#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3rap s ARG 2 N 0.00 3.64 -0.13 0.03 3.52 -1.26 -4.90 118.95 119.85 3rap s ARG 2 Ca 0.00 0.29 -0.08 0.00 -0.13 0.00 0.00 55.73 55.82 3rap s ARG 2 Cb 0.00 -2.40 -0.04 0.00 -1.56 0.00 0.00 34.95 30.95 3rap s ARG 2 CO 0.00 -0.11 0.15 -1.21 -0.81 0.00 0.00 175.30 173.31 3rap s GLU 3 N -4.32 3.56 -0.15 5.12 0.41 -1.26 -1.60 118.70 120.46 3rap s GLU 3 Ca 0.49 -0.12 -0.00 0.00 -0.41 0.00 0.00 54.97 54.92 3rap s GLU 3 Cb -0.10 -3.22 0.03 0.00 -1.78 0.00 0.00 34.13 29.06 3rap s GLU 3 CO 0.39 0.71 -0.08 0.71 -0.49 0.00 0.00 175.26 176.49 3rap s TYR 4 N -0.83 1.84 -0.28 1.61 2.02 0.23 -4.96 117.35 116.98 3rap s TYR 4 Ca 0.14 -1.09 -0.14 0.00 -0.37 0.00 0.00 57.07 55.61 3rap s TYR 4 Cb -0.12 -1.40 -0.04 0.00 -0.40 0.00 0.00 41.96 40.01 3rap s TYR 4 CO 0.04 -0.62 0.35 0.15 -1.57 0.00 0.00 175.55 173.90 3rap s LYS 5 N 1.59 3.97 -0.05 -0.62 1.02 -1.26 -0.95 119.74 123.44 3rap s LYS 5 Ca 0.02 -0.04 0.06 0.00 0.02 0.00 0.00 55.97 56.03 3rap s LYS 5 Cb -0.14 -3.67 -0.01 0.00 -0.52 0.00 0.00 37.83 33.49 3rap s LYS 5 CO -0.09 -0.29 -0.23 0.08 -0.92 0.00 0.00 175.35 173.90 3rap s VAL 6 N 2.03 1.90 -0.08 3.17 1.01 0.32 -0.62 120.40 128.15 3rap s VAL 6 Ca 0.14 -0.99 0.05 0.00 0.00 0.00 0.00 61.98 61.17 3rap s VAL 6 Cb -0.16 -1.61 -0.01 0.00 0.00 0.00 0.00 36.38 34.60 3rap s VAL 6 CO 0.10 0.53 -0.23 -0.69 0.00 0.00 0.00 175.10 174.81 3rap s VAL 7 N -0.20 2.19 -0.33 2.92 1.01 0.37 -0.51 120.40 125.86 3rap s VAL 7 Ca -0.01 -1.00 -0.10 0.00 0.00 0.00 0.00 61.98 60.87 3rap s VAL 7 Cb -0.12 -1.82 0.00 0.00 0.00 0.00 0.00 36.38 34.44 3rap s VAL 7 CO 0.03 0.56 0.17 -0.69 0.00 0.00 0.00 175.10 175.17 3rap s VAL 8 N -0.01 4.60 0.04 2.92 1.01 -0.08 -1.25 120.40 127.63 3rap s VAL 8 Ca -0.08 -0.55 0.08 0.00 0.00 0.00 0.00 61.98 61.43 3rap s VAL 8 Cb -0.15 -3.41 -0.03 0.00 0.00 0.00 0.00 36.38 32.79 3rap s VAL 8 CO 0.05 -0.02 -0.20 -0.76 0.00 0.00 0.00 175.10 174.17 3rap s LEU 9 N 1.60 2.50 0.00 3.92 1.43 0.52 -3.09 118.68 125.55 3rap s LEU 9 Ca 0.04 -0.47 0.00 0.00 -1.03 0.00 0.00 54.13 52.67 3rap s LEU 9 Cb -0.18 -1.46 0.00 0.00 0.03 0.00 0.00 46.19 44.59 3rap s LEU 9 CO 0.06 0.26 0.00 0.61 0.23 0.00 0.00 176.35 177.51 3rap n GLY 10 N 1.59 -2.41 3.77 -3.19 0.00 -1.26 -0.77 105.19 102.92 3rap n GLY 10 Ca -0.16 -1.40 -0.29 0.00 0.00 0.00 0.00 46.02 44.17 3rap n GLY 10 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3rap s SER 11 N -0.19 3.57 0.13 1.61 0.01 -1.26 -4.03 113.70 113.54 3rap s SER 11 Ca 0.00 1.09 -0.32 0.00 1.31 0.00 0.00 55.95 58.03 3rap s SER 11 Cb 0.00 -1.72 -0.12 0.00 0.21 0.00 0.00 66.02 64.39 3rap s SER 11 CO 0.00 -2.53 1.75 0.61 0.41 0.00 0.00 173.24 173.48 3rap n GLY 12 N -1.96 1.49 1.57 3.44 0.00 -1.12 -3.40 105.19 105.20 3rap n GLY 12 Ca 0.06 0.69 0.00 0.00 0.00 0.00 0.00 46.02 46.78 3rap n GLY 12 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3rap n GLY 13 N 3.99 0.60 0.08 -0.02 0.00 -1.26 -4.91 105.19 103.66 3rap n GLY 13 Ca 0.18 -0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.22 3rap n GLY 13 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3rap n VAL 14 N -2.78 0.58 0.00 1.61 0.24 -1.22 -4.92 118.33 111.84 3rap n VAL 14 Ca 0.00 -0.02 0.00 0.00 -2.04 0.00 0.00 64.34 62.28 3rap n VAL 14 Cb 0.00 -0.77 0.00 0.00 -1.47 0.00 0.00 33.84 31.60 3rap n VAL 14 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3rap n GLY 15 N 0.85 1.53 0.37 7.63 0.00 -1.26 -4.56 105.19 109.75 3rap n GLY 15 Ca 0.05 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.89 3rap n GLY 15 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3rap h LYS 16 N 0.00 -0.82 -0.91 1.61 1.57 -1.91 -1.01 116.57 115.10 3rap h LYS 16 Ca 0.00 0.06 0.06 0.00 -1.87 0.00 0.00 60.65 58.90 3rap h LYS 16 Cb 0.00 0.19 -0.06 0.00 0.08 0.00 0.00 32.23 32.43 3rap h LYS 16 CO 0.00 -0.55 0.57 0.77 -0.57 0.00 0.00 179.45 179.68 3rap h SER 17 N -0.85 0.91 -0.56 0.86 0.02 -1.97 -1.56 113.55 110.39 3rap h SER 17 Ca -0.08 0.02 -0.11 0.00 -0.84 0.00 0.00 61.79 60.78 3rap h SER 17 Cb 0.68 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 63.02 3rap h SER 17 CO 0.10 0.58 -0.09 0.00 -1.14 0.00 0.00 176.83 176.29 3rap h ALA 18 N 1.43 0.78 -0.24 3.77 0.00 -1.88 0.71 119.26 123.82 3rap h ALA 18 Ca 0.40 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3rap h ALA 18 Cb 0.18 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3rap h ALA 18 CO -0.18 0.68 0.10 -0.07 0.00 0.00 0.00 179.25 179.78 3rap h LEU 19 N 0.94 0.33 -0.08 0.00 3.38 -0.95 -0.71 115.31 118.22 3rap h LEU 19 Ca 0.15 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 3rap h LEU 19 Cb 0.66 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.32 3rap h LEU 19 CO 0.05 0.41 0.05 0.74 0.09 0.00 0.00 178.44 179.77 3rap h THR 20 N 0.24 1.05 -0.14 0.22 2.02 -0.86 -0.90 112.91 114.53 3rap h THR 20 Ca 0.08 -0.13 -0.10 0.00 0.77 0.00 0.00 66.41 67.03 3rap h THR 20 Cb 0.18 0.99 -0.01 0.00 -1.74 0.00 0.00 68.15 67.57 3rap h THR 20 CO -0.01 0.04 -0.36 0.58 0.37 0.00 0.00 175.52 176.15 3rap h VAL 21 N 0.07 1.29 -0.55 3.16 2.07 -0.83 0.64 116.25 122.11 3rap h VAL 21 Ca 0.03 -1.41 -0.03 0.00 0.82 0.00 0.00 66.70 66.10 3rap h VAL 21 Cb 0.03 1.57 -0.02 0.00 -1.52 0.00 0.00 31.29 31.35 3rap h VAL 21 CO -0.01 0.43 0.22 -0.61 0.02 0.00 0.00 177.57 177.62 3rap h GLN 22 N 0.26 0.82 0.17 1.57 5.75 -0.83 0.19 115.11 123.04 3rap h GLN 22 Ca 0.03 -0.15 -0.00 0.00 -0.15 0.00 0.00 58.65 58.38 3rap h GLN 22 Cb 0.76 -0.13 -0.01 0.00 1.07 0.00 0.00 27.48 29.17 3rap h GLN 22 CO 0.06 0.72 -0.12 0.35 -2.65 0.00 0.00 178.83 177.19 3rap h PHE 23 N 0.75 -0.30 0.02 3.99 3.57 -0.72 -0.25 116.94 124.00 3rap h PHE 23 Ca 0.18 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.68 3rap h PHE 23 Cb 0.21 0.11 0.00 0.00 2.79 0.00 0.00 35.95 39.06 3rap h PHE 23 CO 0.01 -0.18 -0.01 0.28 -2.23 0.00 0.00 178.31 176.18 3rap h VAL 24 N -0.29 1.48 0.00 1.41 2.07 -0.60 -3.38 116.25 116.94 3rap h VAL 24 Ca -0.01 -1.67 0.00 0.00 0.82 0.00 0.00 66.70 65.84 3rap h VAL 24 Cb 0.25 2.57 0.00 0.00 -1.52 0.00 0.00 31.29 32.59 3rap h VAL 24 CO 0.00 0.42 -1.28 0.41 0.02 0.00 0.00 177.57 177.14 3rap n THR 25 N -4.75 0.00 -2.58 2.57 -1.04 0.63 -5.01 114.28 104.10 3rap n THR 25 Ca -0.09 -0.27 -0.11 0.00 -2.04 0.00 0.00 64.05 61.54 3rap n THR 25 Cb 0.35 0.49 0.01 0.00 -1.82 0.00 0.00 70.33 69.36 3rap n THR 25 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3rap n GLY 26 N 1.55 0.06 3.23 3.41 0.00 -0.10 -5.01 105.19 108.33 3rap n GLY 26 Ca -0.01 -0.34 -0.28 0.00 0.00 0.00 0.00 46.02 45.39 3rap n GLY 26 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3rap s THR 27 N -2.81 1.73 -0.16 2.61 2.01 -1.25 -4.99 115.64 112.78 3rap s THR 27 Ca 0.13 -0.92 -0.19 0.00 0.31 0.00 0.00 61.69 61.02 3rap s THR 27 Cb -0.06 -1.45 -0.04 0.00 0.01 0.00 0.00 72.50 70.97 3rap s THR 27 CO 0.16 0.49 0.51 0.12 -0.69 0.00 0.00 174.62 175.21 3rap s PHE 28 N -0.38 3.44 -0.16 4.92 5.36 -1.26 -3.04 117.98 126.86 3rap s PHE 28 Ca 0.05 0.85 -0.12 0.00 -0.96 0.00 0.00 56.93 56.75 3rap s PHE 28 Cb -0.10 -2.63 -0.05 0.00 -0.34 0.00 0.00 43.02 39.91 3rap s PHE 28 CO 0.00 0.02 0.24 0.42 -1.46 0.00 0.00 175.22 174.45 3rap s ILE 29 N 1.16 5.34 -0.19 3.12 -1.09 -1.26 -4.96 121.20 123.32 3rap s ILE 29 Ca 0.26 0.44 0.09 0.00 -2.23 0.00 0.00 60.65 59.21 3rap s ILE 29 Cb -0.15 -3.57 -0.18 0.00 -1.58 0.00 0.00 42.46 36.97 3rap s ILE 29 CO 0.10 0.44 -0.05 -0.62 -1.23 0.00 0.00 174.94 173.58 3rap n GLU 30 N 3.28 0.92 -2.07 2.79 1.02 -1.26 -4.93 120.64 120.38 3rap n GLU 30 Ca -0.14 0.05 -0.39 0.00 -0.02 0.00 0.00 57.16 56.66 3rap n GLU 30 Cb 0.52 -1.44 -0.01 0.00 -0.02 0.00 0.00 31.44 30.50 3rap n GLU 30 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 3rap s LYS 31 N -2.42 4.00 -0.47 3.49 -2.85 -1.26 -4.99 119.74 115.25 3rap s LYS 31 Ca -0.18 2.15 -0.18 0.00 -1.00 0.00 0.00 55.97 56.75 3rap s LYS 31 Cb 0.06 -2.78 0.04 0.00 -2.06 0.00 0.00 37.83 33.10 3rap s LYS 31 CO 0.61 -0.46 0.54 -0.47 0.10 0.00 0.00 175.35 175.67 3rap s TYR 32 N -1.26 3.11 -0.40 1.78 5.04 -1.26 -5.02 117.35 119.34 3rap s TYR 32 Ca 0.56 -0.47 0.00 0.00 -2.44 0.00 0.00 57.07 54.72 3rap s TYR 32 Cb -0.38 -3.26 0.11 0.00 0.35 0.00 0.00 41.96 38.79 3rap s TYR 32 CO 0.49 -0.88 0.16 0.34 -1.34 0.00 0.00 175.55 174.32 3rap s ASP 33 N 2.30 5.02 0.10 4.32 2.15 -1.26 -5.09 116.67 124.20 3rap s ASP 33 Ca 0.14 -2.19 -0.36 0.00 0.43 0.00 0.00 52.55 50.57 3rap s ASP 33 Cb -0.18 -1.74 -0.16 0.00 -0.30 0.00 0.00 42.92 40.53 3rap s ASP 33 CO 0.13 -0.45 1.44 -2.65 -0.17 0.00 0.00 175.17 173.46 3rap n PRO 34 N 4.31 1.49 -2.79 4.34 -0.02 -1.26 -4.95 135.00 136.12 3rap n PRO 34 Ca 0.01 0.54 -0.38 0.00 -2.02 0.00 0.00 63.50 61.65 3rap n PRO 34 Cb 0.41 -2.23 -0.06 0.00 -0.02 0.00 0.00 33.50 31.60 3rap n PRO 34 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3rap s THR 35 N 0.77 4.17 -0.04 3.45 2.01 -1.26 -4.98 115.64 119.75 3rap s THR 35 Ca 0.83 1.91 -0.02 0.00 0.31 0.00 0.00 61.69 64.72 3rap s THR 35 Cb -0.86 -4.15 -0.01 0.00 0.01 0.00 0.00 72.50 67.49 3rap s THR 35 CO 0.44 0.32 -0.05 0.40 -0.69 0.00 0.00 174.62 175.04 3rap h ILE 36 N 2.88 0.00 -1.64 1.82 1.08 -1.91 -3.36 117.51 116.38 3rap h ILE 36 Ca -0.46 -0.30 0.07 0.00 -0.39 0.00 0.00 64.86 63.78 3rap h ILE 36 Cb 1.20 0.00 -0.26 0.00 -3.07 0.00 0.00 36.82 34.69 3rap h ILE 36 CO 0.66 0.00 0.36 -0.70 -0.69 0.00 0.00 178.15 177.78 3rap s GLU 37 N -1.35 0.50 -0.07 2.37 2.12 -1.26 -2.39 118.70 118.62 3rap s GLU 37 Ca -0.04 0.71 -0.17 0.00 0.36 0.00 0.00 54.97 55.84 3rap s GLU 37 Cb 0.01 0.17 0.04 0.00 0.26 0.00 0.00 34.13 34.61 3rap s GLU 37 CO 0.06 -0.08 0.40 -0.51 -0.54 0.00 0.00 175.26 174.59 3rap s ASP 38 N 0.83 -0.34 -0.04 -1.70 1.01 -0.98 -5.02 116.67 110.43 3rap s ASP 38 Ca -0.03 0.43 0.01 0.00 0.71 0.00 0.00 52.55 53.67 3rap s ASP 38 Cb -0.04 0.53 -0.03 0.00 1.01 0.00 0.00 42.92 44.38 3rap s ASP 38 CO -0.11 -0.37 -0.06 -0.36 0.21 0.00 0.00 175.17 174.49 3rap s PHE 39 N -0.78 2.95 0.11 4.23 0.40 -1.26 -0.89 117.98 122.75 3rap s PHE 39 Ca -0.09 0.02 0.07 0.00 -0.60 0.00 0.00 56.93 56.33 3rap s PHE 39 Cb -0.04 -1.68 -0.03 0.00 0.51 0.00 0.00 43.02 41.77 3rap s PHE 39 CO 0.04 0.36 -0.17 0.71 0.70 0.00 0.00 175.22 176.87 3rap s TYR 40 N -0.89 1.51 -0.02 0.36 1.51 0.08 -4.98 117.35 114.92 3rap s TYR 40 Ca 0.14 -0.48 0.06 0.00 -1.01 0.00 0.00 57.07 55.79 3rap s TYR 40 Cb -0.11 -0.81 -0.01 0.00 -0.11 0.00 0.00 41.96 40.91 3rap s TYR 40 CO 0.04 0.16 -0.20 0.50 -1.11 0.00 0.00 175.55 174.94 3rap s ARG 41 N -2.19 1.72 -0.26 -0.62 3.52 -1.26 -0.62 118.95 119.23 3rap s ARG 41 Ca 0.06 -0.72 -0.22 0.00 -0.13 0.00 0.00 55.73 54.72 3rap s ARG 41 Cb -0.08 -1.62 0.07 0.00 -1.56 0.00 0.00 34.95 31.76 3rap s ARG 41 CO 0.04 0.41 0.68 0.21 -0.81 0.00 0.00 175.30 175.82 3rap s LYS 42 N -0.39 0.77 -0.18 5.12 2.36 -0.34 -4.99 119.74 122.09 3rap s LYS 42 Ca 0.06 1.00 -0.11 0.00 -2.55 0.00 0.00 55.97 54.37 3rap s LYS 42 Cb -0.09 0.33 -0.05 0.00 -1.05 0.00 0.00 37.83 36.98 3rap s LYS 42 CO -0.00 -0.11 0.18 -1.21 1.55 0.00 0.00 175.35 175.76 3rap s GLU 43 N 0.64 4.12 0.08 4.03 2.02 -1.26 -0.88 118.70 127.45 3rap s GLU 43 Ca -0.02 -0.12 0.05 0.00 0.02 0.00 0.00 54.97 54.90 3rap s GLU 43 Cb -0.05 -3.39 -0.03 0.00 0.10 0.00 0.00 34.13 30.76 3rap s GLU 43 CO -0.03 0.34 -0.13 -1.50 0.02 0.00 0.00 175.26 173.95 3rap s ILE 44 N 0.21 1.08 -0.31 -1.63 2.07 -0.11 -4.95 121.20 117.55 3rap s ILE 44 Ca 0.11 -1.37 -0.18 0.00 -1.41 0.00 0.00 60.65 57.80 3rap s ILE 44 Cb -0.12 -1.12 -0.01 0.00 0.13 0.00 0.00 42.46 41.34 3rap s ILE 44 CO 0.00 -0.29 0.52 -1.61 -1.91 0.00 0.00 174.94 171.65 3rap s GLU 45 N -1.94 3.81 -0.21 3.50 0.41 -1.26 -0.40 118.70 122.61 3rap s GLU 45 Ca -0.01 0.04 -0.03 0.00 -0.41 0.00 0.00 54.97 54.56 3rap s GLU 45 Cb -0.09 -3.75 -0.00 0.00 -1.78 0.00 0.00 34.13 28.51 3rap s GLU 45 CO 0.02 -0.53 -0.07 0.08 -0.49 0.00 0.00 175.26 174.27 3rap s VAL 46 N 2.37 3.18 -1.35 2.63 1.01 0.34 -4.53 120.40 124.06 3rap s VAL 46 Ca 0.20 -0.56 -0.05 0.00 0.00 0.00 0.00 61.98 61.57 3rap s VAL 46 Cb -0.15 -2.43 -0.00 0.00 0.00 0.00 0.00 36.38 33.79 3rap s VAL 46 CO 0.12 0.44 0.50 0.47 0.00 0.00 0.00 175.10 176.63 3rap n ASP 47 N 4.72 -1.28 0.00 3.32 8.00 -1.26 -1.20 116.55 128.85 3rap n ASP 47 Ca -0.19 -1.01 0.00 0.00 0.71 0.00 0.00 54.79 54.30 3rap n ASP 47 Cb 0.51 -3.11 0.00 0.00 -0.02 0.00 0.00 41.12 38.50 3rap n ASP 47 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 3rap n SER 48 N -2.91 -2.19 -4.71 -2.24 7.64 -1.26 -4.97 113.62 102.97 3rap n SER 48 Ca -0.27 0.00 -0.38 0.00 1.01 0.00 0.00 58.87 59.23 3rap n SER 48 Cb 0.67 -2.00 -0.06 0.00 -1.01 0.00 0.00 64.21 61.80 3rap n SER 48 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 3rap s SER 49 N -1.22 6.60 0.21 6.43 0.15 -0.34 -5.01 113.70 120.53 3rap s SER 49 Ca 0.00 0.72 -0.30 0.00 0.70 0.00 0.00 55.95 57.06 3rap s SER 49 Cb 0.00 -2.26 -0.10 0.00 -1.71 0.00 0.00 66.02 61.95 3rap s SER 49 CO 0.00 -0.01 1.45 -2.16 1.20 0.00 0.00 173.24 173.72 3rap s PRO 50 N 0.76 4.27 -0.04 5.44 0.04 -1.26 -0.50 135.00 143.72 3rap s PRO 50 Ca 0.23 2.26 0.01 0.00 0.04 0.00 0.00 61.00 63.55 3rap s PRO 50 Cb -0.15 -3.14 0.02 0.00 0.04 0.00 0.00 34.50 31.27 3rap s PRO 50 CO 0.09 -0.45 -0.06 -1.12 0.04 0.00 0.00 177.00 175.50 3rap s SER 51 N 0.62 1.03 -0.14 6.66 0.01 0.47 -4.31 113.70 118.04 3rap s SER 51 Ca 0.62 -0.15 -0.04 0.00 1.31 0.00 0.00 55.95 57.69 3rap s SER 51 Cb -0.41 -0.44 -0.03 0.00 0.21 0.00 0.00 66.02 65.35 3rap s SER 51 CO 0.38 -0.02 -0.01 0.54 0.41 0.00 0.00 173.24 174.54 3rap s VAL 52 N 0.69 4.12 -0.17 3.43 0.11 -0.63 -0.94 120.40 127.01 3rap s VAL 52 Ca -0.10 -0.29 -0.07 0.00 -2.93 0.00 0.00 61.98 58.59 3rap s VAL 52 Cb -0.13 -2.79 -0.04 0.00 -1.53 0.00 0.00 36.38 31.89 3rap s VAL 52 CO 0.01 0.52 0.06 -0.76 -3.33 0.00 0.00 175.10 171.60 3rap s LEU 53 N 0.04 3.85 -0.37 2.54 1.02 -0.05 -0.60 118.68 125.11 3rap s LEU 53 Ca 0.02 0.12 -0.06 0.00 0.02 0.00 0.00 54.13 54.23 3rap s LEU 53 Cb -0.13 -1.96 0.07 0.00 0.02 0.00 0.00 46.19 44.18 3rap s LEU 53 CO 0.02 0.21 0.15 -0.70 0.02 0.00 0.00 176.35 176.05 3rap s GLU 54 N 0.17 2.44 -0.21 1.70 2.12 -0.12 -1.20 118.70 123.59 3rap s GLU 54 Ca 0.05 -1.42 -0.08 0.00 0.36 0.00 0.00 54.97 53.87 3rap s GLU 54 Cb -0.12 -3.53 -0.04 0.00 0.26 0.00 0.00 34.13 30.70 3rap s GLU 54 CO 0.00 -0.83 0.09 0.42 -0.54 0.00 0.00 175.26 174.40 3rap s ILE 55 N 1.32 4.83 -0.38 -3.70 1.01 0.21 -0.52 121.20 123.98 3rap s ILE 55 Ca 0.01 -0.01 -0.12 0.00 0.00 0.00 0.00 60.65 60.53 3rap s ILE 55 Cb -0.21 -3.22 0.02 0.00 0.01 0.00 0.00 42.46 39.06 3rap s ILE 55 CO 0.00 0.40 0.23 -0.22 0.00 0.00 0.00 174.94 175.35 3rap s LEU 56 N 0.87 4.75 -0.23 2.97 2.96 0.34 -0.75 118.68 129.59 3rap s LEU 56 Ca 0.05 -0.89 -0.15 0.00 -0.22 0.00 0.00 54.13 52.92 3rap s LEU 56 Cb -0.13 -2.06 -0.04 0.00 0.50 0.00 0.00 46.19 44.45 3rap s LEU 56 CO 0.03 -0.38 0.36 -0.62 -1.32 0.00 0.00 176.35 174.42 3rap s ASP 57 N 1.60 6.34 0.40 3.68 2.15 -0.07 -0.90 116.67 129.87 3rap s ASP 57 Ca 0.03 0.40 0.08 0.00 0.43 0.00 0.00 52.55 53.49 3rap s ASP 57 Cb -0.19 -2.21 -0.03 0.00 -0.30 0.00 0.00 42.92 40.19 3rap s ASP 57 CO 0.08 -0.09 0.32 0.42 -0.17 0.00 0.00 175.17 175.72 3rap s THR 58 N 1.51 2.75 0.43 1.71 -4.23 -1.18 -2.33 115.64 114.31 3rap s THR 58 Ca 0.16 -1.43 -0.23 0.00 -1.18 0.00 0.00 61.69 59.02 3rap s THR 58 Cb -0.15 -3.02 -0.09 0.00 1.34 0.00 0.00 72.50 70.58 3rap s THR 58 CO 0.08 -0.04 1.06 0.00 -0.54 0.00 0.00 174.62 175.19 3rap s ALA 59 N -2.47 3.01 -0.06 3.99 0.00 -1.00 -4.77 121.76 120.45 3rap s ALA 59 Ca 0.45 0.71 0.06 0.00 0.00 0.00 0.00 51.96 53.18 3rap s ALA 59 Cb -0.02 -3.28 -0.08 0.00 0.00 0.00 0.00 23.12 19.73 3rap s ALA 59 CO 0.26 -0.31 0.03 0.41 0.00 0.00 0.00 175.76 176.15 3rap n GLY 60 N 0.21 -0.32 3.86 0.00 0.00 -1.26 -4.76 105.19 102.92 3rap n GLY 60 Ca 0.06 -0.11 -0.37 0.00 0.00 0.00 0.00 46.02 45.60 3rap n GLY 60 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3rap s THR 61 N -2.17 5.21 -0.66 2.61 -4.23 -1.26 -2.80 115.64 112.34 3rap s THR 61 Ca -0.03 0.56 -0.01 0.00 -1.18 0.00 0.00 61.69 61.02 3rap s THR 61 Cb 0.02 -3.60 -0.02 0.00 1.34 0.00 0.00 72.50 70.25 3rap s THR 61 CO 0.27 0.55 0.60 -0.62 -0.54 0.00 0.00 174.62 174.88 3rap n GLU 62 N 1.73 -1.26 0.00 3.99 1.02 -1.26 -4.95 120.64 119.91 3rap n GLU 62 Ca -0.15 1.11 0.00 0.00 -0.02 0.00 0.00 57.16 58.10 3rap n GLU 62 Cb 0.53 -4.89 0.00 0.00 -0.02 0.00 0.00 31.44 27.06 3rap n GLU 62 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3rap n GLN 63 N -1.99 0.00 -2.62 3.49 0.00 -1.26 -4.96 117.38 110.04 3rap n GLN 63 Ca -0.02 0.00 -0.06 0.00 0.00 0.00 0.00 57.00 56.93 3rap n GLN 63 Cb 0.53 0.00 0.01 0.00 0.00 0.00 0.00 30.24 30.78 3rap n GLN 63 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 3rap n PHE 64 N -0.62 -3.02 -0.34 2.61 3.01 -1.26 -4.67 117.46 113.17 3rap n PHE 64 Ca 0.00 1.24 0.14 0.00 1.01 0.00 0.00 57.45 59.84 3rap n PHE 64 Cb 0.00 -3.68 0.35 0.00 -0.01 0.00 0.00 39.48 36.14 3rap n PHE 64 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3rap h ALA 65 N 1.83 1.76 -0.47 4.37 0.00 -1.99 -1.68 119.26 123.09 3rap h ALA 65 Ca 0.00 0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 3rap h ALA 65 Cb 0.71 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 3rap h ALA 65 CO 0.16 -0.13 -0.06 0.77 0.00 0.00 0.00 179.25 179.98 3rap h SER 66 N 0.70 0.87 -0.64 0.00 0.02 -1.99 0.73 113.55 113.25 3rap h SER 66 Ca 0.57 -0.34 -0.08 0.00 -0.84 0.00 0.00 61.79 61.10 3rap h SER 66 Cb 0.97 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 63.25 3rap h SER 66 CO -0.36 1.00 0.09 0.24 -1.14 0.00 0.00 176.83 176.66 3rap h MET 67 N 0.72 1.08 -0.75 3.45 2.86 -1.68 -1.82 114.93 118.79 3rap h MET 67 Ca 0.13 -0.30 -0.05 0.00 -2.06 0.00 0.00 59.70 57.42 3rap h MET 67 Cb 0.59 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 32.09 3rap h MET 67 CO 0.04 1.00 0.28 -0.09 1.06 0.00 0.00 176.91 179.20 3rap h ARG 68 N 1.01 1.12 -0.60 1.72 2.43 -1.10 0.02 114.38 118.99 3rap h ARG 68 Ca 0.20 -0.21 -0.03 0.00 -0.81 0.00 0.00 59.98 59.13 3rap h ARG 68 Cb 0.46 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 29.80 3rap h ARG 68 CO 0.02 0.92 0.26 -0.44 -1.51 0.00 0.00 179.97 179.21 3rap h ASP 69 N 1.09 0.78 -0.15 -3.80 3.32 -0.39 -0.74 116.42 116.54 3rap h ASP 69 Ca 0.25 -0.09 -0.05 0.00 0.02 0.00 0.00 57.03 57.16 3rap h ASP 69 Cb 0.23 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.58 3rap h ASP 69 CO -0.02 0.69 -0.09 -0.07 -1.72 0.00 0.00 179.24 178.02 3rap h LEU 70 N 0.85 0.34 -0.60 1.55 3.38 -0.54 -0.89 115.31 119.40 3rap h LEU 70 Ca 0.21 -0.44 0.11 0.00 0.09 0.00 0.00 57.88 57.84 3rap h LEU 70 Cb 0.14 -0.09 -0.08 0.00 0.09 0.00 0.00 40.66 40.71 3rap h LEU 70 CO -0.02 0.70 0.17 1.88 0.09 0.00 0.00 178.44 181.26 3rap h TYR 71 N -0.03 0.28 -0.26 1.13 0.05 -0.84 -0.99 116.97 116.32 3rap h TYR 71 Ca 0.03 0.03 -0.03 0.00 0.05 0.00 0.00 58.73 58.81 3rap h TYR 71 Cb 0.59 -0.03 -0.01 0.00 1.01 0.00 0.00 36.73 38.28 3rap h TYR 71 CO 0.07 0.02 0.04 0.82 -1.05 0.00 0.00 178.16 178.06 3rap h ILE 72 N 0.32 1.23 -0.91 -2.88 2.04 -1.07 -3.13 117.51 113.10 3rap h ILE 72 Ca 0.31 -0.78 0.18 0.00 1.00 0.00 0.00 64.86 65.58 3rap h ILE 72 Cb 0.44 1.25 -0.11 0.00 -0.74 0.00 0.00 36.82 37.66 3rap h ILE 72 CO -0.36 0.25 0.49 0.50 0.00 0.00 0.00 178.15 179.02 3rap h LYS 73 N 0.24 0.59 0.00 2.37 3.64 0.21 -0.47 116.57 123.14 3rap h LYS 73 Ca 0.08 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 3rap h LYS 73 Cb 0.33 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 3rap h LYS 73 CO 0.01 0.39 -0.04 -1.71 -2.27 0.00 0.00 179.45 175.82 3rap n ASN 74 N -4.88 0.16 -4.89 4.20 5.15 -0.99 -4.89 115.26 109.11 3rap n ASN 74 Ca 0.21 0.45 -0.30 0.00 -0.60 0.00 0.00 54.58 54.34 3rap n ASN 74 Cb 0.55 -0.48 -0.04 0.00 -0.53 0.00 0.00 39.78 39.28 3rap n ASN 74 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 3rap s GLY 75 N -3.09 2.04 -0.01 8.20 0.00 -0.19 -4.89 107.32 109.39 3rap s GLY 75 Ca 0.13 -0.93 0.09 0.00 0.00 0.00 0.00 44.72 44.02 3rap s GLY 75 CO 0.55 -0.92 0.28 -1.06 0.00 0.00 0.00 173.10 171.96 3rap n GLN 76 N 0.11 1.81 -3.89 2.90 6.02 0.21 -4.99 117.38 119.54 3rap n GLN 76 Ca -0.06 -0.05 -0.11 0.00 -0.01 0.00 0.00 57.00 56.77 3rap n GLN 76 Cb 0.52 -1.10 -0.12 0.00 1.02 0.00 0.00 30.24 30.55 3rap n GLN 76 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 3rap s GLY 77 N -2.58 0.06 -0.03 1.08 0.00 -0.50 -4.32 107.32 101.02 3rap s GLY 77 Ca -0.01 -0.12 0.02 0.00 0.00 0.00 0.00 44.72 44.62 3rap s GLY 77 CO 0.39 -0.17 -0.09 -1.36 0.00 0.00 0.00 173.10 171.87 3rap s PHE 78 N -0.63 0.96 -0.26 1.90 0.40 -0.07 -0.48 117.98 119.80 3rap s PHE 78 Ca -0.07 -0.25 -0.03 0.00 -0.60 0.00 0.00 56.93 55.99 3rap s PHE 78 Cb -0.04 -0.69 0.02 0.00 0.51 0.00 0.00 43.02 42.82 3rap s PHE 78 CO -0.00 -0.11 -0.03 0.42 0.70 0.00 0.00 175.22 176.19 3rap s ILE 79 N 0.25 3.08 -0.35 0.64 1.01 -0.38 -1.76 121.20 123.69 3rap s ILE 79 Ca -0.04 -0.96 -0.12 0.00 0.00 0.00 0.00 60.65 59.52 3rap s ILE 79 Cb -0.09 -2.57 -0.00 0.00 0.01 0.00 0.00 42.46 39.80 3rap s ILE 79 CO 0.01 0.17 0.23 -0.76 0.00 0.00 0.00 174.94 174.59 3rap s LEU 80 N 1.36 4.55 -0.11 2.97 1.02 -0.66 -0.36 118.68 127.45 3rap s LEU 80 Ca 0.01 -0.58 -0.02 0.00 0.02 0.00 0.00 54.13 53.55 3rap s LEU 80 Cb -0.17 -2.10 -0.03 0.00 0.02 0.00 0.00 46.19 43.91 3rap s LEU 80 CO -0.03 -0.28 -0.03 -0.69 0.02 0.00 0.00 176.35 175.35 3rap s VAL 81 N 1.68 4.04 0.27 -1.59 1.01 0.05 -0.92 120.40 124.94 3rap s VAL 81 Ca 0.05 -0.33 0.07 0.00 0.00 0.00 0.00 61.98 61.77 3rap s VAL 81 Cb -0.18 -2.72 -0.06 0.00 0.00 0.00 0.00 36.38 33.43 3rap s VAL 81 CO 0.09 0.56 -0.07 -0.72 0.00 0.00 0.00 175.10 174.95 3rap s TYR 82 N -0.35 1.95 -0.25 5.22 1.13 -0.09 -4.26 117.35 120.71 3rap s TYR 82 Ca 0.06 -0.66 -0.13 0.00 -1.41 0.00 0.00 57.07 54.93 3rap s TYR 82 Cb -0.12 -1.08 -0.04 0.00 -1.10 0.00 0.00 41.96 39.61 3rap s TYR 82 CO 0.02 0.31 0.27 0.45 -2.51 0.00 0.00 175.55 174.09 3rap s SER 83 N -3.44 6.20 0.31 -0.18 0.15 -1.26 -0.45 113.70 115.03 3rap s SER 83 Ca 0.29 0.22 0.23 0.00 0.70 0.00 0.00 55.95 57.39 3rap s SER 83 Cb 0.03 -2.16 1.13 0.00 -1.71 0.00 0.00 66.02 63.31 3rap s SER 83 CO 0.12 -0.05 1.70 0.00 1.20 0.00 0.00 173.24 176.21 3rap n LEU 84 N 4.72 0.64 -0.93 3.45 -0.00 -0.51 -0.93 117.00 123.44 3rap n LEU 84 Ca -0.12 0.73 0.09 0.00 -0.00 0.00 0.00 56.01 56.71 3rap n LEU 84 Cb 0.51 -0.74 0.24 0.00 -0.00 0.00 0.00 43.42 43.44 3rap n LEU 84 CO 0.36 -0.81 0.70 1.33 -0.00 0.00 0.00 177.39 178.97 3rap n VAL 85 N -2.29 0.63 -3.64 1.47 0.24 -1.26 -0.46 118.33 113.03 3rap n VAL 85 Ca -0.00 -0.66 -0.29 0.00 -2.04 0.00 0.00 64.34 61.34 3rap n VAL 85 Cb 0.12 0.39 -0.15 0.00 -1.47 0.00 0.00 33.84 32.73 3rap n VAL 85 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 3rap s ASN 86 N -1.08 3.78 0.29 -1.34 3.84 -0.11 -4.60 114.94 115.72 3rap s ASN 86 Ca 0.34 -1.47 0.01 0.00 0.21 0.00 0.00 52.86 51.95 3rap s ASN 86 Cb 0.18 -0.61 0.52 0.00 -0.55 0.00 0.00 41.25 40.80 3rap s ASN 86 CO 0.24 -0.43 1.88 -0.61 -2.79 0.00 0.00 177.10 175.40 3rap h GLN 87 N 8.25 1.01 -0.15 0.43 -0.00 -1.84 -1.82 115.11 120.98 3rap h GLN 87 Ca -0.17 -0.06 -0.09 0.00 -0.00 0.00 0.00 58.65 58.33 3rap h GLN 87 Cb 1.01 -0.23 -0.01 0.00 0.00 0.00 0.00 27.48 28.25 3rap h GLN 87 CO 0.46 0.67 -0.31 0.37 0.00 0.00 0.00 178.83 180.01 3rap h GLN 88 N 1.04 0.30 0.00 1.69 5.75 -1.94 -1.70 115.11 120.25 3rap h GLN 88 Ca 0.43 -0.12 -0.04 0.00 -0.15 0.00 0.00 58.65 58.77 3rap h GLN 88 Cb 0.30 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.82 3rap h GLN 88 CO -0.19 0.59 -0.21 0.66 -2.65 0.00 0.00 178.83 177.03 3rap h SER 89 N 0.26 0.00 -0.04 -0.69 4.64 -1.64 0.25 113.55 116.33 3rap h SER 89 Ca 0.04 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.20 3rap h SER 89 Cb 0.69 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.79 3rap h SER 89 CO 0.05 0.21 -0.58 0.15 -0.87 0.00 0.00 176.83 175.79 3rap h PHE 90 N 0.00 0.67 -0.54 4.77 3.57 -1.28 -2.72 116.94 121.40 3rap h PHE 90 Ca -0.00 -0.33 -0.08 0.00 3.53 0.00 0.00 57.97 61.09 3rap h PHE 90 Cb 0.45 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 39.08 3rap h PHE 90 CO 0.00 1.13 0.03 0.37 -2.23 0.00 0.00 178.31 177.61 3rap h GLN 91 N 0.01 0.90 -0.47 1.11 4.15 -1.06 -2.53 115.11 117.23 3rap h GLN 91 Ca -0.06 -0.25 0.10 0.00 0.77 0.00 0.00 58.65 59.22 3rap h GLN 91 Cb 1.26 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 28.82 3rap h GLN 91 CO 0.12 0.88 0.32 -0.44 -1.93 0.00 0.00 178.83 177.78 3rap h ASP 92 N 0.84 0.15 1.11 -0.69 3.32 -0.96 -1.94 116.42 118.25 3rap h ASP 92 Ca 0.16 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.13 3rap h ASP 92 Cb 0.46 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.97 3rap h ASP 92 CO 0.02 0.09 -0.43 -0.29 -1.72 0.00 0.00 179.24 176.91 3rap h ILE 93 N 0.17 0.86 -0.84 0.35 6.09 -1.12 -3.37 117.51 119.65 3rap h ILE 93 Ca 0.22 -1.80 -0.01 0.00 -1.37 0.00 0.00 64.86 61.90 3rap h ILE 93 Cb 0.65 2.13 -0.04 0.00 0.47 0.00 0.00 36.82 40.02 3rap h ILE 93 CO -0.03 0.42 0.49 0.11 -3.07 0.00 0.00 178.15 176.07 3rap h LYS 94 N 0.00 1.14 0.00 2.19 1.57 -1.33 -0.60 116.57 119.55 3rap h LYS 94 Ca -0.00 -0.11 -0.05 0.00 -1.87 0.00 0.00 60.65 58.62 3rap h LYS 94 Cb 1.09 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 33.16 3rap h LYS 94 CO 0.06 0.81 -0.22 -1.35 -0.57 0.00 0.00 179.45 178.18 3rap h PRO 95 N 1.16 0.00 -0.84 3.15 0.11 -1.76 -3.38 132.00 130.44 3rap h PRO 95 Ca 0.30 0.00 0.04 0.00 0.11 0.00 0.00 66.00 66.45 3rap h PRO 95 Cb -0.03 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 31.03 3rap h PRO 95 CO -0.05 0.22 0.54 1.98 -0.21 0.00 0.00 178.00 180.47 3rap h MET 96 N 0.00 1.00 -0.52 1.05 4.05 -1.30 -1.10 114.93 118.10 3rap h MET 96 Ca -0.00 -0.06 -0.08 0.00 -0.28 0.00 0.00 59.70 59.28 3rap h MET 96 Cb 0.65 -0.22 -0.02 0.00 -0.80 0.00 0.00 31.60 31.20 3rap h MET 96 CO 0.03 0.66 -0.00 -0.09 0.23 0.00 0.00 176.91 177.73 3rap h ARG 97 N 1.03 0.89 -0.72 0.39 2.43 -1.74 -1.48 114.38 115.18 3rap h ARG 97 Ca 0.34 -0.26 -0.04 0.00 -0.81 0.00 0.00 59.98 59.22 3rap h ARG 97 Cb 0.04 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.47 3rap h ARG 97 CO -0.13 0.89 0.29 -0.44 -1.51 0.00 0.00 179.97 179.07 3rap h ASP 98 N 0.82 0.99 -0.65 -3.80 3.32 -1.47 -1.49 116.42 114.14 3rap h ASP 98 Ca 0.15 -0.17 0.06 0.00 0.02 0.00 0.00 57.03 57.09 3rap h ASP 98 Cb 0.49 -0.26 -0.05 0.00 0.22 0.00 0.00 39.33 39.74 3rap h ASP 98 CO 0.02 0.89 0.36 -0.61 -1.72 0.00 0.00 179.24 178.18 3rap h GLN 99 N 1.02 0.65 -0.33 3.56 4.15 -1.10 -1.97 115.11 121.08 3rap h GLN 99 Ca 0.24 -0.04 0.06 0.00 0.77 0.00 0.00 58.65 59.68 3rap h GLN 99 Cb 0.21 -0.15 -0.06 0.00 0.21 0.00 0.00 27.48 27.69 3rap h GLN 99 CO -0.02 0.43 -0.03 0.82 -1.93 0.00 0.00 178.83 178.10 3rap h ILE 100 N 0.67 0.72 -0.65 2.39 2.04 -0.31 -1.58 117.51 120.81 3rap h ILE 100 Ca 0.29 -0.02 -0.03 0.00 1.00 0.00 0.00 64.86 66.09 3rap h ILE 100 Cb 0.17 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 36.88 3rap h ILE 100 CO -0.17 0.01 0.28 0.40 0.00 0.00 0.00 178.15 178.66 3rap h ILE 101 N 0.06 1.23 -0.20 -0.67 2.04 -0.96 -1.07 117.51 117.94 3rap h ILE 101 Ca 0.16 -0.70 0.04 0.00 1.00 0.00 0.00 64.86 65.36 3rap h ILE 101 Cb 0.23 0.49 -0.04 0.00 -0.74 0.00 0.00 36.82 36.76 3rap h ILE 101 CO -0.30 0.28 -0.05 -0.09 0.00 0.00 0.00 178.15 178.00 3rap h ARG 102 N 0.90 0.00 -0.19 2.37 2.43 -0.97 0.70 114.38 119.62 3rap h ARG 102 Ca 0.22 -0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.33 3rap h ARG 102 Cb 0.18 -0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.72 3rap h ARG 102 CO -0.02 0.00 -0.10 0.28 -1.51 0.00 0.00 179.97 178.62 3rap h VAL 103 N 0.00 1.31 0.00 0.20 2.07 -1.10 -3.21 116.25 115.53 3rap h VAL 103 Ca 0.10 -1.16 -0.05 0.00 0.82 0.00 0.00 66.70 66.41 3rap h VAL 103 Cb 0.14 1.68 -0.01 0.00 -1.52 0.00 0.00 31.29 31.59 3rap h VAL 103 CO -0.20 0.35 -0.21 0.11 0.02 0.00 0.00 177.57 177.63 3rap h LYS 104 N 0.08 0.00 0.00 1.57 6.56 -0.78 -3.47 116.57 120.53 3rap h LYS 104 Ca 0.04 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.63 3rap h LYS 104 Cb 0.59 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.25 3rap h LYS 104 CO 0.03 0.21 0.00 0.54 -2.06 0.00 0.00 179.45 178.17 3rap n ARG 105 N -3.91 0.00 -4.45 3.15 3.00 0.20 -4.97 116.66 109.68 3rap n ARG 105 Ca -0.02 0.00 -0.35 0.00 -0.01 0.00 0.00 57.85 57.48 3rap n ARG 105 Cb 0.30 -3.73 -0.10 0.00 0.00 0.00 0.00 32.46 28.93 3rap n ARG 105 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.63 179.15 3rap s TYR 106 N -1.24 3.08 0.23 -1.55 1.13 -1.26 -5.04 117.35 112.70 3rap s TYR 106 Ca 0.00 0.12 -0.01 0.00 -1.41 0.00 0.00 57.07 55.77 3rap s TYR 106 Cb 0.00 -1.77 0.23 0.00 -1.10 0.00 0.00 41.96 39.32 3rap s TYR 106 CO 0.00 0.40 1.60 0.93 -2.51 0.00 0.00 175.55 175.97 3rap h GLU 107 N 5.27 0.55 -2.37 -3.49 4.39 -1.93 -3.37 114.58 113.63 3rap h GLU 107 Ca -0.49 -0.28 -0.80 0.00 0.34 0.00 0.00 59.36 58.14 3rap h GLU 107 Cb 1.19 0.00 -0.24 0.00 -0.10 0.00 0.00 28.75 29.60 3rap h GLU 107 CO 0.54 0.86 1.31 1.63 -1.16 0.00 0.00 179.01 182.19 3rap n LYS 108 N -4.03 5.22 -2.61 2.33 5.02 -1.26 -5.00 118.16 117.83 3rap n LYS 108 Ca -0.02 -4.41 -0.41 0.00 -2.02 0.00 0.00 58.31 51.45 3rap n LYS 108 Cb 0.51 -2.51 -0.04 0.00 -0.02 0.00 0.00 35.03 32.97 3rap n LYS 108 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3rap s VAL 109 N -3.58 4.28 -0.04 -0.18 0.11 -1.26 -4.83 120.40 114.90 3rap s VAL 109 Ca 0.42 1.84 -0.30 0.00 -2.93 0.00 0.00 61.98 61.01 3rap s VAL 109 Cb 0.18 -4.17 -0.06 0.00 -1.53 0.00 0.00 36.38 30.80 3rap s VAL 109 CO -0.11 0.25 1.73 -2.84 -3.33 0.00 0.00 175.10 170.80 3rap s PRO 110 N 0.18 4.14 0.02 1.54 0.02 -1.26 -5.00 135.00 134.64 3rap s PRO 110 Ca 0.50 2.26 0.01 0.00 0.02 0.00 0.00 61.00 63.79 3rap s PRO 110 Cb -0.26 -4.03 -0.01 0.00 0.02 0.00 0.00 34.50 30.22 3rap s PRO 110 CO 0.31 -0.91 -0.04 0.08 -0.33 0.00 0.00 177.00 176.11 3rap s VAL 111 N 4.24 0.28 0.02 3.83 1.01 -1.26 -0.89 120.40 127.63 3rap s VAL 111 Ca 0.77 -0.58 0.04 0.00 0.00 0.00 0.00 61.98 62.21 3rap s VAL 111 Cb -0.35 -0.33 -0.02 0.00 0.00 0.00 0.00 36.38 35.69 3rap s VAL 111 CO 0.32 -0.20 -0.13 -0.63 0.00 0.00 0.00 175.10 174.46 3rap s ILE 112 N -0.77 1.04 -0.21 2.22 1.01 -0.72 -4.27 121.20 119.50 3rap s ILE 112 Ca -0.06 -0.79 -0.10 0.00 0.00 0.00 0.00 60.65 59.70 3rap s ILE 112 Cb -0.06 -0.92 -0.05 0.00 0.01 0.00 0.00 42.46 41.45 3rap s ILE 112 CO -0.00 0.12 0.14 -0.22 0.00 0.00 0.00 174.94 174.98 3rap s LEU 113 N -0.76 4.18 -0.11 2.97 2.96 -0.81 -1.65 118.68 125.46 3rap s LEU 113 Ca 0.03 0.20 0.01 0.00 -0.22 0.00 0.00 54.13 54.15 3rap s LEU 113 Cb -0.06 -2.09 0.02 0.00 0.50 0.00 0.00 46.19 44.55 3rap s LEU 113 CO 0.00 0.15 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.35 3rap s VAL 114 N 0.52 1.46 -0.42 1.68 1.01 -0.10 -1.37 120.40 123.19 3rap s VAL 114 Ca 0.08 -0.61 -0.17 0.00 0.00 0.00 0.00 61.98 61.28 3rap s VAL 114 Cb -0.12 -1.35 0.02 0.00 0.00 0.00 0.00 36.38 34.94 3rap s VAL 114 CO -0.00 0.43 0.43 -0.83 0.00 0.00 0.00 175.10 175.13 3rap s GLY 115 N 1.08 1.89 0.43 4.51 0.00 0.09 -0.91 107.32 114.41 3rap s GLY 115 Ca -0.05 -1.49 0.03 0.00 0.00 0.00 0.00 44.72 43.21 3rap s GLY 115 CO -0.03 1.15 0.62 0.21 0.00 0.00 0.00 173.10 175.05 3rap s ASN 116 N 1.80 5.80 0.00 1.64 2.47 0.40 -1.06 114.94 126.00 3rap s ASN 116 Ca 0.12 0.08 0.00 0.00 0.42 0.00 0.00 52.86 53.48 3rap s ASN 116 Cb -0.17 -1.33 0.00 0.00 -1.45 0.00 0.00 41.25 38.30 3rap s ASN 116 CO 0.13 -0.67 0.00 0.29 -3.72 0.00 0.00 177.10 173.13 3rap n LYS 117 N -1.97 0.00 0.33 0.43 5.02 -0.38 -1.43 118.16 120.16 3rap n LYS 117 Ca 0.02 0.00 0.22 0.00 -2.02 0.00 0.00 58.31 56.53 3rap n LYS 117 Cb 0.58 -2.87 1.13 0.00 -0.02 0.00 0.00 35.03 33.84 3rap n LYS 117 CO 0.00 0.00 0.00 -0.24 -0.52 0.00 0.00 177.40 176.64 3rap h VAL 118 N 0.00 0.00 0.00 -0.18 3.04 -1.42 0.13 116.25 117.81 3rap h VAL 118 Ca 0.00 -0.10 -0.02 0.00 -1.01 0.00 0.00 66.70 65.57 3rap h VAL 118 Cb 0.94 1.10 -0.00 0.00 -2.01 0.00 0.00 31.29 31.32 3rap h VAL 118 CO 0.00 0.00 -0.09 -2.24 -1.01 0.00 0.00 177.57 174.23 3rap h ASP 119 N 0.00 0.00 -0.83 3.17 2.03 -1.94 -2.84 116.42 116.02 3rap h ASP 119 Ca 0.00 0.00 -0.35 0.00 -0.73 0.00 0.00 57.03 55.95 3rap h ASP 119 Cb 0.10 0.00 -0.21 0.00 -0.83 0.00 0.00 39.33 38.39 3rap h ASP 119 CO 0.00 0.09 0.44 0.18 -1.03 0.00 0.00 179.24 178.92 3rap n LEU 120 N -3.49 6.23 0.13 0.15 4.77 0.03 -4.68 117.00 120.14 3rap n LEU 120 Ca -0.02 -3.28 0.08 0.00 -0.03 0.00 0.00 56.01 52.76 3rap n LEU 120 Cb 0.23 -0.78 0.44 0.00 -2.33 0.00 0.00 43.42 40.99 3rap n LEU 120 CO 0.29 0.90 0.76 1.21 -1.33 0.00 0.00 177.39 179.22 3rap n GLU 121 N -0.57 0.10 0.24 3.23 2.13 -1.07 -1.19 120.64 123.51 3rap n GLU 121 Ca 0.48 0.59 0.16 0.00 0.66 0.00 0.00 57.16 59.05 3rap n GLU 121 Cb 1.48 -1.90 0.72 0.00 0.27 0.00 0.00 31.44 32.01 3rap n GLU 121 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 3rap h SER 122 N 0.00 0.00 -0.19 4.31 4.64 -1.89 -2.33 113.55 118.09 3rap h SER 122 Ca 0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 3rap h SER 122 Cb 0.11 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.17 3rap h SER 122 CO 0.00 0.00 -0.08 -0.62 -0.87 0.00 0.00 176.83 175.26 3rap n GLU 123 N -2.75 2.04 -1.89 4.77 -0.58 -0.33 -5.05 120.64 116.85 3rap n GLU 123 Ca 0.00 -2.94 -0.42 0.00 -0.42 0.00 0.00 57.16 53.39 3rap n GLU 123 Cb 0.21 -1.73 -0.03 0.00 -0.57 0.00 0.00 31.44 29.32 3rap n GLU 123 CO 0.00 0.00 0.00 0.50 -0.48 0.00 0.00 177.13 177.15 3rap s ARG 124 N -3.02 4.20 0.00 3.49 3.52 -0.88 -4.50 118.95 121.76 3rap s ARG 124 Ca 0.40 2.42 0.08 0.00 -0.13 0.00 0.00 55.73 58.49 3rap s ARG 124 Cb 0.35 -3.13 -0.07 0.00 -1.56 0.00 0.00 34.95 30.54 3rap s ARG 124 CO 0.03 -0.63 0.36 0.39 -0.81 0.00 0.00 175.30 174.64 3rap n GLU 125 N 3.84 4.12 -3.96 5.12 1.02 0.39 -4.94 120.64 126.23 3rap n GLU 125 Ca 0.14 -0.08 -0.29 0.00 -0.02 0.00 0.00 57.16 56.90 3rap n GLU 125 Cb 0.38 -0.89 -0.16 0.00 -0.02 0.00 0.00 31.44 30.75 3rap n GLU 125 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3rap s VAL 126 N -1.64 1.35 0.61 2.62 1.01 -0.39 -4.75 120.40 119.20 3rap s VAL 126 Ca 0.03 -0.65 -0.15 0.00 0.00 0.00 0.00 61.98 61.21 3rap s VAL 126 Cb 0.06 -1.39 -0.03 0.00 0.00 0.00 0.00 36.38 35.02 3rap s VAL 126 CO 0.30 0.28 1.06 -0.94 0.00 0.00 0.00 175.10 175.80 3rap s SER 127 N 1.55 5.69 0.43 3.32 1.04 -1.26 -4.88 113.70 119.59 3rap s SER 127 Ca 0.02 1.82 0.17 0.00 0.48 0.00 0.00 55.95 58.44 3rap s SER 127 Cb -0.14 -2.53 1.07 0.00 0.10 0.00 0.00 66.02 64.52 3rap s SER 127 CO -0.09 -1.23 1.91 0.28 0.98 0.00 0.00 173.24 175.09 3rap h SER 128 N 0.32 0.38 -0.55 7.02 0.02 -1.99 -1.94 113.55 116.80 3rap h SER 128 Ca -0.47 0.02 -0.06 0.00 -0.84 0.00 0.00 61.79 60.44 3rap h SER 128 Cb 1.22 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 63.69 3rap h SER 128 CO 0.57 0.19 0.09 0.77 -1.14 0.00 0.00 176.83 177.31 3rap h SER 129 N 0.40 0.87 0.80 3.07 4.64 -1.98 -0.75 113.55 120.60 3rap h SER 129 Ca 0.39 -0.26 -0.04 0.00 -0.47 0.00 0.00 61.79 61.41 3rap h SER 129 Cb 0.93 -0.23 0.01 0.00 -0.31 0.00 0.00 62.40 62.79 3rap h SER 129 CO -0.12 0.91 -0.38 -0.33 -0.87 0.00 0.00 176.83 176.03 3rap h GLU 130 N 0.80 -1.04 -0.68 4.77 5.08 -1.74 0.88 114.58 122.66 3rap h GLU 130 Ca 0.17 0.07 0.10 0.00 -1.00 0.00 0.00 59.36 58.70 3rap h GLU 130 Cb 0.40 0.24 -0.07 0.00 0.50 0.00 0.00 28.75 29.82 3rap h GLU 130 CO 0.01 -0.69 0.30 0.78 -1.00 0.00 0.00 179.01 178.41 3rap h GLY 131 N -1.09 0.99 1.28 -3.84 0.00 -1.40 0.58 103.07 99.60 3rap h GLY 131 Ca -0.11 -0.18 -0.03 0.00 0.00 0.00 0.00 47.33 47.01 3rap h GLY 131 CO 0.18 0.01 0.28 -0.09 0.00 0.00 0.00 176.54 176.92 3rap h ARG 132 N 0.51 0.93 -0.32 4.80 2.43 -1.00 -1.64 114.38 120.10 3rap h ARG 132 Ca 0.34 -0.14 -0.06 0.00 -0.81 0.00 0.00 59.98 59.32 3rap h ARG 132 Cb 0.40 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.77 3rap h ARG 132 CO -0.29 0.74 -0.02 0.00 -1.51 0.00 0.00 179.97 178.88 3rap h ALA 133 N 1.39 0.43 -0.60 2.80 0.00 0.14 -0.43 119.26 122.98 3rap h ALA 133 Ca 0.22 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 54.88 3rap h ALA 133 Cb 0.14 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 3rap h ALA 133 CO -0.02 0.21 0.40 1.25 0.00 0.00 0.00 179.25 181.08 3rap h LEU 134 N 0.37 0.69 -1.06 0.00 5.85 -1.02 -1.30 115.31 118.84 3rap h LEU 134 Ca 0.09 -0.02 -0.09 0.00 0.84 0.00 0.00 57.88 58.70 3rap h LEU 134 Cb 0.48 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 3rap h LEU 134 CO 0.02 0.50 -0.26 0.00 -0.34 0.00 0.00 178.44 178.36 3rap h ALA 135 N 1.22 1.21 -0.00 1.25 0.00 -1.14 0.19 119.26 121.99 3rap h ALA 135 Ca 0.22 -0.33 -0.14 0.00 0.00 0.00 0.00 54.91 54.67 3rap h ALA 135 Cb -0.09 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 3rap h ALA 135 CO -0.05 0.52 -0.66 1.05 0.00 0.00 0.00 179.25 180.10 3rap h GLU 136 N 0.32 0.01 -0.51 0.00 -0.00 -0.71 0.94 114.58 114.63 3rap h GLU 136 Ca 0.05 -0.01 -0.09 0.00 -0.00 0.00 0.00 59.36 59.31 3rap h GLU 136 Cb 0.63 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 29.36 3rap h GLU 136 CO 0.04 0.67 -0.02 1.49 -0.00 0.00 0.00 179.01 181.19 3rap h GLU 137 N 0.01 0.92 0.00 1.06 4.81 -0.67 -3.08 114.58 117.62 3rap h GLU 137 Ca -0.01 -0.30 0.00 0.00 -0.13 0.00 0.00 59.36 58.92 3rap h GLU 137 Cb 1.17 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.47 3rap h GLU 137 CO 0.09 0.95 0.00 -1.49 -0.73 0.00 0.00 179.01 177.83 3rap h TRP 138 N 0.78 0.00 -3.80 0.92 6.55 -0.54 -3.47 115.95 116.39 3rap h TRP 138 Ca 0.14 0.00 -0.26 0.00 0.95 0.00 0.00 58.89 59.72 3rap h TRP 138 Cb 0.55 0.00 0.07 0.00 -0.86 0.00 0.00 29.16 28.92 3rap h TRP 138 CO 0.04 0.00 -0.43 0.41 -1.05 0.00 0.00 178.44 177.41 3rap n GLY 139 N 0.57 -0.06 3.33 1.49 0.00 0.26 -5.05 105.19 105.73 3rap n GLY 139 Ca 0.03 -0.11 -0.18 0.00 0.00 0.00 0.00 46.02 45.76 3rap n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3rap s PRO 141 N -3.67 2.85 -0.03 0.00 0.04 -1.26 -4.53 135.00 128.40 3rap s PRO 141 Ca 0.22 1.76 0.07 0.00 0.04 0.00 0.00 61.00 63.09 3rap s PRO 141 Cb 0.00 -1.92 -0.02 0.00 0.04 0.00 0.00 34.50 32.60 3rap s PRO 141 CO 0.06 -1.29 -0.23 0.12 0.04 0.00 0.00 177.00 175.70 3rap s PHE 142 N -1.74 2.41 0.00 0.56 5.36 -1.26 -1.92 117.98 121.40 3rap s PHE 142 Ca 0.76 -0.38 -0.04 0.00 -0.96 0.00 0.00 56.93 56.31 3rap s PHE 142 Cb -0.29 -1.53 -0.00 0.00 -0.34 0.00 0.00 43.02 40.86 3rap s PHE 142 CO 0.35 0.01 0.08 -1.64 -1.46 0.00 0.00 175.22 172.56 3rap s MET 143 N -0.65 0.35 -0.02 10.12 -1.94 -0.47 -4.99 119.30 121.71 3rap s MET 143 Ca 0.10 -0.35 0.02 0.00 -1.71 0.00 0.00 55.69 53.75 3rap s MET 143 Cb -0.10 0.14 -0.03 0.00 2.01 0.00 0.00 34.83 36.85 3rap s MET 143 CO -0.01 -0.07 -0.07 -1.21 -0.01 0.00 0.00 175.02 173.65 3rap s GLU 144 N -1.11 2.62 0.23 2.03 2.02 -1.26 -0.73 118.70 122.51 3rap s GLU 144 Ca -0.12 -0.66 -0.05 0.00 0.02 0.00 0.00 54.97 54.16 3rap s GLU 144 Cb -0.07 -2.53 -0.02 0.00 0.10 0.00 0.00 34.13 31.61 3rap s GLU 144 CO 0.00 0.63 0.30 0.95 0.02 0.00 0.00 175.26 177.16 3rap s THR 145 N -0.93 0.00 -0.02 3.63 -4.23 -0.22 -4.93 115.64 108.95 3rap s THR 145 Ca 0.15 -1.74 0.01 0.00 -1.18 0.00 0.00 61.69 58.93 3rap s THR 145 Cb -0.11 -2.40 0.01 0.00 1.34 0.00 0.00 72.50 71.34 3rap s THR 145 CO 0.05 0.00 -0.04 -0.55 -0.54 0.00 0.00 174.62 173.54 3rap s SER 146 N -3.12 0.60 0.27 3.99 0.15 -1.26 -1.25 113.70 113.07 3rap s SER 146 Ca 0.32 -0.08 0.21 0.00 0.70 0.00 0.00 55.95 57.10 3rap s SER 146 Cb 0.03 -0.16 1.01 0.00 -1.71 0.00 0.00 66.02 65.19 3rap s SER 146 CO 0.12 0.01 1.65 0.00 1.20 0.00 0.00 173.24 176.22 3rap n ALA 147 N 3.37 1.37 1.20 5.45 0.00 -1.26 -1.65 120.51 128.99 3rap n ALA 147 Ca -0.18 0.13 0.14 0.00 0.00 0.00 0.00 53.44 53.53 3rap n ALA 147 Cb 0.55 -1.34 0.68 0.00 0.00 0.00 0.00 19.45 19.35 3rap n ALA 147 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3rap n LYS 148 N -2.19 0.23 -3.61 0.00 5.02 -1.26 -4.69 118.16 111.66 3rap n LYS 148 Ca 0.01 0.01 -0.40 0.00 -2.02 0.00 0.00 58.31 55.90 3rap n LYS 148 Cb 0.14 -1.50 -0.11 0.00 -0.02 0.00 0.00 35.03 33.54 3rap n LYS 148 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3rap s SER 149 N -2.77 5.67 0.40 4.39 0.15 -0.66 -4.93 113.70 115.95 3rap s SER 149 Ca 0.21 -1.25 0.10 0.00 0.70 0.00 0.00 55.95 55.71 3rap s SER 149 Cb 0.19 -2.00 0.90 0.00 -1.71 0.00 0.00 66.02 63.41 3rap s SER 149 CO 0.48 -0.46 1.96 0.50 1.20 0.00 0.00 173.24 176.93 3rap h LYS 150 N 8.41 0.55 -0.02 5.44 3.64 -1.85 -2.02 116.57 130.72 3rap h LYS 150 Ca -0.24 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.10 3rap h LYS 150 Cb 1.09 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 32.79 3rap h LYS 150 CO 0.71 0.36 0.00 1.15 -2.27 0.00 0.00 179.45 179.41 3rap h THR 151 N 0.56 1.19 -0.23 1.00 2.02 -1.94 -1.25 112.91 114.26 3rap h THR 151 Ca 0.30 -0.55 -0.17 0.00 0.77 0.00 0.00 66.41 66.77 3rap h THR 151 Cb 0.43 1.52 -0.00 0.00 -1.74 0.00 0.00 68.15 68.36 3rap h THR 151 CO -0.10 0.15 -0.53 0.24 0.37 0.00 0.00 175.52 175.65 3rap h MET 152 N -0.19 0.67 -0.14 6.66 2.86 -1.81 -2.22 114.93 120.76 3rap h MET 152 Ca 0.01 -0.41 -0.02 0.00 -2.06 0.00 0.00 59.70 57.22 3rap h MET 152 Cb 0.23 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.93 3rap h MET 152 CO 0.00 1.03 0.03 0.28 1.06 0.00 0.00 176.91 179.31 3rap h VAL 153 N 0.52 1.21 -0.25 -2.22 2.07 -1.34 -0.78 116.25 115.46 3rap h VAL 153 Ca 0.02 -0.68 -0.03 0.00 0.82 0.00 0.00 66.70 66.82 3rap h VAL 153 Cb 1.09 1.39 -0.01 0.00 -1.52 0.00 0.00 31.29 32.24 3rap h VAL 153 CO 0.11 0.20 0.00 0.44 0.02 0.00 0.00 177.57 178.34 3rap h ASP 154 N 0.02 0.34 -0.28 0.57 5.19 -1.21 -1.99 116.42 119.07 3rap h ASP 154 Ca 0.04 -0.05 -0.14 0.00 -0.62 0.00 0.00 57.03 56.26 3rap h ASP 154 Cb 0.29 -0.09 -0.01 0.00 0.18 0.00 0.00 39.33 39.70 3rap h ASP 154 CO 0.00 0.40 -0.34 -0.08 -3.12 0.00 0.00 179.24 176.11 3rap h GLU 155 N 0.37 0.80 0.35 3.56 4.57 -1.10 -0.98 114.58 122.16 3rap h GLU 155 Ca 0.08 -0.39 -0.01 0.00 -1.18 0.00 0.00 59.36 57.87 3rap h GLU 155 Cb 0.24 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.82 3rap h GLU 155 CO 0.01 1.02 -0.27 1.25 -1.18 0.00 0.00 179.01 179.84 3rap h LEU 156 N 0.67 -0.69 -0.88 1.64 5.85 -0.45 -0.36 115.31 121.09 3rap h LEU 156 Ca 0.07 0.05 -0.08 0.00 0.84 0.00 0.00 57.88 58.76 3rap h LEU 156 Cb 0.89 0.22 -0.02 0.00 0.37 0.00 0.00 40.66 42.11 3rap h LEU 156 CO 0.08 -0.40 -0.02 -0.26 -0.34 0.00 0.00 178.44 177.50 3rap h PHE 157 N -0.62 0.86 -0.60 1.25 0.04 -1.38 -1.81 116.94 114.68 3rap h PHE 157 Ca -0.03 -0.13 0.06 0.00 2.80 0.00 0.00 57.97 60.67 3rap h PHE 157 Cb 0.53 -0.23 -0.05 0.00 2.20 0.00 0.00 35.95 38.40 3rap h PHE 157 CO -0.13 0.81 0.31 0.00 -0.60 0.00 0.00 178.31 178.70 3rap h ALA 158 N 1.23 0.79 -0.28 2.45 0.00 -1.11 -2.47 119.26 119.86 3rap h ALA 158 Ca 0.14 0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.95 3rap h ALA 158 Cb 0.48 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 3rap h ALA 158 CO 0.02 -0.03 -0.35 1.49 0.00 0.00 0.00 179.25 180.38 3rap h GLU 159 N 0.59 0.63 -0.51 0.00 4.57 -0.53 -2.17 114.58 117.16 3rap h GLU 159 Ca 0.27 -0.30 -0.02 0.00 -1.18 0.00 0.00 59.36 58.14 3rap h GLU 159 Cb 0.19 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.75 3rap h GLU 159 CO -0.19 0.89 0.25 0.97 -1.18 0.00 0.00 179.01 179.76 3rap h ILE 160 N 0.53 1.17 -0.40 2.32 6.09 -1.04 -1.44 117.51 124.74 3rap h ILE 160 Ca 0.06 -0.46 0.01 0.00 -1.37 0.00 0.00 64.86 63.09 3rap h ILE 160 Cb 0.85 0.51 -0.02 0.00 0.47 0.00 0.00 36.82 38.63 3rap h ILE 160 CO 0.07 0.19 0.27 0.58 -3.07 0.00 0.00 178.15 176.19 3rap h VAL 161 N 0.72 1.10 -0.55 2.19 2.07 -0.97 -0.28 116.25 120.52 3rap h VAL 161 Ca 0.18 -0.19 0.01 0.00 0.82 0.00 0.00 66.70 67.53 3rap h VAL 161 Cb 0.06 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.31 3rap h VAL 161 CO -0.03 0.10 0.35 0.03 0.02 0.00 0.00 177.57 178.05 3rap h ARG 162 N 0.54 0.69 -0.60 1.57 3.08 -0.77 -0.81 114.38 118.08 3rap h ARG 162 Ca 0.15 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.15 3rap h ARG 162 Cb -0.06 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 29.81 3rap h ARG 162 CO -0.04 0.46 0.35 1.96 -1.07 0.00 0.00 179.97 181.64 3rap h GLN 163 N 0.71 0.82 0.00 0.04 1.08 -0.91 -2.18 115.11 114.67 3rap h GLN 163 Ca 0.21 -0.08 0.00 0.00 -1.45 0.00 0.00 58.65 57.33 3rap h GLN 163 Cb -0.04 -0.17 0.00 0.00 -0.05 0.00 0.00 27.48 27.22 3rap h GLN 163 CO -0.07 0.60 0.00 0.52 -0.95 0.00 0.00 178.83 178.93 3rap h MET 164 N 0.82 0.00 -0.00 1.46 2.86 -0.43 -0.19 114.93 119.45 3rap h MET 164 Ca 0.22 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.86 3rap h MET 164 Cb -0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 3rap h MET 164 CO -0.04 0.00 -0.01 0.09 1.06 0.00 0.00 176.91 178.01 3rap n ASN 165 N -2.80 0.20 -0.12 1.22 3.02 -0.37 -3.76 115.26 112.66 3rap n ASN 165 Ca 0.01 -0.88 -0.15 0.00 -0.03 0.00 0.00 54.58 53.53 3rap n ASN 165 Cb 0.26 -0.05 -0.13 0.00 -0.61 0.00 0.00 39.78 39.24 3rap n ASN 165 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3rap n TYR 166 N -0.92 0.00 -1.64 3.10 4.19 -0.09 -5.08 117.16 116.71 3rap n TYR 166 Ca 0.21 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.42 3rap n TYR 166 Cb 0.17 -0.99 0.00 0.00 0.49 0.00 0.00 39.34 39.01 3rap n TYR 166 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77