#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3biv s VAL 17 N 0.00 5.22 -1.17 1.39 1.01 0.20 -4.24 120.40 122.81 3biv s VAL 17 Ca 0.00 0.79 -0.01 0.00 0.00 0.00 0.00 61.98 62.77 3biv s VAL 17 Cb 0.00 -3.74 0.00 0.00 0.00 0.00 0.00 36.38 32.64 3biv s VAL 17 CO 0.00 0.37 0.09 -0.62 0.00 0.00 0.00 175.10 174.94 3biv n GLU 18 N 3.46 -1.60 0.00 2.72 -0.58 -1.26 -2.26 120.64 121.12 3biv n GLU 18 Ca -0.09 0.67 0.00 0.00 -0.42 0.00 0.00 57.16 57.31 3biv n GLU 18 Cb 0.52 -4.94 0.00 0.00 -0.57 0.00 0.00 31.44 26.44 3biv n GLU 18 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3biv n GLY 19 N -1.07 2.18 3.26 0.62 0.00 -1.26 -4.54 105.19 104.37 3biv n GLY 19 Ca -0.15 -1.99 -0.10 0.00 0.00 0.00 0.00 46.02 43.78 3biv n GLY 19 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3biv s SER 20 N -0.89 0.14 0.31 1.61 1.04 -0.05 -4.91 113.70 110.96 3biv s SER 20 Ca 0.00 -1.16 -0.30 0.00 0.48 0.00 0.00 55.95 54.97 3biv s SER 20 Cb 0.00 0.39 -0.11 0.00 0.10 0.00 0.00 66.02 66.40 3biv s SER 20 CO 0.00 -0.85 1.58 0.47 0.98 0.00 0.00 173.24 175.41 3biv n ASP 21 N -0.22 3.86 -4.79 7.02 9.92 -1.26 -0.38 116.55 130.70 3biv n ASP 21 Ca -0.03 1.16 -0.32 0.00 -0.53 0.00 0.00 54.79 55.07 3biv n ASP 21 Cb 0.64 -1.60 0.03 0.00 -0.64 0.00 0.00 41.12 39.55 3biv n ASP 21 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3biv s ALA 22 N -0.23 2.60 0.62 2.24 0.00 0.93 -4.74 121.76 123.17 3biv s ALA 22 Ca 0.62 0.40 -0.13 0.00 0.00 0.00 0.00 51.96 52.85 3biv s ALA 22 Cb -0.49 -3.26 -0.03 0.00 0.00 0.00 0.00 23.12 19.34 3biv s ALA 22 CO 0.52 -1.09 1.04 -1.21 0.00 0.00 0.00 175.76 175.01 3biv s GLU 23 N -4.25 3.39 0.17 0.00 2.02 -1.26 -4.94 118.70 113.83 3biv s GLU 23 Ca 0.64 0.97 -0.32 0.00 0.02 0.00 0.00 54.97 56.28 3biv s GLU 23 Cb -0.17 -2.05 -0.11 0.00 0.10 0.00 0.00 34.13 31.90 3biv s GLU 23 CO 0.42 -0.73 1.69 0.42 0.02 0.00 0.00 175.26 177.08 3biv s ILE 24 N -2.85 2.37 0.00 -1.63 -1.09 -1.26 -2.20 121.20 114.54 3biv s ILE 24 Ca 0.59 0.18 0.00 0.00 -2.23 0.00 0.00 60.65 59.19 3biv s ILE 24 Cb -0.13 -3.12 0.00 0.00 -1.58 0.00 0.00 42.46 37.63 3biv s ILE 24 CO 0.45 0.01 0.00 0.61 -1.23 0.00 0.00 174.94 174.79 3biv n GLY 25 N 3.97 0.53 0.21 6.18 0.00 -1.26 -4.90 105.19 109.92 3biv n GLY 25 Ca 0.16 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.16 3biv n GLY 25 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 3biv h MET 26 N 1.32 0.27 -1.96 1.61 -1.53 -1.82 -3.36 114.93 109.46 3biv h MET 26 Ca 0.00 -0.11 -0.54 0.00 -3.44 0.00 0.00 59.70 55.61 3biv h MET 26 Cb 0.13 -0.01 -0.39 0.00 -0.55 0.00 0.00 31.60 30.78 3biv h MET 26 CO 0.00 0.57 -1.11 0.45 0.14 0.00 0.00 176.91 176.96 3biv n SER 27 N -4.09 0.22 0.00 1.39 2.88 -1.26 -4.98 113.62 107.78 3biv n SER 27 Ca -0.01 -2.75 0.12 0.00 -1.33 0.00 0.00 58.87 54.89 3biv n SER 27 Cb 0.42 -0.59 0.67 0.00 -0.75 0.00 0.00 64.21 63.96 3biv n SER 27 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 3biv n PRO 28 N 1.23 0.56 0.00 -1.46 -0.04 -1.26 -0.83 135.00 133.19 3biv n PRO 28 Ca 0.21 0.03 0.13 0.00 -0.04 0.00 0.00 63.50 63.84 3biv n PRO 28 Cb 0.55 -1.50 0.44 0.00 -0.04 0.00 0.00 33.50 32.96 3biv n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 3biv n TRP 29 N -1.14 0.00 -2.03 0.54 2.14 -0.93 -1.49 117.44 114.52 3biv n TRP 29 Ca 0.15 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.30 3biv n TRP 29 Cb 0.14 -0.07 -0.03 0.00 -0.81 0.00 0.00 31.31 30.54 3biv n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 3biv s GLN 30 N -2.29 4.25 -0.02 -2.67 2.00 -0.01 -0.54 119.66 120.37 3biv s GLN 30 Ca 0.30 2.23 0.07 0.00 -2.00 0.00 0.00 55.36 55.95 3biv s GLN 30 Cb 0.20 -3.33 -0.02 0.00 0.80 0.00 0.00 33.01 30.66 3biv s GLN 30 CO 0.44 -0.58 -0.22 0.08 -0.50 0.00 0.00 175.29 174.51 3biv s VAL 31 N 1.60 2.44 -0.26 1.34 1.01 -0.09 -3.98 120.40 122.45 3biv s VAL 31 Ca 0.69 -1.03 -0.09 0.00 0.00 0.00 0.00 61.98 61.54 3biv s VAL 31 Cb -0.39 -1.91 -0.04 0.00 0.00 0.00 0.00 36.38 34.03 3biv s VAL 31 CO 0.31 0.54 0.13 -0.32 0.00 0.00 0.00 175.10 175.75 3biv s MET 32 N -0.80 3.84 -0.17 2.72 1.75 -0.44 -1.64 119.30 124.57 3biv s MET 32 Ca 0.11 -0.38 -0.27 0.00 -1.25 0.00 0.00 55.69 53.90 3biv s MET 32 Cb -0.10 -3.49 -0.01 0.00 2.84 0.00 0.00 34.83 34.07 3biv s MET 32 CO 0.00 -0.14 0.91 -1.17 -0.65 0.00 0.00 175.02 173.98 3biv s LEU 33 N 1.56 4.17 -0.10 4.11 2.96 -0.16 -0.45 118.68 130.77 3biv s LEU 33 Ca 0.06 1.28 0.03 0.00 -0.22 0.00 0.00 54.13 55.29 3biv s LEU 33 Cb -0.15 -3.36 0.01 0.00 0.50 0.00 0.00 46.19 43.18 3biv s LEU 33 CO 0.07 -0.47 -0.20 0.12 -1.32 0.00 0.00 176.35 174.55 3biv s PHE 34 N 2.36 2.26 0.12 5.38 5.36 0.38 -0.48 117.98 133.36 3biv s PHE 34 Ca 0.41 -0.94 -0.30 0.00 -0.96 0.00 0.00 56.93 55.15 3biv s PHE 34 Cb -0.17 -1.54 -0.06 0.00 -0.34 0.00 0.00 43.02 40.91 3biv s PHE 34 CO 0.12 -0.40 0.99 0.50 -1.46 0.00 0.00 175.22 174.96 3biv s ARG 35 N 0.50 4.67 -0.00 10.12 3.52 0.26 -1.83 118.95 136.20 3biv s ARG 35 Ca -0.16 1.50 -0.25 0.00 -0.13 0.00 0.00 55.73 56.69 3biv s ARG 35 Cb -0.17 -3.36 -0.19 0.00 -1.56 0.00 0.00 34.95 29.67 3biv s ARG 35 CO 0.06 0.18 1.32 0.87 -0.81 0.00 0.00 175.30 176.92 3biv h LYS 36 N 5.57 0.08 -2.21 5.12 1.57 -1.78 -3.09 116.57 121.84 3biv h LYS 36 Ca -0.43 -0.04 -0.16 0.00 -1.87 0.00 0.00 60.65 58.15 3biv h LYS 36 Cb 1.21 -0.00 -0.30 0.00 0.08 0.00 0.00 32.23 33.22 3biv h LYS 36 CO 0.72 0.51 -0.47 -1.12 -0.57 0.00 0.00 179.45 178.52 3biv s SER 36 N -5.75 0.23 0.49 0.86 0.01 -1.26 -3.46 113.70 104.82 3biv s SER 36 Ca -0.15 0.41 -0.14 0.00 1.31 0.00 0.00 55.95 57.38 3biv s SER 36 Cb 0.03 1.06 -0.07 0.00 0.21 0.00 0.00 66.02 67.25 3biv s SER 36 CO 0.69 -0.28 0.91 -2.16 0.41 0.00 0.00 173.24 172.81 3biv s PRO 37 N 2.53 3.85 -0.58 12.44 0.04 -1.26 -5.06 135.00 146.95 3biv s PRO 37 Ca 0.07 0.75 -0.27 0.00 0.04 0.00 0.00 61.00 61.60 3biv s PRO 37 Cb -0.14 -2.22 -0.02 0.00 0.04 0.00 0.00 34.50 32.16 3biv s PRO 37 CO -0.14 -0.22 1.82 -0.65 0.04 0.00 0.00 177.00 177.85 3biv s GLN 38 N -4.12 2.75 0.12 4.56 -0.21 -1.23 -4.58 119.66 116.94 3biv s GLN 38 Ca 0.56 0.67 -0.01 0.00 0.02 0.00 0.00 55.36 56.60 3biv s GLN 38 Cb -0.10 -4.35 -0.04 0.00 1.00 0.00 0.00 33.01 29.52 3biv s GLN 38 CO 0.34 -2.59 0.03 -1.83 -2.12 0.00 0.00 175.29 169.12 3biv s GLU 39 N 6.79 0.87 0.05 2.91 -1.05 -1.17 -4.96 118.70 122.14 3biv s GLU 39 Ca 0.67 -1.40 -0.31 0.00 -0.15 0.00 0.00 54.97 53.79 3biv s GLU 39 Cb -0.13 0.17 -0.07 0.00 -0.44 0.00 0.00 34.13 33.66 3biv s GLU 39 CO 0.22 -0.21 1.43 -1.17 0.95 0.00 0.00 175.26 176.49 3biv s LEU 40 N -3.03 4.34 -0.24 1.83 2.96 -1.26 -0.57 118.68 122.71 3biv s LEU 40 Ca 0.20 2.23 -0.12 0.00 -0.22 0.00 0.00 54.13 56.22 3biv s LEU 40 Cb 0.07 -3.57 -0.16 0.00 0.50 0.00 0.00 46.19 43.03 3biv s LEU 40 CO -0.01 -0.72 -0.10 -0.11 -1.32 0.00 0.00 176.35 174.08 3biv n LEU 41 N 4.97 2.22 -3.80 -0.68 0.00 0.37 -4.83 117.00 115.25 3biv n LEU 41 Ca 0.13 0.25 -0.00 0.00 0.00 0.00 0.00 56.01 56.39 3biv n LEU 41 Cb 0.43 -0.91 0.00 0.00 0.00 0.00 0.00 43.42 42.94 3biv n LEU 41 CO 0.59 0.61 0.96 0.00 0.00 0.00 0.00 177.39 179.55 3biv s GLY 43 N -3.29 1.77 0.04 0.00 0.00 0.18 -0.99 107.32 105.03 3biv s GLY 43 Ca 0.20 -1.38 -0.27 0.00 0.00 0.00 0.00 44.72 43.26 3biv s GLY 43 CO 0.00 -0.95 1.20 0.00 0.00 0.00 0.00 173.10 173.36 3biv s ALA 44 N -3.06 -2.14 0.02 3.20 0.00 -0.65 -3.88 121.76 115.25 3biv s ALA 44 Ca 0.62 0.12 -0.02 0.00 0.00 0.00 0.00 51.96 52.67 3biv s ALA 44 Cb -0.08 0.71 -0.01 0.00 0.00 0.00 0.00 23.12 23.73 3biv s ALA 44 CO 0.43 -1.10 0.02 -1.54 0.00 0.00 0.00 175.76 173.57 3biv s SER 45 N -3.44 0.19 -0.21 0.00 1.04 0.15 -0.92 113.70 110.51 3biv s SER 45 Ca 0.23 -0.43 -0.21 0.00 0.48 0.00 0.00 55.95 56.01 3biv s SER 45 Cb 0.00 0.14 -0.02 0.00 0.10 0.00 0.00 66.02 66.23 3biv s SER 45 CO 0.00 -0.34 0.63 -0.22 0.98 0.00 0.00 173.24 174.29 3biv s LEU 46 N -1.50 4.13 0.00 2.42 2.96 0.29 -0.75 118.68 126.23 3biv s LEU 46 Ca -0.15 0.81 0.03 0.00 -0.22 0.00 0.00 54.13 54.61 3biv s LEU 46 Cb -0.09 -2.88 0.01 0.00 0.50 0.00 0.00 46.19 43.74 3biv s LEU 46 CO -0.01 -0.29 0.50 2.30 -1.32 0.00 0.00 176.35 177.53 3biv n ILE 47 N 4.76 0.00 -3.42 6.68 -5.35 -0.56 -1.77 119.36 119.70 3biv n ILE 47 Ca -0.01 -0.49 -0.01 0.00 -0.27 0.00 0.00 62.75 61.97 3biv n ILE 47 Cb 0.50 1.05 0.00 0.00 -1.74 0.00 0.00 39.64 39.45 3biv n ILE 47 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 3biv n SER 48 N -0.09 -0.35 -0.00 7.28 3.41 -1.14 -4.80 113.62 117.93 3biv n SER 48 Ca 0.02 -1.20 0.15 0.00 -0.26 0.00 0.00 58.87 57.57 3biv n SER 48 Cb 0.07 0.57 0.74 0.00 -0.26 0.00 0.00 64.21 65.34 3biv n SER 48 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3biv n ASP 49 N -0.81 0.01 0.00 4.04 3.85 -1.26 -3.78 116.55 118.60 3biv n ASP 49 Ca -0.01 -0.08 0.00 0.00 -0.71 0.00 0.00 54.79 53.99 3biv n ASP 49 Cb 0.11 -0.30 0.00 0.00 -1.35 0.00 0.00 41.12 39.58 3biv n ASP 49 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 3biv n ARG 50 N -1.30 0.32 -4.91 0.11 1.74 -1.26 -0.13 116.66 111.24 3biv n ARG 50 Ca 0.13 -0.50 -0.27 0.00 -0.77 0.00 0.00 57.85 56.44 3biv n ARG 50 Cb 0.25 -0.67 -0.16 0.00 -1.02 0.00 0.00 32.46 30.86 3biv n ARG 50 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 3biv s TRP 51 N -0.17 1.89 -0.07 -1.55 0.52 -1.25 -0.84 118.94 117.47 3biv s TRP 51 Ca 0.00 -0.60 0.05 0.00 0.02 0.00 0.00 56.10 55.57 3biv s TRP 51 Cb 0.00 -1.28 -0.01 0.00 -1.15 0.00 0.00 33.47 31.03 3biv s TRP 51 CO 0.00 -0.22 -0.23 0.08 0.02 0.00 0.00 176.95 176.60 3biv s VAL 52 N 0.15 2.23 -0.11 4.03 1.01 -0.41 -1.50 120.40 125.79 3biv s VAL 52 Ca -0.07 -0.99 -0.04 0.00 0.00 0.00 0.00 61.98 60.87 3biv s VAL 52 Cb -0.13 -1.83 -0.04 0.00 0.00 0.00 0.00 36.38 34.38 3biv s VAL 52 CO 0.04 0.57 0.05 -0.22 0.00 0.00 0.00 175.10 175.53 3biv s LEU 53 N -0.05 3.83 0.00 3.92 2.96 0.07 -0.75 118.68 128.66 3biv s LEU 53 Ca -0.06 0.21 0.00 0.00 -0.22 0.00 0.00 54.13 54.06 3biv s LEU 53 Cb -0.15 -1.91 0.00 0.00 0.50 0.00 0.00 46.19 44.63 3biv s LEU 53 CO 0.05 0.34 0.00 1.07 -1.32 0.00 0.00 176.35 176.49 3biv n THR 54 N 2.38 0.00 -3.49 3.68 5.66 -0.44 -0.68 114.28 121.39 3biv n THR 54 Ca -0.19 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.44 3biv n THR 54 Cb 0.54 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.26 3biv n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3biv s ALA 55 N -1.52 3.67 0.34 1.79 0.00 -1.26 -1.52 121.76 123.26 3biv s ALA 55 Ca 0.00 -0.24 0.05 0.00 0.00 0.00 0.00 51.96 51.77 3biv s ALA 55 Cb 0.00 -2.41 0.68 0.00 0.00 0.00 0.00 23.12 21.39 3biv s ALA 55 CO 0.00 0.41 1.92 0.00 0.00 0.00 0.00 175.76 178.08 3biv h ALA 56 N 5.07 1.66 0.00 0.00 0.00 -1.67 -1.35 119.26 122.97 3biv h ALA 56 Ca -0.50 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3biv h ALA 56 Cb 1.21 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.80 3biv h ALA 56 CO 0.64 0.18 0.00 -2.39 0.00 0.00 0.00 179.25 177.68 3biv n HIS 57 N -4.50 0.79 0.28 0.00 1.44 -1.26 -0.36 115.22 111.60 3biv n HIS 57 Ca 0.13 0.37 0.16 0.00 -2.01 0.00 0.00 57.72 56.37 3biv n HIS 57 Cb 0.28 -1.09 0.72 0.00 0.12 0.00 0.00 29.99 30.02 3biv n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3biv n LEU 59 N -3.19 2.45 -3.83 0.00 4.77 0.51 -4.85 117.00 112.85 3biv n LEU 59 Ca -0.00 -0.03 -0.29 0.00 -0.03 0.00 0.00 56.01 55.65 3biv n LEU 59 Cb 0.29 -0.20 -0.16 0.00 -2.33 0.00 0.00 43.42 41.02 3biv n LEU 59 CO 0.28 0.54 -0.39 -0.22 -1.33 0.00 0.00 177.39 176.27 3biv s LEU 60 N -5.27 1.91 0.11 2.23 2.96 -0.35 0.13 118.68 120.41 3biv s LEU 60 Ca -0.09 -1.04 -0.12 0.00 -0.22 0.00 0.00 54.13 52.66 3biv s LEU 60 Cb 0.03 -0.89 0.01 0.00 0.50 0.00 0.00 46.19 45.84 3biv s LEU 60 CO 0.19 -0.28 0.30 -0.47 -1.32 0.00 0.00 176.35 174.77 3biv s TYR 60 N 1.62 0.01 0.00 5.38 5.04 0.13 -4.13 117.35 125.40 3biv s TYR 60 Ca -0.03 -0.38 0.00 0.00 -2.44 0.00 0.00 57.07 54.22 3biv s TYR 60 Cb -0.18 0.09 0.00 0.00 0.35 0.00 0.00 41.96 42.22 3biv s TYR 60 CO -0.08 -0.63 0.00 -2.30 -1.34 0.00 0.00 175.55 171.20 3biv n PRO 60 N -0.15 0.00 -0.44 4.97 -0.02 -1.26 -2.00 135.00 136.10 3biv n PRO 60 Ca -0.15 0.00 0.08 0.00 -2.02 0.00 0.00 63.50 61.41 3biv n PRO 60 Cb 0.63 0.00 0.26 0.00 -0.02 0.00 0.00 33.50 34.37 3biv n PRO 60 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 3biv n TRP 60 N 0.00 0.96 -2.25 6.00 8.01 -1.26 -4.95 117.44 123.95 3biv n TRP 60 Ca 0.00 -0.81 -0.20 0.00 -1.31 0.00 0.00 57.50 55.18 3biv n TRP 60 Cb 0.00 -0.28 -0.02 0.00 -2.01 0.00 0.00 31.31 28.99 3biv n TRP 60 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 3biv n ASP 60 N -0.24 -5.67 -4.64 -0.99 8.00 -1.09 -4.96 116.55 106.96 3biv n ASP 60 Ca 0.20 0.10 -0.38 0.00 0.71 0.00 0.00 54.79 55.42 3biv n ASP 60 Cb 0.85 -4.78 -0.08 0.00 -0.02 0.00 0.00 41.12 37.08 3biv n ASP 60 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 3biv s LYS 60 N -4.79 4.10 -0.34 -1.24 2.20 -0.85 -4.99 119.74 113.83 3biv s LYS 60 Ca 0.00 0.07 0.04 0.00 -0.36 0.00 0.00 55.97 55.72 3biv s LYS 60 Cb 0.00 -3.58 0.16 0.00 -1.51 0.00 0.00 37.83 32.90 3biv s LYS 60 CO 0.00 -0.12 0.44 1.21 -0.36 0.00 0.00 175.35 176.52 3biv s ASN 60 N 1.28 0.30 -0.12 1.43 3.84 -1.22 0.18 114.94 120.63 3biv s ASN 60 Ca 0.16 -0.92 -0.07 0.00 0.21 0.00 0.00 52.86 52.24 3biv s ASN 60 Cb -0.15 1.07 -0.04 0.00 -0.55 0.00 0.00 41.25 41.58 3biv s ASN 60 CO 0.08 -0.28 0.12 -0.36 -2.79 0.00 0.00 177.10 173.87 3biv s PHE 60 N 1.98 3.54 0.51 0.43 0.08 0.12 -5.01 117.98 119.63 3biv s PHE 60 Ca 0.14 0.48 0.06 0.00 0.12 0.00 0.00 56.93 57.73 3biv s PHE 60 Cb -0.12 -1.93 0.02 0.00 -0.57 0.00 0.00 43.02 40.42 3biv s PHE 60 CO -0.15 0.68 0.39 0.95 -0.10 0.00 0.00 175.22 176.99 3biv s THR 60 N -0.94 1.94 0.25 0.64 -4.23 -1.26 -4.88 115.64 107.15 3biv s THR 60 Ca 0.14 -1.46 -0.06 0.00 -1.18 0.00 0.00 61.69 59.13 3biv s THR 60 Cb -0.12 -2.40 0.27 0.00 1.34 0.00 0.00 72.50 71.60 3biv s THR 60 CO 0.04 0.00 1.64 -0.33 -0.54 0.00 0.00 174.62 175.43 3biv h GLU 61 N 0.84 0.12 -0.00 3.99 3.07 -1.93 -0.10 114.58 120.56 3biv h GLU 61 Ca -0.38 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.47 3biv h GLU 61 Cb 1.29 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 29.17 3biv h GLU 61 CO 0.58 0.08 -0.07 -1.71 -1.40 0.00 0.00 179.01 176.48 3biv n ASN 62 N -5.32 0.40 0.04 1.42 2.85 -1.26 -2.68 115.26 110.70 3biv n ASN 62 Ca 0.14 -0.62 0.12 0.00 -0.11 0.00 0.00 54.58 54.10 3biv n ASN 62 Cb 0.48 -0.09 0.48 0.00 1.24 0.00 0.00 39.78 41.89 3biv n ASN 62 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 3biv n ASP 63 N -0.94 0.28 -2.82 1.20 8.00 -0.05 -4.92 116.55 117.29 3biv n ASP 63 Ca 0.16 0.54 -0.13 0.00 0.71 0.00 0.00 54.79 56.06 3biv n ASP 63 Cb 0.25 -0.61 -0.03 0.00 -0.02 0.00 0.00 41.12 40.71 3biv n ASP 63 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3biv n LEU 64 N -1.77 0.00 -3.95 0.64 -0.00 -1.09 -2.29 117.00 108.54 3biv n LEU 64 Ca 0.05 -2.61 -0.10 0.00 -0.00 0.00 0.00 56.01 53.36 3biv n LEU 64 Cb 0.31 2.28 -0.12 0.00 -0.00 0.00 0.00 43.42 45.89 3biv n LEU 64 CO 0.24 -0.59 -0.36 -0.76 -0.00 0.00 0.00 177.39 175.91 3biv s LEU 65 N 0.00 2.17 -0.20 1.47 1.43 -0.76 -4.42 118.68 118.37 3biv s LEU 65 Ca 0.27 -0.35 -0.10 0.00 -1.03 0.00 0.00 54.13 52.92 3biv s LEU 65 Cb -0.01 0.07 -0.05 0.00 0.03 0.00 0.00 46.19 46.24 3biv s LEU 65 CO 0.19 -0.21 0.12 0.68 0.23 0.00 0.00 176.35 177.36 3biv s VAL 66 N -1.03 5.26 -0.22 -1.59 -7.23 -0.21 -0.47 120.40 114.91 3biv s VAL 66 Ca -0.11 0.14 -0.03 0.00 -1.81 0.00 0.00 61.98 60.16 3biv s VAL 66 Cb -0.07 -3.40 -0.00 0.00 0.56 0.00 0.00 36.38 33.46 3biv s VAL 66 CO -0.01 0.43 -0.05 -0.13 -0.31 0.00 0.00 175.10 175.03 3biv s ARG 67 N 0.48 3.28 0.07 4.82 0.52 0.40 -0.26 118.95 128.26 3biv s ARG 67 Ca 0.07 -0.69 0.07 0.00 -0.52 0.00 0.00 55.73 54.67 3biv s ARG 67 Cb -0.12 -2.99 -0.04 0.00 0.52 0.00 0.00 34.95 32.33 3biv s ARG 67 CO -0.01 -0.23 -0.16 0.42 0.02 0.00 0.00 175.30 175.34 3biv s ILE 68 N 1.45 2.96 0.00 1.52 1.01 0.03 -1.33 121.20 126.84 3biv s ILE 68 Ca 0.05 -1.27 0.00 0.00 0.00 0.00 0.00 60.65 59.43 3biv s ILE 68 Cb -0.14 -2.31 0.00 0.00 0.01 0.00 0.00 42.46 40.02 3biv s ILE 68 CO -0.04 0.23 0.00 0.61 0.00 0.00 0.00 174.94 175.74 3biv n GLY 69 N 1.18 0.63 3.85 6.18 0.00 -1.26 -0.89 105.19 114.90 3biv n GLY 69 Ca -0.15 -0.27 -0.32 0.00 0.00 0.00 0.00 46.02 45.28 3biv n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3biv s LYS 70 N -0.70 3.92 0.11 1.61 1.02 -1.26 -4.25 119.74 120.18 3biv s LYS 70 Ca 0.00 0.73 0.00 0.00 0.02 0.00 0.00 55.97 56.72 3biv s LYS 70 Cb 0.00 -2.29 0.00 0.00 -0.52 0.00 0.00 37.83 35.02 3biv s LYS 70 CO 0.00 -0.09 0.00 1.58 -0.92 0.00 0.00 175.35 175.92 3biv n HIS 71 N -1.19 -0.74 -2.28 3.18 -0.00 -1.26 -4.93 115.22 107.99 3biv n HIS 71 Ca 0.04 0.13 -0.39 0.00 -0.00 0.00 0.00 57.72 57.51 3biv n HIS 71 Cb 0.54 0.27 -0.02 0.00 -0.00 0.00 0.00 29.99 30.78 3biv n HIS 71 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 3biv s SER 72 N -5.29 6.62 0.01 0.26 0.15 -1.26 -0.80 113.70 113.39 3biv s SER 72 Ca 0.00 2.39 -0.21 0.00 0.70 0.00 0.00 55.95 58.83 3biv s SER 72 Cb 0.00 -2.62 -0.12 0.00 -1.71 0.00 0.00 66.02 61.57 3biv s SER 72 CO 0.00 -0.61 1.03 -0.09 1.20 0.00 0.00 173.24 174.77 3biv h ARG 73 N 2.84 -0.74 0.00 5.44 2.43 -1.55 -3.40 114.38 119.40 3biv h ARG 73 Ca -0.49 0.05 -0.09 0.00 -0.81 0.00 0.00 59.98 58.64 3biv h ARG 73 Cb 1.23 0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 30.93 3biv h ARG 73 CO 0.63 -0.49 -1.08 1.79 -1.51 0.00 0.00 179.97 179.31 3biv h THR 74 N -0.99 0.33 -4.00 0.20 1.35 -1.88 -3.48 112.91 104.44 3biv h THR 74 Ca -0.08 -1.61 -0.46 0.00 -0.55 0.00 0.00 66.41 63.71 3biv h THR 74 Cb 0.59 1.89 -0.01 0.00 -1.73 0.00 0.00 68.15 68.88 3biv h THR 74 CO 0.13 0.19 0.29 -0.60 -0.25 0.00 0.00 175.52 175.28 3biv s ARG 75 N -3.10 4.12 -0.69 4.72 3.00 -1.26 -5.01 118.95 120.73 3biv s ARG 75 Ca -0.01 0.98 -0.25 0.00 -1.00 0.00 0.00 55.73 55.45 3biv s ARG 75 Cb 0.09 -2.23 0.05 0.00 0.00 0.00 0.00 34.95 32.86 3biv s ARG 75 CO 0.79 -0.03 1.11 -0.47 0.00 0.00 0.00 175.30 176.69 3biv s TYR 76 N -2.22 2.50 -1.25 5.12 5.04 -1.26 -4.90 117.35 120.37 3biv s TYR 76 Ca 0.59 -0.31 -0.18 0.00 -2.44 0.00 0.00 57.07 54.74 3biv s TYR 76 Cb -0.09 -4.44 0.09 0.00 0.35 0.00 0.00 41.96 37.86 3biv s TYR 76 CO 0.18 -1.84 1.65 -1.21 -1.34 0.00 0.00 175.55 172.99 3biv s GLU 77 N 4.83 3.97 0.15 4.97 2.02 -1.26 -4.93 118.70 128.45 3biv s GLU 77 Ca 0.28 -2.03 -0.34 0.00 0.02 0.00 0.00 54.97 52.90 3biv s GLU 77 Cb -0.13 -5.43 -0.15 0.00 0.10 0.00 0.00 34.13 28.53 3biv s GLU 77 CO 0.13 -2.16 1.47 -2.13 0.02 0.00 0.00 175.26 172.59 3biv n ARG 77 N 7.91 1.80 -1.09 1.61 0.63 -1.26 -1.04 116.66 125.22 3biv n ARG 77 Ca 0.45 0.65 -0.03 0.00 -0.92 0.00 0.00 57.85 58.00 3biv n ARG 77 Cb 0.46 -2.35 -0.01 0.00 0.45 0.00 0.00 32.46 31.00 3biv n ARG 77 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 3biv n ASN 78 N 2.95 -4.01 0.06 6.15 4.13 -1.26 -4.79 115.26 118.48 3biv n ASN 78 Ca 0.17 0.07 0.00 0.00 1.68 0.00 0.00 54.58 56.50 3biv n ASN 78 Cb 0.26 -1.77 0.00 0.00 -1.54 0.00 0.00 39.78 36.73 3biv n ASN 78 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 3biv n ILE 79 N -2.70 0.28 -1.45 2.41 5.41 -0.20 -5.08 119.36 118.03 3biv n ILE 79 Ca -0.03 0.09 -0.31 0.00 1.00 0.00 0.00 62.75 63.50 3biv n ILE 79 Cb 0.21 -0.71 0.07 0.00 -0.71 0.00 0.00 39.64 38.50 3biv n ILE 79 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 3biv s GLU 80 N -1.57 2.61 -0.05 0.38 -1.05 -0.57 -4.81 118.70 113.64 3biv s GLU 80 Ca 0.00 1.10 0.04 0.00 -0.15 0.00 0.00 54.97 55.96 3biv s GLU 80 Cb 0.00 -1.94 -0.00 0.00 -0.44 0.00 0.00 34.13 31.74 3biv s GLU 80 CO 0.00 -1.37 -0.19 0.15 0.95 0.00 0.00 175.26 174.81 3biv s LYS 81 N -4.87 1.99 -0.23 -4.83 -0.14 -0.07 -4.93 119.74 106.67 3biv s LYS 81 Ca 0.60 -0.67 -0.06 0.00 -1.36 0.00 0.00 55.97 54.49 3biv s LYS 81 Cb -0.16 -1.70 -0.02 0.00 -1.68 0.00 0.00 37.83 34.27 3biv s LYS 81 CO 0.54 0.25 0.02 0.42 -0.76 0.00 0.00 175.35 175.82 3biv s ILE 82 N 0.06 3.94 0.25 2.17 1.01 -1.26 -0.79 121.20 126.58 3biv s ILE 82 Ca -0.05 -0.30 0.11 0.00 0.00 0.00 0.00 60.65 60.40 3biv s ILE 82 Cb -0.13 -2.81 -0.05 0.00 0.01 0.00 0.00 42.46 39.48 3biv s ILE 82 CO 0.03 0.39 -0.13 -0.44 0.00 0.00 0.00 174.94 174.79 3biv s SER 83 N 1.39 3.97 0.03 3.58 0.01 0.64 -4.95 113.70 118.37 3biv s SER 83 Ca 0.05 -0.81 -0.02 0.00 1.31 0.00 0.00 55.95 56.47 3biv s SER 83 Cb -0.15 -0.53 -0.04 0.00 0.21 0.00 0.00 66.02 65.51 3biv s SER 83 CO 0.01 0.05 0.22 -0.04 0.41 0.00 0.00 173.24 173.89 3biv s MET 84 N -3.32 3.47 -0.04 12.44 -1.94 -1.26 -1.05 119.30 127.61 3biv s MET 84 Ca 0.28 -0.32 -0.28 0.00 -1.71 0.00 0.00 55.69 53.67 3biv s MET 84 Cb -0.06 -3.05 -0.03 0.00 2.01 0.00 0.00 34.83 33.70 3biv s MET 84 CO 0.16 0.63 0.90 -0.51 -0.01 0.00 0.00 175.02 176.19 3biv s LEU 85 N -2.20 4.34 -0.19 -0.03 1.43 -1.26 -1.08 118.68 119.68 3biv s LEU 85 Ca 0.32 1.50 -0.20 0.00 -1.03 0.00 0.00 54.13 54.71 3biv s LEU 85 Cb -0.13 -3.42 -0.21 0.00 0.03 0.00 0.00 46.19 42.46 3biv s LEU 85 CO 0.23 -0.25 0.28 -0.08 0.23 0.00 0.00 176.35 176.76 3biv h GLU 86 N 6.84 0.04 -2.73 1.70 4.81 -1.01 -3.44 114.58 120.80 3biv h GLU 86 Ca -0.40 -0.07 -0.10 0.00 -0.13 0.00 0.00 59.36 58.66 3biv h GLU 86 Cb 1.20 0.03 -0.20 0.00 0.63 0.00 0.00 28.75 30.41 3biv h GLU 86 CO 0.76 1.03 -0.15 0.21 -0.73 0.00 0.00 179.01 180.14 3biv s LYS 87 N -2.38 0.74 -0.10 1.92 2.47 -1.13 -4.97 119.74 116.29 3biv s LYS 87 Ca -0.27 0.03 -0.03 0.00 -1.56 0.00 0.00 55.97 54.14 3biv s LYS 87 Cb 0.05 0.34 -0.03 0.00 -1.46 0.00 0.00 37.83 36.73 3biv s LYS 87 CO 0.63 -0.20 0.02 0.42 0.16 0.00 0.00 175.35 176.37 3biv s ILE 88 N -1.08 4.49 -0.18 5.43 1.01 -1.26 -0.44 121.20 129.17 3biv s ILE 88 Ca -0.11 -0.18 -0.02 0.00 0.00 0.00 0.00 60.65 60.35 3biv s ILE 88 Cb -0.04 -2.91 0.05 0.00 0.01 0.00 0.00 42.46 39.57 3biv s ILE 88 CO 0.05 0.59 -0.00 -0.31 0.00 0.00 0.00 174.94 175.27 3biv s TYR 89 N -0.75 1.37 -0.02 3.97 1.51 0.04 -5.01 117.35 118.46 3biv s TYR 89 Ca 0.12 -0.98 -0.08 0.00 -1.01 0.00 0.00 57.07 55.11 3biv s TYR 89 Cb -0.12 -1.16 -0.05 0.00 -0.11 0.00 0.00 41.96 40.53 3biv s TYR 89 CO 0.02 -0.61 0.28 0.42 -1.11 0.00 0.00 175.55 174.55 3biv s ILE 90 N 1.74 5.28 0.10 2.71 1.01 -1.26 -0.80 121.20 129.98 3biv s ILE 90 Ca -0.01 0.33 -0.35 0.00 0.00 0.00 0.00 60.65 60.62 3biv s ILE 90 Cb -0.16 -3.56 -0.15 0.00 0.01 0.00 0.00 42.46 38.60 3biv s ILE 90 CO -0.07 0.46 1.52 1.57 0.00 0.00 0.00 174.94 178.41 3biv n HIS 91 N 1.43 2.00 0.31 3.97 -0.00 -1.16 -4.85 115.22 116.93 3biv n HIS 91 Ca -0.13 0.39 0.16 0.00 -0.00 0.00 0.00 57.72 58.13 3biv n HIS 91 Cb 0.53 -2.47 0.59 0.00 -0.00 0.00 0.00 29.99 28.63 3biv n HIS 91 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 3biv h PRO 92 N 5.69 0.00 -0.30 1.57 0.13 -1.95 -2.39 132.00 134.75 3biv h PRO 92 Ca -0.46 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.66 3biv h PRO 92 Cb 1.29 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.41 3biv h PRO 92 CO 0.86 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 179.17 3biv n ARG 93 N -2.87 3.08 -1.60 0.86 1.74 -1.26 -4.98 116.66 111.63 3biv n ARG 93 Ca 0.01 -2.90 -0.53 0.00 -0.77 0.00 0.00 57.85 53.67 3biv n ARG 93 Cb 0.31 -1.90 -0.06 0.00 -1.02 0.00 0.00 32.46 29.80 3biv n ARG 93 CO 0.00 0.00 0.00 0.98 -1.52 0.00 0.00 177.63 177.09 3biv n TYR 94 N -0.43 1.53 -3.72 -1.55 9.36 -0.90 -4.74 117.16 116.71 3biv n TYR 94 Ca 0.23 0.65 -0.35 0.00 3.32 0.00 0.00 57.90 61.74 3biv n TYR 94 Cb 0.94 -2.33 -0.09 0.00 -0.63 0.00 0.00 39.34 37.23 3biv n TYR 94 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 3biv s ASN 95 N 0.79 5.39 0.33 2.98 3.84 0.75 -4.85 114.94 124.17 3biv s ASN 95 Ca 0.86 -3.26 0.24 0.00 0.21 0.00 0.00 52.86 50.91 3biv s ASN 95 Cb -0.98 -1.84 0.55 0.00 -0.55 0.00 0.00 41.25 38.43 3biv s ASN 95 CO 0.49 -0.27 1.67 4.11 -2.79 0.00 0.00 177.10 180.32 3biv h TRP 96 N 6.48 0.00 -0.08 0.43 5.08 -1.91 1.09 115.95 127.05 3biv h TRP 96 Ca 0.06 0.00 -0.18 0.00 1.08 0.00 0.00 58.89 59.85 3biv h TRP 96 Cb 0.88 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.04 3biv h TRP 96 CO 0.71 0.00 -0.72 0.00 -1.28 0.00 0.00 178.44 177.15 3biv h ARG 97 N 0.00 0.39 0.00 0.12 3.08 -1.99 -3.44 114.38 112.54 3biv h ARG 97 Ca 0.00 -0.31 0.00 0.00 0.07 0.00 0.00 59.98 59.74 3biv h ARG 97 Cb 0.88 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.99 3biv h ARG 97 CO 0.00 0.95 0.00 -1.91 -1.07 0.00 0.00 179.97 177.94 3biv n GLU 97 N -3.84 0.00 -0.09 0.04 2.13 -1.25 -4.99 120.64 112.64 3biv n GLU 97 Ca -0.04 0.00 0.03 0.00 0.66 0.00 0.00 57.16 57.81 3biv n GLU 97 Cb 0.70 0.00 0.04 0.00 0.27 0.00 0.00 31.44 32.45 3biv n GLU 97 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 3biv n ASN 98 N -0.51 1.49 -1.13 4.31 6.94 -1.21 -5.00 115.26 120.15 3biv n ASN 98 Ca 0.00 -2.17 -0.13 0.00 -0.02 0.00 0.00 54.58 52.25 3biv n ASN 98 Cb 0.00 -0.16 -0.05 0.00 -2.36 0.00 0.00 39.78 37.21 3biv n ASN 98 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 3biv n LEU 99 N -0.64 -1.10 -4.65 -4.53 4.77 0.38 -4.96 117.00 106.26 3biv n LEU 99 Ca 0.05 0.26 -0.43 0.00 -0.03 0.00 0.00 56.01 55.86 3biv n LEU 99 Cb 0.48 -2.03 -0.01 0.00 -2.33 0.00 0.00 43.42 39.53 3biv n LEU 99 CO 0.00 -0.59 0.74 -0.67 -1.33 0.00 0.00 177.39 175.54 3biv n ASP 100 N -0.25 2.06 -3.61 -1.43 2.03 -1.21 -2.22 116.55 111.93 3biv n ASP 100 Ca -0.14 1.18 -0.21 0.00 0.52 0.00 0.00 54.79 56.14 3biv n ASP 100 Cb 0.48 -1.40 0.06 0.00 -0.72 0.00 0.00 41.12 39.54 3biv n ASP 100 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 3biv n ARG 101 N 0.57 -5.99 -2.35 -0.67 1.74 -1.26 -0.18 116.66 108.52 3biv n ARG 101 Ca 0.07 0.73 -0.38 0.00 -0.77 0.00 0.00 57.85 57.49 3biv n ARG 101 Cb 0.35 -5.55 -0.02 0.00 -1.02 0.00 0.00 32.46 26.21 3biv n ARG 101 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3biv n ASP 102 N -3.06 4.27 -3.77 0.55 2.03 -0.94 -4.30 116.55 111.33 3biv n ASP 102 Ca -0.22 -2.84 -0.13 0.00 0.52 0.00 0.00 54.79 52.11 3biv n ASP 102 Cb 0.64 -1.73 -0.09 0.00 -0.72 0.00 0.00 41.12 39.22 3biv n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 3biv s ILE 103 N 6.31 0.04 0.05 5.18 2.07 -1.26 -3.88 121.20 129.71 3biv s ILE 103 Ca 0.58 -0.36 -0.19 0.00 -1.41 0.00 0.00 60.65 59.27 3biv s ILE 103 Cb 0.03 -0.55 0.04 0.00 0.13 0.00 0.00 42.46 42.12 3biv s ILE 103 CO 0.09 -0.20 0.45 0.00 -1.91 0.00 0.00 174.94 173.37 3biv s ALA 104 N -0.89 -1.11 0.12 1.50 0.00 -0.57 -2.96 121.76 117.84 3biv s ALA 104 Ca -0.10 0.38 0.10 0.00 0.00 0.00 0.00 51.96 52.35 3biv s ALA 104 Cb -0.05 0.38 -0.04 0.00 0.00 0.00 0.00 23.12 23.41 3biv s ALA 104 CO 0.03 -0.48 -0.22 -0.51 0.00 0.00 0.00 175.76 174.57 3biv s LEU 105 N -2.04 2.52 -0.04 0.00 1.43 0.02 -1.33 118.68 119.24 3biv s LEU 105 Ca -0.05 -0.64 0.02 0.00 -1.03 0.00 0.00 54.13 52.43 3biv s LEU 105 Cb -0.01 -1.39 0.01 0.00 0.03 0.00 0.00 46.19 44.83 3biv s LEU 105 CO -0.03 0.18 -0.07 -0.04 0.23 0.00 0.00 176.35 176.63 3biv s MET 106 N -2.07 0.94 -0.15 1.70 -1.94 0.07 -0.78 119.30 117.07 3biv s MET 106 Ca 0.16 -0.20 -0.11 0.00 -1.71 0.00 0.00 55.69 53.83 3biv s MET 106 Cb -0.10 -0.89 -0.05 0.00 2.01 0.00 0.00 34.83 35.80 3biv s MET 106 CO 0.08 -0.00 0.22 0.21 -0.01 0.00 0.00 175.02 175.52 3biv s LYS 107 N 0.61 4.05 0.35 2.03 2.20 0.42 -1.29 119.74 128.11 3biv s LYS 107 Ca -0.09 -0.03 -0.14 0.00 -0.36 0.00 0.00 55.97 55.35 3biv s LYS 107 Cb -0.12 -3.36 -0.08 0.00 -1.51 0.00 0.00 37.83 32.75 3biv s LYS 107 CO 0.01 0.40 0.76 -0.51 -0.36 0.00 0.00 175.35 175.65 3biv s LEU 108 N 0.02 3.98 0.12 5.43 1.43 -0.02 -0.46 118.68 129.18 3biv s LEU 108 Ca 0.14 1.26 -0.17 0.00 -1.03 0.00 0.00 54.13 54.33 3biv s LEU 108 Cb -0.12 -4.09 -0.02 0.00 0.03 0.00 0.00 46.19 41.98 3biv s LEU 108 CO 0.03 -0.28 1.65 0.50 0.23 0.00 0.00 176.35 178.48 3biv h LYS 109 N 1.93 0.56 -5.42 1.70 3.64 -1.39 -3.41 116.57 114.17 3biv h LYS 109 Ca -0.48 -0.11 -0.41 0.00 -1.27 0.00 0.00 60.65 58.38 3biv h LYS 109 Cb 1.18 -0.08 -0.17 0.00 -0.41 0.00 0.00 32.23 32.74 3biv h LYS 109 CO 0.65 0.56 -0.75 0.15 -2.27 0.00 0.00 179.45 177.79 3biv s LYS 110 N -5.45 1.09 0.58 1.90 1.02 -1.26 -4.98 119.74 112.64 3biv s LYS 110 Ca -0.13 -1.34 -0.19 0.00 0.02 0.00 0.00 55.97 54.33 3biv s LYS 110 Cb 0.09 -0.92 -0.04 0.00 -0.52 0.00 0.00 37.83 36.44 3biv s LYS 110 CO 0.75 0.17 1.17 -1.25 -0.92 0.00 0.00 175.35 175.27 3biv s PRO 111 N -3.00 3.08 0.05 -1.68 0.04 -1.26 -4.87 135.00 127.36 3biv s PRO 111 Ca 0.13 1.72 -0.06 0.00 0.04 0.00 0.00 61.00 62.83 3biv s PRO 111 Cb -0.03 -1.96 -0.05 0.00 0.04 0.00 0.00 34.50 32.50 3biv s PRO 111 CO 0.03 -1.09 0.30 0.54 0.04 0.00 0.00 177.00 176.82 3biv s VAL 112 N -1.71 5.26 0.04 -0.36 0.11 0.82 -5.00 120.40 119.55 3biv s VAL 112 Ca 0.75 0.12 -0.29 0.00 -2.93 0.00 0.00 61.98 59.63 3biv s VAL 112 Cb -0.27 -3.59 -0.04 0.00 -1.53 0.00 0.00 36.38 30.94 3biv s VAL 112 CO 0.32 0.27 0.92 0.00 -3.33 0.00 0.00 175.10 173.27 3biv s ALA 113 N -1.40 3.23 0.61 1.54 0.00 -1.26 -4.82 121.76 119.66 3biv s ALA 113 Ca 0.32 0.48 -0.14 0.00 0.00 0.00 0.00 51.96 52.61 3biv s ALA 113 Cb -0.13 -3.23 -0.03 0.00 0.00 0.00 0.00 23.12 19.73 3biv s ALA 113 CO 0.19 -0.11 1.05 -0.06 0.00 0.00 0.00 175.76 176.83 3biv s PHE 114 N 0.52 3.09 0.12 0.00 0.08 -1.26 -4.89 117.98 115.63 3biv s PHE 114 Ca 0.47 1.48 -0.04 0.00 0.12 0.00 0.00 56.93 58.96 3biv s PHE 114 Cb -0.21 -2.94 0.02 0.00 -0.57 0.00 0.00 43.02 39.31 3biv s PHE 114 CO 0.27 -1.05 0.22 -1.13 -0.10 0.00 0.00 175.22 173.43 3biv n SER 115 N -2.29 -0.64 0.30 1.36 3.41 -0.43 -4.95 113.62 110.38 3biv n SER 115 Ca 0.08 -1.49 0.18 0.00 -0.26 0.00 0.00 58.87 57.38 3biv n SER 115 Cb 0.53 1.08 0.92 0.00 -0.26 0.00 0.00 64.21 66.48 3biv n SER 115 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 3biv h ASP 116 N 0.59 0.00 -0.00 4.04 3.32 -1.98 -3.03 116.42 119.36 3biv h ASP 116 Ca -0.10 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.95 3biv h ASP 116 Cb 0.37 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.92 3biv h ASP 116 CO 0.12 0.04 -0.38 -1.22 -1.72 0.00 0.00 179.24 176.08 3biv n TYR 117 N -3.31 0.00 -3.80 4.55 4.01 -1.26 -4.74 117.16 112.62 3biv n TYR 117 Ca -0.02 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.45 3biv n TYR 117 Cb 0.18 0.00 -0.17 0.00 -0.31 0.00 0.00 39.34 39.04 3biv n TYR 117 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 3biv s ILE 118 N -1.75 0.71 -0.27 -0.72 1.01 -1.14 -4.14 121.20 114.91 3biv s ILE 118 Ca 0.03 -0.46 -0.25 0.00 0.00 0.00 0.00 60.65 59.97 3biv s ILE 118 Cb 0.06 -1.03 0.08 0.00 0.01 0.00 0.00 42.46 41.58 3biv s ILE 118 CO 0.33 0.00 0.77 -2.28 0.00 0.00 0.00 174.94 173.76 3biv s HIS 119 N 1.79 -0.73 0.43 3.97 2.46 -0.55 -1.31 115.29 121.34 3biv s HIS 119 Ca 0.01 1.78 -0.20 0.00 0.47 0.00 0.00 55.06 57.11 3biv s HIS 119 Cb -0.16 0.29 -0.11 0.00 -0.13 0.00 0.00 32.58 32.48 3biv s HIS 119 CO -0.07 -0.36 0.93 -1.25 -2.47 0.00 0.00 174.74 171.52 3biv s PRO 120 N 0.31 4.18 0.51 2.88 0.04 -1.26 -2.20 135.00 139.46 3biv s PRO 120 Ca 0.00 1.06 -0.04 0.00 0.04 0.00 0.00 61.00 62.06 3biv s PRO 120 Cb -0.05 -2.20 -0.01 0.00 0.04 0.00 0.00 34.50 32.27 3biv s PRO 120 CO 0.00 -0.03 0.80 0.54 0.04 0.00 0.00 177.00 178.35 3biv s VAL 121 N -2.19 4.30 0.29 -0.36 0.11 -0.73 -4.91 120.40 116.90 3biv s VAL 121 Ca 0.61 -0.03 -0.07 0.00 -2.93 0.00 0.00 61.98 59.56 3biv s VAL 121 Cb -0.09 -3.65 -0.06 0.00 -1.53 0.00 0.00 36.38 31.05 3biv s VAL 121 CO 0.15 -0.60 0.59 0.00 -3.33 0.00 0.00 175.10 171.90 3biv s LEU 123 N -3.39 4.13 0.44 0.00 1.43 -1.26 -0.90 118.68 119.13 3biv s LEU 123 Ca 0.46 0.32 -0.23 0.00 -1.03 0.00 0.00 54.13 53.65 3biv s LEU 123 Cb -0.11 -2.15 -0.08 0.00 0.03 0.00 0.00 46.19 43.88 3biv s LEU 123 CO 0.28 0.35 1.13 -2.16 0.23 0.00 0.00 176.35 176.17 3biv s PRO 124 N -1.29 3.92 0.56 1.29 0.04 -1.26 -4.95 135.00 133.30 3biv s PRO 124 Ca 0.18 1.69 0.09 0.00 0.04 0.00 0.00 61.00 63.00 3biv s PRO 124 Cb -0.12 -2.47 0.08 0.00 0.04 0.00 0.00 34.50 32.03 3biv s PRO 124 CO 0.08 -0.40 0.75 0.16 0.04 0.00 0.00 177.00 177.63 3biv s ASP 125 N -1.42 5.14 0.25 6.66 1.47 -1.26 -4.83 116.67 122.69 3biv s ASP 125 Ca 0.61 -0.82 -0.03 0.00 1.18 0.00 0.00 52.55 53.49 3biv s ASP 125 Cb -0.26 0.20 0.48 0.00 -0.34 0.00 0.00 42.92 42.99 3biv s ASP 125 CO 0.32 -1.27 1.75 -0.09 0.68 0.00 0.00 175.17 176.57 3biv h ARG 126 N 0.26 0.52 -0.20 2.11 2.43 -1.98 -2.50 114.38 115.02 3biv h ARG 126 Ca -0.31 -0.03 -0.14 0.00 -0.81 0.00 0.00 59.98 58.68 3biv h ARG 126 Cb 1.29 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.71 3biv h ARG 126 CO 0.42 0.34 -0.48 1.49 -1.51 0.00 0.00 179.97 180.23 3biv h GLU 127 N 0.53 0.52 -0.05 0.20 4.81 -2.04 -0.07 114.58 118.48 3biv h GLU 127 Ca 0.43 -0.30 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 3biv h GLU 127 Cb 0.62 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.02 3biv h GLU 127 CO -0.37 0.89 0.00 2.41 -0.73 0.00 0.00 179.01 181.21 3biv n THR 128 N -3.99 0.00 0.00 0.32 -1.04 -0.94 -0.56 114.28 108.07 3biv n THR 128 Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 3biv n THR 128 Cb 0.56 -0.20 0.00 0.00 -1.82 0.00 0.00 70.33 68.88 3biv n THR 128 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3biv n ALA 129 N 0.10 0.00 -0.09 2.41 0.00 -0.04 -0.38 120.51 122.52 3biv n ALA 129 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 3biv n ALA 129 Cb 0.01 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.43 3biv n ALA 129 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3biv h SER 129 N 0.00 0.42 0.00 0.00 4.64 -1.07 -3.38 113.55 114.16 3biv h SER 129 Ca 0.00 -0.25 -0.17 0.00 -0.47 0.00 0.00 61.79 60.90 3biv h SER 129 Cb 0.00 -0.11 -0.03 0.00 -0.31 0.00 0.00 62.40 61.95 3biv h SER 129 CO 0.00 0.56 -2.00 0.18 -0.87 0.00 0.00 176.83 174.70 3biv n LEU 129 N -4.68 0.00 -4.45 5.97 4.77 0.49 -4.73 117.00 114.38 3biv n LEU 129 Ca -0.03 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.53 3biv n LEU 129 Cb 0.20 0.22 -0.00 0.00 -2.33 0.00 0.00 43.42 41.51 3biv n LEU 129 CO 0.37 0.22 2.05 0.18 -1.33 0.00 0.00 177.39 178.89 3biv n LEU 130 N -2.39 5.10 -3.99 2.23 4.77 -1.26 -4.80 117.00 116.64 3biv n LEU 130 Ca -0.16 -3.90 -0.19 0.00 -0.03 0.00 0.00 56.01 51.73 3biv n LEU 130 Cb 0.78 -1.73 -0.15 0.00 -2.33 0.00 0.00 43.42 39.99 3biv n LEU 130 CO 0.37 0.16 -0.43 -1.10 -1.33 0.00 0.00 177.39 175.06 3biv s GLN 131 N 4.22 0.79 0.14 3.23 -0.21 -1.26 -4.92 119.66 121.65 3biv s GLN 131 Ca 0.54 -0.28 -0.34 0.00 0.02 0.00 0.00 55.36 55.30 3biv s GLN 131 Cb 0.05 -0.76 -0.16 0.00 1.00 0.00 0.00 33.01 33.15 3biv s GLN 131 CO 0.06 0.13 1.27 0.00 -2.12 0.00 0.00 175.29 174.63 3biv n ALA 132 N 3.14 -0.68 0.00 6.09 0.00 -1.26 -0.64 120.51 127.16 3biv n ALA 132 Ca -0.16 0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.76 3biv n ALA 132 Cb 0.55 -2.07 0.00 0.00 0.00 0.00 0.00 19.45 17.93 3biv n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3biv n GLY 133 N 2.30 2.97 3.74 0.00 0.00 -0.06 -4.94 105.19 109.20 3biv n GLY 133 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 3biv n GLY 133 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3biv s TYR 134 N -1.83 3.19 -0.03 1.61 1.51 0.19 -4.60 117.35 117.40 3biv s TYR 134 Ca 0.00 1.23 -0.12 0.00 -1.01 0.00 0.00 57.07 57.17 3biv s TYR 134 Cb 0.00 -3.64 -0.05 0.00 -0.11 0.00 0.00 41.96 38.16 3biv s TYR 134 CO 0.00 -1.97 0.33 0.15 -1.11 0.00 0.00 175.55 172.95 3biv s LYS 135 N -0.47 3.77 0.40 -0.62 1.02 -1.26 -0.28 119.74 122.30 3biv s LYS 135 Ca 0.55 0.25 0.02 0.00 0.02 0.00 0.00 55.97 56.82 3biv s LYS 135 Cb -0.38 -3.20 0.02 0.00 -0.52 0.00 0.00 37.83 33.76 3biv s LYS 135 CO 0.41 0.71 0.20 0.41 -0.92 0.00 0.00 175.35 176.17 3biv n GLY 136 N 1.81 3.12 2.97 -3.33 0.00 -0.47 -4.82 105.19 104.47 3biv n GLY 136 Ca -0.15 -2.29 -0.23 0.00 0.00 0.00 0.00 46.02 43.35 3biv n GLY 136 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3biv s ARG 137 N -3.57 1.38 -0.01 1.61 3.52 0.41 -0.93 118.95 121.37 3biv s ARG 137 Ca 0.16 -0.30 0.07 0.00 -0.13 0.00 0.00 55.73 55.53 3biv s ARG 137 Cb -0.01 -1.20 -0.02 0.00 -1.56 0.00 0.00 34.95 32.15 3biv s ARG 137 CO 0.10 -0.02 -0.23 0.08 -0.81 0.00 0.00 175.30 174.41 3biv s VAL 138 N 0.79 2.31 0.04 7.11 1.01 -0.05 -0.80 120.40 130.81 3biv s VAL 138 Ca -0.13 -1.11 0.03 0.00 0.00 0.00 0.00 61.98 60.77 3biv s VAL 138 Cb -0.15 -1.85 -0.02 0.00 0.00 0.00 0.00 36.38 34.35 3biv s VAL 138 CO 0.02 0.52 -0.09 0.42 0.00 0.00 0.00 175.10 175.97 3biv s THR 139 N -0.70 0.64 0.00 3.92 -4.23 -1.24 -1.49 115.64 112.53 3biv s THR 139 Ca 0.11 -1.06 0.00 0.00 -1.18 0.00 0.00 61.69 59.56 3biv s THR 139 Cb -0.10 -0.67 0.00 0.00 1.34 0.00 0.00 72.50 73.06 3biv s THR 139 CO 0.00 -0.32 0.00 0.61 -0.54 0.00 0.00 174.62 174.38 3biv n GLY 140 N 1.54 0.42 1.60 3.99 0.00 -0.81 -4.51 105.19 107.42 3biv n GLY 140 Ca -0.22 -0.81 0.08 0.00 0.00 0.00 0.00 46.02 45.08 3biv n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3biv n TRP 141 N -0.04 1.61 -1.35 1.61 8.01 -1.26 -1.56 117.44 124.45 3biv n TRP 141 Ca 0.00 -0.67 -0.30 0.00 -1.31 0.00 0.00 57.50 55.22 3biv n TRP 141 Cb 0.00 -0.34 0.22 0.00 -2.01 0.00 0.00 31.31 29.18 3biv n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 3biv s GLY 142 N -0.97 1.65 0.29 6.99 0.00 -1.26 -4.55 107.32 109.46 3biv s GLY 142 Ca 0.51 -1.02 -0.26 0.00 0.00 0.00 0.00 44.72 43.94 3biv s GLY 142 CO 0.20 -0.18 0.66 0.70 0.00 0.00 0.00 173.10 174.48 3biv n ASN 143 N -4.44 -0.41 0.11 1.64 4.13 0.14 -3.10 115.26 113.33 3biv n ASN 143 Ca 0.14 1.08 0.12 0.00 1.68 0.00 0.00 54.58 57.59 3biv n ASN 143 Cb 0.59 -1.10 0.09 0.00 -1.54 0.00 0.00 39.78 37.83 3biv n ASN 143 CO 0.00 0.00 0.00 -0.07 0.28 0.00 0.00 177.26 177.47 3biv h LEU 144 N 1.25 0.00 -8.19 3.41 3.38 -1.43 0.19 115.31 113.92 3biv h LEU 144 Ca -0.35 -0.05 -0.18 0.00 0.09 0.00 0.00 57.88 57.38 3biv h LEU 144 Cb 1.40 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.97 3biv h LEU 144 CO 0.56 0.03 -0.70 -0.54 0.09 0.00 0.00 178.44 177.88 3biv s LYS 145 N -3.28 0.55 0.13 1.13 -0.14 -1.26 -4.31 119.74 112.56 3biv s LYS 145 Ca 0.03 -0.98 -0.18 0.00 -1.36 0.00 0.00 55.97 53.48 3biv s LYS 145 Cb 0.10 0.01 -0.03 0.00 -1.68 0.00 0.00 37.83 36.22 3biv s LYS 145 CO 0.74 -0.04 1.78 1.49 -0.76 0.00 0.00 175.35 178.56 3biv h GLU 146 N 3.81 0.31 -0.21 1.68 4.81 -1.91 -3.48 114.58 119.59 3biv h GLU 146 Ca -0.34 -0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 58.78 3biv h GLU 146 Cb 1.18 -0.07 -0.06 0.00 0.63 0.00 0.00 28.75 30.43 3biv h GLU 146 CO 0.54 0.21 -0.19 0.25 -0.73 0.00 0.00 179.01 179.08 3biv n THR 147 N -4.94 2.36 0.00 0.32 -2.24 -1.26 -4.97 114.28 103.56 3biv n THR 147 Ca -0.02 -2.77 0.00 0.00 -2.27 0.00 0.00 64.05 58.99 3biv n THR 147 Cb 0.04 -0.28 0.00 0.00 -2.10 0.00 0.00 70.33 67.99 3biv n THR 147 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3biv n GLY 150 N -1.09 1.51 3.58 3.38 0.00 -1.26 -5.12 105.19 106.18 3biv n GLY 150 Ca 0.26 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.00 3biv n GLY 150 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3biv s GLN 151 N 2.54 2.11 0.48 1.61 -1.52 -1.26 -1.46 119.66 122.17 3biv s GLN 151 Ca 0.00 -1.17 -0.15 0.00 -1.95 0.00 0.00 55.36 52.09 3biv s GLN 151 Cb 0.00 -2.23 -0.08 0.00 -0.22 0.00 0.00 33.01 30.48 3biv s GLN 151 CO 0.00 0.46 0.93 -1.25 -0.25 0.00 0.00 175.29 175.18 3biv s PRO 152 N -2.62 3.92 0.14 2.91 0.04 -1.26 -4.95 135.00 133.18 3biv s PRO 152 Ca 0.24 0.84 0.06 0.00 0.04 0.00 0.00 61.00 62.18 3biv s PRO 152 Cb -0.10 -2.20 -0.13 0.00 0.04 0.00 0.00 34.50 32.11 3biv s PRO 152 CO 0.15 -0.20 1.31 1.03 0.04 0.00 0.00 177.00 179.33 3biv h SER 153 N 1.06 0.08 -4.61 6.66 0.87 -1.97 -3.42 113.55 112.22 3biv h SER 153 Ca -0.47 -0.08 -0.34 0.00 -1.23 0.00 0.00 61.79 59.67 3biv h SER 153 Cb 1.18 -0.03 -0.14 0.00 -0.44 0.00 0.00 62.40 62.97 3biv h SER 153 CO 0.62 1.00 -0.61 0.68 -0.53 0.00 0.00 176.83 177.99 3biv s VAL 154 N -2.86 0.49 0.17 2.23 -7.23 -1.26 -1.60 120.40 110.33 3biv s VAL 154 Ca -0.00 -2.00 -0.33 0.00 -1.81 0.00 0.00 61.98 57.84 3biv s VAL 154 Cb 0.10 -2.61 -0.15 0.00 0.56 0.00 0.00 36.38 34.27 3biv s VAL 154 CO 0.82 0.00 1.20 -0.11 -0.31 0.00 0.00 175.10 176.70 3biv n LEU 155 N -0.46 1.70 -4.75 1.32 7.94 0.02 -4.82 117.00 117.94 3biv n LEU 155 Ca 0.00 1.14 -0.30 0.00 -1.11 0.00 0.00 56.01 55.75 3biv n LEU 155 Cb 0.66 -1.24 -0.07 0.00 0.53 0.00 0.00 43.42 43.31 3biv n LEU 155 CO 0.37 -1.20 -0.28 -1.10 -1.11 0.00 0.00 177.39 174.07 3biv s GLN 156 N -0.33 2.79 0.03 1.96 -1.52 -0.60 -0.05 119.66 121.93 3biv s GLN 156 Ca 0.73 -0.77 0.03 0.00 -1.95 0.00 0.00 55.36 53.41 3biv s GLN 156 Cb -0.84 -2.66 -0.02 0.00 -0.22 0.00 0.00 33.01 29.28 3biv s GLN 156 CO 0.52 0.54 -0.10 0.54 -0.25 0.00 0.00 175.29 176.54 3biv s VAL 157 N -1.43 0.73 -0.09 1.09 0.11 0.49 -1.92 120.40 119.37 3biv s VAL 157 Ca 0.29 -0.79 -0.05 0.00 -2.93 0.00 0.00 61.98 58.50 3biv s VAL 157 Cb -0.12 -0.69 0.04 0.00 -1.53 0.00 0.00 36.38 34.08 3biv s VAL 157 CO 0.21 -0.08 0.21 0.54 -3.33 0.00 0.00 175.10 172.65 3biv s VAL 158 N -0.79 -0.03 -0.12 2.04 0.11 -0.56 -0.87 120.40 120.18 3biv s VAL 158 Ca -0.02 0.11 -0.17 0.00 -2.93 0.00 0.00 61.98 58.97 3biv s VAL 158 Cb -0.07 -0.32 -0.04 0.00 -1.53 0.00 0.00 36.38 34.42 3biv s VAL 158 CO 0.00 0.05 0.44 0.20 -3.33 0.00 0.00 175.10 172.46 3biv s ASN 159 N 0.88 6.64 -0.02 3.54 0.01 -1.26 -0.87 114.94 123.86 3biv s ASN 159 Ca -0.06 0.77 0.02 0.00 -0.71 0.00 0.00 52.86 52.87 3biv s ASN 159 Cb -0.08 -2.27 0.00 0.00 0.41 0.00 0.00 41.25 39.32 3biv s ASN 159 CO -0.05 0.03 -0.06 -0.76 -1.51 0.00 0.00 177.10 174.75 3biv s LEU 160 N 0.55 1.79 0.31 0.60 1.43 -0.10 -4.98 118.68 118.27 3biv s LEU 160 Ca 0.24 -0.12 -0.26 0.00 -1.03 0.00 0.00 54.13 52.96 3biv s LEU 160 Cb -0.15 -0.38 -0.10 0.00 0.03 0.00 0.00 46.19 45.60 3biv s LEU 160 CO 0.09 0.04 0.93 -2.16 0.23 0.00 0.00 176.35 175.48 3biv s PRO 161 N 0.19 4.58 0.43 1.29 0.04 -1.26 -1.37 135.00 138.90 3biv s PRO 161 Ca -0.02 1.31 -0.24 0.00 0.04 0.00 0.00 61.00 62.08 3biv s PRO 161 Cb -0.07 -2.83 -0.08 0.00 0.04 0.00 0.00 34.50 31.56 3biv s PRO 161 CO -0.00 0.30 1.20 0.42 0.04 0.00 0.00 177.00 178.96 3biv s ILE 162 N -1.58 3.00 0.01 0.56 1.01 0.62 -1.09 121.20 123.73 3biv s ILE 162 Ca 0.49 0.81 0.03 0.00 0.00 0.00 0.00 60.65 61.98 3biv s ILE 162 Cb -0.19 -3.44 -0.04 0.00 0.01 0.00 0.00 42.46 38.81 3biv s ILE 162 CO 0.24 0.04 -0.04 -0.69 0.00 0.00 0.00 174.94 174.50 3biv s VAL 163 N -1.44 3.86 0.27 2.92 1.01 0.01 -0.89 120.40 126.15 3biv s VAL 163 Ca 0.60 -0.75 -0.30 0.00 0.00 0.00 0.00 61.98 61.53 3biv s VAL 163 Cb -0.31 -2.72 -0.13 0.00 0.00 0.00 0.00 36.38 33.21 3biv s VAL 163 CO 0.39 0.35 1.26 -0.62 0.00 0.00 0.00 175.10 176.48 3biv n GLU 164 N 1.36 1.82 -0.22 2.72 4.71 -1.26 -4.62 120.64 125.16 3biv n GLU 164 Ca -0.15 0.64 0.02 0.00 -0.01 0.00 0.00 57.16 57.67 3biv n GLU 164 Cb 0.52 -2.20 0.12 0.00 -1.01 0.00 0.00 31.44 28.87 3biv n GLU 164 CO 0.00 0.00 0.00 -0.09 0.09 0.00 0.00 177.13 177.13 3biv h ARG 165 N 3.17 0.15 -0.80 3.49 2.43 -1.98 -1.78 114.38 119.06 3biv h ARG 165 Ca -0.44 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 58.72 3biv h ARG 165 Cb 1.30 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 30.78 3biv h ARG 165 CO 0.68 0.10 0.48 -1.35 -1.51 0.00 0.00 179.97 178.37 3biv h PRO 166 N 0.15 1.09 -0.60 0.20 0.11 -2.00 -0.65 132.00 130.31 3biv h PRO 166 Ca 0.34 -0.10 -0.02 0.00 0.11 0.00 0.00 66.00 66.34 3biv h PRO 166 Cb 0.57 -0.23 -0.03 0.00 0.11 0.00 0.00 31.00 31.42 3biv h PRO 166 CO -0.53 0.77 0.31 0.28 -0.21 0.00 0.00 178.00 178.63 3biv h VAL 167 N 1.10 1.20 -0.07 3.15 2.07 -1.75 -0.44 116.25 121.51 3biv h VAL 167 Ca 0.29 -0.54 0.04 0.00 0.82 0.00 0.00 66.70 67.31 3biv h VAL 167 Cb -0.04 0.45 -0.05 0.00 -1.52 0.00 0.00 31.29 30.14 3biv h VAL 167 CO -0.05 0.22 -0.20 0.00 0.02 0.00 0.00 177.57 177.56 3biv h LYS 169 N -0.29 0.72 0.00 0.00 1.57 -0.83 -1.71 116.57 116.04 3biv h LYS 169 Ca 0.08 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 3biv h LYS 169 Cb 0.40 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.55 3biv h LYS 169 CO -0.24 0.48 0.00 -0.25 -0.57 0.00 0.00 179.45 178.87 3biv n ASP 170 N -4.71 0.00 -0.28 0.86 8.00 -0.20 -2.50 116.55 117.73 3biv n ASP 170 Ca 0.04 -0.05 0.12 0.00 0.71 0.00 0.00 54.79 55.61 3biv n ASP 170 Cb 0.03 -0.24 0.27 0.00 -0.02 0.00 0.00 41.12 41.16 3biv n ASP 170 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3biv n SER 171 N -1.24 1.21 -3.83 -2.24 3.41 -0.64 -4.94 113.62 105.33 3biv n SER 171 Ca 0.09 -0.99 -0.11 0.00 -0.26 0.00 0.00 58.87 57.60 3biv n SER 171 Cb 0.12 0.24 -0.09 0.00 -0.26 0.00 0.00 64.21 64.23 3biv n SER 171 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3biv s THR 172 N -2.55 0.10 -0.60 6.66 -1.32 -1.04 -4.85 115.64 112.03 3biv s THR 172 Ca 0.22 -0.79 0.24 0.00 -1.21 0.00 0.00 61.69 60.15 3biv s THR 172 Cb 0.19 -0.79 0.16 0.00 -1.51 0.00 0.00 72.50 70.55 3biv s THR 172 CO 0.55 -0.44 1.48 0.03 -2.21 0.00 0.00 174.62 174.04 3biv h ARG 173 N 3.64 0.00 -7.07 7.08 3.08 -1.92 -3.47 114.38 115.72 3biv h ARG 173 Ca -0.32 0.00 -0.50 0.00 0.07 0.00 0.00 59.98 59.23 3biv h ARG 173 Cb 1.19 0.00 0.07 0.00 0.08 0.00 0.00 29.97 31.31 3biv h ARG 173 CO 0.46 0.00 0.44 0.42 -1.07 0.00 0.00 179.97 180.22 3biv s ILE 174 N -3.17 3.14 -0.49 2.04 -1.09 -1.26 -4.95 121.20 115.42 3biv s ILE 174 Ca 0.07 0.75 -0.29 0.00 -2.23 0.00 0.00 60.65 58.95 3biv s ILE 174 Cb 0.12 -3.32 0.03 0.00 -1.58 0.00 0.00 42.46 37.70 3biv s ILE 174 CO 0.68 -0.12 1.21 -0.60 -1.23 0.00 0.00 174.94 174.88 3biv s ARG 175 N -3.15 3.64 0.22 2.79 3.52 -1.26 -5.02 118.95 119.68 3biv s ARG 175 Ca 0.71 0.57 -0.30 0.00 -0.13 0.00 0.00 55.73 56.57 3biv s ARG 175 Cb -0.25 -3.96 -0.08 0.00 -1.56 0.00 0.00 34.95 29.10 3biv s ARG 175 CO 0.29 -1.50 0.96 0.42 -0.81 0.00 0.00 175.30 174.66 3biv s ILE 176 N 4.81 4.09 0.40 4.11 -1.09 -1.26 -4.88 121.20 127.39 3biv s ILE 176 Ca 0.50 2.01 0.07 0.00 -2.23 0.00 0.00 60.65 61.01 3biv s ILE 176 Cb -0.08 -4.28 -0.06 0.00 -1.58 0.00 0.00 42.46 36.45 3biv s ILE 176 CO 0.31 0.44 0.08 0.42 -1.23 0.00 0.00 174.94 174.96 3biv s THR 177 N -0.92 2.21 0.21 2.92 -4.23 -1.26 -5.00 115.64 109.57 3biv s THR 177 Ca 0.43 -1.87 0.28 0.00 -1.18 0.00 0.00 61.69 59.35 3biv s THR 177 Cb -0.26 -2.97 0.28 0.00 1.34 0.00 0.00 72.50 70.89 3biv s THR 177 CO 0.33 -0.03 1.85 0.44 -0.54 0.00 0.00 174.62 176.67 3biv h ASP 178 N 1.63 0.00 -0.45 3.99 3.32 -2.03 -1.84 116.42 121.04 3biv h ASP 178 Ca -0.43 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.62 3biv h ASP 178 Cb 1.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.80 3biv h ASP 178 CO 0.74 0.00 0.00 0.59 -1.72 0.00 0.00 179.24 178.85 3biv n ASN 179 N -2.55 3.07 -4.19 6.45 3.02 -1.26 -4.88 115.26 114.91 3biv n ASN 179 Ca -0.02 -2.19 -0.15 0.00 -0.03 0.00 0.00 54.58 52.18 3biv n ASN 179 Cb 0.14 -0.42 -0.11 0.00 -0.61 0.00 0.00 39.78 38.78 3biv n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 3biv s MET 180 N -1.60 0.89 0.12 3.52 -1.94 -0.69 -1.15 119.30 118.43 3biv s MET 180 Ca 0.33 -1.16 -0.02 0.00 -1.71 0.00 0.00 55.69 53.13 3biv s MET 180 Cb 0.20 -0.64 -0.03 0.00 2.01 0.00 0.00 34.83 36.37 3biv s MET 180 CO 0.18 0.11 0.07 -0.59 -0.01 0.00 0.00 175.02 174.78 3biv s PHE 181 N -2.29 0.71 0.21 -0.03 -0.12 -0.61 -4.84 117.98 111.02 3biv s PHE 181 Ca 0.06 -1.12 0.10 0.00 -0.05 0.00 0.00 56.93 55.91 3biv s PHE 181 Cb -0.04 -0.40 -0.05 0.00 -0.63 0.00 0.00 43.02 41.91 3biv s PHE 181 CO 0.01 -0.51 -0.19 0.00 -0.05 0.00 0.00 175.22 174.48 3biv s ALA 183 N -2.35 -0.10 0.00 0.00 0.00 -0.60 -0.81 121.76 117.90 3biv s ALA 183 Ca 0.23 -0.48 0.00 0.00 0.00 0.00 0.00 51.96 51.71 3biv s ALA 183 Cb -0.05 0.22 0.00 0.00 0.00 0.00 0.00 23.12 23.29 3biv s ALA 183 CO 0.10 -0.29 0.00 0.41 0.00 0.00 0.00 175.76 175.98 3biv n GLY 184 N 0.94 4.00 3.81 0.00 0.00 -0.25 -1.91 105.19 111.79 3biv n GLY 184 Ca -0.20 -1.50 -0.35 0.00 0.00 0.00 0.00 46.02 43.98 3biv n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3biv s TYR 184 N -2.00 3.51 0.46 1.61 2.02 -1.26 -4.57 117.35 117.11 3biv s TYR 184 Ca 0.00 1.52 -0.14 0.00 -0.37 0.00 0.00 57.07 58.08 3biv s TYR 184 Cb 0.00 -2.75 -0.07 0.00 -0.40 0.00 0.00 41.96 38.74 3biv s TYR 184 CO 0.00 0.13 0.88 0.15 -1.57 0.00 0.00 175.55 175.14 3biv s LYS 185 N -2.55 3.88 0.32 -0.62 1.02 -1.26 -4.80 119.74 115.72 3biv s LYS 185 Ca 0.53 0.73 0.10 0.00 0.02 0.00 0.00 55.97 57.35 3biv s LYS 185 Cb -0.14 -2.26 0.92 0.00 -0.52 0.00 0.00 37.83 35.84 3biv s LYS 185 CO 0.19 -0.15 1.70 -1.35 -0.92 0.00 0.00 175.35 174.82 3biv h PRO 186 N 1.11 0.46 0.00 -1.68 0.11 -1.95 0.16 132.00 130.20 3biv h PRO 186 Ca -0.47 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.58 3biv h PRO 186 Cb 1.19 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 3biv h PRO 186 CO 0.63 0.30 -0.16 0.38 -0.21 0.00 0.00 178.00 178.93 3biv h ASP 186 N 0.47 0.00 0.96 -2.05 2.03 -1.96 -2.87 116.42 113.00 3biv h ASP 186 Ca 0.66 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.96 3biv h ASP 186 Cb 1.34 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.84 3biv h ASP 186 CO -0.53 0.16 0.00 -0.33 -1.03 0.00 0.00 179.24 177.52 3biv h GLU 186 N 0.00 0.00 0.00 4.15 5.08 -1.04 -3.46 114.58 119.30 3biv h GLU 186 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3biv h GLU 186 Cb 0.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.56 3biv h GLU 186 CO 0.02 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.44 3biv n GLY 186 N 0.10 1.04 3.85 -3.84 0.00 -1.09 -4.96 105.19 100.30 3biv n GLY 186 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 3biv n GLY 186 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3biv s LYS 186 N 0.00 2.27 0.29 1.61 1.02 -1.26 -5.06 119.74 118.62 3biv s LYS 186 Ca 0.00 0.45 0.02 0.00 0.02 0.00 0.00 55.97 56.47 3biv s LYS 186 Cb 0.00 -1.96 -0.06 0.00 -0.52 0.00 0.00 37.83 35.30 3biv s LYS 186 CO 0.00 -1.45 0.08 1.03 -0.92 0.00 0.00 175.35 174.09 3biv s ARG 187 N -5.31 1.54 0.00 1.68 0.52 -1.26 -4.66 118.95 111.45 3biv s ARG 187 Ca 0.60 -1.84 0.00 0.00 -0.52 0.00 0.00 55.73 53.97 3biv s ARG 187 Cb -0.13 -0.55 0.00 0.00 0.52 0.00 0.00 34.95 34.79 3biv s ARG 187 CO 0.52 -0.25 0.00 0.41 0.02 0.00 0.00 175.30 176.00 3biv n GLY 188 N -0.58 4.46 3.51 -3.53 0.00 -1.26 -4.91 105.19 102.89 3biv n GLY 188 Ca -0.01 -1.18 -0.09 0.00 0.00 0.00 0.00 46.02 44.74 3biv n GLY 188 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3biv s ASP 189 N 0.00 -0.42 1.03 1.61 2.15 -0.96 -4.66 116.67 115.43 3biv s ASP 189 Ca 0.00 -0.07 -0.16 0.00 0.43 0.00 0.00 52.55 52.75 3biv s ASP 189 Cb 0.00 0.50 0.21 0.00 -0.30 0.00 0.00 42.92 43.33 3biv s ASP 189 CO 0.00 -0.82 1.19 0.00 -0.17 0.00 0.00 175.17 175.36 3biv s ALA 190 N -3.43 1.49 0.33 3.66 0.00 -1.26 -0.63 121.76 121.92 3biv s ALA 190 Ca 0.04 -0.90 -0.15 0.00 0.00 0.00 0.00 51.96 50.96 3biv s ALA 190 Cb -0.01 -2.90 0.06 0.00 0.00 0.00 0.00 23.12 20.27 3biv s ALA 190 CO -0.09 -2.81 0.79 0.00 0.00 0.00 0.00 175.76 173.65 3biv n GLU 192 N -0.54 0.00 0.00 0.00 2.13 -1.26 -0.57 120.64 120.41 3biv n GLU 192 Ca -0.07 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.75 3biv n GLU 192 Cb 0.55 -1.38 0.00 0.00 0.27 0.00 0.00 31.44 30.88 3biv n GLU 192 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3biv n GLY 193 N 2.28 3.29 0.05 8.31 0.00 -1.26 -0.69 105.19 117.18 3biv n GLY 193 Ca 0.22 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.37 3biv n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3biv n ASP 194 N 0.04 0.52 -4.48 1.61 8.00 0.27 -3.83 116.55 118.68 3biv n ASP 194 Ca 0.00 0.31 -0.56 0.00 0.71 0.00 0.00 54.79 55.25 3biv n ASP 194 Cb 0.00 -0.31 -0.07 0.00 -0.02 0.00 0.00 41.12 40.72 3biv n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 3biv n SER 195 N -1.90 -0.30 0.00 -2.24 7.64 -1.25 -1.62 113.62 113.95 3biv n SER 195 Ca 0.05 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.09 3biv n SER 195 Cb 0.39 -0.93 0.00 0.00 -1.01 0.00 0.00 64.21 62.66 3biv n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3biv n GLY 196 N 1.63 2.92 3.93 0.23 0.00 -0.40 0.49 105.19 113.98 3biv n GLY 196 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 3biv n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3biv s GLY 197 N -2.12 1.71 0.13 -0.02 0.00 -0.64 -3.23 107.32 103.16 3biv s GLY 197 Ca 0.00 -1.06 -0.13 0.00 0.00 0.00 0.00 44.72 43.53 3biv s GLY 197 CO 0.00 -0.42 0.52 2.56 0.00 0.00 0.00 173.10 175.75 3biv s PRO 198 N -5.67 3.93 -0.35 2.90 0.04 -1.26 -0.94 135.00 133.66 3biv s PRO 198 Ca 0.68 0.42 -0.11 0.00 0.04 0.00 0.00 61.00 62.04 3biv s PRO 198 Cb -0.07 -2.95 0.01 0.00 0.04 0.00 0.00 34.50 31.53 3biv s PRO 198 CO 0.50 0.50 0.19 0.12 0.04 0.00 0.00 177.00 178.35 3biv s PHE 199 N -1.44 3.21 0.17 0.56 2.19 -0.07 -3.64 117.98 118.97 3biv s PHE 199 Ca 0.37 -0.69 0.09 0.00 0.33 0.00 0.00 56.93 57.03 3biv s PHE 199 Cb -0.15 -2.42 -0.04 0.00 -1.31 0.00 0.00 43.02 39.10 3biv s PHE 199 CO 0.19 -0.53 -0.14 0.14 1.83 0.00 0.00 175.22 176.71 3biv s VAL 200 N 1.60 2.97 0.06 3.12 -7.23 0.02 -0.63 120.40 120.31 3biv s VAL 200 Ca 0.04 -1.71 0.05 0.00 -1.81 0.00 0.00 61.98 58.55 3biv s VAL 200 Cb -0.18 -2.45 -0.03 0.00 0.56 0.00 0.00 36.38 34.29 3biv s VAL 200 CO 0.07 -0.08 -0.14 -0.04 -0.31 0.00 0.00 175.10 174.60 3biv s MET 201 N -2.69 0.86 -0.35 4.82 -1.94 0.19 -0.44 119.30 119.75 3biv s MET 201 Ca 0.23 -0.86 -0.12 0.00 -1.71 0.00 0.00 55.69 53.23 3biv s MET 201 Cb -0.09 -0.86 -0.00 0.00 2.01 0.00 0.00 34.83 35.89 3biv s MET 201 CO 0.13 0.20 0.23 0.21 -0.01 0.00 0.00 175.02 175.78 3biv s LYS 202 N -1.46 3.29 0.17 2.03 2.20 -1.26 -0.89 119.74 123.83 3biv s LYS 202 Ca -0.01 -0.78 -0.31 0.00 -0.36 0.00 0.00 55.97 54.51 3biv s LYS 202 Cb -0.09 -3.77 -0.10 0.00 -1.51 0.00 0.00 37.83 32.36 3biv s LYS 202 CO 0.02 -0.52 1.56 0.45 -0.36 0.00 0.00 175.35 176.49 3biv s SER 203 N 1.67 6.59 0.00 1.43 0.15 0.37 -4.85 113.70 119.06 3biv s SER 203 Ca 0.05 2.63 0.31 0.00 0.70 0.00 0.00 55.95 59.64 3biv s SER 203 Cb -0.18 -2.60 1.69 0.00 -1.71 0.00 0.00 66.02 63.22 3biv s SER 203 CO 0.09 -0.81 2.13 -0.81 1.20 0.00 0.00 173.24 175.03 3biv n PRO 204 N 3.78 0.67 -0.02 5.44 -0.04 -1.26 -0.48 135.00 143.10 3biv n PRO 204 Ca 0.13 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.38 3biv n PRO 204 Cb 0.39 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.21 3biv n PRO 204 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3biv n PHE 204 N -1.16 1.20 -0.46 0.54 3.72 -1.26 -4.59 117.46 115.44 3biv n PHE 204 Ca 0.18 0.29 0.00 0.00 -0.05 0.00 0.00 57.45 57.88 3biv n PHE 204 Cb 0.18 -1.15 0.00 0.00 -0.94 0.00 0.00 39.48 37.57 3biv n PHE 204 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 3biv n ASN 204 N -3.65 0.81 -2.23 4.37 6.94 -1.24 -5.02 115.26 115.24 3biv n ASN 204 Ca -0.32 -1.27 -0.20 0.00 -0.02 0.00 0.00 54.58 52.76 3biv n ASN 204 Cb 0.98 0.00 -0.02 0.00 -2.36 0.00 0.00 39.78 38.38 3biv n ASN 204 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 3biv n ASN 205 N -0.14 -5.78 -4.88 0.53 3.02 0.37 -4.98 115.26 103.40 3biv n ASN 205 Ca 0.00 0.05 -0.32 0.00 -0.03 0.00 0.00 54.58 54.28 3biv n ASN 205 Cb 0.24 -4.84 -0.05 0.00 -0.61 0.00 0.00 39.78 34.53 3biv n ASN 205 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3biv s ARG 206 N -4.84 3.32 -0.12 3.52 0.52 -1.25 -4.83 118.95 115.27 3biv s ARG 206 Ca 0.00 -0.43 -0.24 0.00 -0.52 0.00 0.00 55.73 54.53 3biv s ARG 206 Cb 0.00 -3.00 -0.02 0.00 0.52 0.00 0.00 34.95 32.45 3biv s ARG 206 CO 0.00 0.63 0.77 -1.58 0.02 0.00 0.00 175.30 175.15 3biv s TRP 207 N -1.38 3.49 -0.07 -0.53 0.52 -1.26 -0.48 118.94 119.23 3biv s TRP 207 Ca 0.30 1.24 0.02 0.00 0.02 0.00 0.00 56.10 57.69 3biv s TRP 207 Cb -0.13 -2.92 -0.02 0.00 -1.15 0.00 0.00 33.47 29.25 3biv s TRP 207 CO 0.22 -0.10 -0.13 0.71 0.02 0.00 0.00 176.95 177.67 3biv s TYR 208 N 1.57 2.75 -0.53 -1.98 2.02 -0.06 -1.83 117.35 119.29 3biv s TYR 208 Ca 0.38 -0.25 -0.24 0.00 -0.37 0.00 0.00 57.07 56.59 3biv s TYR 208 Cb -0.17 -1.69 0.04 0.00 -0.40 0.00 0.00 41.96 39.74 3biv s TYR 208 CO 0.15 0.11 0.89 -1.14 -1.57 0.00 0.00 175.55 173.99 3biv s GLN 209 N -0.49 3.33 0.10 -0.62 0.74 -0.08 -0.63 119.66 122.02 3biv s GLN 209 Ca 0.06 -0.28 0.21 0.00 0.05 0.00 0.00 55.36 55.40 3biv s GLN 209 Cb -0.12 -4.03 -0.11 0.00 1.10 0.00 0.00 33.01 29.84 3biv s GLN 209 CO 0.02 -1.39 0.83 -1.33 -0.55 0.00 0.00 175.29 172.86 3biv n MET 210 N 7.22 0.62 -4.01 1.67 2.81 0.20 -4.44 117.12 121.19 3biv n MET 210 Ca 0.01 0.08 -0.09 0.00 -1.81 0.00 0.00 57.70 55.89 3biv n MET 210 Cb 0.47 -1.75 -0.08 0.00 -0.71 0.00 0.00 33.22 31.15 3biv n MET 210 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 3biv s GLY 211 N -4.56 0.54 -0.05 3.03 0.00 -0.90 -1.90 107.32 103.48 3biv s GLY 211 Ca -0.03 -1.04 0.05 0.00 0.00 0.00 0.00 44.72 43.69 3biv s GLY 211 CO 0.82 -1.05 -0.19 -0.42 0.00 0.00 0.00 173.10 172.26 3biv s ILE 212 N -3.96 1.62 0.01 0.90 1.01 -0.75 -0.89 121.20 119.13 3biv s ILE 212 Ca 0.15 -0.81 -0.30 0.00 0.00 0.00 0.00 60.65 59.69 3biv s ILE 212 Cb 0.05 -1.39 -0.08 0.00 0.01 0.00 0.00 42.46 41.06 3biv s ILE 212 CO -0.03 0.46 1.83 -0.69 0.00 0.00 0.00 174.94 176.50 3biv s VAL 213 N 0.04 3.22 0.09 2.92 1.01 -0.12 -0.46 120.40 127.11 3biv s VAL 213 Ca -0.05 0.31 -0.00 0.00 0.00 0.00 0.00 61.98 62.23 3biv s VAL 213 Cb -0.13 -3.20 -0.00 0.00 0.00 0.00 0.00 36.38 33.05 3biv s VAL 213 CO 0.03 -0.02 -0.00 -0.24 0.00 0.00 0.00 175.10 174.86 3biv n SER 214 N 7.20 1.07 -3.91 3.32 2.88 -0.73 -1.28 113.62 122.18 3biv n SER 214 Ca 0.19 0.13 -0.08 0.00 -1.33 0.00 0.00 58.87 57.78 3biv n SER 214 Cb 0.42 -0.33 -0.04 0.00 -0.75 0.00 0.00 64.21 63.51 3biv n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 3biv s TRP 215 N -2.01 0.05 0.16 0.66 1.48 -0.96 -4.94 118.94 113.38 3biv s TRP 215 Ca -0.00 -0.46 -0.25 0.00 -1.06 0.00 0.00 56.10 54.33 3biv s TRP 215 Cb 0.00 0.47 0.06 0.00 -1.16 0.00 0.00 33.47 32.84 3biv s TRP 215 CO 0.00 -1.11 0.92 0.20 -4.06 0.00 0.00 176.95 172.90 3biv s GLY 216 N -2.96 -0.23 -0.39 3.67 0.00 -1.26 -0.57 107.32 105.58 3biv s GLY 216 Ca 0.16 0.11 -0.09 0.00 0.00 0.00 0.00 44.72 44.89 3biv s GLY 216 CO 0.07 0.01 0.21 -0.54 0.00 0.00 0.00 173.10 172.84 3biv s GLU 217 N -3.38 2.69 2.18 2.90 2.02 -1.26 -4.96 118.70 118.89 3biv s GLU 217 Ca 0.12 -1.26 0.00 0.00 0.02 0.00 0.00 54.97 53.85 3biv s GLU 217 Cb -0.02 -3.70 0.00 0.00 0.10 0.00 0.00 34.13 30.51 3biv s GLU 217 CO 0.02 -0.80 0.00 0.41 0.02 0.00 0.00 175.26 174.91 3biv n GLY 219 N 4.93 -0.54 2.87 -1.39 0.00 -1.26 -4.74 105.19 105.05 3biv n GLY 219 Ca -0.11 -1.02 -0.17 0.00 0.00 0.00 0.00 46.02 44.72 3biv n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3biv n ASP 221 N 3.72 -4.17 -4.76 0.00 2.03 -1.26 -4.60 116.55 107.50 3biv n ASP 221 Ca -0.22 -0.81 -0.39 0.00 0.52 0.00 0.00 54.79 53.89 3biv n ASP 221 Cb 0.53 -3.78 -0.06 0.00 -0.72 0.00 0.00 41.12 37.10 3biv n ASP 221 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 3biv s ARG 221 N -6.58 4.34 0.15 -0.67 0.52 -1.26 -4.93 118.95 110.52 3biv s ARG 221 Ca 0.58 0.78 -0.34 0.00 -0.52 0.00 0.00 55.73 56.23 3biv s ARG 221 Cb -0.30 -3.34 -0.15 0.00 0.52 0.00 0.00 34.95 31.69 3biv s ARG 221 CO 0.84 0.36 1.49 -0.25 0.02 0.00 0.00 175.30 177.76 3biv n ASP 222 N 2.71 2.67 0.00 0.23 9.92 -1.26 -1.48 116.55 129.34 3biv n ASP 222 Ca -0.06 1.10 0.00 0.00 -0.53 0.00 0.00 54.79 55.30 3biv n ASP 222 Cb 0.51 -1.36 0.00 0.00 -0.64 0.00 0.00 41.12 39.62 3biv n ASP 222 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3biv n GLY 223 N 3.04 0.55 3.73 0.44 0.00 -1.26 -5.03 105.19 106.67 3biv n GLY 223 Ca 0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.92 3biv n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3biv s LYS 224 N -0.34 2.66 0.23 1.61 -0.14 -0.55 -4.81 119.74 118.40 3biv s LYS 224 Ca 0.00 -0.97 0.07 0.00 -1.36 0.00 0.00 55.97 53.70 3biv s LYS 224 Cb 0.00 -2.51 -0.05 0.00 -1.68 0.00 0.00 37.83 33.59 3biv s LYS 224 CO 0.00 0.48 -0.09 0.71 -0.76 0.00 0.00 175.35 175.69 3biv s TYR 225 N -1.71 1.75 0.23 3.18 2.02 -1.26 -4.72 117.35 116.83 3biv s TYR 225 Ca 0.29 -0.68 -0.19 0.00 -0.37 0.00 0.00 57.07 56.12 3biv s TYR 225 Cb -0.10 -0.92 -0.08 0.00 -0.40 0.00 0.00 41.96 40.46 3biv s TYR 225 CO 0.21 0.26 0.72 0.20 -1.57 0.00 0.00 175.55 175.37 3biv s GLY 226 N -3.35 2.60 -0.10 0.71 0.00 -0.80 -4.57 107.32 101.80 3biv s GLY 226 Ca 0.25 0.16 -0.01 0.00 0.00 0.00 0.00 44.72 45.12 3biv s GLY 226 CO 0.08 0.50 -0.05 -1.36 0.00 0.00 0.00 173.10 172.28 3biv s PHE 227 N -1.55 3.00 0.02 1.90 0.40 0.26 -1.56 117.98 120.45 3biv s PHE 227 Ca 0.43 -0.06 0.06 0.00 -0.60 0.00 0.00 56.93 56.76 3biv s PHE 227 Cb -0.16 -1.80 -0.02 0.00 0.51 0.00 0.00 43.02 41.55 3biv s PHE 227 CO 0.21 0.23 -0.17 0.71 0.70 0.00 0.00 175.22 176.90 3biv s TYR 228 N -0.45 1.50 0.20 0.36 1.51 0.14 -1.77 117.35 118.85 3biv s TYR 228 Ca 0.07 -0.32 -0.30 0.00 -1.01 0.00 0.00 57.07 55.50 3biv s TYR 228 Cb -0.12 -0.93 -0.09 0.00 -0.11 0.00 0.00 41.96 40.71 3biv s TYR 228 CO 0.02 0.02 1.42 0.99 -1.11 0.00 0.00 175.55 176.90 3biv s THR 229 N -0.63 2.89 -0.93 -0.71 2.01 0.40 -1.57 115.64 117.09 3biv s THR 229 Ca 0.05 0.71 -0.24 0.00 0.31 0.00 0.00 61.69 62.52 3biv s THR 229 Cb -0.07 -3.45 0.05 0.00 0.01 0.00 0.00 72.50 69.03 3biv s THR 229 CO 0.01 0.09 1.38 -2.28 -0.69 0.00 0.00 174.62 173.13 3biv s HIS 230 N 0.38 2.48 0.16 4.92 2.46 -0.30 -1.82 115.29 123.57 3biv s HIS 230 Ca 0.61 -0.63 -0.15 0.00 0.47 0.00 0.00 55.06 55.36 3biv s HIS 230 Cb -0.40 -4.66 0.07 0.00 -0.13 0.00 0.00 32.58 27.46 3biv s HIS 230 CO 0.38 -1.96 1.78 0.28 -2.47 0.00 0.00 174.74 172.75 3biv h VAL 231 N 6.54 0.96 -0.05 0.89 2.07 -1.68 -2.16 116.25 122.82 3biv h VAL 231 Ca 0.06 -0.14 -0.05 0.00 0.82 0.00 0.00 66.70 67.39 3biv h VAL 231 Cb 1.02 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 3biv h VAL 231 CO 1.37 0.07 -0.19 0.15 0.02 0.00 0.00 177.57 178.99 3biv h PHE 232 N 0.40 0.08 0.00 1.57 3.57 -1.87 -1.35 116.94 119.35 3biv h PHE 232 Ca 0.18 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.67 3biv h PHE 232 Cb 0.09 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 38.81 3biv h PHE 232 CO -0.11 0.27 -0.02 0.00 -2.23 0.00 0.00 178.31 176.23 3biv h ARG 233 N 0.07 0.00 -0.37 1.11 2.47 -1.76 -2.56 114.38 113.34 3biv h ARG 233 Ca 0.01 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.73 3biv h ARG 233 Cb 0.39 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.71 3biv h ARG 233 CO 0.03 0.02 0.00 1.28 0.56 0.00 0.00 179.97 181.85 3biv n LEU 234 N -3.12 4.27 -0.16 3.04 4.77 -0.53 -4.66 117.00 120.61 3biv n LEU 234 Ca 0.00 -2.83 -0.12 0.00 -0.03 0.00 0.00 56.01 53.03 3biv n LEU 234 Cb 0.29 -0.54 -0.00 0.00 -2.33 0.00 0.00 43.42 40.83 3biv n LEU 234 CO 0.27 0.68 0.65 0.50 -1.33 0.00 0.00 177.39 178.17 3biv h LYS 235 N 2.52 1.00 -0.52 3.23 1.63 -1.17 -2.13 116.57 121.13 3biv h LYS 235 Ca 0.00 -0.44 0.10 0.00 -0.85 0.00 0.00 60.65 59.47 3biv h LYS 235 Cb 1.48 -0.03 -0.09 0.00 -0.60 0.00 0.00 32.23 33.00 3biv h LYS 235 CO 0.26 1.12 -0.06 0.87 -3.45 0.00 0.00 179.45 178.19 3biv h LYS 236 N 0.85 0.06 -0.80 1.90 1.57 -1.83 0.43 116.57 118.75 3biv h LYS 236 Ca 0.10 -0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.85 3biv h LYS 236 Cb 0.82 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 33.08 3biv h LYS 236 CO 0.07 0.04 0.37 2.35 -0.57 0.00 0.00 179.45 181.71 3biv h TRP 237 N 0.06 1.17 -0.66 -1.35 7.01 -1.83 -0.86 115.95 119.49 3biv h TRP 237 Ca 0.26 -0.06 -0.01 0.00 2.11 0.00 0.00 58.89 61.19 3biv h TRP 237 Cb 0.40 -0.36 -0.03 0.00 -2.10 0.00 0.00 29.16 27.07 3biv h TRP 237 CO -0.37 0.85 0.39 0.82 -2.79 0.00 0.00 178.44 177.34 3biv h ILE 238 N 1.15 1.20 -0.33 2.65 2.04 -0.50 -1.49 117.51 122.23 3biv h ILE 238 Ca 0.28 -0.45 -0.04 0.00 1.00 0.00 0.00 64.86 65.64 3biv h ILE 238 Cb 0.13 0.30 -0.01 0.00 -0.74 0.00 0.00 36.82 36.50 3biv h ILE 238 CO -0.03 0.21 0.04 1.56 0.00 0.00 0.00 178.15 179.92 3biv h GLN 239 N 0.90 0.56 -0.34 2.37 1.08 -0.52 -1.55 115.11 117.60 3biv h GLN 239 Ca 0.24 -0.16 -0.00 0.00 -1.45 0.00 0.00 58.65 57.28 3biv h GLN 239 Cb -0.01 -0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 27.34 3biv h GLN 239 CO -0.04 0.65 0.21 -0.22 -0.95 0.00 0.00 178.83 178.48 3biv h LYS 240 N 0.38 0.46 -0.71 1.46 3.64 -1.01 0.26 116.57 121.05 3biv h LYS 240 Ca 0.10 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.42 3biv h LYS 240 Cb 0.37 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.06 3biv h LYS 240 CO 0.01 0.34 0.34 0.28 -2.27 0.00 0.00 179.45 178.15 3biv h VAL 241 N 0.45 1.23 -0.22 2.00 2.07 -1.09 -0.40 116.25 120.29 3biv h VAL 241 Ca 0.12 -0.64 -0.15 0.00 0.82 0.00 0.00 66.70 66.84 3biv h VAL 241 Cb -0.01 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.11 3biv h VAL 241 CO -0.02 0.27 -0.50 0.40 0.02 0.00 0.00 177.57 177.74 3biv h ILE 242 N 0.98 1.31 -0.28 4.57 5.03 -0.81 -0.34 117.51 127.98 3biv h ILE 242 Ca 0.24 -1.71 -0.11 0.00 -0.12 0.00 0.00 64.86 63.17 3biv h ILE 242 Cb 0.11 1.67 -0.01 0.00 -3.03 0.00 0.00 36.82 35.56 3biv h ILE 242 CO -0.03 0.54 -0.28 0.44 -0.68 0.00 0.00 178.15 178.14 3biv h ASP 243 N 0.48 0.56 0.10 1.72 3.45 -0.27 -3.20 116.42 119.27 3biv h ASP 243 Ca 0.02 -0.20 -0.01 0.00 0.43 0.00 0.00 57.03 57.27 3biv h ASP 243 Cb 1.04 -0.15 0.00 0.00 -0.56 0.00 0.00 39.33 39.65 3biv h ASP 243 CO 0.10 0.82 -0.05 -0.61 -1.57 0.00 0.00 179.24 177.92 3biv h GLN 244 N 0.48 -0.14 -0.01 3.56 4.15 -0.91 -3.51 115.11 118.74 3biv h GLN 244 Ca 0.06 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.49 3biv h GLN 244 Cb 0.73 0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.45 3biv h GLN 244 CO 0.06 0.36 0.00 1.19 -1.93 0.00 0.00 178.83 178.51