#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1odg n ILE 24 N 0.00 0.00 -0.13 0.00 0.00 -1.26 -4.77 119.36 113.20 1odg n ILE 24 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 62.75 62.72 1odg n ILE 24 Cb 0.00 0.00 0.18 0.00 0.00 0.00 0.00 39.64 39.82 1odg n ILE 24 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 1odg h GLU 25 N 0.00 0.84 0.58 9.51 3.07 -1.98 -3.08 114.58 123.52 1odg h GLU 25 Ca 0.00 -0.18 -0.03 0.00 -0.50 0.00 0.00 59.36 58.65 1odg h GLU 25 Cb 0.00 -0.12 0.01 0.00 -0.84 0.00 0.00 28.75 27.80 1odg h GLU 25 CO 0.00 0.77 -0.28 0.87 -1.40 0.00 0.00 179.01 178.97 1odg h LYS 26 N 0.80 -0.76 -0.62 2.33 1.57 -1.96 0.66 116.57 118.60 1odg h LYS 26 Ca 0.17 0.05 0.25 0.00 -1.87 0.00 0.00 60.65 59.25 1odg h LYS 26 Cb 0.33 0.17 -0.10 0.00 0.08 0.00 0.00 32.23 32.71 1odg h LYS 26 CO 0.00 -0.50 0.35 -2.13 -0.57 0.00 0.00 179.45 176.60 1odg n ARG 27 N -4.39 -0.03 0.01 3.15 3.00 -1.17 0.25 116.66 117.48 1odg n ARG 27 Ca -0.10 0.79 -0.22 0.00 -0.00 0.00 0.00 57.85 58.32 1odg n ARG 27 Cb 0.31 -1.44 -0.14 0.00 0.00 0.00 0.00 32.46 31.19 1odg n ARG 27 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 1odg h LEU 28 N 0.00 0.39 -1.20 6.15 5.85 -1.48 -3.37 115.31 121.65 1odg h LEU 28 Ca 0.50 -0.86 0.09 0.00 0.84 0.00 0.00 57.88 58.44 1odg h LEU 28 Cb 1.36 -0.13 -0.06 0.00 0.37 0.00 0.00 40.66 42.21 1odg h LEU 28 CO -0.42 1.70 0.57 0.00 -0.34 0.00 0.00 178.44 179.96 1odg h ALA 29 N -0.04 1.61 -0.44 1.25 0.00 0.96 -1.92 119.26 120.68 1odg h ALA 29 Ca -0.35 -0.01 0.08 0.00 0.00 0.00 0.00 54.91 54.63 1odg h ALA 29 Cb 1.84 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 19.39 1odg h ALA 29 CO 0.06 0.23 0.30 1.03 0.00 0.00 0.00 179.25 180.86 1odg h SER 30 N 0.91 0.22 0.43 0.00 0.87 -0.23 -1.79 113.55 113.96 1odg h SER 30 Ca 0.40 0.00 -0.26 0.00 -1.23 0.00 0.00 61.79 60.70 1odg h SER 30 Cb 0.34 -0.04 0.01 0.00 -0.44 0.00 0.00 62.40 62.26 1odg h SER 30 CO -0.16 0.14 -1.11 -0.07 -0.53 0.00 0.00 176.83 175.10 1odg h LEU 31 N 0.25 0.54 -0.10 2.23 3.38 -1.53 -3.16 115.31 116.91 1odg h LEU 31 Ca 0.20 -0.50 0.02 0.00 0.09 0.00 0.00 57.88 57.69 1odg h LEU 31 Cb 0.47 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 1odg h LEU 31 CO -0.04 1.33 -0.27 -0.07 0.09 0.00 0.00 178.44 179.49 1odg h LEU 32 N 0.17 -0.87 -2.40 1.67 3.38 -1.21 0.25 115.31 116.30 1odg h LEU 32 Ca -0.12 0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1odg h LEU 32 Cb 1.79 0.34 -0.00 0.00 0.09 0.00 0.00 40.66 42.88 1odg h LEU 32 CO 0.19 -0.23 -0.03 0.74 0.09 0.00 0.00 178.44 179.20 1odg h THR 33 N -0.26 0.29 -0.10 0.22 2.02 -1.72 0.00 112.91 113.37 1odg h THR 33 Ca 0.02 -0.20 0.03 0.00 0.77 0.00 0.00 66.41 67.03 1odg h THR 33 Cb 0.32 1.15 -0.00 0.00 -1.74 0.00 0.00 68.15 67.87 1odg h THR 33 CO -0.24 0.03 0.18 1.23 0.37 0.00 0.00 175.52 177.10 1odg h GLY 34 N 0.45 0.00 -0.59 2.16 0.00 -0.47 0.92 103.07 105.54 1odg h GLY 34 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1odg h GLY 34 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.48 1odg n GLN 35 N -3.44 1.96 0.00 4.80 1.13 -0.03 -4.98 117.38 116.82 1odg n GLN 35 Ca -0.00 -2.62 0.00 0.00 -1.94 0.00 0.00 57.00 52.44 1odg n GLN 35 Cb 0.27 -1.60 0.00 0.00 0.11 0.00 0.00 30.24 29.03 1odg n GLN 35 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1odg n GLY 36 N -1.03 0.82 0.00 1.08 0.00 0.32 -4.89 105.19 101.49 1odg n GLY 36 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1odg n GLY 36 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1odg n LEU 37 N 0.00 0.00 -4.62 0.99 4.77 -1.22 -4.63 117.00 112.28 1odg n LEU 37 Ca 0.00 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.55 1odg n LEU 37 Cb 0.00 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.07 1odg n LEU 37 CO 0.00 0.00 1.28 0.00 -1.33 0.00 0.00 177.39 177.34 1odg s ALA 38 N 0.00 3.26 -0.03 -1.18 0.00 -1.26 -4.54 121.76 118.01 1odg s ALA 38 Ca 0.00 0.25 -0.03 0.00 0.00 0.00 0.00 51.96 52.18 1odg s ALA 38 Cb 0.00 -3.84 0.01 0.00 0.00 0.00 0.00 23.12 19.28 1odg s ALA 38 CO 0.00 -1.98 0.09 -0.59 0.00 0.00 0.00 175.76 173.28 1odg s PHE 39 N 5.02 -0.05 0.50 0.00 -0.12 -1.26 -3.59 117.98 118.48 1odg s PHE 39 Ca 0.65 0.14 0.07 0.00 -0.05 0.00 0.00 56.93 57.74 1odg s PHE 39 Cb -0.20 0.01 0.09 0.00 -0.63 0.00 0.00 43.02 42.28 1odg s PHE 39 CO 0.28 -0.08 0.69 -2.13 -0.05 0.00 0.00 175.22 173.93 1odg n ARG 40 N 2.75 0.56 -4.11 1.99 0.63 0.18 -4.89 116.66 113.76 1odg n ARG 40 Ca -0.14 -2.54 -0.15 0.00 -0.92 0.00 0.00 57.85 54.10 1odg n ARG 40 Cb 0.59 -0.26 -0.11 0.00 0.45 0.00 0.00 32.46 33.12 1odg n ARG 40 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1odg s VAL 41 N -2.08 0.77 -0.01 5.15 1.01 -1.26 -2.04 120.40 121.94 1odg s VAL 41 Ca 0.51 -1.24 -0.01 0.00 0.00 0.00 0.00 61.98 61.25 1odg s VAL 41 Cb -0.04 -0.87 0.00 0.00 0.00 0.00 0.00 36.38 35.47 1odg s VAL 41 CO 0.33 -0.37 0.01 0.00 0.00 0.00 0.00 175.10 175.07 1odg n GLN 42 N 1.26 -0.03 -3.80 2.72 6.02 0.52 -4.88 117.38 119.18 1odg n GLN 42 Ca -0.21 0.04 -0.35 0.00 -0.01 0.00 0.00 57.00 56.46 1odg n GLN 42 Cb 0.55 -0.05 -0.10 0.00 1.02 0.00 0.00 30.24 31.66 1odg n GLN 42 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1odg s ASP 43 N -0.04 5.89 -0.06 1.08 -1.08 -1.23 -4.97 116.67 116.26 1odg s ASP 43 Ca 0.01 0.10 0.09 0.00 -0.52 0.00 0.00 52.55 52.23 1odg s ASP 43 Cb -0.00 -2.04 0.37 0.00 -1.46 0.00 0.00 42.92 39.79 1odg s ASP 43 CO 0.01 0.12 1.20 0.00 0.52 0.00 0.00 175.17 177.03 1odg n ALA 44 N 3.92 2.79 0.83 3.66 0.00 -1.26 -3.40 120.51 127.06 1odg n ALA 44 Ca -0.16 -0.79 0.09 0.00 0.00 0.00 0.00 53.44 52.58 1odg n ALA 44 Cb 0.52 -1.01 -0.03 0.00 0.00 0.00 0.00 19.45 18.93 1odg n ALA 44 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1odg n SER 45 N 0.46 1.54 -4.40 0.00 3.41 -1.26 -4.90 113.62 108.46 1odg n SER 45 Ca 0.13 -1.27 -0.32 0.00 -0.26 0.00 0.00 58.87 57.15 1odg n SER 45 Cb 0.51 0.62 -0.14 0.00 -0.26 0.00 0.00 64.21 64.93 1odg n SER 45 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1odg s LEU 46 N -2.39 2.52 0.80 1.04 1.43 -1.22 -5.09 118.68 115.78 1odg s LEU 46 Ca 0.13 -0.31 -0.15 0.00 -1.03 0.00 0.00 54.13 52.77 1odg s LEU 46 Cb 0.15 -1.50 -0.04 0.00 0.03 0.00 0.00 46.19 44.83 1odg s LEU 46 CO 0.54 0.30 0.30 -2.65 0.23 0.00 0.00 176.35 175.07 1odg n PRO 47 N 2.60 0.09 -0.95 1.29 -0.02 -1.26 -1.01 135.00 135.73 1odg n PRO 47 Ca -0.17 0.07 -0.04 0.00 -2.02 0.00 0.00 63.50 61.33 1odg n PRO 47 Cb 0.52 -1.69 -0.02 0.00 -0.02 0.00 0.00 33.50 32.29 1odg n PRO 47 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1odg n GLY 48 N 1.88 0.41 2.01 -1.23 0.00 -1.26 -3.71 105.19 103.28 1odg n GLY 48 Ca 0.08 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.98 1odg n GLY 48 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1odg n ARG 49 N 0.01 -0.60 -0.80 1.61 0.63 -0.18 -4.78 116.66 112.54 1odg n ARG 49 Ca -0.04 0.42 -0.35 0.00 -0.92 0.00 0.00 57.85 56.96 1odg n ARG 49 Cb 0.42 -0.65 0.12 0.00 0.45 0.00 0.00 32.46 32.79 1odg n ARG 49 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 1odg n PRO 50 N -0.26 -0.96 -0.12 -0.14 -0.02 -1.24 -4.67 135.00 127.59 1odg n PRO 50 Ca -0.04 -0.27 -0.20 0.00 -2.02 0.00 0.00 63.50 60.97 1odg n PRO 50 Cb 0.22 -1.42 -0.10 0.00 -0.02 0.00 0.00 33.50 32.19 1odg n PRO 50 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1odg n ASP 51 N 0.42 2.05 -4.19 2.55 8.00 -0.98 -3.48 116.55 120.92 1odg n ASP 51 Ca -0.00 0.02 -0.32 0.00 0.71 0.00 0.00 54.79 55.20 1odg n ASP 51 Cb 0.68 -0.49 -0.17 0.00 -0.02 0.00 0.00 41.12 41.12 1odg n ASP 51 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1odg s PHE 52 N -2.46 2.53 -0.13 1.24 2.99 -1.20 -0.36 117.98 120.60 1odg s PHE 52 Ca -0.32 -1.12 0.02 0.00 0.00 0.00 0.00 56.93 55.51 1odg s PHE 52 Cb 0.10 -1.71 0.00 0.00 0.00 0.00 0.00 43.02 41.41 1odg s PHE 52 CO 0.50 -0.48 -0.19 0.08 -0.00 0.00 0.00 175.22 175.12 1odg s VAL 53 N 0.53 2.35 -0.18 -0.44 1.01 -0.87 -0.04 120.40 122.77 1odg s VAL 53 Ca -0.14 -0.89 0.01 0.00 0.00 0.00 0.00 61.98 60.95 1odg s VAL 53 Cb -0.17 -1.95 0.02 0.00 0.00 0.00 0.00 36.38 34.28 1odg s VAL 53 CO 0.05 0.54 -0.18 -0.69 0.00 0.00 0.00 175.10 174.81 1odg s VAL 54 N 0.64 2.01 -0.34 2.92 1.01 0.43 0.47 120.40 127.54 1odg s VAL 54 Ca -0.10 -0.96 0.23 0.00 0.00 0.00 0.00 61.98 61.14 1odg s VAL 54 Cb -0.16 -1.85 0.11 0.00 0.00 0.00 0.00 36.38 34.48 1odg s VAL 54 CO 0.02 0.48 1.25 0.44 0.00 0.00 0.00 175.10 177.30 1odg h ASP 55 N 7.94 0.00 0.05 3.32 3.32 -1.81 -1.62 116.42 127.62 1odg h ASP 55 Ca -0.43 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.61 1odg h ASP 55 Cb 1.13 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.68 1odg h ASP 55 CO 0.61 0.01 0.00 1.21 -1.72 0.00 0.00 179.24 179.35 1odg n GLU 56 N -2.76 0.05 0.00 3.56 2.13 -1.26 -2.97 120.64 119.39 1odg n GLU 56 Ca 0.02 0.21 0.00 0.00 0.66 0.00 0.00 57.16 58.05 1odg n GLU 56 Cb 0.53 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.74 1odg n GLU 56 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 1odg n TYR 57 N -1.24 0.00 -3.21 4.31 4.01 -1.24 -5.03 117.16 114.75 1odg n TYR 57 Ca 0.02 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.60 1odg n TYR 57 Cb 0.02 0.04 0.06 0.00 -0.31 0.00 0.00 39.34 39.15 1odg n TYR 57 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 1odg n ARG 58 N 0.00 -5.49 -4.11 -0.72 3.00 -0.97 -4.84 116.66 103.53 1odg n ARG 58 Ca 0.00 0.61 -0.10 0.00 -0.00 0.00 0.00 57.85 58.36 1odg n ARG 58 Cb 0.25 -4.95 -0.10 0.00 0.00 0.00 0.00 32.46 27.66 1odg n ARG 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1odg s VAL 60 N -3.15 1.23 0.26 0.00 -7.23 -0.11 -0.43 120.40 110.97 1odg s VAL 60 Ca 0.04 -1.05 0.09 0.00 -1.81 0.00 0.00 61.98 59.25 1odg s VAL 60 Cb 0.02 -1.10 -0.04 0.00 0.56 0.00 0.00 36.38 35.82 1odg s VAL 60 CO -0.05 0.04 0.06 -0.63 -0.31 0.00 0.00 175.10 174.20 1odg s ILE 61 N -0.85 3.74 -0.01 -0.62 1.01 0.95 -2.05 121.20 123.37 1odg s ILE 61 Ca 0.03 -1.76 0.01 0.00 0.00 0.00 0.00 60.65 58.93 1odg s ILE 61 Cb -0.08 -3.02 0.00 0.00 0.01 0.00 0.00 42.46 39.37 1odg s ILE 61 CO 0.01 -0.36 -0.04 -0.36 0.00 0.00 0.00 174.94 174.19 1odg s PHE 62 N -2.27 0.43 -0.73 3.97 0.40 -0.07 -2.31 117.98 117.40 1odg s PHE 62 Ca 0.32 -0.08 0.04 0.00 -0.60 0.00 0.00 56.93 56.61 1odg s PHE 62 Cb -0.07 -0.30 0.21 0.00 0.51 0.00 0.00 43.02 43.37 1odg s PHE 62 CO 0.21 -0.03 0.67 0.25 0.70 0.00 0.00 175.22 177.03 1odg n THR 63 N 3.11 2.25 -2.73 0.64 -2.24 -1.26 -0.58 114.28 113.47 1odg n THR 63 Ca -0.15 -5.08 -0.41 0.00 -2.27 0.00 0.00 64.05 56.14 1odg n THR 63 Cb 0.57 -2.18 -0.04 0.00 -2.10 0.00 0.00 70.33 66.58 1odg n THR 63 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1odg s HIS 64 N -1.89 3.78 0.29 4.78 3.76 -1.21 -4.91 115.29 119.89 1odg s HIS 64 Ca 0.31 1.78 -0.29 0.00 -0.15 0.00 0.00 55.06 56.70 1odg s HIS 64 Cb 0.03 -3.06 -0.10 0.00 1.11 0.00 0.00 32.58 30.56 1odg s HIS 64 CO -0.10 0.17 1.26 0.20 -0.85 0.00 0.00 174.74 175.42 1odg s GLY 65 N 0.17 2.88 0.61 -2.22 0.00 -1.26 -2.80 107.32 104.70 1odg s GLY 65 Ca 0.48 1.14 0.33 0.00 0.00 0.00 0.00 44.72 46.66 1odg s GLY 65 CO 0.29 1.86 2.24 0.00 0.00 0.00 0.00 173.10 177.48 1odg h PHE 67 N 0.00 0.00 -0.40 0.00 3.57 -1.91 -2.22 116.94 115.99 1odg h PHE 67 Ca 0.02 0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.63 1odg h PHE 67 Cb 0.13 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 38.86 1odg h PHE 67 CO 0.00 0.31 0.31 -1.49 -2.23 0.00 0.00 178.31 175.21 1odg h TRP 68 N -1.00 0.00 -0.37 0.41 -0.00 -1.98 -2.64 115.95 110.37 1odg h TRP 68 Ca -0.01 0.00 -0.17 0.00 -0.00 0.00 0.00 58.89 58.71 1odg h TRP 68 Cb 0.32 0.00 -0.10 0.00 -0.00 0.00 0.00 29.16 29.38 1odg h TRP 68 CO 0.07 0.00 -0.04 0.72 -0.00 0.00 0.00 178.44 179.19 1odg n HIS 69 N -4.25 1.16 -3.87 0.49 8.25 -1.22 -4.69 115.22 111.08 1odg n HIS 69 Ca 0.07 -1.53 -0.32 0.00 -0.26 0.00 0.00 57.72 55.68 1odg n HIS 69 Cb 0.50 -0.49 0.01 0.00 1.12 0.00 0.00 29.99 31.12 1odg n HIS 69 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 1odg n HIS 70 N -1.06 -1.72 -3.07 4.41 -0.00 -1.00 -4.86 115.22 107.92 1odg n HIS 70 Ca 0.33 0.53 -0.39 0.00 0.46 0.00 0.00 57.72 58.65 1odg n HIS 70 Cb 1.05 -2.64 -0.05 0.00 -0.12 0.00 0.00 29.99 28.23 1odg n HIS 70 CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 1odg s HIS 71 N -3.17 3.57 -1.23 1.57 5.04 -0.84 -4.92 115.29 115.31 1odg s HIS 71 Ca 0.17 1.21 -0.08 0.00 -1.54 0.00 0.00 55.06 54.82 1odg s HIS 71 Cb -0.09 -2.78 -0.07 0.00 0.04 0.00 0.00 32.58 29.68 1odg s HIS 71 CO 0.89 0.10 2.53 0.72 -2.34 0.00 0.00 174.74 176.64 1odg n HIS 72 N 3.77 1.82 -4.54 3.88 8.25 -1.26 -4.48 115.22 122.66 1odg n HIS 72 Ca -0.02 -2.47 -0.25 0.00 -0.26 0.00 0.00 57.72 54.72 1odg n HIS 72 Cb 0.51 -2.05 -0.11 0.00 1.12 0.00 0.00 29.99 29.47 1odg n HIS 72 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1odg h TYR 74 N 1.92 0.00 -0.00 0.00 -0.00 -2.00 -1.97 116.97 114.93 1odg h TYR 74 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.31 1odg h TYR 74 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.97 1odg h TYR 74 CO 0.70 0.00 0.00 1.28 -0.00 0.00 0.00 178.16 180.14 1odg n LEU 75 N -3.82 0.04 -4.62 0.10 4.77 -1.26 -4.75 117.00 107.45 1odg n LEU 75 Ca 0.02 -0.01 -0.38 0.00 -0.03 0.00 0.00 56.01 55.61 1odg n LEU 75 Cb 0.35 -0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.34 1odg n LEU 75 CO 0.28 0.01 -0.04 0.12 -1.33 0.00 0.00 177.39 176.42 1odg s PHE 76 N -2.00 3.26 -0.09 -1.77 5.36 -0.74 -4.62 117.98 117.38 1odg s PHE 76 Ca 0.47 0.32 -0.02 0.00 -0.96 0.00 0.00 56.93 56.73 1odg s PHE 76 Cb 0.21 -2.46 0.04 0.00 -0.34 0.00 0.00 43.02 40.47 1odg s PHE 76 CO 0.36 -0.14 0.03 0.15 -1.46 0.00 0.00 175.22 174.16 1odg s LYS 77 N 1.73 0.41 0.13 10.12 3.01 -1.26 -4.92 119.74 128.94 1odg s LYS 77 Ca 0.12 0.07 -0.31 0.00 -1.01 0.00 0.00 55.97 54.84 1odg s LYS 77 Cb -0.15 -1.12 -0.10 0.00 -1.01 0.00 0.00 37.83 35.45 1odg s LYS 77 CO 0.09 -0.39 1.71 0.08 0.51 0.00 0.00 175.35 177.35 1odg s VAL 78 N 2.02 2.62 0.82 3.17 1.01 -1.26 -4.94 120.40 123.83 1odg s VAL 78 Ca 0.04 0.24 -0.12 0.00 0.00 0.00 0.00 61.98 62.14 1odg s VAL 78 Cb -0.13 -3.16 0.09 0.00 0.00 0.00 0.00 36.38 33.18 1odg s VAL 78 CO -0.06 0.01 1.17 -2.84 0.00 0.00 0.00 175.10 173.38 1odg s PRO 79 N 2.18 1.64 0.00 2.72 0.02 -1.26 -4.91 135.00 135.39 1odg s PRO 79 Ca 0.76 1.62 0.23 0.00 0.02 0.00 0.00 61.00 63.63 1odg s PRO 79 Cb -0.44 -1.79 0.65 0.00 0.02 0.00 0.00 34.50 32.93 1odg s PRO 79 CO 0.34 -2.18 1.54 0.00 -0.33 0.00 0.00 177.00 176.37 1odg n ALA 80 N -3.47 2.38 -2.46 -1.55 0.00 -1.26 -4.40 120.51 109.74 1odg n ALA 80 Ca 0.12 -1.29 -0.26 0.00 0.00 0.00 0.00 53.44 52.01 1odg n ALA 80 Cb 0.51 -0.94 -0.15 0.00 0.00 0.00 0.00 19.45 18.88 1odg n ALA 80 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1odg s THR 81 N -1.03 1.56 -1.42 0.00 2.01 -1.26 -4.69 115.64 110.81 1odg s THR 81 Ca 0.49 -0.92 -0.16 0.00 0.31 0.00 0.00 61.69 61.41 1odg s THR 81 Cb 0.26 -1.31 0.15 0.00 0.01 0.00 0.00 72.50 71.61 1odg s THR 81 CO 0.34 0.37 0.52 0.54 -0.69 0.00 0.00 174.62 175.70 1odg n ARG 82 N 2.41 -2.13 -0.36 4.92 1.74 -1.26 -4.79 116.66 117.20 1odg n ARG 82 Ca -0.16 0.23 -0.09 0.00 -0.77 0.00 0.00 57.85 57.06 1odg n ARG 82 Cb 0.53 -4.85 -0.08 0.00 -1.02 0.00 0.00 32.46 27.03 1odg n ARG 82 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1odg n THR 83 N -3.84 -0.58 -0.21 0.55 -1.04 -1.26 -0.01 114.28 107.90 1odg n THR 83 Ca 0.07 2.25 0.20 0.00 -2.04 0.00 0.00 64.05 64.53 1odg n THR 83 Cb 0.48 -2.80 0.56 0.00 -1.82 0.00 0.00 70.33 66.76 1odg n THR 83 CO 0.00 0.00 0.00 -0.08 -0.64 0.00 0.00 175.07 174.35 1odg h GLU 84 N 0.00 0.30 -0.03 -2.82 4.81 -1.93 0.19 114.58 115.09 1odg h GLU 84 Ca 0.14 -0.02 -0.13 0.00 -0.13 0.00 0.00 59.36 59.22 1odg h GLU 84 Cb 0.35 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.64 1odg h GLU 84 CO -0.80 0.20 -0.58 0.35 -0.73 0.00 0.00 179.01 177.46 1odg h PHE 85 N 0.31 0.13 0.17 0.92 3.57 -0.77 -2.41 116.94 118.86 1odg h PHE 85 Ca 0.44 -0.05 -0.34 0.00 3.53 0.00 0.00 57.97 61.55 1odg h PHE 85 Cb 1.21 -0.02 0.01 0.00 2.79 0.00 0.00 35.95 39.94 1odg h PHE 85 CO -0.00 0.66 -1.69 -1.49 -2.23 0.00 0.00 178.31 173.56 1odg h TRP 86 N 0.08 0.65 -0.48 0.41 4.06 0.17 -2.85 115.95 117.99 1odg h TRP 86 Ca -0.00 -0.48 -0.06 0.00 2.06 0.00 0.00 58.89 60.41 1odg h TRP 86 Cb 1.04 -0.03 -0.02 0.00 -1.00 0.00 0.00 29.16 29.15 1odg h TRP 86 CO 0.01 1.59 0.05 -0.07 -3.56 0.00 0.00 178.44 176.46 1odg h LEU 87 N 0.10 0.72 -0.04 -4.49 3.38 -0.89 0.10 115.31 114.19 1odg h LEU 87 Ca -0.32 -0.15 -0.26 0.00 0.09 0.00 0.00 57.88 57.25 1odg h LEU 87 Cb 2.08 -0.19 0.02 0.00 0.09 0.00 0.00 40.66 42.66 1odg h LEU 87 CO 0.18 0.76 -0.98 -0.08 0.09 0.00 0.00 178.44 178.40 1odg h GLU 88 N 0.72 0.72 -0.79 1.13 4.57 -1.56 -0.87 114.58 118.51 1odg h GLU 88 Ca 0.15 -0.73 -0.03 0.00 -1.18 0.00 0.00 59.36 57.58 1odg h GLU 88 Cb 0.37 0.20 -0.04 0.00 -0.16 0.00 0.00 28.75 29.12 1odg h GLU 88 CO 0.01 1.31 0.38 -0.22 -1.18 0.00 0.00 179.01 179.31 1odg h LYS 89 N 0.43 1.13 0.15 1.92 3.64 -1.26 -2.16 116.57 120.41 1odg h LYS 89 Ca -0.11 -0.16 -0.01 0.00 -1.27 0.00 0.00 60.65 59.10 1odg h LYS 89 Cb 1.63 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 33.25 1odg h LYS 89 CO 0.19 0.87 -0.07 0.82 -2.27 0.00 0.00 179.45 178.99 1odg h ILE 90 N 1.11 0.97 -0.76 2.00 2.04 -0.76 -2.95 117.51 119.15 1odg h ILE 90 Ca 0.27 -0.58 0.17 0.00 1.00 0.00 0.00 64.86 65.72 1odg h ILE 90 Cb 0.11 1.33 -0.14 0.00 -0.74 0.00 0.00 36.82 37.38 1odg h ILE 90 CO -0.04 0.13 -0.06 1.23 0.00 0.00 0.00 178.15 179.42 1odg h GLY 91 N -0.48 0.76 1.90 5.37 0.00 -0.96 0.80 103.07 110.45 1odg h GLY 91 Ca -0.02 0.16 0.01 0.00 0.00 0.00 0.00 47.33 47.48 1odg h GLY 91 CO 0.03 -0.30 0.04 0.50 0.00 0.00 0.00 176.54 176.82 1odg h LYS 92 N 0.06 0.00 0.15 4.80 1.57 -1.24 -0.86 116.57 121.06 1odg h LYS 92 Ca 0.40 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.18 1odg h LYS 92 Cb 0.69 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.00 1odg h LYS 92 CO -0.71 0.00 -0.07 -0.91 -0.57 0.00 0.00 179.45 177.19 1odg h ASN 93 N 0.00 -0.18 -0.38 0.86 2.35 0.75 0.69 115.58 119.68 1odg h ASN 93 Ca 0.02 -0.33 0.08 0.00 -0.55 0.00 0.00 56.30 55.52 1odg h ASN 93 Cb 0.10 0.05 -0.07 0.00 0.05 0.00 0.00 38.32 38.44 1odg h ASN 93 CO -0.00 0.27 -0.10 0.58 -1.65 0.00 0.00 177.43 176.53 1odg h VAL 94 N -0.67 0.60 -0.69 2.81 2.07 -0.73 0.28 116.25 119.93 1odg h VAL 94 Ca -0.02 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.63 1odg h VAL 94 Cb 0.49 0.60 -0.09 0.00 -1.52 0.00 0.00 31.29 30.77 1odg h VAL 94 CO 0.03 0.00 0.20 -0.33 0.02 0.00 0.00 177.57 177.50 1odg h GLU 95 N -0.01 0.32 -0.40 1.57 5.08 -1.12 0.75 114.58 120.76 1odg h GLU 95 Ca 0.18 -0.02 -0.08 0.00 -1.00 0.00 0.00 59.36 58.44 1odg h GLU 95 Cb 0.29 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 1odg h GLU 95 CO -0.40 0.21 -0.10 -0.09 -1.00 0.00 0.00 179.01 177.64 1odg h ARG 96 N 0.33 0.70 0.21 2.33 2.43 0.16 -2.14 114.38 118.41 1odg h ARG 96 Ca 0.37 -0.22 -0.01 0.00 -0.81 0.00 0.00 59.98 59.32 1odg h ARG 96 Cb 0.58 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.07 1odg h ARG 96 CO -0.43 0.78 -0.10 -0.44 -1.51 0.00 0.00 179.97 178.28 1odg h ASP 97 N 0.64 -0.24 -0.56 -3.80 3.32 0.11 0.20 116.42 116.09 1odg h ASP 97 Ca 0.11 -0.16 0.08 0.00 0.02 0.00 0.00 57.03 57.08 1odg h ASP 97 Cb 0.55 0.06 -0.10 0.00 0.22 0.00 0.00 39.33 40.06 1odg h ASP 97 CO 0.03 0.03 -0.48 0.03 -1.72 0.00 0.00 179.24 177.13 1odg h ARG 98 N -0.52 -0.25 0.28 3.56 2.47 -0.83 0.45 114.38 119.54 1odg h ARG 98 Ca -0.03 0.02 0.01 0.00 -1.26 0.00 0.00 59.98 58.71 1odg h ARG 98 Cb 0.39 0.06 -0.03 0.00 -1.65 0.00 0.00 29.97 28.73 1odg h ARG 98 CO 0.05 -0.17 -0.43 0.00 0.56 0.00 0.00 179.97 179.98 1odg h ARG 99 N -0.26 -0.74 -0.44 0.04 3.08 -1.29 -1.14 114.38 113.63 1odg h ARG 99 Ca 0.15 0.05 0.05 0.00 0.07 0.00 0.00 59.98 60.30 1odg h ARG 99 Cb 0.56 0.17 -0.08 0.00 0.08 0.00 0.00 29.97 30.70 1odg h ARG 99 CO -0.68 -0.49 -0.54 -0.44 -1.07 0.00 0.00 179.97 176.74 1odg h ASP 100 N -0.77 -1.83 -0.37 7.04 3.32 0.99 -1.30 116.42 123.49 1odg h ASP 100 Ca -0.01 0.24 0.08 0.00 0.02 0.00 0.00 57.03 57.36 1odg h ASP 100 Cb 0.73 0.76 -0.09 0.00 0.22 0.00 0.00 39.33 40.95 1odg h ASP 100 CO -0.16 -0.38 -0.29 0.40 -1.72 0.00 0.00 179.24 177.09 1odg h ILE 101 N -0.36 0.28 -0.99 0.35 2.04 0.02 -1.30 117.51 117.55 1odg h ILE 101 Ca 0.08 0.00 0.22 0.00 1.00 0.00 0.00 64.86 66.16 1odg h ILE 101 Cb 0.56 0.28 -0.12 0.00 -0.74 0.00 0.00 36.82 36.81 1odg h ILE 101 CO -0.60 0.00 0.57 -1.28 0.00 0.00 0.00 178.15 176.84 1odg h SER 102 N -0.23 0.67 0.11 1.72 0.87 -0.13 0.14 113.55 116.70 1odg h SER 102 Ca 0.17 0.13 -0.01 0.00 -1.23 0.00 0.00 61.79 60.85 1odg h SER 102 Cb 0.51 0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.50 1odg h SER 102 CO -0.51 0.14 -0.06 -0.09 -0.53 0.00 0.00 176.83 175.79 1odg h ARG 103 N 0.61 -0.15 -0.42 2.24 2.43 -0.35 -1.72 114.38 117.01 1odg h ARG 103 Ca 0.61 0.01 0.08 0.00 -0.81 0.00 0.00 59.98 59.87 1odg h ARG 103 Cb 1.10 0.03 -0.09 0.00 -0.42 0.00 0.00 29.97 30.59 1odg h ARG 103 CO -0.45 0.25 -0.34 -0.07 -1.51 0.00 0.00 179.97 177.84 1odg h LEU 104 N -0.59 -1.15 -1.33 3.80 3.38 -0.32 0.65 115.31 119.74 1odg h LEU 104 Ca -0.02 0.20 0.14 0.00 0.09 0.00 0.00 57.88 58.30 1odg h LEU 104 Cb 0.47 0.54 -0.07 0.00 0.09 0.00 0.00 40.66 41.69 1odg h LEU 104 CO 0.03 -0.33 0.56 1.56 0.09 0.00 0.00 178.44 180.35 1odg h GLN 105 N -0.25 0.64 -0.54 1.13 4.20 -0.75 0.19 115.11 119.72 1odg h GLN 105 Ca 0.17 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.82 1odg h GLN 105 Cb 0.55 -0.14 -0.03 0.00 0.30 0.00 0.00 27.48 28.16 1odg h GLN 105 CO -0.56 0.42 0.22 1.49 -0.67 0.00 0.00 178.83 179.72 1odg h GLU 106 N 0.66 0.78 -1.00 1.46 4.81 0.12 -2.22 114.58 119.19 1odg h GLU 106 Ca 0.43 -0.12 -0.21 0.00 -0.13 0.00 0.00 59.36 59.34 1odg h GLU 106 Cb 0.72 -0.14 -0.13 0.00 0.63 0.00 0.00 28.75 29.84 1odg h GLU 106 CO -0.19 0.65 0.27 1.28 -0.73 0.00 0.00 179.01 180.28 1odg n LEU 107 N -4.34 4.52 -2.46 1.64 4.77 0.59 -4.85 117.00 116.87 1odg n LEU 107 Ca 0.04 -2.35 -0.20 0.00 -0.03 0.00 0.00 56.01 53.47 1odg n LEU 107 Cb 0.16 -0.64 0.01 0.00 -2.33 0.00 0.00 43.42 40.62 1odg n LEU 107 CO 0.38 0.72 -0.14 0.61 -1.33 0.00 0.00 177.39 177.64 1odg n GLY 108 N -0.17 -0.43 3.67 -0.72 0.00 -0.83 -5.01 105.19 101.70 1odg n GLY 108 Ca 0.24 -0.02 -0.33 0.00 0.00 0.00 0.00 46.02 45.92 1odg n GLY 108 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1odg s TRP 109 N -3.04 3.06 -0.19 1.61 0.52 -0.84 -4.86 118.94 115.20 1odg s TRP 109 Ca 0.13 0.08 -0.10 0.00 0.02 0.00 0.00 56.10 56.23 1odg s TRP 109 Cb -0.06 -1.69 -0.05 0.00 -1.15 0.00 0.00 33.47 30.53 1odg s TRP 109 CO 0.16 0.45 0.13 1.03 0.02 0.00 0.00 176.95 178.73 1odg s ARG 110 N -1.37 4.13 -0.07 4.98 0.52 -0.73 -3.93 118.95 122.48 1odg s ARG 110 Ca 0.18 -0.21 0.00 0.00 -0.52 0.00 0.00 55.73 55.18 1odg s ARG 110 Cb -0.11 -3.40 -0.03 0.00 0.52 0.00 0.00 34.95 31.92 1odg s ARG 110 CO 0.08 0.33 -0.06 0.08 0.02 0.00 0.00 175.30 175.75 1odg s VAL 111 N 0.26 3.78 -0.04 3.52 1.01 -1.26 -0.93 120.40 126.74 1odg s VAL 111 Ca 0.08 -0.45 0.02 0.00 0.00 0.00 0.00 61.98 61.64 1odg s VAL 111 Cb -0.11 -2.55 0.01 0.00 0.00 0.00 0.00 36.38 33.73 1odg s VAL 111 CO -0.02 0.60 -0.08 -0.22 0.00 0.00 0.00 175.10 175.38 1odg s LEU 112 N -0.79 1.61 -0.12 3.92 2.96 -0.87 -2.01 118.68 123.39 1odg s LEU 112 Ca 0.12 -0.19 0.01 0.00 -0.22 0.00 0.00 54.13 53.85 1odg s LEU 112 Cb -0.11 -0.57 -0.01 0.00 0.50 0.00 0.00 46.19 46.00 1odg s LEU 112 CO 0.02 0.02 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.27 1odg s ILE 113 N 0.53 2.79 -0.23 6.68 1.01 -0.31 -0.89 121.20 130.78 1odg s ILE 113 Ca -0.09 -0.76 0.02 0.00 0.00 0.00 0.00 60.65 59.82 1odg s ILE 113 Cb -0.12 -2.14 0.05 0.00 0.01 0.00 0.00 42.46 40.25 1odg s ILE 113 CO 0.01 0.54 -0.13 -0.69 0.00 0.00 0.00 174.94 174.67 1odg s VAL 114 N 0.27 2.04 0.63 2.92 1.01 0.25 0.21 120.40 127.74 1odg s VAL 114 Ca -0.12 -1.37 -0.12 0.00 0.00 0.00 0.00 61.98 60.37 1odg s VAL 114 Cb -0.16 -2.08 -0.03 0.00 0.00 0.00 0.00 36.38 34.11 1odg s VAL 114 CO 0.06 0.12 1.04 0.26 0.00 0.00 0.00 175.10 176.58 1odg s TRP 115 N 1.20 3.39 0.15 5.22 0.52 -0.88 -3.32 118.94 125.22 1odg s TRP 115 Ca -0.05 1.37 -0.10 0.00 0.02 0.00 0.00 56.10 57.34 1odg s TRP 115 Cb -0.18 -2.80 -0.02 0.00 -1.15 0.00 0.00 33.47 29.32 1odg s TRP 115 CO -0.07 -0.88 1.48 1.05 0.02 0.00 0.00 176.95 178.55 1odg h GLU 116 N -0.29 0.88 0.00 4.98 4.11 -1.87 -2.98 114.58 119.42 1odg h GLU 116 Ca -0.44 -0.48 0.00 0.00 0.07 0.00 0.00 59.36 58.50 1odg h GLU 116 Cb 1.20 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1odg h GLU 116 CO 0.60 1.13 0.61 0.00 0.07 0.00 0.00 179.01 181.42 1odg n ALA 118 N -1.63 3.54 -1.37 0.00 0.00 -1.12 -3.51 120.51 116.43 1odg n ALA 118 Ca -0.01 -2.80 0.00 0.00 0.00 0.00 0.00 53.44 50.63 1odg n ALA 118 Cb 0.63 -0.66 0.00 0.00 0.00 0.00 0.00 19.45 19.43 1odg n ALA 118 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1odg n LEU 119 N -0.96 0.00 -3.61 0.00 7.94 0.57 -3.40 117.00 117.54 1odg n LEU 119 Ca 0.26 0.00 -0.12 0.00 -1.11 0.00 0.00 56.01 55.04 1odg n LEU 119 Cb 0.91 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 44.80 1odg n LEU 119 CO 0.14 0.10 0.64 -0.60 -1.11 0.00 0.00 177.39 176.56 1odg s ARG 120 N 0.00 0.66 0.00 1.96 3.52 -0.40 -4.98 118.95 119.71 1odg s ARG 120 Ca 0.00 0.56 0.00 0.00 -0.13 0.00 0.00 55.73 56.16 1odg s ARG 120 Cb 0.00 0.32 0.00 0.00 -1.56 0.00 0.00 34.95 33.71 1odg s ARG 120 CO 0.00 -0.13 0.00 0.41 -0.81 0.00 0.00 175.30 174.77 1odg n GLY 121 N 1.87 1.59 2.00 8.12 0.00 -1.26 -4.27 105.19 113.23 1odg n GLY 121 Ca -0.13 -2.07 -0.08 0.00 0.00 0.00 0.00 46.02 43.75 1odg n GLY 121 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1odg n ARG 122 N 0.84 1.44 0.00 1.61 3.00 -1.26 -2.14 116.66 120.15 1odg n ARG 122 Ca 0.00 -0.64 0.00 0.00 -0.00 0.00 0.00 57.85 57.21 1odg n ARG 122 Cb 0.00 -1.74 0.00 0.00 0.00 0.00 0.00 32.46 30.72 1odg n ARG 122 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1odg n GLU 123 N 2.39 0.00 -1.62 -0.14 1.02 -1.26 -5.13 120.64 115.90 1odg n GLU 123 Ca 0.27 0.00 -0.51 0.00 -0.02 0.00 0.00 57.16 56.90 1odg n GLU 123 Cb 0.67 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 32.03 1odg n GLU 123 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 1odg n LYS 124 N 0.00 1.43 -1.60 3.49 2.85 -0.91 -4.80 118.16 118.62 1odg n LYS 124 Ca 0.00 0.52 -0.49 0.00 -1.05 0.00 0.00 58.31 57.29 1odg n LYS 124 Cb 0.05 -2.20 -0.04 0.00 -0.65 0.00 0.00 35.03 32.18 1odg n LYS 124 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 1odg n LEU 125 N 3.20 1.86 -4.69 -5.58 4.77 -1.22 -4.85 117.00 110.49 1odg n LEU 125 Ca 0.19 1.13 -0.44 0.00 -0.03 0.00 0.00 56.01 56.86 1odg n LEU 125 Cb 0.21 -1.25 -0.02 0.00 -2.33 0.00 0.00 43.42 40.03 1odg n LEU 125 CO 0.65 -1.07 1.01 0.35 -1.33 0.00 0.00 177.39 177.01 1odg n THR 126 N 1.95 1.23 0.17 -5.08 -2.24 -1.26 -4.71 114.28 104.34 1odg n THR 126 Ca 0.16 -0.31 0.03 0.00 -2.27 0.00 0.00 64.05 61.66 1odg n THR 126 Cb 0.24 -1.56 0.16 0.00 -2.10 0.00 0.00 70.33 67.06 1odg n THR 126 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 1odg h ASP 127 N 3.86 0.00 0.00 3.42 1.82 -1.99 -1.50 116.42 122.03 1odg h ASP 127 Ca -0.46 0.00 -0.00 0.00 -0.39 0.00 0.00 57.03 56.18 1odg h ASP 127 Cb 1.27 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.28 1odg h ASP 127 CO 0.73 0.00 -0.00 -0.33 -1.61 0.00 0.00 179.24 178.03 1odg h GLU 128 N 0.00 -0.00 -1.01 0.28 3.07 -2.01 -3.36 114.58 111.55 1odg h GLU 128 Ca 0.00 0.00 0.34 0.00 -0.50 0.00 0.00 59.36 59.20 1odg h GLU 128 Cb 1.16 0.00 -0.10 0.00 -0.84 0.00 0.00 28.75 28.97 1odg h GLU 128 CO 0.00 -0.00 0.66 0.00 -1.40 0.00 0.00 179.01 178.27 1odg n ALA 129 N -2.00 1.00 -0.07 3.43 0.00 -0.56 -1.81 120.51 120.49 1odg n ALA 129 Ca -0.00 0.61 0.00 0.00 0.00 0.00 0.00 53.44 54.05 1odg n ALA 129 Cb 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 19.45 18.69 1odg n ALA 129 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1odg n LEU 130 N -4.05 0.04 -0.30 0.00 4.77 -1.24 -0.41 117.00 115.82 1odg n LEU 130 Ca 0.29 0.87 0.08 0.00 -0.03 0.00 0.00 56.01 57.22 1odg n LEU 130 Cb 1.14 -0.46 0.19 0.00 -2.33 0.00 0.00 43.42 41.96 1odg n LEU 130 CO 0.14 -0.46 0.79 0.74 -1.33 0.00 0.00 177.39 177.27 1odg h THR 131 N 0.00 0.18 -0.15 -5.08 2.02 -1.50 2.53 112.91 110.91 1odg h THR 131 Ca 0.00 -0.02 0.04 0.00 0.77 0.00 0.00 66.41 67.20 1odg h THR 131 Cb 0.00 0.12 -0.01 0.00 -1.74 0.00 0.00 68.15 66.53 1odg h THR 131 CO 0.00 0.01 0.11 -0.33 0.37 0.00 0.00 175.52 175.68 1odg h GLU 132 N 0.05 0.00 0.05 6.66 5.08 -1.42 0.69 114.58 125.69 1odg h GLU 132 Ca 0.48 0.00 -0.38 0.00 -1.00 0.00 0.00 59.36 58.46 1odg h GLU 132 Cb 0.88 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.08 1odg h GLU 132 CO -0.81 0.00 -2.28 -2.13 -1.00 0.00 0.00 179.01 172.79 1odg n ARG 133 N -4.38 0.69 -0.26 2.33 3.00 0.44 -3.81 116.66 114.67 1odg n ARG 133 Ca 0.00 0.19 -0.01 0.00 -0.00 0.00 0.00 57.85 58.03 1odg n ARG 133 Cb 0.24 -1.60 0.18 0.00 0.00 0.00 0.00 32.46 31.28 1odg n ARG 133 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.63 177.56 1odg h LEU 134 N 0.03 0.97 0.64 6.15 3.38 0.42 -2.73 115.31 124.16 1odg h LEU 134 Ca -0.51 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 57.37 1odg h LEU 134 Cb 1.97 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 42.48 1odg h LEU 134 CO -0.01 0.75 -0.35 -0.33 0.09 0.00 0.00 178.44 178.58 1odg h GLU 135 N 1.11 -0.88 -0.27 1.13 5.08 0.22 -0.38 114.58 120.59 1odg h GLU 135 Ca 0.29 0.06 0.08 0.00 -1.00 0.00 0.00 59.36 58.79 1odg h GLU 135 Cb -0.04 0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 1odg h GLU 135 CO -0.05 -0.59 0.56 1.05 -1.00 0.00 0.00 179.01 178.98 1odg h GLU 136 N -0.91 0.00 0.00 2.33 4.11 -1.64 -3.11 114.58 115.35 1odg h GLU 136 Ca -0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.34 1odg h GLU 136 Cb 0.71 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.96 1odg h GLU 136 CO 0.12 0.00 0.00 1.87 0.07 0.00 0.00 179.01 181.07 1odg n TRP 137 N -3.18 0.00 0.00 2.06 -0.00 -0.88 -3.81 117.44 111.63 1odg n TRP 137 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.55 1odg n TRP 137 Cb 0.68 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.99 1odg n TRP 137 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 177.69 176.80 1odg n ILE 138 N 0.00 0.00 -0.04 5.87 5.41 -0.20 -1.15 119.36 129.24 1odg n ILE 138 Ca 0.00 0.00 -0.01 0.00 1.00 0.00 0.00 62.75 63.74 1odg n ILE 138 Cb 0.00 0.00 -0.00 0.00 -0.71 0.00 0.00 39.64 38.93 1odg n ILE 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1odg n GLY 140 N 1.78 0.32 0.74 0.00 0.00 -0.30 -4.91 105.19 102.81 1odg n GLY 140 Ca -0.02 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.08 1odg n GLY 140 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1odg n GLU 141 N 1.08 -1.18 0.00 1.61 1.02 -1.18 -4.86 120.64 117.13 1odg n GLU 141 Ca 0.00 0.84 0.00 0.00 -0.02 0.00 0.00 57.16 57.98 1odg n GLU 141 Cb 0.06 -1.60 0.00 0.00 -0.02 0.00 0.00 31.44 29.88 1odg n GLU 141 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1odg n GLY 142 N -2.49 4.81 3.54 0.62 0.00 -1.26 -4.71 105.19 105.70 1odg n GLY 142 Ca -0.01 -1.10 -0.38 0.00 0.00 0.00 0.00 46.02 44.54 1odg n GLY 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1odg n ALA 143 N -1.94 -0.57 -1.54 4.61 0.00 -1.26 -4.87 120.51 114.93 1odg n ALA 143 Ca 0.00 -0.03 -0.39 0.00 0.00 0.00 0.00 53.44 53.02 1odg n ALA 143 Cb 0.00 -1.96 0.03 0.00 0.00 0.00 0.00 19.45 17.52 1odg n ALA 143 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1odg n SER 144 N -0.20 0.04 -3.32 0.00 7.64 -1.26 -4.80 113.62 111.72 1odg n SER 144 Ca 0.13 0.83 -0.08 0.00 1.01 0.00 0.00 58.87 60.76 1odg n SER 144 Cb 0.48 -1.28 0.01 0.00 -1.01 0.00 0.00 64.21 62.41 1odg n SER 144 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1odg s ALA 145 N -1.54 -0.94 0.04 -0.43 0.00 -0.85 -0.31 121.76 117.73 1odg s ALA 145 Ca 0.70 -0.57 0.06 0.00 0.00 0.00 0.00 51.96 52.16 1odg s ALA 145 Cb -0.47 0.75 -0.02 0.00 0.00 0.00 0.00 23.12 23.37 1odg s ALA 145 CO 0.53 -1.01 -0.19 1.14 0.00 0.00 0.00 175.76 176.23 1odg s GLN 146 N -2.98 1.26 -0.28 0.00 -2.07 0.06 -1.16 119.66 114.49 1odg s GLN 146 Ca 0.14 -0.86 -0.06 0.00 -1.82 0.00 0.00 55.36 52.75 1odg s GLN 146 Cb -0.05 -1.33 0.01 0.00 -1.09 0.00 0.00 33.01 30.54 1odg s GLN 146 CO 0.10 0.34 0.05 0.42 -1.32 0.00 0.00 175.29 174.87 1odg s ILE 147 N -0.78 3.77 0.37 3.63 1.01 0.57 -1.38 121.20 128.39 1odg s ILE 147 Ca 0.06 -0.69 0.00 0.00 0.00 0.00 0.00 60.65 60.02 1odg s ILE 147 Cb -0.08 -2.90 0.00 0.00 0.01 0.00 0.00 42.46 39.48 1odg s ILE 147 CO 0.01 0.15 0.00 -0.90 0.00 0.00 0.00 174.94 174.21 1odg n ASP 148 N 4.83 3.04 0.29 3.58 5.75 0.61 -2.08 116.55 132.57 1odg n ASP 148 Ca -0.15 -2.64 0.19 0.00 -0.01 0.00 0.00 54.79 52.17 1odg n ASP 148 Cb 0.48 0.26 1.00 0.00 -1.03 0.00 0.00 41.12 41.83 1odg n ASP 148 CO 0.00 0.00 0.00 0.74 -0.11 0.00 0.00 177.20 177.83 1odg h THR 149 N 1.19 0.00 -0.27 2.12 2.02 -1.87 -2.24 112.91 113.86 1odg h THR 149 Ca -0.31 0.00 -0.19 0.00 0.77 0.00 0.00 66.41 66.68 1odg h THR 149 Cb 0.94 0.81 -0.14 0.00 -1.74 0.00 0.00 68.15 68.03 1odg h THR 149 CO 0.52 0.00 -0.51 0.00 0.37 0.00 0.00 175.52 175.90 1odg n GLN 150 N -2.83 2.19 0.00 6.66 10.64 -1.26 -4.74 117.38 128.04 1odg n GLN 150 Ca -0.02 -3.53 0.00 0.00 -1.83 0.00 0.00 57.00 51.62 1odg n GLN 150 Cb 0.11 -1.84 0.00 0.00 -0.86 0.00 0.00 30.24 27.65 1odg n GLN 150 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1odg n GLY 151 N -1.01 0.49 2.87 2.61 0.00 -0.84 -5.04 105.19 104.28 1odg n GLY 151 Ca 0.28 -2.10 -0.14 0.00 0.00 0.00 0.00 46.02 44.06 1odg n GLY 151 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1odg s ILE 152 N -0.63 -0.05 0.23 -0.61 2.07 -1.26 -0.28 121.20 120.67 1odg s ILE 152 Ca 0.00 0.17 0.01 0.00 -1.41 0.00 0.00 60.65 59.42 1odg s ILE 152 Cb 0.00 -0.17 -0.05 0.00 0.13 0.00 0.00 42.46 42.38 1odg s ILE 152 CO 0.00 0.07 0.07 -1.00 -1.91 0.00 0.00 174.94 172.16 1odg s HIS 153 N 0.97 1.42 0.51 3.50 3.76 -0.48 -4.97 115.29 120.00 1odg s HIS 153 Ca -0.08 -1.13 -0.22 0.00 -0.15 0.00 0.00 55.06 53.48 1odg s HIS 153 Cb -0.10 -0.82 -0.08 0.00 1.11 0.00 0.00 32.58 32.69 1odg s HIS 153 CO -0.04 -0.30 1.03 1.28 -0.85 0.00 0.00 174.74 175.85 1odg n LEU 154 N -0.38 3.36 -4.65 0.89 4.77 -1.26 -0.76 117.00 118.97 1odg n LEU 154 Ca -0.02 0.93 -0.43 0.00 -0.03 0.00 0.00 56.01 56.46 1odg n LEU 154 Cb 0.65 -1.39 -0.02 0.00 -2.33 0.00 0.00 43.42 40.32 1odg n LEU 154 CO 0.36 -1.54 1.25 -0.22 -1.33 0.00 0.00 177.39 175.91 1odg s LEU 155 N -1.44 4.10 0.00 2.23 2.96 0.58 -4.44 118.68 122.67 1odg s LEU 155 Ca 0.69 1.77 0.00 0.00 -0.22 0.00 0.00 54.13 56.37 1odg s LEU 155 Cb -0.48 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 42.68 1odg s LEU 155 CO 0.52 -0.99 0.00 0.00 -1.32 0.00 0.00 176.35 174.57