#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ivg s PRO 4 N 0.00 -1.02 0.29 0.38 0.04 -1.26 -4.97 135.00 128.46 3ivg s PRO 4 Ca 0.00 0.06 -0.30 0.00 0.04 0.00 0.00 61.00 60.80 3ivg s PRO 4 Cb 0.00 -1.61 -0.11 0.00 0.04 0.00 0.00 34.50 32.82 3ivg s PRO 4 CO 0.00 -3.60 1.60 0.00 0.04 0.00 0.00 177.00 175.03 3ivg s ALA 5 N -2.96 3.75 -0.15 8.56 0.00 -1.26 -4.95 121.76 124.75 3ivg s ALA 5 Ca 0.70 1.58 -0.01 0.00 0.00 0.00 0.00 51.96 54.22 3ivg s ALA 5 Cb -0.12 -3.65 0.04 0.00 0.00 0.00 0.00 23.12 19.39 3ivg s ALA 5 CO 0.57 -0.99 -0.03 0.12 0.00 0.00 0.00 175.76 175.43 3ivg s PHE 6 N -0.00 1.40 -0.46 0.00 5.36 -1.26 -5.02 117.98 117.99 3ivg s PHE 6 Ca 0.63 -0.86 -0.14 0.00 -0.96 0.00 0.00 56.93 55.60 3ivg s PHE 6 Cb -0.48 -1.17 0.07 0.00 -0.34 0.00 0.00 43.02 41.10 3ivg s PHE 6 CO 0.48 -0.56 0.36 -1.01 -1.46 0.00 0.00 175.22 173.03 3ivg s HIS 7 N 1.73 3.26 0.52 10.12 3.76 -1.26 -5.07 115.29 128.35 3ivg s HIS 7 Ca 0.02 -1.00 -0.22 0.00 -0.15 0.00 0.00 55.06 53.71 3ivg s HIS 7 Cb -0.15 -3.08 -0.07 0.00 1.11 0.00 0.00 32.58 30.40 3ivg s HIS 7 CO -0.07 -0.79 1.18 -2.30 -0.85 0.00 0.00 174.74 171.91 3ivg n PRO 8 N 5.15 1.46 -0.69 8.40 -0.02 -1.26 -2.38 135.00 145.65 3ivg n PRO 8 Ca -0.12 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 3ivg n PRO 8 Cb 0.44 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 3ivg n PRO 8 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ivg n GLY 9 N 0.98 1.39 3.40 -1.23 0.00 -1.26 -5.00 105.19 103.47 3ivg n GLY 9 Ca 0.10 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.88 3ivg n GLY 9 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ivg s GLU 10 N -0.09 1.46 -0.31 1.61 2.02 -1.00 -5.03 118.70 117.36 3ivg s GLU 10 Ca 0.00 -1.54 -0.29 0.00 0.02 0.00 0.00 54.97 53.16 3ivg s GLU 10 Cb 0.00 -1.61 0.01 0.00 0.10 0.00 0.00 34.13 32.63 3ivg s GLU 10 CO 0.00 0.33 1.18 -1.17 0.02 0.00 0.00 175.26 175.62 3ivg s LEU 11 N -2.88 3.92 -0.25 1.80 2.96 -1.25 -4.31 118.68 118.67 3ivg s LEU 11 Ca 0.21 1.14 -0.09 0.00 -0.22 0.00 0.00 54.13 55.16 3ivg s LEU 11 Cb -0.06 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 43.04 3ivg s LEU 11 CO 0.10 -0.97 0.13 0.20 -1.32 0.00 0.00 176.35 174.49 3ivg s ASN 12 N 2.17 5.71 -0.22 3.68 0.01 0.14 -4.97 114.94 121.47 3ivg s ASN 12 Ca 0.51 -0.03 -0.05 0.00 -0.71 0.00 0.00 52.86 52.57 3ivg s ASN 12 Cb -0.14 -2.04 -0.02 0.00 0.41 0.00 0.00 41.25 39.46 3ivg s ASN 12 CO 0.19 0.01 0.01 -0.69 -1.51 0.00 0.00 177.10 175.11 3ivg s VAL 13 N 1.39 3.92 -0.06 1.60 1.01 -1.26 -0.66 120.40 126.34 3ivg s VAL 13 Ca 0.06 -0.31 0.06 0.00 0.00 0.00 0.00 61.98 61.79 3ivg s VAL 13 Cb -0.15 -2.79 -0.01 0.00 0.00 0.00 0.00 36.38 33.43 3ivg s VAL 13 CO 0.06 0.40 -0.24 -0.31 0.00 0.00 0.00 175.10 175.01 3ivg s TYR 14 N 1.27 2.47 -0.19 5.22 2.02 -0.13 -4.99 117.35 123.02 3ivg s TYR 14 Ca 0.04 -0.69 0.14 0.00 -0.37 0.00 0.00 57.07 56.20 3ivg s TYR 14 Cb -0.15 -1.61 -0.24 0.00 -0.40 0.00 0.00 41.96 39.57 3ivg s TYR 14 CO 0.01 -0.19 0.09 0.43 -1.57 0.00 0.00 175.55 174.32 3ivg n SER 15 N 2.93 0.44 -4.69 2.29 7.64 -1.26 -0.78 113.62 120.19 3ivg n SER 15 Ca -0.17 0.02 -0.42 0.00 1.01 0.00 0.00 58.87 59.31 3ivg n SER 15 Cb 0.52 0.64 -0.03 0.00 -1.01 0.00 0.00 64.21 64.33 3ivg n SER 15 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3ivg s ALA 16 N -2.51 3.38 0.28 -0.43 0.00 -1.26 -3.96 121.76 117.26 3ivg s ALA 16 Ca -0.14 0.31 0.02 0.00 0.00 0.00 0.00 51.96 52.15 3ivg s ALA 16 Cb 0.07 -3.34 0.64 0.00 0.00 0.00 0.00 23.12 20.48 3ivg s ALA 16 CO 0.79 -0.51 1.74 -1.35 0.00 0.00 0.00 175.76 176.43 3ivg h PRO 17 N 7.07 0.53 -0.81 0.00 0.11 -1.92 -2.24 132.00 134.74 3ivg h PRO 17 Ca -0.33 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.74 3ivg h PRO 17 Cb 1.16 -0.12 -0.04 0.00 0.11 0.00 0.00 31.00 32.11 3ivg h PRO 17 CO 0.83 0.35 0.47 0.78 -0.21 0.00 0.00 178.00 180.22 3ivg h GLY 18 N 0.55 1.18 0.99 -0.55 0.00 -1.97 -1.02 103.07 102.25 3ivg h GLY 18 Ca 0.52 -0.51 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 3ivg h GLY 18 CO -0.43 0.49 -0.14 -0.55 0.00 0.00 0.00 176.54 175.91 3ivg h ASP 19 N 1.12 -0.32 -0.33 0.19 5.19 -1.81 -0.55 116.42 119.90 3ivg h ASP 19 Ca 0.29 -0.00 -0.06 0.00 -0.62 0.00 0.00 57.03 56.63 3ivg h ASP 19 Cb -0.01 0.08 -0.02 0.00 0.18 0.00 0.00 39.33 39.56 3ivg h ASP 19 CO -0.05 -0.21 -0.00 1.62 -3.12 0.00 0.00 179.24 177.47 3ivg h VAL 20 N -0.40 1.23 -0.37 -1.35 3.04 -1.37 -1.67 116.25 115.35 3ivg h VAL 20 Ca -0.04 -0.93 -0.05 0.00 -1.01 0.00 0.00 66.70 64.67 3ivg h VAL 20 Cb 0.31 0.91 -0.01 0.00 -2.01 0.00 0.00 31.29 30.48 3ivg h VAL 20 CO 0.06 0.32 0.05 0.00 -1.01 0.00 0.00 177.57 176.99 3ivg h ALA 21 N 1.35 0.50 0.01 3.17 0.00 -1.12 -0.36 119.26 122.80 3ivg h ALA 21 Ca 0.13 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 3ivg h ALA 21 Cb 0.41 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.06 3ivg h ALA 21 CO 0.02 0.22 -0.00 -0.44 0.00 0.00 0.00 179.25 179.04 3ivg h ASP 22 N 0.46 -0.01 -0.68 0.00 3.32 -0.90 -1.93 116.42 116.69 3ivg h ASP 22 Ca 0.11 -0.31 0.09 0.00 0.02 0.00 0.00 57.03 56.94 3ivg h ASP 22 Cb 0.39 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.87 3ivg h ASP 22 CO 0.01 0.31 0.32 0.58 -1.72 0.00 0.00 179.24 178.74 3ivg h VAL 23 N -0.32 0.83 -0.51 -1.35 2.07 -1.30 -1.36 116.25 114.30 3ivg h VAL 23 Ca -0.00 -0.19 -0.03 0.00 0.82 0.00 0.00 66.70 67.30 3ivg h VAL 23 Cb 0.32 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 30.30 3ivg h VAL 23 CO 0.00 0.10 0.18 -1.28 0.02 0.00 0.00 177.57 176.59 3ivg h SER 24 N 0.55 0.73 -0.37 0.57 0.87 -0.94 -0.23 113.55 114.72 3ivg h SER 24 Ca 0.34 -0.19 -0.10 0.00 -1.23 0.00 0.00 61.79 60.61 3ivg h SER 24 Cb 0.37 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.13 3ivg h SER 24 CO -0.28 0.72 -0.15 -0.09 -0.53 0.00 0.00 176.83 176.50 3ivg h ARG 25 N 0.69 0.76 -0.54 2.24 2.43 -1.00 -0.50 114.38 118.47 3ivg h ARG 25 Ca 0.17 -0.32 -0.08 0.00 -0.81 0.00 0.00 59.98 58.93 3ivg h ARG 25 Cb 0.23 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.73 3ivg h ARG 25 CO -0.01 0.93 -0.00 0.00 -1.51 0.00 0.00 179.97 179.38 3ivg h ALA 26 N 0.81 0.99 -0.25 2.80 0.00 -1.16 -0.71 119.26 121.74 3ivg h ALA 26 Ca 0.09 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 3ivg h ALA 26 Cb 0.69 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 3ivg h ALA 26 CO 0.05 0.62 0.03 -0.07 0.00 0.00 0.00 179.25 179.88 3ivg h LEU 27 N 0.84 0.40 -1.02 0.00 3.38 -0.74 -2.29 115.31 115.87 3ivg h LEU 27 Ca 0.16 -0.27 0.06 0.00 0.09 0.00 0.00 57.88 57.91 3ivg h LEU 27 Cb 0.50 -0.11 -0.06 0.00 0.09 0.00 0.00 40.66 41.08 3ivg h LEU 27 CO 0.02 0.57 0.65 -0.09 0.09 0.00 0.00 178.44 179.68 3ivg h ARG 28 N 0.21 1.17 0.00 1.13 2.43 -0.85 -0.77 114.38 117.70 3ivg h ARG 28 Ca 0.07 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3ivg h ARG 28 Cb 0.34 -0.26 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 3ivg h ARG 28 CO 0.01 0.77 0.00 -0.07 -1.51 0.00 0.00 179.97 179.17 3ivg h LEU 29 N 1.20 0.00 -1.23 3.80 3.38 -0.95 -1.93 115.31 119.58 3ivg h LEU 29 Ca 0.42 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.39 3ivg h LEU 29 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 3ivg h LEU 29 CO -0.15 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.73 3ivg n THR 30 N -2.31 0.08 -0.21 0.22 -2.24 -0.34 -4.95 114.28 104.53 3ivg n THR 30 Ca 0.03 -0.34 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 3ivg n THR 30 Cb 0.27 0.66 0.00 0.00 -2.10 0.00 0.00 70.33 69.16 3ivg n THR 30 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ivg n GLY 31 N 1.21 0.62 3.79 3.38 0.00 -0.72 -5.08 105.19 108.39 3ivg n GLY 31 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 3ivg n GLY 31 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ivg s ARG 32 N -0.77 4.29 -0.18 1.61 1.81 -0.95 -5.01 118.95 119.75 3ivg s ARG 32 Ca 0.00 1.37 -0.15 0.00 -1.72 0.00 0.00 55.73 55.23 3ivg s ARG 32 Cb 0.00 -2.53 -0.04 0.00 -0.45 0.00 0.00 34.95 31.93 3ivg s ARG 32 CO 0.00 -0.00 0.35 1.03 -0.68 0.00 0.00 175.30 176.00 3ivg s ARG 33 N -2.52 4.21 -0.24 3.54 0.52 -0.71 -4.06 118.95 119.69 3ivg s ARG 33 Ca 0.57 0.15 -0.19 0.00 -0.52 0.00 0.00 55.73 55.74 3ivg s ARG 33 Cb -0.18 -3.49 -0.03 0.00 0.52 0.00 0.00 34.95 31.77 3ivg s ARG 33 CO 0.23 0.08 0.56 0.08 0.02 0.00 0.00 175.30 176.27 3ivg s VAL 34 N 0.94 5.05 -0.15 3.52 1.01 -1.26 -0.34 120.40 129.17 3ivg s VAL 34 Ca 0.18 0.99 -0.06 0.00 0.00 0.00 0.00 61.98 63.09 3ivg s VAL 34 Cb -0.14 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.33 3ivg s VAL 34 CO 0.06 0.09 0.05 -0.04 0.00 0.00 0.00 175.10 175.26 3ivg s MET 35 N 2.19 3.63 -0.10 2.72 1.00 -0.18 -0.31 119.30 128.25 3ivg s MET 35 Ca 0.24 -0.35 0.02 0.00 0.00 0.00 0.00 55.69 55.61 3ivg s MET 35 Cb -0.16 -3.08 -0.01 0.00 0.00 0.00 0.00 34.83 31.59 3ivg s MET 35 CO 0.09 0.45 -0.18 -1.17 0.00 0.00 0.00 175.02 174.21 3ivg s LEU 36 N -0.14 2.43 -0.44 -0.03 2.96 -0.64 -0.42 118.68 122.40 3ivg s LEU 36 Ca 0.06 -0.41 0.03 0.00 -0.22 0.00 0.00 54.13 53.59 3ivg s LEU 36 Cb -0.12 -1.51 0.12 0.00 0.50 0.00 0.00 46.19 45.18 3ivg s LEU 36 CO 0.01 0.20 0.18 -0.69 -1.32 0.00 0.00 176.35 174.73 3ivg s VAL 37 N 0.15 2.63 -0.03 1.68 1.01 -0.29 -1.25 120.40 124.29 3ivg s VAL 37 Ca -0.10 -2.76 -0.30 0.00 0.00 0.00 0.00 61.98 58.82 3ivg s VAL 37 Cb -0.16 -2.85 -0.03 0.00 0.00 0.00 0.00 36.38 33.34 3ivg s VAL 37 CO 0.06 -0.71 1.08 -2.84 0.00 0.00 0.00 175.10 172.69 3ivg s PRO 38 N 0.36 4.45 0.15 2.72 0.02 -1.26 -1.81 135.00 139.62 3ivg s PRO 38 Ca 0.14 1.54 0.00 0.00 0.02 0.00 0.00 61.00 62.70 3ivg s PRO 38 Cb -0.22 -3.49 -0.04 0.00 0.02 0.00 0.00 34.50 30.77 3ivg s PRO 38 CO -0.04 -0.26 0.02 0.95 -0.33 0.00 0.00 177.00 177.34 3ivg s THR 39 N 1.61 0.41 -0.32 0.99 -4.23 -0.13 -4.92 115.64 109.03 3ivg s THR 39 Ca 0.53 -1.94 0.09 0.00 -1.18 0.00 0.00 61.69 59.19 3ivg s THR 39 Cb -0.23 -2.05 0.59 0.00 1.34 0.00 0.00 72.50 72.16 3ivg s THR 39 CO 0.24 -0.51 1.64 0.23 -0.54 0.00 0.00 174.62 175.68 3ivg n MET 40 N -0.16 2.41 0.00 3.99 2.81 -1.26 -2.23 117.12 122.69 3ivg n MET 40 Ca -0.07 -3.08 0.00 0.00 -1.81 0.00 0.00 57.70 52.74 3ivg n MET 40 Cb 0.63 -1.98 0.00 0.00 -0.71 0.00 0.00 33.22 31.16 3ivg n MET 40 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3ivg n GLY 41 N -0.89 -0.38 3.72 3.03 0.00 -1.26 -4.58 105.19 104.83 3ivg n GLY 41 Ca 0.40 -1.08 -0.26 0.00 0.00 0.00 0.00 46.02 45.07 3ivg n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ivg n ALA 42 N 1.80 -2.28 -2.08 4.61 0.00 -1.26 -4.86 120.51 116.44 3ivg n ALA 42 Ca 0.00 -0.20 -0.41 0.00 0.00 0.00 0.00 53.44 52.82 3ivg n ALA 42 Cb 0.00 -3.05 -0.03 0.00 0.00 0.00 0.00 19.45 16.37 3ivg n ALA 42 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3ivg s LEU 43 N -6.57 4.44 0.00 0.00 1.43 -1.26 -4.81 118.68 111.92 3ivg s LEU 43 Ca 0.24 2.22 0.02 0.00 -1.03 0.00 0.00 54.13 55.58 3ivg s LEU 43 Cb -0.08 -3.60 -0.01 0.00 0.03 0.00 0.00 46.19 42.53 3ivg s LEU 43 CO 0.85 -0.38 0.09 0.00 0.23 0.00 0.00 176.35 177.14 3ivg n HIS 44 N 2.62 0.12 0.25 0.29 1.44 -1.26 -4.92 115.22 113.75 3ivg n HIS 44 Ca 0.05 -1.65 0.13 0.00 -2.01 0.00 0.00 57.72 54.24 3ivg n HIS 44 Cb 0.45 -0.01 0.78 0.00 0.12 0.00 0.00 29.99 31.33 3ivg n HIS 44 CO 0.00 0.00 0.00 1.49 -2.81 0.00 0.00 176.34 175.02 3ivg h GLU 45 N 0.00 0.00 0.36 -1.40 4.57 -1.99 -1.89 114.58 114.24 3ivg h GLU 45 Ca -0.20 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 57.97 3ivg h GLU 45 Cb 0.77 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.35 3ivg h GLU 45 CO 0.32 0.00 -0.24 0.78 -1.18 0.00 0.00 179.01 178.69 3ivg h GLY 46 N 0.00 -0.62 0.43 1.92 0.00 -1.91 -1.08 103.07 101.81 3ivg h GLY 46 Ca 0.03 0.27 0.14 0.00 0.00 0.00 0.00 47.33 47.77 3ivg h GLY 46 CO -0.00 -0.24 0.62 0.45 0.00 0.00 0.00 176.54 177.37 3ivg h HIS 47 N -0.59 1.05 -0.08 5.60 3.86 -1.76 -2.56 115.15 120.66 3ivg h HIS 47 Ca -0.04 0.03 -0.11 0.00 -1.16 0.00 0.00 60.37 59.09 3ivg h HIS 47 Cb 0.50 -0.33 -0.01 0.00 1.06 0.00 0.00 27.41 28.63 3ivg h HIS 47 CO -0.11 0.38 -0.45 -0.07 0.86 0.00 0.00 177.93 178.54 3ivg h LEU 48 N 0.88 0.21 -1.13 2.43 3.38 -1.00 -1.88 115.31 118.21 3ivg h LEU 48 Ca 0.50 -0.09 0.05 0.00 0.09 0.00 0.00 57.88 58.42 3ivg h LEU 48 Cb 0.62 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.26 3ivg h LEU 48 CO -0.27 0.64 0.59 0.00 0.09 0.00 0.00 178.44 179.49 3ivg h ALA 49 N 1.37 1.46 -0.34 1.53 0.00 -0.79 0.12 119.26 122.61 3ivg h ALA 49 Ca 0.01 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 3ivg h ALA 49 Cb 0.87 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 3ivg h ALA 49 CO 0.07 0.43 -0.07 -0.07 0.00 0.00 0.00 179.25 179.61 3ivg h LEU 50 N 1.09 0.65 -0.02 0.00 3.38 -1.23 -1.49 115.31 117.69 3ivg h LEU 50 Ca 0.37 -0.36 0.01 0.00 0.09 0.00 0.00 57.88 58.00 3ivg h LEU 50 Cb 0.10 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 3ivg h LEU 50 CO -0.13 0.85 -0.05 0.58 0.09 0.00 0.00 178.44 179.78 3ivg h VAL 51 N 0.43 0.86 -0.81 1.22 2.07 -0.84 -1.82 116.25 117.35 3ivg h VAL 51 Ca 0.09 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.69 3ivg h VAL 51 Cb 0.56 0.86 -0.07 0.00 -1.52 0.00 0.00 31.29 31.12 3ivg h VAL 51 CO 0.03 0.00 0.47 0.03 0.02 0.00 0.00 177.57 178.13 3ivg h ARG 52 N -0.08 0.80 -0.71 1.57 3.08 -0.67 0.21 114.38 118.57 3ivg h ARG 52 Ca 0.03 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 3ivg h ARG 52 Cb 0.12 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 29.96 3ivg h ARG 52 CO -0.07 0.53 0.40 0.00 -1.07 0.00 0.00 179.97 179.76 3ivg h ALA 53 N 1.43 0.91 -0.44 0.04 0.00 -1.02 -1.86 119.26 118.32 3ivg h ALA 53 Ca 0.38 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 55.10 3ivg h ALA 53 Cb 0.29 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3ivg h ALA 53 CO -0.22 0.41 -0.04 0.00 0.00 0.00 0.00 179.25 179.40 3ivg h ALA 54 N 1.21 0.60 -0.39 0.00 0.00 -0.73 -3.14 119.26 116.80 3ivg h ALA 54 Ca 0.25 -0.29 0.01 0.00 0.00 0.00 0.00 54.91 54.87 3ivg h ALA 54 Cb 0.01 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3ivg h ALA 54 CO -0.04 0.43 0.26 0.87 0.00 0.00 0.00 179.25 180.76 3ivg h LYS 55 N 0.64 0.50 -0.00 0.00 1.79 -0.11 -2.60 116.57 116.77 3ivg h LYS 55 Ca 0.12 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.56 3ivg h LYS 55 Cb 0.56 -0.11 0.00 0.00 -1.58 0.00 0.00 32.23 31.10 3ivg h LYS 55 CO 0.03 0.33 -0.02 2.89 -1.08 0.00 0.00 179.45 181.59 3ivg n ARG 56 N -4.48 1.06 -2.25 3.15 1.85 -0.74 -4.68 116.66 110.57 3ivg n ARG 56 Ca 0.03 -0.29 -0.43 0.00 -1.00 0.00 0.00 57.85 56.16 3ivg n ARG 56 Cb 0.07 -1.49 -0.02 0.00 -1.05 0.00 0.00 32.46 29.96 3ivg n ARG 56 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 3ivg s VAL 57 N -2.14 3.96 0.22 8.89 1.01 -0.98 -4.95 120.40 126.40 3ivg s VAL 57 Ca 0.40 1.14 -0.32 0.00 0.00 0.00 0.00 61.98 63.20 3ivg s VAL 57 Cb 0.21 -3.81 -0.13 0.00 0.00 0.00 0.00 36.38 32.66 3ivg s VAL 57 CO 0.39 -0.18 1.58 -2.65 0.00 0.00 0.00 175.10 174.24 3ivg n PRO 58 N 7.04 2.40 -1.01 2.72 -0.02 -1.26 -1.44 135.00 143.43 3ivg n PRO 58 Ca 0.16 0.86 -0.00 0.00 -2.02 0.00 0.00 63.50 62.50 3ivg n PRO 58 Cb 0.45 -2.63 -0.00 0.00 -0.02 0.00 0.00 33.50 31.30 3ivg n PRO 58 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ivg n GLY 59 N 2.98 0.39 3.77 -1.23 0.00 -1.26 -4.76 105.19 105.08 3ivg n GLY 59 Ca 0.14 -0.05 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 3ivg n GLY 59 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3ivg s SER 60 N -2.06 6.36 -0.09 1.61 1.04 -0.52 -1.73 113.70 118.31 3ivg s SER 60 Ca 0.00 2.58 -0.00 0.00 0.48 0.00 0.00 55.95 59.01 3ivg s SER 60 Cb 0.00 -2.63 -0.03 0.00 0.10 0.00 0.00 66.02 63.46 3ivg s SER 60 CO 0.00 -0.81 -0.07 0.54 0.98 0.00 0.00 173.24 173.88 3ivg s VAL 61 N -1.29 3.67 -0.18 5.02 0.11 0.54 -4.84 120.40 123.42 3ivg s VAL 61 Ca 0.57 -0.48 -0.05 0.00 -2.93 0.00 0.00 61.98 59.09 3ivg s VAL 61 Cb -0.36 -2.52 -0.03 0.00 -1.53 0.00 0.00 36.38 31.93 3ivg s VAL 61 CO 0.46 0.57 0.01 -0.69 -3.33 0.00 0.00 175.10 172.13 3ivg s VAL 62 N -0.47 4.24 -0.25 2.04 1.01 -1.26 -1.01 120.40 124.70 3ivg s VAL 62 Ca 0.07 -0.23 -0.05 0.00 0.00 0.00 0.00 61.98 61.77 3ivg s VAL 62 Cb -0.12 -2.90 -0.00 0.00 0.00 0.00 0.00 36.38 33.36 3ivg s VAL 62 CO 0.02 0.46 0.01 -0.69 0.00 0.00 0.00 175.10 174.90 3ivg s VAL 63 N 0.57 3.63 -0.24 2.92 1.01 0.44 -2.21 120.40 126.53 3ivg s VAL 63 Ca -0.00 -0.59 -0.08 0.00 0.00 0.00 0.00 61.98 61.31 3ivg s VAL 63 Cb -0.14 -2.76 -0.04 0.00 0.00 0.00 0.00 36.38 33.44 3ivg s VAL 63 CO 0.02 0.27 0.10 -0.69 0.00 0.00 0.00 175.10 174.80 3ivg s VAL 64 N 1.48 4.75 -0.01 2.92 1.01 -0.06 -1.14 120.40 129.35 3ivg s VAL 64 Ca 0.04 -0.03 -0.07 0.00 0.00 0.00 0.00 61.98 61.92 3ivg s VAL 64 Cb -0.16 -3.21 -0.05 0.00 0.00 0.00 0.00 36.38 32.97 3ivg s VAL 64 CO -0.01 0.35 0.27 -0.94 0.00 0.00 0.00 175.10 174.77 3ivg s SER 65 N 1.24 6.51 -0.19 3.32 1.04 -0.75 -0.86 113.70 124.01 3ivg s SER 65 Ca 0.06 0.59 -0.01 0.00 0.48 0.00 0.00 55.95 57.06 3ivg s SER 65 Cb -0.14 -2.10 0.05 0.00 0.10 0.00 0.00 66.02 63.92 3ivg s SER 65 CO 0.05 0.28 -0.01 -0.63 0.98 0.00 0.00 173.24 173.91 3ivg s ILE 66 N -1.24 0.90 -0.30 -1.02 1.01 -0.27 -0.96 121.20 119.32 3ivg s ILE 66 Ca 0.25 -0.68 -0.06 0.00 0.00 0.00 0.00 60.65 60.16 3ivg s ILE 66 Cb -0.13 -1.24 0.16 0.00 0.01 0.00 0.00 42.46 41.26 3ivg s ILE 66 CO 0.14 -0.06 0.67 0.12 0.00 0.00 0.00 174.94 175.81 3ivg s PHE 67 N 1.70 -1.39 -0.55 3.97 5.36 -0.95 -4.19 117.98 121.93 3ivg s PHE 67 Ca -0.01 1.86 -0.25 0.00 -0.96 0.00 0.00 56.93 57.56 3ivg s PHE 67 Cb -0.17 0.63 0.04 0.00 -0.34 0.00 0.00 43.02 43.18 3ivg s PHE 67 CO -0.07 -0.73 1.01 0.08 -1.46 0.00 0.00 175.22 174.05 3ivg s VAL 68 N 2.85 4.29 -0.56 3.12 1.01 -1.26 -4.33 120.40 125.52 3ivg s VAL 68 Ca 0.08 0.48 -0.27 0.00 0.00 0.00 0.00 61.98 62.26 3ivg s VAL 68 Cb -0.13 -4.58 0.03 0.00 0.00 0.00 0.00 36.38 31.70 3ivg s VAL 68 CO -0.19 -1.16 1.13 0.21 0.00 0.00 0.00 175.10 175.08 3ivg s ASN 69 N 2.84 6.43 0.57 3.32 2.47 -1.26 -4.90 114.94 124.41 3ivg s ASN 69 Ca 0.34 0.03 0.27 0.00 0.42 0.00 0.00 52.86 53.92 3ivg s ASN 69 Cb -0.11 -2.52 1.55 0.00 -1.45 0.00 0.00 41.25 38.72 3ivg s ASN 69 CO 0.21 -1.40 2.06 -0.65 -3.72 0.00 0.00 177.10 173.60 3ivg h PRO 70 N 9.46 0.00 0.00 0.43 0.11 -1.97 -2.88 132.00 137.16 3ivg h PRO 70 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 3ivg h PRO 70 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 3ivg h PRO 70 CO 1.16 0.00 0.00 1.98 -0.21 0.00 0.00 178.00 180.93 3ivg h MET 71 N 0.00 0.00 -0.36 1.05 4.05 -1.90 -2.45 114.93 115.32 3ivg h MET 71 Ca 0.12 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.54 3ivg h MET 71 Cb 0.62 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.42 3ivg h MET 71 CO -0.00 0.00 0.00 0.00 0.23 0.00 0.00 176.91 177.14 3ivg n GLN 72 N -3.08 2.31 -3.97 0.39 10.64 -1.09 -4.05 117.38 118.53 3ivg n GLN 72 Ca 0.01 -1.98 -0.30 0.00 -1.83 0.00 0.00 57.00 52.90 3ivg n GLN 72 Cb 0.36 -1.48 -0.05 0.00 -0.86 0.00 0.00 30.24 28.21 3ivg n GLN 72 CO 0.00 0.00 0.00 -0.06 -1.83 0.00 0.00 177.06 175.17 3ivg s PHE 73 N -1.54 3.39 0.00 2.61 0.40 -0.92 -4.69 117.98 117.22 3ivg s PHE 73 Ca 0.37 0.16 0.00 0.00 -0.60 0.00 0.00 56.93 56.86 3ivg s PHE 73 Cb 0.21 -1.69 0.00 0.00 0.51 0.00 0.00 43.02 42.06 3ivg s PHE 73 CO 0.30 0.55 0.00 0.41 0.70 0.00 0.00 175.22 177.18 3ivg n GLY 74 N 0.18 0.09 3.93 4.36 0.00 -1.26 -4.92 105.19 107.58 3ivg n GLY 74 Ca -0.07 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.69 3ivg n GLY 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ivg s ALA 75 N -3.38 3.84 0.56 4.61 0.00 -1.26 -4.98 121.76 121.14 3ivg s ALA 75 Ca 0.00 -0.88 0.27 0.00 0.00 0.00 0.00 51.96 51.36 3ivg s ALA 75 Cb 0.00 -1.97 1.48 0.00 0.00 0.00 0.00 23.12 22.63 3ivg s ALA 75 CO 0.00 0.40 1.98 0.78 0.00 0.00 0.00 175.76 178.93 3ivg h GLY 76 N 1.89 0.00 0.39 0.00 0.00 -1.97 -2.83 103.07 100.56 3ivg h GLY 76 Ca -0.48 0.00 0.03 0.00 0.00 0.00 0.00 47.33 46.87 3ivg h GLY 76 CO 0.67 0.00 -0.30 -1.33 0.00 0.00 0.00 176.54 175.58 3ivg h GLY 77 N 0.00 -0.52 -0.39 4.60 0.00 -2.00 0.61 103.07 105.38 3ivg h GLY 77 Ca 0.22 0.36 0.09 0.00 0.00 0.00 0.00 47.33 48.00 3ivg h GLY 77 CO -0.00 -0.23 -0.36 -0.55 0.00 0.00 0.00 176.54 175.40 3ivg h ASP 78 N -0.48 -1.24 -0.26 0.19 5.19 -1.92 -2.16 116.42 115.75 3ivg h ASP 78 Ca 0.05 0.22 0.05 0.00 -0.62 0.00 0.00 57.03 56.73 3ivg h ASP 78 Cb 0.54 0.59 -0.05 0.00 0.18 0.00 0.00 39.33 40.59 3ivg h ASP 78 CO -0.22 -0.32 -0.05 0.25 -3.12 0.00 0.00 179.24 175.78 3ivg h LEU 79 N -0.20 -0.22 -1.19 1.55 5.85 -1.32 -2.27 115.31 117.51 3ivg h LEU 79 Ca 0.21 0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.96 3ivg h LEU 79 Cb 0.55 0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.71 3ivg h LEU 79 CO -0.65 -0.07 0.08 0.44 -0.34 0.00 0.00 178.44 177.90 3ivg h ASP 80 N 0.01 0.60 1.45 1.25 3.32 -0.76 -2.92 116.42 119.37 3ivg h ASP 80 Ca 0.12 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.08 3ivg h ASP 80 Cb 0.19 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.58 3ivg h ASP 80 CO -0.26 0.62 0.00 0.00 -1.72 0.00 0.00 179.24 177.88 3ivg h ALA 81 N 1.47 1.00 -2.35 3.45 0.00 -1.12 -3.47 119.26 118.24 3ivg h ALA 81 Ca 0.14 0.00 -0.58 0.00 0.00 0.00 0.00 54.91 54.47 3ivg h ALA 81 Cb 0.27 0.00 0.08 0.00 0.00 0.00 0.00 17.79 18.14 3ivg h ALA 81 CO 0.00 0.00 0.67 0.98 0.00 0.00 0.00 179.25 180.90 3ivg n TYR 82 N -2.95 2.24 -1.86 0.00 9.36 -0.88 -4.89 117.16 118.18 3ivg n TYR 82 Ca 0.03 0.39 -0.42 0.00 3.32 0.00 0.00 57.90 61.22 3ivg n TYR 82 Cb 0.40 -2.49 -0.03 0.00 -0.63 0.00 0.00 39.34 36.60 3ivg n TYR 82 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 3ivg s PRO 83 N -0.19 4.18 -0.13 2.98 0.04 -1.26 -5.00 135.00 135.62 3ivg s PRO 83 Ca 0.70 2.46 0.00 0.00 0.04 0.00 0.00 61.00 64.20 3ivg s PRO 83 Cb -0.64 -3.11 0.02 0.00 0.04 0.00 0.00 34.50 30.81 3ivg s PRO 83 CO 0.47 -0.64 -0.12 1.03 0.04 0.00 0.00 177.00 177.78 3ivg s ARG 84 N 0.90 1.99 -0.38 4.56 0.52 -1.26 -4.38 118.95 120.90 3ivg s ARG 84 Ca 0.70 -0.44 0.11 0.00 -0.52 0.00 0.00 55.73 55.58 3ivg s ARG 84 Cb -0.46 -1.88 0.33 0.00 0.52 0.00 0.00 34.95 33.47 3ivg s ARG 84 CO 0.34 -0.23 0.70 0.25 0.02 0.00 0.00 175.30 176.38 3ivg n THR 85 N 4.77 -0.26 0.25 0.02 -2.24 -1.26 -5.00 114.28 110.56 3ivg n THR 85 Ca -0.16 -4.43 0.12 0.00 -2.27 0.00 0.00 64.05 57.31 3ivg n THR 85 Cb 0.50 -0.53 0.65 0.00 -2.10 0.00 0.00 70.33 68.86 3ivg n THR 85 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 3ivg h PRO 86 N 3.18 0.00 -0.13 -0.78 0.13 -1.99 -1.37 132.00 131.05 3ivg h PRO 86 Ca 0.09 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.13 3ivg h PRO 86 Cb 0.96 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.09 3ivg h PRO 86 CO 0.49 0.15 -0.28 -0.44 -0.23 0.00 0.00 178.00 177.69 3ivg h ASP 87 N 0.00 0.46 -0.64 1.44 3.32 -1.99 -1.21 116.42 117.79 3ivg h ASP 87 Ca -0.00 -0.57 -0.02 0.00 0.02 0.00 0.00 57.03 56.46 3ivg h ASP 87 Cb 0.44 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.83 3ivg h ASP 87 CO 0.02 0.95 0.34 0.44 -1.72 0.00 0.00 179.24 179.26 3ivg h ASP 88 N -0.00 0.81 0.24 6.45 3.32 -1.92 -2.25 116.42 123.08 3ivg h ASP 88 Ca 0.00 -0.11 0.01 0.00 0.02 0.00 0.00 57.03 56.95 3ivg h ASP 88 Cb 0.88 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 40.19 3ivg h ASP 88 CO 0.06 0.69 -0.34 0.44 -1.72 0.00 0.00 179.24 178.37 3ivg h ASP 89 N 0.88 -0.96 -0.62 6.45 3.32 -1.10 0.23 116.42 124.60 3ivg h ASP 89 Ca 0.22 0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.35 3ivg h ASP 89 Cb 0.07 0.34 -0.03 0.00 0.22 0.00 0.00 39.33 39.93 3ivg h ASP 89 CO -0.03 -0.46 0.34 -0.07 -1.72 0.00 0.00 179.24 177.30 3ivg h LEU 90 N -0.65 0.80 -0.52 1.55 3.38 -1.21 -1.79 115.31 116.88 3ivg h LEU 90 Ca 0.00 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 57.85 3ivg h LEU 90 Cb 0.63 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 3ivg h LEU 90 CO -0.13 0.66 0.11 0.00 0.09 0.00 0.00 178.44 179.17 3ivg h ALA 91 N 1.47 0.69 -0.72 1.53 0.00 -0.93 -0.84 119.26 120.45 3ivg h ALA 91 Ca 0.23 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3ivg h ALA 91 Cb 0.05 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 3ivg h ALA 91 CO -0.03 0.40 0.40 1.96 0.00 0.00 0.00 179.25 181.98 3ivg h GLN 92 N 0.73 1.00 -0.33 0.00 4.20 -0.60 -1.94 115.11 118.17 3ivg h GLN 92 Ca 0.16 -0.11 -0.08 0.00 0.06 0.00 0.00 58.65 58.69 3ivg h GLN 92 Cb 0.37 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.94 3ivg h GLN 92 CO 0.01 0.73 -0.09 -0.07 -0.67 0.00 0.00 178.83 178.73 3ivg h LEU 93 N 1.01 0.66 -0.48 1.46 3.38 -0.90 -1.52 115.31 118.91 3ivg h LEU 93 Ca 0.26 -0.37 0.08 0.00 0.09 0.00 0.00 57.88 57.93 3ivg h LEU 93 Cb 0.02 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 40.53 3ivg h LEU 93 CO -0.04 0.88 0.12 0.03 0.09 0.00 0.00 178.44 179.52 3ivg h ARG 94 N 0.43 0.26 -0.77 1.13 3.08 -1.00 -2.31 114.38 115.20 3ivg h ARG 94 Ca 0.08 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.11 3ivg h ARG 94 Cb 0.60 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.55 3ivg h ARG 94 CO 0.04 0.17 0.45 0.00 -1.07 0.00 0.00 179.97 179.55 3ivg h ALA 95 N 1.36 1.35 0.00 0.04 0.00 -1.14 -1.99 119.26 118.88 3ivg h ALA 95 Ca 0.24 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3ivg h ALA 95 Cb 0.30 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3ivg h ALA 95 CO -0.29 0.55 0.00 0.39 0.00 0.00 0.00 179.25 179.90 3ivg n GLU 96 N -4.37 0.20 -0.88 0.00 -0.58 -0.59 -4.92 120.64 109.50 3ivg n GLU 96 Ca 0.08 0.06 0.00 0.00 -0.42 0.00 0.00 57.16 56.88 3ivg n GLU 96 Cb 0.08 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.45 3ivg n GLU 96 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3ivg n GLY 97 N 0.92 0.55 3.72 0.62 0.00 -0.75 -5.02 105.19 105.24 3ivg n GLY 97 Ca 0.09 -0.06 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 3ivg n GLY 97 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3ivg n VAL 98 N -2.88 0.31 0.01 1.61 0.31 -0.95 -4.91 118.33 111.83 3ivg n VAL 98 Ca 0.00 -0.08 0.03 0.00 -0.01 0.00 0.00 64.34 64.28 3ivg n VAL 98 Cb 0.00 -1.96 -0.11 0.00 -0.91 0.00 0.00 33.84 30.86 3ivg n VAL 98 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3ivg n GLU 99 N 3.39 0.64 -4.17 5.55 1.02 -1.24 -3.97 120.64 121.87 3ivg n GLU 99 Ca 0.14 0.05 -0.28 0.00 -0.02 0.00 0.00 57.16 57.05 3ivg n GLU 99 Cb 0.35 -1.68 -0.17 0.00 -0.02 0.00 0.00 31.44 29.92 3ivg n GLU 99 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3ivg s ILE 100 N -3.07 1.29 -0.14 -3.67 1.01 -0.94 0.28 121.20 115.96 3ivg s ILE 100 Ca -0.05 -0.48 -0.04 0.00 0.00 0.00 0.00 60.65 60.07 3ivg s ILE 100 Cb 0.10 -1.23 -0.03 0.00 0.01 0.00 0.00 42.46 41.31 3ivg s ILE 100 CO 0.84 0.41 0.01 0.00 0.00 0.00 0.00 174.94 176.20 3ivg s ALA 101 N 1.32 3.26 -0.29 9.38 0.00 0.16 -0.89 121.76 134.71 3ivg s ALA 101 Ca -0.01 -0.78 0.01 0.00 0.00 0.00 0.00 51.96 51.18 3ivg s ALA 101 Cb -0.14 -1.66 0.06 0.00 0.00 0.00 0.00 23.12 21.38 3ivg s ALA 101 CO -0.05 0.35 -0.03 0.12 0.00 0.00 0.00 175.76 176.14 3ivg s PHE 102 N -0.12 3.34 -0.66 0.00 5.36 -0.04 -0.95 117.98 124.91 3ivg s PHE 102 Ca 0.05 -2.24 0.06 0.00 -0.96 0.00 0.00 56.93 53.83 3ivg s PHE 102 Cb -0.12 -2.19 0.22 0.00 -0.34 0.00 0.00 43.02 40.58 3ivg s PHE 102 CO 0.02 -0.87 0.65 0.25 -1.46 0.00 0.00 175.22 173.82 3ivg n THR 103 N 4.49 2.07 -1.86 0.12 -2.24 0.04 -1.11 114.28 115.79 3ivg n THR 103 Ca -0.11 -5.08 -0.33 0.00 -2.27 0.00 0.00 64.05 56.26 3ivg n THR 103 Cb 0.42 -2.13 0.03 0.00 -2.10 0.00 0.00 70.33 66.56 3ivg n THR 103 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3ivg s PRO 104 N -2.10 2.98 0.56 -0.78 0.04 -1.25 -4.31 135.00 130.14 3ivg s PRO 104 Ca 0.34 1.33 -0.15 0.00 0.04 0.00 0.00 61.00 62.56 3ivg s PRO 104 Cb 0.08 -1.98 -0.06 0.00 0.04 0.00 0.00 34.50 32.59 3ivg s PRO 104 CO -0.07 -1.10 1.02 0.95 0.04 0.00 0.00 177.00 177.84 3ivg s THR 105 N -2.37 4.29 0.27 1.26 -4.23 -1.26 -4.90 115.64 108.69 3ivg s THR 105 Ca 0.66 1.03 -0.02 0.00 -1.18 0.00 0.00 61.69 62.17 3ivg s THR 105 Cb -0.19 -3.61 0.27 0.00 1.34 0.00 0.00 72.50 70.31 3ivg s THR 105 CO 0.40 -0.70 1.89 0.74 -0.54 0.00 0.00 174.62 176.41 3ivg h THR 106 N 0.52 1.10 -0.45 3.99 2.02 -1.96 -2.15 112.91 115.98 3ivg h THR 106 Ca -0.46 -0.41 -0.07 0.00 0.77 0.00 0.00 66.41 66.23 3ivg h THR 106 Cb 1.20 -0.19 -0.02 0.00 -1.74 0.00 0.00 68.15 67.39 3ivg h THR 106 CO 0.60 0.22 -0.03 0.00 0.37 0.00 0.00 175.52 176.68 3ivg h ALA 107 N 1.45 1.11 -0.24 6.16 0.00 -1.94 0.77 119.26 126.58 3ivg h ALA 107 Ca 0.43 -0.27 -0.16 0.00 0.00 0.00 0.00 54.91 54.91 3ivg h ALA 107 Cb 0.15 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3ivg h ALA 107 CO -0.17 0.56 -0.49 0.00 0.00 0.00 0.00 179.25 179.16 3ivg h ALA 108 N 1.27 0.69 0.02 0.00 0.00 -1.85 -2.22 119.26 117.17 3ivg h ALA 108 Ca 0.13 -0.48 -0.24 0.00 0.00 0.00 0.00 54.91 54.32 3ivg h ALA 108 Cb 0.47 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3ivg h ALA 108 CO 0.02 0.67 -1.00 0.52 0.00 0.00 0.00 179.25 179.47 3ivg h MET 109 N 0.52 0.41 -2.15 0.00 2.86 -1.05 -3.39 114.93 112.12 3ivg h MET 109 Ca 0.03 -0.48 -0.54 0.00 -2.06 0.00 0.00 59.70 56.65 3ivg h MET 109 Cb 1.03 0.14 -0.41 0.00 0.06 0.00 0.00 31.60 32.43 3ivg h MET 109 CO 0.10 1.14 -0.90 0.66 1.06 0.00 0.00 176.91 178.97 3ivg n TYR 110 N -3.73 2.25 0.30 -0.22 4.01 0.23 -4.91 117.16 115.09 3ivg n TYR 110 Ca -0.07 -3.92 0.19 0.00 -0.16 0.00 0.00 57.90 53.94 3ivg n TYR 110 Cb 0.87 -0.46 0.85 0.00 -0.31 0.00 0.00 39.34 40.29 3ivg n TYR 110 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3ivg h PRO 111 N 3.04 0.00 -0.29 -0.72 0.13 -1.61 -2.42 132.00 130.13 3ivg h PRO 111 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 3ivg h PRO 111 Cb 0.72 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.85 3ivg h PRO 111 CO 0.67 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.20 3ivg n ASP 112 N -3.10 3.64 0.00 1.44 8.00 -1.26 -5.09 116.55 120.19 3ivg n ASP 112 Ca -0.01 -2.72 0.00 0.00 0.71 0.00 0.00 54.79 52.78 3ivg n ASP 112 Cb 0.23 -0.46 0.00 0.00 -0.02 0.00 0.00 41.12 40.88 3ivg n ASP 112 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3ivg n GLY 113 N -0.18 0.03 3.68 0.44 0.00 -0.91 -4.61 105.19 103.64 3ivg n GLY 113 Ca 0.19 -1.00 -0.42 0.00 0.00 0.00 0.00 46.02 44.78 3ivg n GLY 113 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ivg s LEU 114 N 0.00 4.25 0.00 0.99 1.43 -1.26 -4.89 118.68 119.20 3ivg s LEU 114 Ca 0.00 1.64 0.00 0.00 -1.03 0.00 0.00 54.13 54.74 3ivg s LEU 114 Cb 0.00 -3.56 0.00 0.00 0.03 0.00 0.00 46.19 42.66 3ivg s LEU 114 CO 0.00 -0.52 0.00 -1.14 0.23 0.00 0.00 176.35 174.92 3ivg n ARG 115 N 5.20 0.00 -2.28 1.70 0.63 -1.26 -5.07 116.66 115.59 3ivg n ARG 115 Ca 0.10 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.61 3ivg n ARG 115 Cb 0.47 0.00 -0.03 0.00 0.45 0.00 0.00 32.46 33.35 3ivg n ARG 115 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 3ivg s THR 116 N 1.25 3.44 0.27 5.15 2.01 -1.26 -5.02 115.64 121.48 3ivg s THR 116 Ca 0.00 1.14 0.02 0.00 0.31 0.00 0.00 61.69 63.15 3ivg s THR 116 Cb 0.00 -3.73 -0.05 0.00 0.01 0.00 0.00 72.50 68.73 3ivg s THR 116 CO 0.00 0.15 0.10 0.42 -0.69 0.00 0.00 174.62 174.59 3ivg s THR 117 N 0.40 0.58 -0.12 -0.82 -4.23 -1.26 -5.12 115.64 105.07 3ivg s THR 117 Ca 0.57 -2.00 -0.18 0.00 -1.18 0.00 0.00 61.69 58.91 3ivg s THR 117 Cb -0.34 -2.64 -0.04 0.00 1.34 0.00 0.00 72.50 70.82 3ivg s THR 117 CO 0.35 0.00 0.47 -0.69 -0.54 0.00 0.00 174.62 174.21 3ivg s VAL 118 N -3.71 5.19 -0.39 2.29 1.01 -1.26 -5.05 120.40 118.47 3ivg s VAL 118 Ca 0.37 0.93 -0.13 0.00 0.00 0.00 0.00 61.98 63.15 3ivg s VAL 118 Cb 0.08 -3.81 0.02 0.00 0.00 0.00 0.00 36.38 32.67 3ivg s VAL 118 CO 0.14 0.33 0.26 -1.58 0.00 0.00 0.00 175.10 174.26 3ivg s GLN 119 N 0.58 2.91 0.96 2.72 2.00 -1.26 -4.56 119.66 123.01 3ivg s GLN 119 Ca 0.25 -1.04 -0.12 0.00 -2.00 0.00 0.00 55.36 52.45 3ivg s GLN 119 Cb -0.15 -3.87 0.17 0.00 0.80 0.00 0.00 33.01 29.95 3ivg s GLN 119 CO 0.10 -0.73 1.09 -2.14 -0.50 0.00 0.00 175.29 173.11 3ivg s PRO 120 N 1.63 0.70 0.63 1.67 0.02 -1.26 -5.06 135.00 133.34 3ivg s PRO 120 Ca 0.04 0.81 -0.11 0.00 0.02 0.00 0.00 61.00 61.76 3ivg s PRO 120 Cb -0.19 -1.75 0.16 0.00 0.02 0.00 0.00 34.50 32.74 3ivg s PRO 120 CO 0.09 -2.62 0.55 0.41 -0.33 0.00 0.00 177.00 175.10 3ivg n GLY 121 N -0.72 -2.70 0.21 0.52 0.00 -1.26 -4.84 105.19 96.40 3ivg n GLY 121 Ca 0.06 -1.46 0.15 0.00 0.00 0.00 0.00 46.02 44.77 3ivg n GLY 121 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3ivg h PRO 122 N 0.00 0.00 -0.08 1.61 0.11 -2.02 -2.25 132.00 129.37 3ivg h PRO 122 Ca -0.21 0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.93 3ivg h PRO 122 Cb 0.64 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.75 3ivg h PRO 122 CO 0.14 0.00 0.11 1.25 -0.21 0.00 0.00 178.00 179.29 3ivg h LEU 123 N 0.00 0.00 -0.55 2.35 5.85 -1.94 -1.82 115.31 119.20 3ivg h LEU 123 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3ivg h LEU 123 Cb 0.21 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.24 3ivg h LEU 123 CO 0.00 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 178.10 3ivg n ALA 124 N -2.27 1.81 1.32 1.25 0.00 -0.85 -1.65 120.51 120.13 3ivg n ALA 124 Ca -0.01 0.06 0.13 0.00 0.00 0.00 0.00 53.44 53.63 3ivg n ALA 124 Cb 0.21 -1.41 0.38 0.00 0.00 0.00 0.00 19.45 18.62 3ivg n ALA 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ivg n ALA 125 N -1.78 2.56 -2.88 0.00 0.00 -0.68 -4.07 120.51 113.66 3ivg n ALA 125 Ca 0.03 -0.53 -0.23 0.00 0.00 0.00 0.00 53.44 52.71 3ivg n ALA 125 Cb 0.28 -1.04 -0.02 0.00 0.00 0.00 0.00 19.45 18.66 3ivg n ALA 125 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3ivg s GLU 126 N -2.02 3.46 5.60 0.00 0.41 -0.66 -3.25 118.70 122.24 3ivg s GLU 126 Ca 0.34 -0.60 0.00 0.00 -0.41 0.00 0.00 54.97 54.31 3ivg s GLU 126 Cb 0.21 -2.86 0.00 0.00 -1.78 0.00 0.00 34.13 29.70 3ivg s GLU 126 CO 0.33 0.39 0.00 1.28 -0.49 0.00 0.00 175.26 176.77 3ivg n LEU 127 N -1.22 0.00 0.27 1.80 4.77 -1.26 -0.76 117.00 120.60 3ivg n LEU 127 Ca -0.07 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.03 3ivg n LEU 127 Cb 0.56 0.00 0.75 0.00 -2.33 0.00 0.00 43.42 42.40 3ivg n LEU 127 CO 0.47 0.00 1.00 -0.33 -1.33 0.00 0.00 177.39 177.20 3ivg h GLU 128 N 0.00 0.00 0.00 3.23 4.39 -1.93 -2.33 114.58 117.95 3ivg h GLU 128 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3ivg h GLU 128 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 3ivg h GLU 128 CO 0.00 0.10 -0.14 0.41 -1.16 0.00 0.00 179.01 178.22 3ivg n GLY 129 N -0.88 -1.58 0.36 -3.84 0.00 0.06 -4.07 105.19 95.25 3ivg n GLY 129 Ca -0.02 -0.10 -0.12 0.00 0.00 0.00 0.00 46.02 45.77 3ivg n GLY 129 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3ivg h GLY 130 N 4.66 -1.17 -1.25 -0.02 0.00 -1.39 -2.16 103.07 101.74 3ivg h GLY 130 Ca 0.00 0.59 0.00 0.00 0.00 0.00 0.00 47.33 47.92 3ivg h GLY 130 CO 0.00 -0.33 0.00 -1.55 0.00 0.00 0.00 176.54 174.66 3ivg n PRO 131 N -4.67 1.83 -3.29 4.80 -0.04 -1.26 -4.42 135.00 127.95 3ivg n PRO 131 Ca -0.07 -1.29 -0.25 0.00 -0.04 0.00 0.00 63.50 61.85 3ivg n PRO 131 Cb 0.31 -1.31 -0.08 0.00 -0.04 0.00 0.00 33.50 32.39 3ivg n PRO 131 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3ivg n ARG 132 N 0.53 1.04 0.25 0.54 1.74 -0.82 -5.00 116.66 114.94 3ivg n ARG 132 Ca 0.13 -3.54 0.17 0.00 -0.77 0.00 0.00 57.85 53.83 3ivg n ARG 132 Cb 0.32 -1.51 0.71 0.00 -1.02 0.00 0.00 32.46 30.95 3ivg n ARG 132 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 3ivg h PRO 133 N 4.28 0.00 -0.03 5.56 0.13 -1.76 -2.24 132.00 137.94 3ivg h PRO 133 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 3ivg h PRO 133 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 3ivg h PRO 133 CO 0.53 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 178.55 3ivg n THR 134 N -2.85 0.02 0.30 1.56 -2.24 -1.26 -4.71 114.28 105.10 3ivg n THR 134 Ca 0.00 -0.51 -0.17 0.00 -2.27 0.00 0.00 64.05 61.10 3ivg n THR 134 Cb 0.25 1.35 -0.08 0.00 -2.10 0.00 0.00 70.33 69.74 3ivg n THR 134 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 3ivg h HIS 135 N 3.51 -0.91 0.00 4.78 6.17 -1.68 -1.87 115.15 125.15 3ivg h HIS 135 Ca 0.00 -0.01 -0.10 0.00 0.71 0.00 0.00 60.37 60.97 3ivg h HIS 135 Cb 0.75 0.33 -0.01 0.00 2.52 0.00 0.00 27.41 31.00 3ivg h HIS 135 CO 0.01 -0.52 -0.47 0.74 0.71 0.00 0.00 177.93 178.40 3ivg h PHE 136 N -0.83 0.00 -0.52 5.26 0.04 -1.84 -1.91 116.94 117.13 3ivg h PHE 136 Ca -0.06 0.00 0.08 0.00 2.80 0.00 0.00 57.97 60.79 3ivg h PHE 136 Cb 0.69 0.00 -0.06 0.00 2.20 0.00 0.00 35.95 38.78 3ivg h PHE 136 CO -0.12 0.47 0.16 0.00 -0.60 0.00 0.00 178.31 178.23 3ivg h ALA 137 N 1.53 0.62 -0.54 2.45 0.00 -1.78 0.98 119.26 122.52 3ivg h ALA 137 Ca -0.00 0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.01 3ivg h ALA 137 Cb 0.91 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.74 3ivg h ALA 137 CO 0.06 -0.24 0.34 0.78 0.00 0.00 0.00 179.25 180.18 3ivg h GLY 138 N 0.32 0.77 0.77 0.00 0.00 -0.61 -0.31 103.07 104.01 3ivg h GLY 138 Ca 0.25 -0.26 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 3ivg h GLY 138 CO -0.28 0.23 0.00 -2.08 0.00 0.00 0.00 176.54 174.41 3ivg h VAL 139 N 0.67 1.25 -0.31 4.60 2.07 -1.05 -2.34 116.25 121.14 3ivg h VAL 139 Ca 0.21 -0.79 -0.11 0.00 0.82 0.00 0.00 66.70 66.83 3ivg h VAL 139 Cb -0.01 1.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.30 3ivg h VAL 139 CO -0.08 0.23 -0.25 -0.07 0.02 0.00 0.00 177.57 177.42 3ivg h LEU 140 N -0.07 0.62 0.09 2.57 3.38 -0.70 0.02 115.31 121.22 3ivg h LEU 140 Ca 0.03 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 57.78 3ivg h LEU 140 Cb 0.35 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.93 3ivg h LEU 140 CO 0.01 0.85 -0.04 0.74 0.09 0.00 0.00 178.44 180.08 3ivg h THR 141 N 0.53 0.94 -0.23 0.22 2.02 -1.06 0.79 112.91 116.12 3ivg h THR 141 Ca 0.07 -0.10 -0.11 0.00 0.77 0.00 0.00 66.41 67.05 3ivg h THR 141 Cb 0.71 1.00 -0.01 0.00 -1.74 0.00 0.00 68.15 68.12 3ivg h THR 141 CO 0.05 0.02 -0.31 1.62 0.37 0.00 0.00 175.52 177.28 3ivg h VAL 142 N -0.17 1.28 -0.36 3.16 3.04 -1.16 -2.04 116.25 120.00 3ivg h VAL 142 Ca -0.01 -1.38 -0.16 0.00 -1.01 0.00 0.00 66.70 64.14 3ivg h VAL 142 Cb 0.13 1.44 -0.01 0.00 -2.01 0.00 0.00 31.29 30.85 3ivg h VAL 142 CO 0.02 0.43 -0.40 0.58 -1.01 0.00 0.00 177.57 177.19 3ivg h VAL 143 N 0.41 1.27 -0.49 1.51 2.07 -0.90 0.11 116.25 120.24 3ivg h VAL 143 Ca 0.05 -1.58 0.03 0.00 0.82 0.00 0.00 66.70 66.02 3ivg h VAL 143 Cb 0.75 1.42 -0.04 0.00 -1.52 0.00 0.00 31.29 31.90 3ivg h VAL 143 CO 0.06 0.52 0.28 0.25 0.02 0.00 0.00 177.57 178.70 3ivg h LEU 144 N 0.73 0.44 -0.38 2.57 5.85 -0.73 -0.27 115.31 123.52 3ivg h LEU 144 Ca 0.06 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.77 3ivg h LEU 144 Cb 0.99 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.92 3ivg h LEU 144 CO 0.10 0.31 0.17 0.11 -0.34 0.00 0.00 178.44 178.79 3ivg h LYS 145 N 0.55 0.55 -0.61 1.25 1.57 -0.77 -2.01 116.57 117.09 3ivg h LYS 145 Ca 0.20 -0.09 0.03 0.00 -1.87 0.00 0.00 60.65 58.93 3ivg h LYS 145 Cb 0.05 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.22 3ivg h LYS 145 CO -0.11 0.50 0.37 -0.07 -0.57 0.00 0.00 179.45 179.57 3ivg h LEU 146 N 0.47 0.60 -1.24 2.94 3.38 -0.49 -0.05 115.31 120.91 3ivg h LEU 146 Ca 0.13 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 3ivg h LEU 146 Cb 0.14 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 3ivg h LEU 146 CO -0.01 0.41 0.22 -0.07 0.09 0.00 0.00 178.44 179.07 3ivg h LEU 147 N 0.72 0.67 -0.27 1.67 3.38 -0.84 -0.52 115.31 120.11 3ivg h LEU 147 Ca 0.25 -0.07 -0.21 0.00 0.09 0.00 0.00 57.88 57.94 3ivg h LEU 147 Cb 0.04 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.62 3ivg h LEU 147 CO -0.11 0.60 -0.83 1.56 0.09 0.00 0.00 178.44 179.75 3ivg h GLN 148 N 0.74 0.47 0.07 1.13 1.08 -0.80 0.37 115.11 118.16 3ivg h GLN 148 Ca 0.18 -0.43 -0.00 0.00 -1.45 0.00 0.00 58.65 56.95 3ivg h GLN 148 Cb 0.13 0.10 0.00 0.00 -0.05 0.00 0.00 27.48 27.67 3ivg h GLN 148 CO -0.02 1.07 -0.03 0.82 -0.95 0.00 0.00 178.83 179.72 3ivg h ILE 149 N 0.30 1.20 0.02 2.54 2.04 -0.78 -3.35 117.51 119.49 3ivg h ILE 149 Ca -0.06 -1.03 -0.25 0.00 1.00 0.00 0.00 64.86 64.53 3ivg h ILE 149 Cb 1.43 1.86 -0.03 0.00 -0.74 0.00 0.00 36.82 39.35 3ivg h ILE 149 CO 0.15 0.25 -1.29 0.58 0.00 0.00 0.00 178.15 177.84 3ivg h VAL 150 N -0.56 1.38 -6.58 1.67 2.07 -1.17 -3.36 116.25 109.70 3ivg h VAL 150 Ca -0.01 -3.12 -0.52 0.00 0.82 0.00 0.00 66.70 63.87 3ivg h VAL 150 Cb 0.48 2.71 0.02 0.00 -1.52 0.00 0.00 31.29 32.98 3ivg h VAL 150 CO 0.02 0.81 -0.97 0.54 0.02 0.00 0.00 177.57 177.99 3ivg n ARG 151 N -3.27 -1.03 -1.83 1.57 1.74 0.13 -4.78 116.66 109.19 3ivg n ARG 151 Ca -0.07 0.28 -0.31 0.00 -0.77 0.00 0.00 57.85 56.98 3ivg n ARG 151 Cb 0.99 -3.50 0.03 0.00 -1.02 0.00 0.00 32.46 28.97 3ivg n ARG 151 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 3ivg s PRO 152 N -6.70 3.13 0.16 5.56 0.04 -1.26 -4.92 135.00 131.01 3ivg s PRO 152 Ca 0.41 0.64 0.00 0.00 0.04 0.00 0.00 61.00 62.09 3ivg s PRO 152 Cb -0.18 -2.04 -0.02 0.00 0.04 0.00 0.00 34.50 32.29 3ivg s PRO 152 CO 0.92 -0.88 1.36 -0.44 0.04 0.00 0.00 177.00 178.00 3ivg h ASP 153 N -0.54 0.35 -4.60 6.66 3.32 -0.99 -3.43 116.42 117.19 3ivg h ASP 153 Ca -0.45 -0.28 -0.18 0.00 0.02 0.00 0.00 57.03 56.15 3ivg h ASP 153 Cb 1.22 -0.11 -0.23 0.00 0.22 0.00 0.00 39.33 40.44 3ivg h ASP 153 CO 0.62 1.07 -0.64 -0.13 -1.72 0.00 0.00 179.24 178.44 3ivg s ARG 154 N -3.25 0.27 -0.02 3.56 0.52 -1.20 -1.97 118.95 116.86 3ivg s ARG 154 Ca -0.04 -0.35 0.04 0.00 -0.52 0.00 0.00 55.73 54.87 3ivg s ARG 154 Cb 0.10 0.11 -0.01 0.00 0.52 0.00 0.00 34.95 35.67 3ivg s ARG 154 CO 0.84 -0.05 -0.16 0.54 0.02 0.00 0.00 175.30 176.49 3ivg s VAL 155 N -0.98 1.26 -0.20 3.52 0.11 -0.14 -1.62 120.40 122.36 3ivg s VAL 155 Ca -0.11 -0.66 -0.04 0.00 -2.93 0.00 0.00 61.98 58.24 3ivg s VAL 155 Cb -0.06 -1.07 -0.02 0.00 -1.53 0.00 0.00 36.38 33.70 3ivg s VAL 155 CO -0.00 0.36 -0.03 -0.36 -3.33 0.00 0.00 175.10 171.74 3ivg s PHE 156 N -0.18 2.98 0.05 1.54 0.40 -0.38 -1.12 117.98 121.28 3ivg s PHE 156 Ca 0.02 -0.64 0.06 0.00 -0.60 0.00 0.00 56.93 55.77 3ivg s PHE 156 Cb -0.08 -2.06 -0.03 0.00 0.51 0.00 0.00 43.02 41.36 3ivg s PHE 156 CO 0.00 -0.34 -0.16 -0.06 0.70 0.00 0.00 175.22 175.37 3ivg s PHE 157 N 1.07 1.38 0.39 0.36 0.08 -0.60 -4.28 117.98 116.38 3ivg s PHE 157 Ca 0.01 -0.39 -0.24 0.00 0.12 0.00 0.00 56.93 56.44 3ivg s PHE 157 Cb -0.15 -0.80 -0.10 0.00 -0.57 0.00 0.00 43.02 41.41 3ivg s PHE 157 CO 0.01 0.07 1.00 0.20 -0.10 0.00 0.00 175.22 176.40 3ivg s GLY 158 N -1.38 2.67 0.44 4.36 0.00 -1.26 -0.59 107.32 111.55 3ivg s GLY 158 Ca 0.02 0.59 0.30 0.00 0.00 0.00 0.00 44.72 45.64 3ivg s GLY 158 CO 0.02 0.99 1.91 0.83 0.00 0.00 0.00 173.10 176.85 3ivg h GLU 159 N 2.47 0.00 -0.20 2.90 5.08 -1.15 -3.26 114.58 120.42 3ivg h GLU 159 Ca -0.48 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 57.93 3ivg h GLU 159 Cb 1.20 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.40 3ivg h GLU 159 CO 0.62 0.00 -0.16 -0.22 -1.00 0.00 0.00 179.01 178.25 3ivg h LYS 160 N 0.00 -0.16 -4.22 2.33 1.63 -1.92 -2.36 116.57 111.87 3ivg h LYS 160 Ca 0.00 0.01 -0.75 0.00 -0.85 0.00 0.00 60.65 59.06 3ivg h LYS 160 Cb 0.26 0.04 -0.18 0.00 -0.60 0.00 0.00 32.23 31.75 3ivg h LYS 160 CO 0.00 -0.11 1.54 -0.25 -3.45 0.00 0.00 179.45 177.18 3ivg n ASP 161 N -5.32 5.22 -0.07 4.20 8.00 -1.23 -4.73 116.55 122.62 3ivg n ASP 161 Ca -0.02 -3.04 -0.14 0.00 0.71 0.00 0.00 54.79 52.31 3ivg n ASP 161 Cb 0.23 -1.52 -0.06 0.00 -0.02 0.00 0.00 41.12 39.75 3ivg n ASP 161 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 3ivg h TYR 162 N 6.57 0.73 -0.46 1.24 3.20 -1.65 -1.84 116.97 124.76 3ivg h TYR 162 Ca 0.34 -0.24 0.04 0.00 3.14 0.00 0.00 58.73 62.01 3ivg h TYR 162 Cb 0.78 -0.14 -0.04 0.00 1.54 0.00 0.00 36.73 38.86 3ivg h TYR 162 CO 1.14 0.96 0.23 0.37 -1.64 0.00 0.00 178.16 179.22 3ivg h GLN 163 N 0.28 0.44 -0.63 1.82 4.15 -1.87 -1.73 115.11 117.57 3ivg h GLN 163 Ca 0.02 -0.03 0.11 0.00 0.77 0.00 0.00 58.65 59.53 3ivg h GLN 163 Cb 0.88 -0.10 -0.09 0.00 0.21 0.00 0.00 27.48 28.38 3ivg h GLN 163 CO 0.07 0.29 0.18 0.37 -1.93 0.00 0.00 178.83 177.81 3ivg h GLN 164 N 0.46 0.31 -0.50 1.69 4.15 -1.92 -1.26 115.11 118.04 3ivg h GLN 164 Ca 0.20 -0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.58 3ivg h GLN 164 Cb 0.11 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 27.71 3ivg h GLN 164 CO -0.14 0.21 0.24 1.25 -1.93 0.00 0.00 178.83 178.46 3ivg h LEU 165 N 0.32 0.66 -0.12 -2.39 5.85 -0.77 -0.21 115.31 118.64 3ivg h LEU 165 Ca 0.33 -0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.92 3ivg h LEU 165 Cb 0.48 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.34 3ivg h LEU 165 CO -0.38 0.60 0.06 0.58 -0.34 0.00 0.00 178.44 178.96 3ivg h VAL 166 N 0.67 1.10 -0.96 1.05 2.07 -1.08 -1.57 116.25 117.53 3ivg h VAL 166 Ca 0.17 -0.29 0.09 0.00 0.82 0.00 0.00 66.70 67.49 3ivg h VAL 166 Cb 0.12 1.07 -0.07 0.00 -1.52 0.00 0.00 31.29 30.89 3ivg h VAL 166 CO -0.02 0.09 0.60 -0.07 0.02 0.00 0.00 177.57 178.19 3ivg h LEU 167 N 0.09 0.92 -0.54 2.57 3.38 -0.99 -1.09 115.31 119.65 3ivg h LEU 167 Ca 0.04 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 3ivg h LEU 167 Cb 0.09 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 3ivg h LEU 167 CO -0.01 0.55 0.24 0.40 0.09 0.00 0.00 178.44 179.71 3ivg h ILE 168 N 1.03 1.21 -0.90 1.22 2.04 -0.76 0.02 117.51 121.38 3ivg h ILE 168 Ca 0.44 -0.61 0.09 0.00 1.00 0.00 0.00 64.86 65.78 3ivg h ILE 168 Cb 0.30 0.61 -0.07 0.00 -0.74 0.00 0.00 36.82 36.92 3ivg h ILE 168 CO -0.21 0.24 0.55 0.03 0.00 0.00 0.00 178.15 178.75 3ivg h ARG 169 N 0.73 0.90 -0.37 2.37 3.08 -0.80 -0.56 114.38 119.72 3ivg h ARG 169 Ca 0.18 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.15 3ivg h ARG 169 Cb 0.15 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 29.98 3ivg h ARG 169 CO -0.02 0.59 0.12 1.96 -1.07 0.00 0.00 179.97 181.55 3ivg h GLN 170 N 0.93 0.58 -0.27 0.04 4.20 -0.84 -1.60 115.11 118.14 3ivg h GLN 170 Ca 0.42 -0.12 0.06 0.00 0.06 0.00 0.00 58.65 59.07 3ivg h GLN 170 Cb 0.33 -0.08 -0.07 0.00 0.30 0.00 0.00 27.48 27.95 3ivg h GLN 170 CO -0.23 0.59 -0.26 1.25 -0.67 0.00 0.00 178.83 179.52 3ivg h LEU 171 N 0.46 -0.83 -0.61 1.46 5.85 -0.67 0.16 115.31 121.12 3ivg h LEU 171 Ca 0.12 0.15 -0.04 0.00 0.84 0.00 0.00 57.88 58.95 3ivg h LEU 171 Cb 0.25 0.39 -0.03 0.00 0.37 0.00 0.00 40.66 41.65 3ivg h LEU 171 CO -0.00 -0.29 0.21 0.58 -0.34 0.00 0.00 178.44 178.60 3ivg h VAL 172 N -0.25 1.24 0.02 1.05 2.07 -0.99 -1.41 116.25 117.97 3ivg h VAL 172 Ca 0.14 -0.79 -0.00 0.00 0.82 0.00 0.00 66.70 66.87 3ivg h VAL 172 Cb 0.48 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 3ivg h VAL 172 CO -0.41 0.30 -0.01 0.00 0.02 0.00 0.00 177.57 177.47 3ivg h ALA 173 N 1.07 -0.02 0.00 1.67 0.00 -1.01 0.17 119.26 121.14 3ivg h ALA 173 Ca 0.20 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 3ivg h ALA 173 Cb 0.26 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 3ivg h ALA 173 CO -0.01 -0.35 -0.51 -0.44 0.00 0.00 0.00 179.25 177.95 3ivg h ASP 174 N -0.35 0.00 -0.50 0.00 3.32 -0.64 -2.50 116.42 115.75 3ivg h ASP 174 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3ivg h ASP 174 Cb 0.34 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.89 3ivg h ASP 174 CO 0.00 0.51 0.00 0.49 -1.72 0.00 0.00 179.24 178.52 3ivg n PHE 175 N -3.72 0.65 -3.31 4.55 3.72 -0.54 -4.97 117.46 113.85 3ivg n PHE 175 Ca -0.01 -0.37 -0.23 0.00 -0.05 0.00 0.00 57.45 56.80 3ivg n PHE 175 Cb 0.56 -0.00 0.06 0.00 -0.94 0.00 0.00 39.48 39.16 3ivg n PHE 175 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3ivg n ASN 176 N 1.38 -6.18 -4.77 4.37 4.13 -0.92 -4.92 115.26 108.36 3ivg n ASN 176 Ca 0.20 -0.41 -0.39 0.00 1.68 0.00 0.00 54.58 55.65 3ivg n ASN 176 Cb 0.57 -4.89 -0.04 0.00 -1.54 0.00 0.00 39.78 33.88 3ivg n ASN 176 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 3ivg s LEU 177 N -6.86 4.40 -1.16 3.41 1.43 0.00 -4.93 118.68 114.97 3ivg s LEU 177 Ca 0.45 2.15 -0.06 0.00 -1.03 0.00 0.00 54.13 55.64 3ivg s LEU 177 Cb -0.20 -3.84 0.25 0.00 0.03 0.00 0.00 46.19 42.43 3ivg s LEU 177 CO 0.55 -0.25 1.72 -0.67 0.23 0.00 0.00 176.35 177.93 3ivg n ASP 178 N 0.73 6.14 -3.79 2.29 2.03 -1.26 -4.85 116.55 117.84 3ivg n ASP 178 Ca 0.01 -3.31 -0.13 0.00 0.52 0.00 0.00 54.79 51.88 3ivg n ASP 178 Cb 0.47 -1.34 -0.11 0.00 -0.72 0.00 0.00 41.12 39.42 3ivg n ASP 178 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 3ivg s VAL 179 N -1.70 0.02 -0.15 5.18 0.11 -1.26 -4.83 120.40 117.76 3ivg s VAL 179 Ca 0.36 -0.15 -0.20 0.00 -2.93 0.00 0.00 61.98 59.07 3ivg s VAL 179 Cb 0.09 -0.41 -0.03 0.00 -1.53 0.00 0.00 36.38 34.49 3ivg s VAL 179 CO 0.04 -0.08 0.57 0.00 -3.33 0.00 0.00 175.10 172.30 3ivg s ALA 180 N -0.24 3.48 -0.19 1.54 0.00 -0.83 -4.97 121.76 120.55 3ivg s ALA 180 Ca -0.04 -0.20 -0.18 0.00 0.00 0.00 0.00 51.96 51.54 3ivg s ALA 180 Cb -0.03 -2.83 -0.03 0.00 0.00 0.00 0.00 23.12 20.23 3ivg s ALA 180 CO 0.01 -0.27 0.52 0.08 0.00 0.00 0.00 175.76 176.09 3ivg s VAL 181 N 1.24 5.12 -0.25 0.00 1.01 -1.26 -0.96 120.40 125.30 3ivg s VAL 181 Ca 0.28 0.96 -0.04 0.00 0.00 0.00 0.00 61.98 63.18 3ivg s VAL 181 Cb -0.16 -3.84 0.00 0.00 0.00 0.00 0.00 36.38 32.38 3ivg s VAL 181 CO 0.12 0.20 -0.01 -0.69 0.00 0.00 0.00 175.10 174.71 3ivg s VAL 182 N 1.50 3.51 -0.11 2.92 1.01 -0.28 -4.96 120.40 123.99 3ivg s VAL 182 Ca 0.24 -0.61 -0.18 0.00 0.00 0.00 0.00 61.98 61.43 3ivg s VAL 182 Cb -0.15 -2.69 -0.04 0.00 0.00 0.00 0.00 36.38 33.50 3ivg s VAL 182 CO 0.10 0.29 0.49 -0.83 0.00 0.00 0.00 175.10 175.15 3ivg s GLY 183 N 1.47 2.41 -0.18 4.51 0.00 -1.26 -1.56 107.32 112.71 3ivg s GLY 183 Ca 0.04 -0.17 -0.06 0.00 0.00 0.00 0.00 44.72 44.53 3ivg s GLY 183 CO -0.02 0.79 0.03 0.14 0.00 0.00 0.00 173.10 174.04 3ivg s VAL 184 N 0.59 4.41 0.28 1.40 1.01 0.24 -4.85 120.40 123.48 3ivg s VAL 184 Ca 0.27 -0.17 -0.29 0.00 0.00 0.00 0.00 61.98 61.79 3ivg s VAL 184 Cb -0.15 -2.98 -0.14 0.00 0.00 0.00 0.00 36.38 33.11 3ivg s VAL 184 CO 0.11 0.46 1.11 -2.65 0.00 0.00 0.00 175.10 174.13 3ivg n PRO 185 N 3.67 1.52 -1.69 2.72 -0.02 -1.26 -0.59 135.00 139.35 3ivg n PRO 185 Ca -0.17 0.54 -0.53 0.00 -2.02 0.00 0.00 63.50 61.31 3ivg n PRO 185 Cb 0.52 -1.98 -0.06 0.00 -0.02 0.00 0.00 33.50 31.96 3ivg n PRO 185 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 3ivg n THR 186 N 0.57 0.35 -2.80 3.45 -1.04 -1.26 -4.78 114.28 108.76 3ivg n THR 186 Ca 0.10 -0.06 -0.40 0.00 -2.04 0.00 0.00 64.05 61.64 3ivg n THR 186 Cb 0.32 -1.41 -0.06 0.00 -1.82 0.00 0.00 70.33 67.36 3ivg n THR 186 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3ivg s VAL 187 N 3.23 4.23 0.14 12.58 1.01 -1.26 -4.99 120.40 135.33 3ivg s VAL 187 Ca 0.94 1.99 0.09 0.00 0.00 0.00 0.00 61.98 65.00 3ivg s VAL 187 Cb -0.91 -4.28 -0.04 0.00 0.00 0.00 0.00 36.38 31.15 3ivg s VAL 187 CO 0.57 0.47 -0.20 -0.13 0.00 0.00 0.00 175.10 175.81 3ivg s ARG 188 N -0.93 1.22 1.04 2.72 0.52 -1.26 -1.48 118.95 120.78 3ivg s ARG 188 Ca 0.41 -1.30 -0.12 0.00 -0.52 0.00 0.00 55.73 54.19 3ivg s ARG 188 Cb -0.25 -1.39 0.21 0.00 0.52 0.00 0.00 34.95 34.04 3ivg s ARG 188 CO 0.30 0.30 1.07 -1.21 0.02 0.00 0.00 175.30 175.79 3ivg s GLU 189 N -2.38 0.09 0.41 3.54 0.41 0.14 -4.86 118.70 116.05 3ivg s GLU 189 Ca 0.12 0.64 0.12 0.00 -0.41 0.00 0.00 54.97 55.44 3ivg s GLU 189 Cb -0.08 -1.69 0.94 0.00 -1.78 0.00 0.00 34.13 31.53 3ivg s GLU 189 CO 0.06 -2.99 1.95 0.00 -0.49 0.00 0.00 175.26 173.78 3ivg h ALA 190 N -2.09 1.94 -0.00 5.21 0.00 -2.01 0.10 119.26 122.41 3ivg h ALA 190 Ca -0.56 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.34 3ivg h ALA 190 Cb 1.33 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3ivg h ALA 190 CO 0.55 -0.10 -0.08 -0.40 0.00 0.00 0.00 179.25 179.22 3ivg n ASP 191 N -4.48 0.23 0.00 0.00 5.75 -1.26 -4.91 116.55 111.87 3ivg n ASP 191 Ca 0.12 -0.21 0.00 0.00 -0.01 0.00 0.00 54.79 54.68 3ivg n ASP 191 Cb 0.38 -0.19 0.00 0.00 -1.03 0.00 0.00 41.12 40.28 3ivg n ASP 191 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3ivg n GLY 192 N 1.34 0.89 3.68 6.12 0.00 0.02 -4.85 105.19 112.39 3ivg n GLY 192 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 3ivg n GLY 192 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3ivg s LEU 193 N 0.00 4.39 0.25 0.99 2.96 -1.25 -4.57 118.68 121.45 3ivg s LEU 193 Ca 0.00 2.62 -0.31 0.00 -0.22 0.00 0.00 54.13 56.22 3ivg s LEU 193 Cb 0.00 -3.55 -0.12 0.00 0.50 0.00 0.00 46.19 43.02 3ivg s LEU 193 CO 0.00 -0.98 1.65 0.00 -1.32 0.00 0.00 176.35 175.69 3ivg n ALA 194 N 6.32 2.61 -1.78 5.97 0.00 -1.26 0.26 120.51 132.63 3ivg n ALA 194 Ca 0.18 0.39 -0.41 0.00 0.00 0.00 0.00 53.44 53.59 3ivg n ALA 194 Cb 0.40 -2.48 -0.01 0.00 0.00 0.00 0.00 19.45 17.35 3ivg n ALA 194 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3ivg s MET 195 N 0.25 4.14 -0.08 0.00 -1.94 -0.55 -4.82 119.30 116.29 3ivg s MET 195 Ca 0.69 2.55 -0.30 0.00 -1.71 0.00 0.00 55.69 56.92 3ivg s MET 195 Cb -0.51 -3.02 0.10 0.00 2.01 0.00 0.00 34.83 33.41 3ivg s MET 195 CO 0.41 -0.59 0.86 0.45 -0.01 0.00 0.00 175.02 176.15 3ivg s SER 196 N 0.34 -0.46 0.11 3.03 0.15 -1.26 -4.92 113.70 110.68 3ivg s SER 196 Ca 0.61 0.39 0.18 0.00 0.70 0.00 0.00 55.95 57.83 3ivg s SER 196 Cb -0.47 0.40 0.77 0.00 -1.71 0.00 0.00 66.02 65.02 3ivg s SER 196 CO 0.51 -0.51 1.57 -1.54 1.20 0.00 0.00 173.24 174.46 3ivg n SER 197 N 0.52 0.29 0.02 5.45 3.41 -1.26 -1.83 113.62 120.23 3ivg n SER 197 Ca -0.13 0.57 0.12 0.00 -0.26 0.00 0.00 58.87 59.17 3ivg n SER 197 Cb 0.59 -0.64 0.20 0.00 -0.26 0.00 0.00 64.21 64.10 3ivg n SER 197 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3ivg n ARG 198 N -1.83 0.11 0.27 4.33 1.74 -1.26 -4.17 116.66 115.85 3ivg n ARG 198 Ca 0.03 0.02 0.12 0.00 -0.77 0.00 0.00 57.85 57.25 3ivg n ARG 198 Cb 0.19 -1.56 0.77 0.00 -1.02 0.00 0.00 32.46 30.84 3ivg n ARG 198 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 3ivg h ASN 199 N 0.00 0.00 -0.00 0.55 2.35 -1.74 -2.43 115.58 114.31 3ivg h ASN 199 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3ivg h ASN 199 Cb 0.59 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.96 3ivg h ASN 199 CO 0.00 0.04 0.00 0.08 -1.65 0.00 0.00 177.43 175.90 3ivg h ARG 200 N 0.00 0.00 -0.11 0.81 0.11 -1.78 -2.47 114.38 110.94 3ivg h ARG 200 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3ivg h ARG 200 Cb 0.08 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.16 3ivg h ARG 200 CO 0.00 0.00 0.00 0.66 0.10 0.00 0.00 179.97 180.73 3ivg n TYR 201 N -3.72 0.14 -3.11 4.08 4.01 -0.91 -4.83 117.16 112.80 3ivg n TYR 201 Ca -0.03 -0.07 -0.40 0.00 -0.16 0.00 0.00 57.90 57.24 3ivg n TYR 201 Cb 0.08 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.05 3ivg n TYR 201 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3ivg s LEU 202 N -1.62 4.13 1.04 7.72 1.43 -0.93 -4.83 118.68 125.62 3ivg s LEU 202 Ca 0.32 0.81 -0.15 0.00 -1.03 0.00 0.00 54.13 54.08 3ivg s LEU 202 Cb 0.17 -2.89 0.21 0.00 0.03 0.00 0.00 46.19 43.71 3ivg s LEU 202 CO 0.26 -0.29 1.14 1.51 0.23 0.00 0.00 176.35 179.19 3ivg s ASP 203 N 1.26 2.35 0.34 2.29 1.47 -1.26 -4.64 116.67 118.48 3ivg s ASP 203 Ca 0.28 0.81 0.05 0.00 1.18 0.00 0.00 52.55 54.87 3ivg s ASP 203 Cb -0.16 -1.24 0.69 0.00 -0.34 0.00 0.00 42.92 41.88 3ivg s ASP 203 CO 0.10 -3.26 1.94 -0.65 0.68 0.00 0.00 175.17 173.98 3ivg h PRO 204 N -1.98 0.80 0.14 2.11 0.11 -1.99 0.18 132.00 131.36 3ivg h PRO 204 Ca -0.49 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.56 3ivg h PRO 204 Cb 1.31 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.24 3ivg h PRO 204 CO 0.49 0.53 -0.07 0.00 -0.21 0.00 0.00 178.00 178.74 3ivg h ALA 205 N 1.58 -0.19 -0.98 -0.75 0.00 -2.00 -2.49 119.26 114.44 3ivg h ALA 205 Ca 0.34 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 55.14 3ivg h ALA 205 Cb 0.27 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.08 3ivg h ALA 205 CO -0.12 -0.48 0.64 1.96 0.00 0.00 0.00 179.25 181.25 3ivg h GLN 206 N -0.42 1.22 -0.60 0.00 4.20 -1.75 -1.43 115.11 116.32 3ivg h GLN 206 Ca -0.02 -0.07 -0.09 0.00 0.06 0.00 0.00 58.65 58.53 3ivg h GLN 206 Cb 0.34 -0.27 -0.02 0.00 0.30 0.00 0.00 27.48 27.82 3ivg h GLN 206 CO 0.03 0.80 0.04 -0.09 -0.67 0.00 0.00 178.83 178.95 3ivg h ARG 207 N 1.25 1.03 -0.12 1.46 9.65 -0.57 -0.39 114.38 126.69 3ivg h ARG 207 Ca 0.38 -0.31 0.02 0.00 -1.10 0.00 0.00 59.98 58.98 3ivg h ARG 207 Cb -0.02 -0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 28.43 3ivg h ARG 207 CO -0.11 0.99 -0.02 0.00 2.80 0.00 0.00 179.97 183.63 3ivg h ALA 208 N 1.00 0.09 0.00 2.80 0.00 -0.90 -2.91 119.26 119.33 3ivg h ALA 208 Ca 0.17 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 3ivg h ALA 208 Cb 0.50 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 3ivg h ALA 208 CO 0.02 -0.47 -0.21 0.00 0.00 0.00 0.00 179.25 178.59 3ivg h ALA 209 N 1.12 1.57 0.00 0.00 0.00 -0.87 -3.19 119.26 117.89 3ivg h ALA 209 Ca 0.06 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3ivg h ALA 209 Cb 0.08 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3ivg h ALA 209 CO -0.12 0.26 0.00 0.00 0.00 0.00 0.00 179.25 179.40 3ivg h ALA 210 N 1.79 1.00 0.00 0.00 0.00 -0.87 -1.23 119.26 119.96 3ivg h ALA 210 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3ivg h ALA 210 Cb 0.39 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 3ivg h ALA 210 CO 0.03 0.00 -0.04 -0.24 0.00 0.00 0.00 179.25 179.00 3ivg h VAL 211 N 0.00 0.13 -0.54 0.00 3.04 -1.67 -2.97 116.25 114.24 3ivg h VAL 211 Ca 0.00 -0.44 0.08 0.00 -1.01 0.00 0.00 66.70 65.33 3ivg h VAL 211 Cb 0.30 1.38 -0.03 0.00 -2.01 0.00 0.00 31.29 30.93 3ivg h VAL 211 CO 0.00 0.03 0.37 0.00 -1.01 0.00 0.00 177.57 176.96 3ivg h ALA 212 N 1.96 2.00 0.82 3.17 0.00 -1.47 -1.31 119.26 124.43 3ivg h ALA 212 Ca -0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 3ivg h ALA 212 Cb 0.38 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.10 3ivg h ALA 212 CO 0.00 -0.11 -0.39 -0.07 0.00 0.00 0.00 179.25 178.68 3ivg h LEU 213 N 0.39 -0.93 -0.80 0.00 4.07 -1.76 -0.23 115.31 116.05 3ivg h LEU 213 Ca 0.25 0.03 -0.08 0.00 0.08 0.00 0.00 57.88 58.15 3ivg h LEU 213 Cb 0.46 0.24 -0.02 0.00 1.08 0.00 0.00 40.66 42.42 3ivg h LEU 213 CO -0.06 -0.64 -0.00 0.77 -1.08 0.00 0.00 178.44 177.42 3ivg h SER 214 N -1.14 0.87 -0.39 -0.43 4.64 -1.73 -1.23 113.55 114.14 3ivg h SER 214 Ca -0.11 -0.23 0.05 0.00 -0.47 0.00 0.00 61.79 61.03 3ivg h SER 214 Cb 0.85 -0.23 -0.05 0.00 -0.31 0.00 0.00 62.40 62.66 3ivg h SER 214 CO 0.18 0.94 0.11 0.00 -0.87 0.00 0.00 176.83 177.19 3ivg h ALA 215 N 1.16 0.44 -0.45 5.18 0.00 -1.27 -0.63 119.26 123.69 3ivg h ALA 215 Ca 0.16 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 3ivg h ALA 215 Cb 0.50 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 3ivg h ALA 215 CO 0.02 -0.28 0.25 0.00 0.00 0.00 0.00 179.25 179.24 3ivg h ALA 216 N 1.27 0.58 -0.34 0.00 0.00 -0.78 0.13 119.26 120.10 3ivg h ALA 216 Ca 0.18 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 3ivg h ALA 216 Cb 0.18 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3ivg h ALA 216 CO -0.20 0.09 -0.04 -0.07 0.00 0.00 0.00 179.25 179.03 3ivg h LEU 217 N 0.59 0.62 -0.63 0.00 3.38 -1.04 0.02 115.31 118.27 3ivg h LEU 217 Ca 0.16 -0.34 -0.14 0.00 0.09 0.00 0.00 57.88 57.65 3ivg h LEU 217 Cb 0.05 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 3ivg h LEU 217 CO -0.03 0.81 -0.40 0.71 0.09 0.00 0.00 178.44 179.62 3ivg h THR 218 N 0.42 1.30 -0.23 0.22 1.35 -1.07 -1.05 112.91 113.86 3ivg h THR 218 Ca 0.09 -1.57 0.04 0.00 -0.55 0.00 0.00 66.41 64.42 3ivg h THR 218 Cb 0.52 1.53 -0.04 0.00 -1.73 0.00 0.00 68.15 68.43 3ivg h THR 218 CO 0.03 0.50 -0.00 0.00 -0.25 0.00 0.00 175.52 175.80 3ivg h ALA 219 N 1.04 0.20 -0.75 6.62 0.00 -0.65 -2.52 119.26 123.20 3ivg h ALA 219 Ca 0.04 0.06 0.09 0.00 0.00 0.00 0.00 54.91 55.10 3ivg h ALA 219 Cb 0.92 0.11 -0.07 0.00 0.00 0.00 0.00 17.79 18.75 3ivg h ALA 219 CO 0.08 -0.43 0.40 0.00 0.00 0.00 0.00 179.25 179.31 3ivg h ALA 220 N 1.19 1.04 -0.17 0.00 0.00 -0.73 0.13 119.26 120.73 3ivg h ALA 220 Ca 0.11 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 3ivg h ALA 220 Cb 0.14 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3ivg h ALA 220 CO -0.18 0.02 -0.14 0.00 0.00 0.00 0.00 179.25 178.95 3ivg h ALA 221 N 1.43 1.44 0.05 0.00 0.00 -0.78 -1.40 119.26 119.99 3ivg h ALA 221 Ca 0.36 -0.23 -0.27 0.00 0.00 0.00 0.00 54.91 54.77 3ivg h ALA 221 Cb 0.34 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 3ivg h ALA 221 CO -0.25 0.39 -1.40 0.45 0.00 0.00 0.00 179.25 178.44 3ivg h HIS 222 N 0.27 0.17 0.00 0.00 3.86 -1.13 -3.28 115.15 115.04 3ivg h HIS 222 Ca 0.05 -0.13 -0.02 0.00 -1.16 0.00 0.00 60.37 59.12 3ivg h HIS 222 Cb 0.42 -0.01 -0.00 0.00 1.06 0.00 0.00 27.41 28.88 3ivg h HIS 222 CO 0.01 1.15 -0.08 0.00 0.86 0.00 0.00 177.93 179.86 3ivg h ALA 223 N 0.80 1.35 0.00 2.45 0.00 -0.53 -3.28 119.26 120.04 3ivg h ALA 223 Ca -0.18 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3ivg h ALA 223 Cb 1.93 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.71 3ivg h ALA 223 CO 0.13 0.11 0.00 0.00 0.00 0.00 0.00 179.25 179.48 3ivg n ALA 224 N -2.29 1.18 0.27 0.00 0.00 -0.57 -0.57 120.51 118.53 3ivg n ALA 224 Ca -0.02 0.05 0.13 0.00 0.00 0.00 0.00 53.44 53.60 3ivg n ALA 224 Cb 0.19 -1.15 0.75 0.00 0.00 0.00 0.00 19.45 19.25 3ivg n ALA 224 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3ivg h THR 225 N 0.00 0.54 -0.27 0.00 1.35 -1.76 0.11 112.91 112.89 3ivg h THR 225 Ca 0.00 -0.47 0.00 0.00 -0.55 0.00 0.00 66.41 65.39 3ivg h THR 225 Cb 0.07 1.31 0.00 0.00 -1.73 0.00 0.00 68.15 67.80 3ivg h THR 225 CO 0.00 0.10 0.00 0.00 -0.25 0.00 0.00 175.52 175.37 3ivg n ALA 226 N -2.28 2.48 0.00 6.62 0.00 0.27 -4.25 120.51 123.34 3ivg n ALA 226 Ca -0.02 -0.71 0.00 0.00 0.00 0.00 0.00 53.44 52.71 3ivg n ALA 226 Cb 0.22 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.67 3ivg n ALA 226 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ivg n GLY 227 N 1.27 -1.36 0.21 0.00 0.00 -0.53 -4.54 105.19 100.25 3ivg n GLY 227 Ca 0.17 -2.24 -0.12 0.00 0.00 0.00 0.00 46.02 43.83 3ivg n GLY 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ivg h ALA 228 N 0.00 0.47 -0.28 4.61 0.00 -1.93 -2.05 119.26 120.08 3ivg h ALA 228 Ca 0.00 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.56 3ivg h ALA 228 Cb 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3ivg h ALA 228 CO 0.00 0.37 0.12 0.37 0.00 0.00 0.00 179.25 180.11 3ivg h GLN 229 N 0.46 0.42 -0.57 0.00 5.75 -1.98 -0.11 115.11 119.09 3ivg h GLN 229 Ca 0.08 -0.07 0.05 0.00 -0.15 0.00 0.00 58.65 58.55 3ivg h GLN 229 Cb 0.68 -0.07 -0.05 0.00 1.07 0.00 0.00 27.48 29.11 3ivg h GLN 229 CO 0.05 0.44 0.29 0.00 -2.65 0.00 0.00 178.83 176.96 3ivg h ALA 230 N 0.96 0.74 -0.10 3.38 0.00 -1.79 0.17 119.26 122.62 3ivg h ALA 230 Ca 0.09 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3ivg h ALA 230 Cb 0.17 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 3ivg h ALA 230 CO -0.01 -0.05 0.06 0.00 0.00 0.00 0.00 179.25 179.25 3ivg h ALA 231 N 1.31 0.12 -0.55 0.00 0.00 -1.04 0.10 119.26 119.20 3ivg h ALA 231 Ca 0.25 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 3ivg h ALA 231 Cb 0.17 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 3ivg h ALA 231 CO -0.18 -0.39 0.29 -0.07 0.00 0.00 0.00 179.25 178.91 3ivg h LEU 232 N 0.13 0.70 -0.52 0.00 3.38 -0.83 -2.01 115.31 116.15 3ivg h LEU 232 Ca 0.04 -0.10 -0.16 0.00 0.09 0.00 0.00 57.88 57.74 3ivg h LEU 232 Cb -0.01 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 3ivg h LEU 232 CO -0.01 0.60 -0.61 0.44 0.09 0.00 0.00 178.44 178.96 3ivg h ASP 233 N 0.74 0.51 -0.13 -0.43 3.32 -0.46 -0.99 116.42 118.98 3ivg h ASP 233 Ca 0.19 -0.29 0.03 0.00 0.02 0.00 0.00 57.03 56.99 3ivg h ASP 233 Cb 0.07 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.44 3ivg h ASP 233 CO -0.03 0.99 -0.07 0.00 -1.72 0.00 0.00 179.24 178.41 3ivg h ALA 234 N 1.01 0.04 -0.55 3.45 0.00 -0.61 -1.22 119.26 121.38 3ivg h ALA 234 Ca -0.01 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3ivg h ALA 234 Cb 1.15 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 19.08 3ivg h ALA 234 CO 0.11 -0.52 0.36 0.00 0.00 0.00 0.00 179.25 179.20 3ivg h ALA 235 N 1.05 0.70 -0.64 0.00 0.00 -1.21 -2.46 119.26 116.69 3ivg h ALA 235 Ca 0.08 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 3ivg h ALA 235 Cb 0.18 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 3ivg h ALA 235 CO -0.17 0.14 0.14 -0.09 0.00 0.00 0.00 179.25 179.27 3ivg h ARG 236 N 0.74 1.01 -0.83 0.00 9.65 -1.01 -2.00 114.38 121.95 3ivg h ARG 236 Ca 0.20 -0.23 -0.03 0.00 -1.10 0.00 0.00 59.98 58.82 3ivg h ARG 236 Cb -0.08 -0.14 -0.04 0.00 -1.39 0.00 0.00 29.97 28.33 3ivg h ARG 236 CO -0.04 0.90 0.40 0.00 2.80 0.00 0.00 179.97 184.03 3ivg h ALA 237 N 1.20 1.16 -0.20 2.80 0.00 -0.96 0.98 119.26 124.22 3ivg h ALA 237 Ca 0.20 -0.15 -0.20 0.00 0.00 0.00 0.00 54.91 54.76 3ivg h ALA 237 Cb 0.35 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3ivg h ALA 237 CO 0.00 0.65 -0.65 0.28 0.00 0.00 0.00 179.25 179.53 3ivg h VAL 238 N 1.17 1.29 -0.16 0.00 2.07 -1.07 -1.62 116.25 117.94 3ivg h VAL 238 Ca 0.29 -1.87 -0.03 0.00 0.82 0.00 0.00 66.70 65.91 3ivg h VAL 238 Cb 0.10 1.83 -0.01 0.00 -1.52 0.00 0.00 31.29 31.69 3ivg h VAL 238 CO -0.04 0.59 -0.01 -0.07 0.02 0.00 0.00 177.57 178.07 3ivg h LEU 239 N 0.54 0.29 -1.88 2.57 3.38 -1.02 -2.98 115.31 116.21 3ivg h LEU 239 Ca -0.02 -0.32 0.12 0.00 0.09 0.00 0.00 57.88 57.75 3ivg h LEU 239 Cb 1.25 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.90 3ivg h LEU 239 CO 0.13 0.54 0.34 0.44 0.09 0.00 0.00 178.44 179.99 3ivg h ASP 240 N 0.03 0.12 0.95 -0.43 3.32 -0.80 -2.14 116.42 117.47 3ivg h ASP 240 Ca 0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.10 3ivg h ASP 240 Cb 0.40 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.93 3ivg h ASP 240 CO 0.01 0.07 0.00 0.00 -1.72 0.00 0.00 179.24 177.60 3ivg n ALA 241 N -2.59 2.21 -2.70 3.45 0.00 -0.61 -4.81 120.51 115.46 3ivg n ALA 241 Ca 0.08 -0.08 -0.38 0.00 0.00 0.00 0.00 53.44 53.06 3ivg n ALA 241 Cb 0.46 -1.43 -0.06 0.00 0.00 0.00 0.00 19.45 18.42 3ivg n ALA 241 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ivg s ALA 242 N -3.01 3.51 0.08 0.00 0.00 -0.81 -5.06 121.76 116.47 3ivg s ALA 242 Ca 0.13 -0.24 -0.31 0.00 0.00 0.00 0.00 51.96 51.54 3ivg s ALA 242 Cb 0.17 -2.58 -0.06 0.00 0.00 0.00 0.00 23.12 20.65 3ivg s ALA 242 CO 0.49 0.06 1.24 -1.25 0.00 0.00 0.00 175.76 176.30 3ivg s PRO 243 N 0.45 4.41 -0.79 0.00 0.04 -1.26 -3.57 135.00 134.28 3ivg s PRO 243 Ca 0.24 1.85 0.00 0.00 0.04 0.00 0.00 61.00 63.13 3ivg s PRO 243 Cb -0.15 -3.32 0.00 0.00 0.04 0.00 0.00 34.50 31.07 3ivg s PRO 243 CO 0.09 -0.30 0.00 0.41 0.04 0.00 0.00 177.00 177.25 3ivg n GLY 244 N 3.26 0.41 3.23 0.56 0.00 -1.26 -4.82 105.19 106.57 3ivg n GLY 244 Ca 0.09 -0.58 -0.40 0.00 0.00 0.00 0.00 46.02 45.13 3ivg n GLY 244 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ivg s VAL 245 N -2.38 4.08 -0.42 1.61 1.01 -1.23 -4.34 120.40 118.73 3ivg s VAL 245 Ca 0.00 -1.62 -0.21 0.00 0.00 0.00 0.00 61.98 60.15 3ivg s VAL 245 Cb 0.00 -3.59 0.02 0.00 0.00 0.00 0.00 36.38 32.80 3ivg s VAL 245 CO 0.00 -0.62 0.67 0.00 0.00 0.00 0.00 175.10 175.16 3ivg s ALA 246 N 1.36 3.37 -0.08 5.51 0.00 0.15 -4.90 121.76 127.17 3ivg s ALA 246 Ca 0.04 -1.06 -0.30 0.00 0.00 0.00 0.00 51.96 50.65 3ivg s ALA 246 Cb -0.24 -3.30 -0.03 0.00 0.00 0.00 0.00 23.12 19.55 3ivg s ALA 246 CO 0.00 -1.69 1.26 0.08 0.00 0.00 0.00 175.76 175.41 3ivg s VAL 247 N 2.89 4.17 0.00 0.00 1.01 -1.26 0.98 120.40 128.19 3ivg s VAL 247 Ca 0.25 1.48 0.00 0.00 0.00 0.00 0.00 61.98 63.71 3ivg s VAL 247 Cb -0.14 -3.96 0.00 0.00 0.00 0.00 0.00 36.38 32.29 3ivg s VAL 247 CO 0.19 -0.04 0.37 -0.67 0.00 0.00 0.00 175.10 174.94 3ivg n ASP 248 N 5.69 0.00 -4.02 3.32 -0.08 0.90 -4.92 116.55 117.43 3ivg n ASP 248 Ca 0.12 0.60 -0.08 0.00 -1.51 0.00 0.00 54.79 53.92 3ivg n ASP 248 Cb 0.45 -0.40 -0.11 0.00 2.34 0.00 0.00 41.12 43.41 3ivg n ASP 248 CO 0.00 0.00 0.00 -0.72 0.12 0.00 0.00 177.20 176.60 3ivg s TYR 249 N -1.53 0.36 -0.17 -0.67 -0.85 -1.09 -4.99 117.35 108.42 3ivg s TYR 249 Ca 0.00 -0.73 -0.04 0.00 -0.52 0.00 0.00 57.07 55.78 3ivg s TYR 249 Cb 0.00 -0.27 0.07 0.00 0.38 0.00 0.00 41.96 42.15 3ivg s TYR 249 CO 0.00 -0.26 0.15 -1.17 -1.52 0.00 0.00 175.55 172.76 3ivg s LEU 250 N -2.00 0.08 -0.00 -3.49 2.96 -1.26 -1.39 118.68 113.59 3ivg s LEU 250 Ca -0.07 -0.29 -0.00 0.00 -0.22 0.00 0.00 54.13 53.54 3ivg s LEU 250 Cb -0.03 0.10 0.00 0.00 0.50 0.00 0.00 46.19 46.76 3ivg s LEU 250 CO -0.04 -0.32 0.00 -1.61 -1.32 0.00 0.00 176.35 173.06 3ivg s GLU 251 N 2.24 0.00 -0.26 1.98 2.02 -0.18 -4.97 118.70 119.54 3ivg s GLU 251 Ca 0.04 0.01 -0.07 0.00 0.02 0.00 0.00 54.97 54.97 3ivg s GLU 251 Cb -0.15 -0.00 -0.02 0.00 0.10 0.00 0.00 34.13 34.05 3ivg s GLU 251 CO -0.10 -0.00 0.07 -1.17 0.02 0.00 0.00 175.26 174.09 3ivg s LEU 252 N 0.01 3.51 0.26 1.80 2.96 -1.26 -0.68 118.68 125.29 3ivg s LEU 252 Ca -0.00 -0.28 0.04 0.00 -0.22 0.00 0.00 54.13 53.68 3ivg s LEU 252 Cb -0.00 -1.92 -0.06 0.00 0.50 0.00 0.00 46.19 44.71 3ivg s LEU 252 CO -0.00 -0.06 -0.01 -0.13 -1.32 0.00 0.00 176.35 174.83 3ivg s ARG 253 N 1.60 1.46 0.78 1.98 0.52 -0.65 -4.95 118.95 119.68 3ivg s ARG 253 Ca 0.06 -1.75 -0.15 0.00 -0.52 0.00 0.00 55.73 53.36 3ivg s ARG 253 Cb -0.15 -0.82 -0.02 0.00 0.52 0.00 0.00 34.95 34.47 3ivg s ARG 253 CO 0.04 -0.07 0.48 -3.47 0.02 0.00 0.00 175.30 172.29 3ivg n ASP 254 N -0.51 -1.48 0.26 0.23 2.03 -1.26 -0.61 116.55 115.20 3ivg n ASP 254 Ca -0.05 0.53 0.11 0.00 0.52 0.00 0.00 54.79 55.90 3ivg n ASP 254 Cb 0.64 -1.20 0.69 0.00 -0.72 0.00 0.00 41.12 40.52 3ivg n ASP 254 CO 0.00 0.00 0.00 0.16 -1.92 0.00 0.00 177.20 175.44 3ivg h ILE 255 N -0.64 0.68 -0.01 5.18 -0.00 -1.84 0.13 117.51 121.02 3ivg h ILE 255 Ca -0.45 -0.55 0.00 0.00 -0.00 0.00 0.00 64.86 63.86 3ivg h ILE 255 Cb 1.33 1.34 0.00 0.00 -0.00 0.00 0.00 36.82 39.49 3ivg h ILE 255 CO 0.40 0.13 -0.04 0.61 -0.00 0.00 0.00 178.15 179.25 3ivg n GLY 256 N -0.76 -0.38 2.22 0.16 0.00 -1.26 -4.94 105.19 100.23 3ivg n GLY 256 Ca -0.02 -0.37 -0.12 0.00 0.00 0.00 0.00 46.02 45.51 3ivg n GLY 256 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ivg n LEU 257 N -0.29 -0.72 0.00 0.99 4.77 0.46 -4.94 117.00 117.27 3ivg n LEU 257 Ca 0.19 0.29 0.00 0.00 -0.03 0.00 0.00 56.01 56.46 3ivg n LEU 257 Cb 0.30 -2.09 0.00 0.00 -2.33 0.00 0.00 43.42 39.29 3ivg n LEU 257 CO 0.19 -0.75 0.00 0.61 -1.33 0.00 0.00 177.39 176.11 3ivg n GLY 258 N -0.09 1.98 2.37 -0.72 0.00 -1.26 -4.91 105.19 102.57 3ivg n GLY 258 Ca -0.12 -2.12 -0.09 0.00 0.00 0.00 0.00 46.02 43.70 3ivg n GLY 258 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3ivg n PRO 259 N -0.85 1.11 -3.78 1.61 -0.04 -1.26 -4.72 135.00 127.08 3ivg n PRO 259 Ca 0.00 -0.66 -0.13 0.00 -0.04 0.00 0.00 63.50 62.67 3ivg n PRO 259 Cb 0.00 -1.89 -0.13 0.00 -0.04 0.00 0.00 33.50 31.45 3ivg n PRO 259 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3ivg s MET 260 N 2.47 0.19 0.47 0.54 0.23 -1.26 -5.14 119.30 116.80 3ivg s MET 260 Ca 0.31 0.34 -0.23 0.00 -1.03 0.00 0.00 55.69 55.08 3ivg s MET 260 Cb 0.13 -0.00 -0.07 0.00 -1.53 0.00 0.00 34.83 33.36 3ivg s MET 260 CO -0.01 -0.08 1.21 -2.14 -2.03 0.00 0.00 175.02 171.97 3ivg s PRO 261 N 0.57 3.66 0.21 3.16 0.02 -1.26 -4.56 135.00 136.79 3ivg s PRO 261 Ca -0.04 1.88 -0.32 0.00 0.02 0.00 0.00 61.00 62.54 3ivg s PRO 261 Cb -0.05 -2.40 -0.14 0.00 0.02 0.00 0.00 34.50 31.93 3ivg s PRO 261 CO -0.03 -0.66 1.46 -0.11 -0.33 0.00 0.00 177.00 177.32 3ivg n LEU 262 N -0.55 3.07 0.00 -5.54 7.94 -1.26 -4.79 117.00 115.87 3ivg n LEU 262 Ca 0.08 1.12 0.00 0.00 -1.11 0.00 0.00 56.01 56.10 3ivg n LEU 262 Cb 0.47 -1.42 0.00 0.00 0.53 0.00 0.00 43.42 43.00 3ivg n LEU 262 CO 0.49 -0.44 0.00 -0.46 -1.11 0.00 0.00 177.39 175.87 3ivg n ASN 263 N 2.54 0.00 0.07 1.96 0.23 -1.26 -4.99 115.26 113.81 3ivg n ASN 263 Ca 0.13 0.00 -0.19 0.00 -0.53 0.00 0.00 54.58 53.99 3ivg n ASN 263 Cb 0.30 0.00 -0.15 0.00 -2.08 0.00 0.00 39.78 37.86 3ivg n ASN 263 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 3ivg h GLY 264 N 0.00 0.36 -5.94 4.83 0.00 -1.95 -3.43 103.07 96.94 3ivg h GLY 264 Ca 0.00 -0.92 -0.66 0.00 0.00 0.00 0.00 47.33 45.75 3ivg h GLY 264 CO 0.00 0.81 -0.75 -0.56 0.00 0.00 0.00 176.54 176.04 3ivg s SER 265 N -7.12 4.11 0.07 0.19 0.01 -1.26 0.96 113.70 110.66 3ivg s SER 265 Ca -0.11 -0.34 0.01 0.00 1.31 0.00 0.00 55.95 56.83 3ivg s SER 265 Cb 0.06 -1.65 -0.01 0.00 0.21 0.00 0.00 66.02 64.64 3ivg s SER 265 CO 0.86 0.11 0.05 0.61 0.41 0.00 0.00 173.24 175.29 3ivg n GLY 266 N 3.88 3.82 2.82 3.44 0.00 0.63 -3.94 105.19 115.84 3ivg n GLY 266 Ca -0.18 -1.73 -0.16 0.00 0.00 0.00 0.00 46.02 43.95 3ivg n GLY 266 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3ivg s ARG 267 N -2.28 0.17 -0.18 1.61 6.06 0.22 -1.80 118.95 122.75 3ivg s ARG 267 Ca 0.08 0.09 -0.07 0.00 -2.50 0.00 0.00 55.73 53.32 3ivg s ARG 267 Cb 0.00 -0.36 -0.04 0.00 0.06 0.00 0.00 34.95 34.62 3ivg s ARG 267 CO 0.05 -0.12 0.06 -1.17 -2.50 0.00 0.00 175.30 171.63 3ivg s LEU 268 N 0.86 3.79 -0.02 -0.88 2.96 -0.05 -1.64 118.68 123.69 3ivg s LEU 268 Ca -0.08 0.07 0.06 0.00 -0.22 0.00 0.00 54.13 53.96 3ivg s LEU 268 Cb -0.11 -1.96 -0.01 0.00 0.50 0.00 0.00 46.19 44.61 3ivg s LEU 268 CO -0.02 0.17 -0.19 -0.76 -1.32 0.00 0.00 176.35 174.23 3ivg s LEU 269 N 0.38 2.01 0.02 -0.68 1.02 0.15 -1.10 118.68 120.48 3ivg s LEU 269 Ca 0.03 -0.35 0.03 0.00 0.02 0.00 0.00 54.13 53.86 3ivg s LEU 269 Cb -0.12 -1.00 -0.02 0.00 0.02 0.00 0.00 46.19 45.07 3ivg s LEU 269 CO 0.00 0.22 -0.10 0.54 0.02 0.00 0.00 176.35 177.03 3ivg s VAL 270 N -0.34 0.80 -0.04 -1.59 0.11 -0.05 -1.01 120.40 118.28 3ivg s VAL 270 Ca 0.05 -0.72 0.03 0.00 -2.93 0.00 0.00 61.98 58.40 3ivg s VAL 270 Cb -0.08 -0.73 0.01 0.00 -1.53 0.00 0.00 36.38 34.04 3ivg s VAL 270 CO -0.00 0.01 -0.12 0.00 -3.33 0.00 0.00 175.10 171.67 3ivg s ALA 271 N -0.65 1.11 0.01 1.54 0.00 -0.49 -1.53 121.76 121.76 3ivg s ALA 271 Ca 0.00 -0.42 -0.08 0.00 0.00 0.00 0.00 51.96 51.45 3ivg s ALA 271 Cb -0.06 -0.43 0.00 0.00 0.00 0.00 0.00 23.12 22.63 3ivg s ALA 271 CO 0.00 0.16 0.16 0.00 0.00 0.00 0.00 175.76 176.09 3ivg s ALA 272 N 0.31 -0.36 -0.18 0.00 0.00 -0.12 -0.07 121.76 121.34 3ivg s ALA 272 Ca -0.06 -0.16 -0.07 0.00 0.00 0.00 0.00 51.96 51.67 3ivg s ALA 272 Cb -0.11 0.16 -0.04 0.00 0.00 0.00 0.00 23.12 23.13 3ivg s ALA 272 CO 0.02 -0.26 0.05 1.03 0.00 0.00 0.00 175.76 176.60 3ivg s ARG 273 N -1.75 3.92 -0.31 0.00 0.52 0.28 -0.64 118.95 120.96 3ivg s ARG 273 Ca -0.12 -0.38 -0.01 0.00 -0.52 0.00 0.00 55.73 54.71 3ivg s ARG 273 Cb -0.05 -3.18 0.06 0.00 0.52 0.00 0.00 34.95 32.30 3ivg s ARG 273 CO 0.00 0.25 0.02 -0.51 0.02 0.00 0.00 175.30 175.08 3ivg s LEU 274 N 0.43 4.11 0.00 2.53 1.02 0.32 -0.67 118.68 126.42 3ivg s LEU 274 Ca 0.02 -1.46 0.00 0.00 0.02 0.00 0.00 54.13 52.71 3ivg s LEU 274 Cb -0.13 -1.71 0.00 0.00 0.02 0.00 0.00 46.19 44.38 3ivg s LEU 274 CO 0.01 -0.30 0.00 0.61 0.02 0.00 0.00 176.35 176.69 3ivg n GLY 275 N 4.57 2.97 0.36 -3.19 0.00 -1.26 -0.57 105.19 108.07 3ivg n GLY 275 Ca -0.10 0.28 0.11 0.00 0.00 0.00 0.00 46.02 46.31 3ivg n GLY 275 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3ivg n THR 276 N 0.00 0.00 -3.28 2.61 -2.24 -1.26 -4.93 114.28 105.18 3ivg n THR 276 Ca 0.00 -0.19 -0.39 0.00 -2.27 0.00 0.00 64.05 61.20 3ivg n THR 276 Cb 0.00 1.06 -0.07 0.00 -2.10 0.00 0.00 70.33 69.21 3ivg n THR 276 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3ivg s THR 277 N -2.59 5.12 -0.28 4.28 2.01 0.26 -5.05 115.64 119.39 3ivg s THR 277 Ca 0.17 0.86 -0.13 0.00 0.31 0.00 0.00 61.69 62.91 3ivg s THR 277 Cb 0.18 -3.81 -0.04 0.00 0.01 0.00 0.00 72.50 68.84 3ivg s THR 277 CO 0.62 0.17 0.28 -0.60 -0.69 0.00 0.00 174.62 174.40 3ivg s ARG 278 N 1.74 3.92 0.04 4.92 3.52 -1.26 -0.52 118.95 131.31 3ivg s ARG 278 Ca 0.22 -0.20 0.03 0.00 -0.13 0.00 0.00 55.73 55.65 3ivg s ARG 278 Cb -0.15 -3.68 -0.04 0.00 -1.56 0.00 0.00 34.95 29.52 3ivg s ARG 278 CO 0.09 -0.26 -0.02 -0.51 -0.81 0.00 0.00 175.30 173.78 3ivg s LEU 279 N 1.91 3.38 0.14 -0.88 1.43 0.19 -4.97 118.68 119.88 3ivg s LEU 279 Ca 0.11 -0.12 0.09 0.00 -1.03 0.00 0.00 54.13 53.17 3ivg s LEU 279 Cb -0.16 -2.02 -0.04 0.00 0.03 0.00 0.00 46.19 44.00 3ivg s LEU 279 CO 0.11 0.24 -0.21 -0.76 0.23 0.00 0.00 176.35 175.96 3ivg s LEU 280 N -1.82 2.38 0.22 1.79 1.43 -1.26 -0.95 118.68 120.47 3ivg s LEU 280 Ca 0.21 -0.79 -0.19 0.00 -1.03 0.00 0.00 54.13 52.33 3ivg s LEU 280 Cb -0.11 -0.93 0.03 0.00 0.03 0.00 0.00 46.19 45.20 3ivg s LEU 280 CO 0.13 0.04 0.60 -0.62 0.23 0.00 0.00 176.35 176.72 3ivg s ASP 281 N -2.35 -0.28 0.16 2.29 -1.08 -0.58 -4.91 116.67 109.91 3ivg s ASP 281 Ca 0.13 -0.51 -0.23 0.00 -0.52 0.00 0.00 52.55 51.42 3ivg s ASP 281 Cb -0.08 0.63 0.07 0.00 -1.46 0.00 0.00 42.92 42.08 3ivg s ASP 281 CO 0.06 -1.15 0.65 0.54 0.52 0.00 0.00 175.17 175.79 3ivg s ASN 282 N -2.89 -0.50 -0.07 -0.34 2.20 -1.26 -0.87 114.94 111.20 3ivg s ASN 282 Ca 0.10 -0.08 -0.19 0.00 -0.94 0.00 0.00 52.86 51.75 3ivg s ASN 282 Cb -0.03 0.59 0.04 0.00 -2.00 0.00 0.00 41.25 39.86 3ivg s ASN 282 CO 0.00 -0.98 0.45 -0.51 -2.94 0.00 0.00 177.10 173.12 3ivg s ILE 283 N -3.70 0.03 0.34 0.54 2.07 -0.26 -4.98 121.20 115.23 3ivg s ILE 283 Ca 0.03 -0.22 -0.29 0.00 -1.41 0.00 0.00 60.65 58.77 3ivg s ILE 283 Cb -0.02 -0.72 -0.11 0.00 0.13 0.00 0.00 42.46 41.75 3ivg s ILE 283 CO -0.10 -0.12 1.39 0.00 -1.91 0.00 0.00 174.94 174.20 3ivg s ALA 284 N -0.81 3.54 -0.05 1.50 0.00 -1.26 -0.87 121.76 123.81 3ivg s ALA 284 Ca -0.09 1.38 0.02 0.00 0.00 0.00 0.00 51.96 53.27 3ivg s ALA 284 Cb -0.03 -3.53 0.02 0.00 0.00 0.00 0.00 23.12 19.57 3ivg s ALA 284 CO 0.04 -0.79 -0.08 0.42 0.00 0.00 0.00 175.76 175.35 3ivg s ILE 285 N -0.97 0.80 -0.16 0.00 -1.09 -0.75 -4.87 121.20 114.16 3ivg s ILE 285 Ca 0.52 -0.29 -0.03 0.00 -2.23 0.00 0.00 60.65 58.61 3ivg s ILE 285 Cb -0.42 -0.76 -0.02 0.00 -1.58 0.00 0.00 42.46 39.67 3ivg s ILE 285 CO 0.55 0.28 -0.04 -1.61 -1.23 0.00 0.00 174.94 172.88 3ivg s GLU 286 N 0.71 3.62 -0.19 2.79 8.01 -1.26 -0.27 118.70 132.12 3ivg s GLU 286 Ca -0.12 -0.54 -0.09 0.00 0.01 0.00 0.00 54.97 54.22 3ivg s GLU 286 Cb -0.14 -2.91 -0.05 0.00 -4.31 0.00 0.00 34.13 26.72 3ivg s GLU 286 CO 0.02 0.18 0.13 0.42 0.01 0.00 0.00 175.26 176.02 3ivg s ILE 287 N 0.51 5.38 -0.28 -1.63 -1.09 0.27 -4.34 121.20 120.02 3ivg s ILE 287 Ca -0.04 0.18 0.00 0.00 -2.23 0.00 0.00 60.65 58.56 3ivg s ILE 287 Cb -0.14 -3.44 0.00 0.00 -1.58 0.00 0.00 42.46 37.30 3ivg s ILE 287 CO 0.03 0.47 0.00 0.61 -1.23 0.00 0.00 174.94 174.81 3ivg n GLY 288 N 3.32 0.33 0.31 6.18 0.00 0.28 -4.80 105.19 110.81 3ivg n GLY 288 Ca -0.17 -0.03 0.04 0.00 0.00 0.00 0.00 46.02 45.87 3ivg n GLY 288 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95