07 1o5a s ALA 184 CO 0.00 -0.88 0.24 0.34 0.00 0.00 0.00 175.76 175.46 1o5a s ASP 185 N -3.05 6.39 0.47 0.00 -1.08 -1.26 -1.12 116.67 117.03 1o5a s ASP 185 Ca 0.21 0.46 0.34 0.00 -0.52 0.00 0.00 52.55 53.04 1o5a s ASP 185 Cb -0.02 -2.15 1.47 0.00 -1.46 0.00 0.00 42.92 40.77 1o5a s ASP 185 CO 0.11 0.16 1.65 -0.65 0.52 0.00 0.00 175.17 176.96 1o5a h PRO 185 N 6.40 0.08 -0.31 4.34 0.11 -1.95 0.18 132.00 140.85 1o5a h PRO 185 Ca -0.43 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.63 1o5a h PRO 185 Cb 1.17 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 1o5a h PRO 185 CO 0.73 0.06 0.01 1.04 -0.21 0.00 0.00 178.00 179.63 1o5a n GLN 185 N -4.47 2.86 -4.20 1.05 6.02 -1.26 -4.97 117.38 112.40 1o5a n GLN 185 Ca 0.36 -2.92 -0.29 0.00 -0.01 0.00 0.00 57.00 54.14 1o5a n GLN 185 Cb 1.48 -1.88 -0.07 0.00 1.02 0.00 0.00 30.24 30.79 1o5a n GLN 185 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 177.06 176.96 1o5a n TRP 186 N -0.56 -1.39 -0.08 1.08 7.02 0.63 -4.88 117.44 119.27 1o5a n TRP 186 Ca 0.24 0.66 -0.10 0.00 -1.02 0.00 0.00 57.50 57.28 1o5a n TRP 186 Cb 0.95 -3.10 -0.09 0.00 -2.42 0.00 0.00 31.31 26.66 1o5a n TRP 186 CO 0.00 0.00 0.00 1.63 -2.02 0.00 0.00 177.69 177.30 1o5a n LYS 187 N -4.52 0.87 -4.37 -0.99 4.01 -1.26 -4.72 118.16 107.17 1o5a n LYS 187 Ca -0.32 0.07 -0.22 0.00 -0.51 0.00 0.00 58.31 57.33 1o5a n LYS 187 Cb 0.69 -1.34 -0.11 0.00 -0.51 0.00 0.00 35.03 33.77 1o5a n LYS 187 CO 0.00 0.00 0.00 -0.08 -1.11 0.00 0.00 177.40 176.21 1o5a s THR 188 N -2.33 1.99 -0.01 -0.18 -1.32 -1.26 -4.48 115.64 108.05 1o5a s THR 188 Ca -0.18 -2.11 -0.29 0.00 -1.21 0.00 0.00 61.69 57.90 1o5a s THR 188 Cb 0.05 -2.02 0.10 0.00 -1.51 0.00 0.00 72.50 69.12 1o5a s THR 188 CO 0.44 -0.39 1.28 -0.62 -2.21 0.00 0.00 174.62 173.12 1o5a s ASP 189 N -3.02 -0.00 0.60 8.08 2.15 -1.06 -4.27 116.67 119.14 1o5a s ASP 189 Ca 0.21 -0.20 -0.02 0.00 0.43 0.00 0.00 52.55 52.97 1o5a s ASP 189 Cb -0.04 0.15 0.04 0.00 -0.30 0.00 0.00 42.92 42.76 1o5a s ASP 189 CO 0.09 -0.30 0.86 0.00 -0.17 0.00 0.00 175.17 175.64 1o5a s ALA 190 N -2.09 3.56 0.33 3.66 0.00 -1.26 -1.35 121.76 124.62 1o5a s ALA 190 Ca 0.26 -1.09 -0.08 0.00 0.00 0.00 0.00 51.96 51.06 1o5a s ALA 190 Cb 0.00 -2.32 0.03 0.00 0.00 0.00 0.00 23.12 20.84 1o5a s ALA 190 CO -0.01 -0.90 0.58 0.00 0.00 0.00 0.00 175.76 175.43 1o5a n GLN 192 N -0.50 1.94 0.00 0.00 7.27 -1.26 -0.96 117.38 123.87 1o5a n GLN 192 Ca -0.04 0.69 0.00 0.00 0.07 0.00 0.00 57.00 57.72 1o5a n GLN 192 Cb 0.53 -2.37 0.00 0.00 2.41 0.00 0.00 30.24 30.80 1o5a n GLN 192 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1o5a n GLY 193 N 2.58 2.91 0.04 1.69 0.00 -1.26 -0.77 105.19 110.38 1o5a n GLY 193 Ca 0.14 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.28 1o5a n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1o5a n ASP 194 N 0.00 0.60 -4.54 1.61 8.00 -0.13 -3.68 116.55 118.41 1o5a n ASP 194 Ca 0.00 -0.37 -0.43 0.00 0.71 0.00 0.00 54.79 54.69 1o5a n ASP 194 Cb 0.00 0.25 -0.00 0.00 -0.02 0.00 0.00 41.12 41.34 1o5a n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1o5a n SER 195 N -1.36 0.48 0.00 -2.24 7.64 -1.26 -2.50 113.62 114.38 1o5a n SER 195 Ca 0.07 1.07 0.00 0.00 1.01 0.00 0.00 58.87 61.01 1o5a n SER 195 Cb 0.34 -1.23 0.00 0.00 -1.01 0.00 0.00 64.21 62.31 1o5a n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1o5a n GLY 196 N 1.43 2.98 3.96 0.23 0.00 -0.15 -1.41 105.19 112.24 1o5a n GLY 196 Ca 0.11 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.85 1o5a n GLY 196 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o5a n GLY 197 N -2.00 -0.72 3.89 -0.02 0.00 -1.04 -3.26 105.19 102.03 1o5a n GLY 197 Ca 0.00 -1.83 -0.29 0.00 0.00 0.00 0.00 46.02 43.90 1o5a n GLY 197 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1o5a s PRO 198 N -5.68 3.70 -0.23 1.61 0.04 -1.26 -0.75 135.00 132.43 1o5a s PRO 198 Ca 0.74 0.22 0.01 0.00 0.04 0.00 0.00 61.00 62.01 1o5a s PRO 198 Cb -0.03 -2.53 0.05 0.00 0.04 0.00 0.00 34.50 32.04 1o5a s PRO 198 CO 0.51 0.09 -0.09 -1.17 0.04 0.00 0.00 177.00 176.39 1o5a s LEU 199 N -3.71 2.70 -0.08 -3.56 2.96 0.20 -3.78 118.68 113.41 1o5a s LEU 199 Ca 0.47 -1.14 0.04 0.00 -0.22 0.00 0.00 54.13 53.28 1o5a s LEU 199 Cb -0.10 -1.30 -0.02 0.00 0.50 0.00 0.00 46.19 45.27 1o5a s LEU 199 CO 0.31 -0.19 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.27 1o5a s VAL 200 N 1.32 2.65 0.07 1.68 1.01 -0.35 -0.95 120.40 125.82 1o5a s VAL 200 Ca -0.05 -0.85 0.00 0.00 0.00 0.00 0.00 61.98 61.09 1o5a s VAL 200 Cb -0.18 -2.03 -0.04 0.00 0.00 0.00 0.00 36.38 34.12 1o5a s VAL 200 CO -0.07 0.56 -0.05 0.00 0.00 0.00 0.00 175.10 175.55 1o5a s SER 202 N -2.88 6.90 -0.05 0.00 0.01 -1.26 -0.48 113.70 115.93 1o5a s SER 202 Ca 0.08 1.07 -0.00 0.00 1.31 0.00 0.00 55.95 58.41 1o5a s SER 202 Cb 0.06 -2.35 0.03 0.00 0.21 0.00 0.00 66.02 63.97 1o5a s SER 202 CO -0.07 0.06 -0.01 -0.22 0.41 0.00 0.00 173.24 173.40 1o5a s LEU 203 N 0.10 0.95 -1.36 2.44 0.20 0.19 -4.78 118.68 116.42 1o5a s LEU 203 Ca 0.30 -0.08 -0.08 0.00 0.69 0.00 0.00 54.13 54.96 1o5a s LEU 203 Cb -0.17 -0.38 0.05 0.00 -0.43 0.00 0.00 46.19 45.26 1o5a s LEU 203 CO 0.15 -0.13 0.54 0.00 -0.29 0.00 0.00 176.35 176.63 1o5a n GLN 204 N 4.55 -3.88 -0.33 1.98 6.02 -1.26 -0.70 117.38 123.75 1o5a n GLN 204 Ca -0.17 0.60 0.00 0.00 -0.01 0.00 0.00 57.00 57.41 1o5a n GLN 204 Cb 0.50 -5.35 0.00 0.00 1.02 0.00 0.00 30.24 26.41 1o5a n GLN 204 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1o5a n GLY 205 N -1.29 1.29 3.59 1.08 0.00 -1.26 -5.04 105.19 103.55 1o5a n GLY 205 Ca -0.04 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.70 1o5a n GLY 205 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1o5a s ARG 206 N -0.38 2.13 -0.23 1.61 0.52 0.12 -5.06 118.95 117.67 1o5a s ARG 206 Ca 0.00 -1.12 -0.26 0.00 -0.52 0.00 0.00 55.73 53.83 1o5a s ARG 206 Cb 0.00 -2.26 -0.00 0.00 0.52 0.00 0.00 34.95 33.21 1o5a s ARG 206 CO 0.00 0.47 0.87 -1.64 0.02 0.00 0.00 175.30 175.02 1o5a s MET 207 N -2.52 4.22 0.14 3.54 -1.94 -1.26 0.57 119.30 122.05 1o5a s MET 207 Ca 0.23 1.04 0.10 0.00 -1.71 0.00 0.00 55.69 55.35 1o5a s MET 207 Cb -0.10 -3.63 -0.04 0.00 2.01 0.00 0.00 34.83 33.07 1o5a s MET 207 CO 0.15 -0.51 -0.23 0.99 -0.01 0.00 0.00 175.02 175.41 1o5a s THR 208 N 2.79 2.50 -0.77 2.05 2.01 0.36 -3.31 115.64 121.26 1o5a s THR 208 Ca 0.37 -1.72 -0.27 0.00 0.31 0.00 0.00 61.69 60.39 1o5a s THR 208 Cb -0.15 -2.14 0.03 0.00 0.01 0.00 0.00 72.50 70.25 1o5a s THR 208 CO 0.08 0.05 1.30 -0.22 -0.69 0.00 0.00 174.62 175.14 1o5a s LEU 209 N -2.21 3.20 -0.09 4.42 0.20 0.58 -2.09 118.68 122.67 1o5a s LEU 209 Ca 0.17 -0.55 0.04 0.00 0.69 0.00 0.00 54.13 54.47 1o5a s LEU 209 Cb -0.10 -2.56 -0.24 0.00 -0.43 0.00 0.00 46.19 42.86 1o5a s LEU 209 CO 0.08 -1.81 0.47 0.41 -0.29 0.00 0.00 176.35 175.21 1o5a n THR 210 N 6.44 1.67 -4.06 3.68 -1.04 -0.13 -4.34 114.28 116.50 1o5a n THR 210 Ca 0.06 -0.73 -0.10 0.00 -2.04 0.00 0.00 64.05 61.24 1o5a n THR 210 Cb 0.49 -1.33 -0.07 0.00 -1.82 0.00 0.00 70.33 67.59 1o5a n THR 210 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 1o5a s GLY 211 N -5.40 0.85 -0.10 3.41 0.00 -0.80 -3.03 107.32 102.25 1o5a s GLY 211 Ca -0.14 -1.18 0.03 0.00 0.00 0.00 0.00 44.72 43.42 1o5a s GLY 211 CO 0.79 -0.97 -0.19 -0.42 0.00 0.00 0.00 173.10 172.31 1o5a s ILE 212 N -4.06 1.76 0.10 0.90 1.01 -1.16 -0.63 121.20 119.11 1o5a s ILE 212 Ca 0.27 -0.82 -0.31 0.00 0.00 0.00 0.00 60.65 59.79 1o5a s ILE 212 Cb 0.03 -1.56 -0.11 0.00 0.01 0.00 0.00 42.46 40.84 1o5a s ILE 212 CO 0.08 0.49 1.86 0.52 0.00 0.00 0.00 174.94 177.89 1o5a n VAL 213 N 3.87 0.44 0.03 2.92 0.31 0.08 -1.62 118.33 124.35 1o5a n VAL 213 Ca -0.20 -0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.05 1o5a n VAL 213 Cb 0.52 -2.13 0.00 0.00 -0.91 0.00 0.00 33.84 31.31 1o5a n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1o5a n SER 214 N 5.98 0.60 -3.08 4.52 2.88 -0.85 -0.97 113.62 122.70 1o5a n SER 214 Ca 0.19 0.08 -0.13 0.00 -1.33 0.00 0.00 58.87 57.68 1o5a n SER 214 Cb 0.37 -0.18 -0.01 0.00 -0.75 0.00 0.00 64.21 63.64 1o5a n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1o5a s TRP 215 N -1.55 0.72 0.00 0.66 1.48 -1.10 -4.89 118.94 114.26 1o5a s TRP 215 Ca 0.00 -1.12 0.00 0.00 -1.06 0.00 0.00 56.10 53.92 1o5a s TRP 215 Cb 0.00 0.27 0.00 0.00 -1.16 0.00 0.00 33.47 32.58 1o5a s TRP 215 CO 0.00 -1.32 0.00 0.41 -4.06 0.00 0.00 176.95 171.98 1o5a n GLY 216 N -0.56 0.86 3.58 3.67 0.00 -1.26 -0.68 105.19 110.80 1o5a n GLY 216 Ca -0.03 -0.43 -0.41 0.00 0.00 0.00 0.00 46.02 45.15 1o5a n GLY 216 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1o5a s ARG 217 N -2.00 3.80 2.55 1.61 3.52 -1.26 -4.87 118.95 122.31 1o5a s ARG 217 Ca 0.00 0.02 0.00 0.00 -0.13 0.00 0.00 55.73 55.62 1o5a s ARG 217 Cb 0.00 -3.74 0.00 0.00 -1.56 0.00 0.00 34.95 29.65 1o5a s ARG 217 CO 0.00 -0.52 0.00 0.41 -0.81 0.00 0.00 175.30 174.38 1o5a n GLY 219 N 4.65 -0.31 3.01 8.12 0.00 -1.26 -4.68 105.19 114.73 1o5a n GLY 219 Ca -0.05 -1.07 -0.13 0.00 0.00 0.00 0.00 46.02 44.77 1o5a n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o5a n ALA 221 N 4.45 -1.55 -2.78 0.00 0.00 -1.26 -4.90 120.51 114.46 1o5a n ALA 221 Ca -0.22 0.15 -0.34 0.00 0.00 0.00 0.00 53.44 53.04 1o5a n ALA 221 Cb 0.52 -4.01 -0.05 0.00 0.00 0.00 0.00 19.45 15.91 1o5a n ALA 221 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1o5a s LEU 222 N -7.03 4.36 0.27 0.00 1.43 -1.26 -4.75 118.68 111.71 1o5a s LEU 222 Ca 0.41 0.51 -0.30 0.00 -1.03 0.00 0.00 54.13 53.72 1o5a s LEU 222 Cb -0.19 -2.73 -0.11 0.00 0.03 0.00 0.00 46.19 43.19 1o5a s LEU 222 CO 0.78 0.23 1.58 -0.75 0.23 0.00 0.00 176.35 178.42 1o5a s LYS 223 N -1.89 4.15 -1.75 1.70 2.20 -1.26 -2.07 119.74 120.81 1o5a s LYS 223 Ca 0.29 2.53 0.00 0.00 -0.36 0.00 0.00 55.97 58.43 1o5a s LYS 223 Cb -0.13 -3.05 0.00 0.00 -1.51 0.00 0.00 37.83 33.14 1o5a s LYS 223 CO 0.18 -0.61 0.00 -0.25 -0.36 0.00 0.00 175.35 174.31 1o5a n ASP 223 N 2.40 -5.06 -3.58 1.43 8.00 -1.26 -4.94 116.55 113.55 1o5a n ASP 223 Ca 0.09 0.34 -0.28 0.00 0.71 0.00 0.00 54.79 55.65 1o5a n ASP 223 Cb 0.38 -4.09 -0.11 0.00 -0.02 0.00 0.00 41.12 37.28 1o5a n ASP 223 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1o5a s LYS 224 N -3.72 1.33 1.06 -1.24 -0.14 -0.88 -4.31 119.74 111.84 1o5a s LYS 224 Ca 0.00 -2.34 -0.13 0.00 -1.36 0.00 0.00 55.97 52.15 1o5a s LYS 224 Cb 0.00 -2.06 0.22 0.00 -1.68 0.00 0.00 37.83 34.32 1o5a s LYS 224 CO 0.00 -1.31 1.07 -2.14 -0.76 0.00 0.00 175.35 172.21 1o5a s PRO 225 N -0.18 -0.08 0.26 -1.68 0.02 -1.26 -4.28 135.00 127.79 1o5a s PRO 225 Ca 0.27 0.56 -0.10 0.00 0.02 0.00 0.00 61.00 61.76 1o5a s PRO 225 Cb -0.05 -1.67 -0.07 0.00 0.02 0.00 0.00 34.50 32.72 1o5a s PRO 225 CO -0.14 -3.09 0.59 0.20 -0.33 0.00 0.00 177.00 174.23 1o5a s GLY 226 N -3.20 2.21 -0.06 0.52 0.00 -0.39 -4.53 107.32 101.87 1o5a s GLY 226 Ca 0.66 -0.26 0.02 0.00 0.00 0.00 0.00 44.72 45.14 1o5a s GLY 226 CO 0.60 -0.12 -0.12 0.14 0.00 0.00 0.00 173.10 173.60 1o5a s VAL 227 N -1.91 3.29 0.15 1.40 1.01 0.14 -1.85 120.40 122.62 1o5a s VAL 227 Ca 0.48 -0.63 0.07 0.00 0.00 0.00 0.00 61.98 61.89 1o5a s VAL 227 Cb -0.11 -2.31 -0.04 0.00 0.00 0.00 0.00 36.38 33.92 1o5a s VAL 227 CO 0.22 0.59 -0.14 -0.31 0.00 0.00 0.00 175.10 175.46 1o5a s TYR 228 N -0.69 1.52 0.23 5.22 1.51 0.31 -2.01 117.35 123.44 1o5a s TYR 228 Ca 0.10 -0.57 -0.30 0.00 -1.01 0.00 0.00 57.07 55.30 1o5a s TYR 228 Cb -0.11 -0.76 -0.09 0.00 -0.11 0.00 0.00 41.96 40.89 1o5a s TYR 228 CO 0.01 0.21 0.97 0.99 -1.11 0.00 0.00 175.55 176.63 1o5a s THR 229 N -2.43 4.01 -0.94 -0.71 2.01 -0.64 -0.85 115.64 116.10 1o5a s THR 229 Ca 0.14 1.97 -0.19 0.00 0.31 0.00 0.00 61.69 63.92 1o5a s THR 229 Cb -0.03 -4.26 0.12 0.00 0.01 0.00 0.00 72.50 68.34 1o5a s THR 229 CO 0.04 0.45 1.16 -0.60 -0.69 0.00 0.00 174.62 174.98 1o5a s ARG 230 N -1.07 3.59 0.30 4.92 3.52 -0.49 -3.00 118.95 126.72 1o5a s ARG 230 Ca 0.43 -1.68 0.06 0.00 -0.13 0.00 0.00 55.73 54.40 1o5a s ARG 230 Cb -0.27 -4.96 0.76 0.00 -1.56 0.00 0.00 34.95 28.93 1o5a s ARG 230 CO 0.33 -1.82 1.74 0.28 -0.81 0.00 0.00 175.30 175.02 1o5a h VAL 231 N 5.94 0.60 -0.12 7.11 2.07 -1.85 -1.20 116.25 128.81 1o5a h VAL 231 Ca 0.16 -0.21 0.04 0.00 0.82 0.00 0.00 66.70 67.50 1o5a h VAL 231 Cb 1.02 -0.06 -0.00 0.00 -1.52 0.00 0.00 31.29 30.73 1o5a h VAL 231 CO 1.14 0.11 0.16 0.77 0.02 0.00 0.00 177.57 179.77 1o5a h SER 232 N 0.60 0.00 -0.11 0.57 4.64 -1.85 0.61 113.55 118.02 1o5a h SER 232 Ca 0.58 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.90 1o5a h SER 232 Cb 1.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.11 1o5a h SER 232 CO -0.44 0.00 0.00 1.41 -0.87 0.00 0.00 176.83 176.93 1o5a n HIS 233 N -3.69 0.13 0.06 4.77 -0.00 -0.45 -1.69 115.22 114.35 1o5a n HIS 233 Ca 0.00 -0.06 0.02 0.00 -0.00 0.00 0.00 57.72 57.68 1o5a n HIS 233 Cb 0.26 0.00 0.04 0.00 -0.00 0.00 0.00 29.99 30.30 1o5a n HIS 233 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.34 177.53 1o5a n PHE 234 N 0.46 0.10 -0.32 4.41 3.01 0.19 -4.79 117.46 120.54 1o5a n PHE 234 Ca 0.17 -0.26 0.09 0.00 1.01 0.00 0.00 57.45 58.47 1o5a n PHE 234 Cb 0.39 -0.02 0.26 0.00 -0.01 0.00 0.00 39.48 40.10 1o5a n PHE 234 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 1o5a h LEU 235 N 0.91 0.63 -0.61 4.37 -0.00 -1.64 -0.12 115.31 118.84 1o5a h LEU 235 Ca 0.00 0.09 0.02 0.00 -0.00 0.00 0.00 57.88 58.00 1o5a h LEU 235 Cb 0.41 -0.01 -0.04 0.00 -0.00 0.00 0.00 40.66 41.02 1o5a h LEU 235 CO 0.00 0.25 0.38 -0.65 -0.00 0.00 0.00 178.44 178.42 1o5a h PRO 236 N 0.68 0.73 0.35 1.13 0.11 -1.90 -0.76 132.00 132.34 1o5a h PRO 236 Ca 0.50 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.55 1o5a h PRO 236 Cb 0.73 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 31.68 1o5a h PRO 236 CO -0.37 0.49 -0.17 2.35 -0.21 0.00 0.00 178.00 180.09 1o5a h TRP 237 N 0.76 -0.43 0.07 0.65 7.01 -1.53 0.16 115.95 122.63 1o5a h TRP 237 Ca 0.24 -0.01 0.02 0.00 2.11 0.00 0.00 58.89 61.25 1o5a h TRP 237 Cb -0.00 0.14 -0.05 0.00 -2.10 0.00 0.00 29.16 27.15 1o5a h TRP 237 CO -0.05 -0.21 -0.50 0.82 -2.79 0.00 0.00 178.44 175.71 1o5a h ILE 238 N -0.56 0.05 -0.56 2.65 2.04 -0.98 -1.24 117.51 118.90 1o5a h ILE 238 Ca -0.05 0.00 0.11 0.00 1.00 0.00 0.00 64.86 65.92 1o5a h ILE 238 Cb 0.42 0.05 -0.11 0.00 -0.74 0.00 0.00 36.82 36.43 1o5a h ILE 238 CO 0.08 0.00 -0.29 0.03 0.00 0.00 0.00 178.15 177.96 1o5a h ARG 239 N -0.69 -0.14 -1.53 2.37 3.08 -1.00 0.68 114.38 117.15 1o5a h ARG 239 Ca 0.01 0.01 0.47 0.00 0.07 0.00 0.00 59.98 60.54 1o5a h ARG 239 Cb 0.73 0.03 -0.10 0.00 0.08 0.00 0.00 29.97 30.71 1o5a h ARG 239 CO -0.31 -0.09 1.05 0.77 -1.07 0.00 0.00 179.97 180.32 1o5a h SER 240 N -0.15 0.13 0.00 7.04 0.02 0.56 -2.32 113.55 118.83 1o5a h SER 240 Ca 0.24 0.07 -0.05 0.00 -0.84 0.00 0.00 61.79 61.21 1o5a h SER 240 Cb 0.53 0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.12 1o5a h SER 240 CO -0.65 -0.08 -1.56 1.41 -1.14 0.00 0.00 176.83 174.81 1o5a n HIS 241 N -4.35 0.00 -3.55 3.45 8.25 0.06 -4.72 115.22 114.36 1o5a n HIS 241 Ca 0.38 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.47 1o5a n HIS 241 Cb 1.60 -0.32 -0.05 0.00 1.12 0.00 0.00 29.99 32.33 1o5a n HIS 241 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 1o5a n THR 242 N -2.01 3.28 -0.72 1.59 -1.04 -0.19 -5.13 114.28 110.05 1o5a n THR 242 Ca -0.06 -5.21 0.00 0.00 -2.04 0.00 0.00 64.05 56.74 1o5a n THR 242 Cb 0.42 -2.35 0.00 0.00 -1.82 0.00 0.00 70.33 66.58 1o5a n THR 242 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60