#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rl8 n THR 5 N 0.00 0.00 -1.76 -0.18 5.66 -1.26 -4.78 114.28 111.96 2rl8 n THR 5 Ca 0.00 -1.33 -0.41 0.00 -3.05 0.00 0.00 64.05 59.26 2rl8 n THR 5 Cb 0.00 0.67 -0.01 0.00 -1.55 0.00 0.00 70.33 69.44 2rl8 n THR 5 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2rl8 s ASP 7 N 0.04 3.99 0.37 0.00 -1.08 -0.45 -5.00 116.67 114.53 2rl8 s ASP 7 Ca 0.57 -0.41 -0.01 0.00 -0.52 0.00 0.00 52.55 52.17 2rl8 s ASP 7 Cb -0.49 -1.65 -0.04 0.00 -1.46 0.00 0.00 42.92 39.29 2rl8 s ASP 7 CO 0.59 0.05 0.60 -0.76 0.52 0.00 0.00 175.17 176.18 2rl8 s LEU 8 N 1.02 3.93 0.43 -1.34 1.43 -1.26 -1.64 118.68 121.26 2rl8 s LEU 8 Ca -0.01 0.59 -0.26 0.00 -1.03 0.00 0.00 54.13 53.43 2rl8 s LEU 8 Cb -0.15 -3.47 -0.08 0.00 0.03 0.00 0.00 46.19 42.52 2rl8 s LEU 8 CO -0.02 -0.34 1.36 0.54 0.23 0.00 0.00 176.35 178.12 2rl8 s VAL 9 N -2.38 2.37 0.00 -1.59 0.11 -1.26 -4.81 120.40 112.84 2rl8 s VAL 9 Ca 0.42 0.32 0.00 0.00 -2.93 0.00 0.00 61.98 59.80 2rl8 s VAL 9 Cb -0.10 -3.19 0.00 0.00 -1.53 0.00 0.00 36.38 31.56 2rl8 s VAL 9 CO 0.37 0.04 0.00 0.61 -3.33 0.00 0.00 175.10 172.80 2rl8 n GLY 10 N 0.62 2.26 3.67 6.54 0.00 -1.26 -4.48 105.19 112.54 2rl8 n GLY 10 Ca 0.04 -1.62 -0.30 0.00 0.00 0.00 0.00 46.02 44.14 2rl8 n GLY 10 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2rl8 s GLU 11 N -4.67 0.83 0.07 1.61 2.12 -1.26 -4.63 118.70 112.77 2rl8 s GLU 11 Ca 0.00 1.00 -0.34 0.00 0.36 0.00 0.00 54.97 55.99 2rl8 s GLU 11 Cb 0.00 -1.75 -0.13 0.00 0.26 0.00 0.00 34.13 32.51 2rl8 s GLU 11 CO 0.00 -2.59 1.67 1.63 -0.54 0.00 0.00 175.26 175.43 2rl8 n LYS 12 N -4.15 2.10 0.00 4.30 5.02 -1.26 -0.63 118.16 123.55 2rl8 n LYS 12 Ca 0.07 0.76 0.00 0.00 -2.02 0.00 0.00 58.31 57.13 2rl8 n LYS 12 Cb 0.54 -2.55 0.00 0.00 -0.02 0.00 0.00 35.03 33.00 2rl8 n LYS 12 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2rl8 n GLY 13 N 3.71 0.58 0.18 0.72 0.00 -1.26 -4.87 105.19 104.24 2rl8 n GLY 13 Ca 0.19 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.27 2rl8 n GLY 13 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2rl8 n LYS 14 N -2.00 2.22 -3.00 1.61 4.76 0.20 -5.04 118.16 116.91 2rl8 n LYS 14 Ca 0.00 -2.16 -0.30 0.00 -2.87 0.00 0.00 58.31 52.98 2rl8 n LYS 14 Cb 0.00 -1.33 -0.03 0.00 -1.84 0.00 0.00 35.03 31.83 2rl8 n LYS 14 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2rl8 s GLU 15 N -2.02 3.74 0.22 1.97 2.02 -1.23 -4.69 118.70 118.71 2rl8 s GLU 15 Ca 0.21 0.34 -0.32 0.00 0.02 0.00 0.00 54.97 55.22 2rl8 s GLU 15 Cb 0.17 -2.46 -0.12 0.00 0.10 0.00 0.00 34.13 31.82 2rl8 s GLU 15 CO 0.04 0.04 1.71 0.45 0.02 0.00 0.00 175.26 177.51 2rl8 s SER 16 N -3.13 6.37 0.28 -0.19 0.15 -1.26 -4.90 113.70 111.01 2rl8 s SER 16 Ca 0.49 2.89 0.00 0.00 0.70 0.00 0.00 55.95 60.03 2rl8 s SER 16 Cb -0.10 -2.61 0.42 0.00 -1.71 0.00 0.00 66.02 62.02 2rl8 s SER 16 CO 0.31 -0.97 1.79 -0.33 1.20 0.00 0.00 173.24 175.24 2rl8 h GLU 17 N 6.48 0.70 -0.31 5.44 4.39 -1.99 -0.06 114.58 129.23 2rl8 h GLU 17 Ca -0.44 -0.18 -0.05 0.00 0.34 0.00 0.00 59.36 59.03 2rl8 h GLU 17 Cb 1.20 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 29.76 2rl8 h GLU 17 CO 0.93 0.72 -0.01 0.87 -1.16 0.00 0.00 179.01 180.37 2rl8 h LYS 18 N 0.66 0.56 -0.54 2.33 1.57 -1.99 -1.87 116.57 117.28 2rl8 h LYS 18 Ca 0.13 -0.18 -0.10 0.00 -1.87 0.00 0.00 60.65 58.63 2rl8 h LYS 18 Cb 0.43 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.67 2rl8 h LYS 18 CO 0.02 0.70 -0.07 0.93 -0.57 0.00 0.00 179.45 180.46 2rl8 h GLU 19 N 0.36 0.99 -0.68 3.15 5.08 -1.77 -1.56 114.58 120.16 2rl8 h GLU 19 Ca 0.09 -0.34 -0.01 0.00 -1.00 0.00 0.00 59.36 58.10 2rl8 h GLU 19 Cb 0.45 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 2rl8 h GLU 19 CO 0.02 1.02 0.38 -0.07 -1.00 0.00 0.00 179.01 179.36 2rl8 h LEU 20 N 0.89 0.83 -0.58 1.33 3.38 -0.92 0.76 115.31 121.01 2rl8 h LEU 20 Ca 0.15 -0.08 -0.11 0.00 0.09 0.00 0.00 57.88 57.92 2rl8 h LEU 20 Cb 0.62 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 2rl8 h LEU 20 CO 0.04 0.68 -0.11 0.00 0.09 0.00 0.00 178.44 179.14 2rl8 h ALA 21 N 1.19 0.78 -0.51 1.53 0.00 -1.16 -2.12 119.26 118.97 2rl8 h ALA 21 Ca 0.24 -0.35 -0.10 0.00 0.00 0.00 0.00 54.91 54.70 2rl8 h ALA 21 Cb 0.02 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 2rl8 h ALA 21 CO -0.04 0.67 -0.08 1.25 0.00 0.00 0.00 179.25 181.04 2rl8 h LEU 22 N 0.90 0.91 -0.85 0.00 6.46 -0.94 -1.74 115.31 120.05 2rl8 h LEU 22 Ca 0.14 -0.28 0.01 0.00 -0.12 0.00 0.00 57.88 57.63 2rl8 h LEU 22 Cb 0.67 -0.25 -0.04 0.00 -0.73 0.00 0.00 40.66 40.31 2rl8 h LEU 22 CO 0.05 1.02 0.56 0.25 -0.62 0.00 0.00 178.44 179.70 2rl8 h LEU 23 N 0.83 0.97 -0.81 2.25 5.85 -0.61 -1.69 115.31 122.10 2rl8 h LEU 23 Ca 0.14 -0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.76 2rl8 h LEU 23 Cb 0.61 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.37 2rl8 h LEU 23 CO 0.04 0.70 0.07 0.50 -0.34 0.00 0.00 178.44 179.41 2rl8 h LYS 24 N 1.15 0.96 -0.21 1.25 3.64 -0.99 -2.71 116.57 119.66 2rl8 h LYS 24 Ca 0.32 -0.25 -0.04 0.00 -1.27 0.00 0.00 60.65 59.40 2rl8 h LYS 24 Cb -0.12 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.58 2rl8 h LYS 24 CO -0.07 0.91 -0.07 -0.09 -2.27 0.00 0.00 179.45 177.86 2rl8 h ARG 25 N 0.90 0.32 -0.00 1.90 2.43 -0.49 -2.73 114.38 116.71 2rl8 h ARG 25 Ca 0.18 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.28 2rl8 h ARG 25 Cb 0.44 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 2rl8 h ARG 25 CO 0.01 0.41 -0.01 1.28 -1.51 0.00 0.00 179.97 180.15 2rl8 n LEU 26 N -4.30 0.10 -0.31 3.80 4.77 -0.72 -4.33 117.00 116.01 2rl8 n LEU 26 Ca 0.00 0.13 0.16 0.00 -0.03 0.00 0.00 56.01 56.27 2rl8 n LEU 26 Cb 0.24 -0.16 0.34 0.00 -2.33 0.00 0.00 43.42 41.51 2rl8 n LEU 26 CO 0.38 0.02 0.98 0.74 -1.33 0.00 0.00 177.39 178.17 2rl8 h THR 27 N 0.13 0.28 0.00 -5.08 2.02 -1.47 0.70 112.91 109.50 2rl8 h THR 27 Ca 0.00 -0.08 0.00 0.00 0.77 0.00 0.00 66.41 67.10 2rl8 h THR 27 Cb 0.20 0.05 0.00 0.00 -1.74 0.00 0.00 68.15 66.66 2rl8 h THR 27 CO 0.00 0.04 0.00 1.55 0.37 0.00 0.00 175.52 177.48 2rl8 h PRO 28 N 0.22 0.00 0.00 6.66 0.13 -1.85 -1.96 132.00 135.20 2rl8 h PRO 28 Ca 0.61 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.74 2rl8 h PRO 28 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 2rl8 h PRO 28 CO -0.66 0.00 -0.86 -0.07 -0.23 0.00 0.00 178.00 176.18 2rl8 h LEU 29 N 0.00 0.00 -0.81 1.56 3.38 -1.19 -3.40 115.31 114.85 2rl8 h LEU 29 Ca 0.00 -0.07 0.15 0.00 0.09 0.00 0.00 57.88 58.06 2rl8 h LEU 29 Cb 0.00 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.66 2rl8 h LEU 29 CO 0.00 0.03 0.37 -0.26 0.09 0.00 0.00 178.44 178.67 2rl8 h PHE 30 N 0.00 0.64 0.00 1.13 0.04 -1.42 -1.21 116.94 116.12 2rl8 h PHE 30 Ca 0.00 0.04 0.00 0.00 2.80 0.00 0.00 57.97 60.81 2rl8 h PHE 30 Cb 0.93 -0.16 0.00 0.00 2.20 0.00 0.00 35.95 38.92 2rl8 h PHE 30 CO 0.00 0.10 0.00 0.00 -0.60 0.00 0.00 178.31 177.81 2rl8 n GLN 31 N -4.95 0.04 -2.47 1.51 10.64 -1.26 -4.64 117.38 116.25 2rl8 n GLN 31 Ca 0.16 0.23 -0.26 0.00 -1.83 0.00 0.00 57.00 55.31 2rl8 n GLN 31 Cb 0.45 -1.57 0.03 0.00 -0.86 0.00 0.00 30.24 28.30 2rl8 n GLN 31 CO 0.00 0.00 0.00 0.15 -1.83 0.00 0.00 177.06 175.38 2rl8 s LYS 32 N -3.05 2.81 -0.00 2.61 1.02 -0.46 -5.11 119.74 117.55 2rl8 s LYS 32 Ca 0.08 -0.17 -0.02 0.00 0.02 0.00 0.00 55.97 55.88 2rl8 s LYS 32 Cb 0.11 -2.32 -0.00 0.00 -0.52 0.00 0.00 37.83 35.10 2rl8 s LYS 32 CO 0.35 -0.72 0.04 0.45 -0.92 0.00 0.00 175.35 174.55 2rl8 s SER 33 N -4.33 0.06 0.01 2.83 0.15 -1.26 -4.55 113.70 106.61 2rl8 s SER 33 Ca 0.54 -0.14 0.04 0.00 0.70 0.00 0.00 55.95 57.09 2rl8 s SER 33 Cb -0.10 0.12 -0.01 0.00 -1.71 0.00 0.00 66.02 64.31 2rl8 s SER 33 CO 0.43 -0.16 -0.13 -0.36 1.20 0.00 0.00 173.24 174.23 2rl8 s PHE 34 N -0.67 1.12 0.00 3.44 0.08 -0.20 -5.00 117.98 116.75 2rl8 s PHE 34 Ca -0.07 -0.27 -0.07 0.00 0.12 0.00 0.00 56.93 56.64 2rl8 s PHE 34 Cb -0.05 -0.69 -0.00 0.00 -0.57 0.00 0.00 43.02 41.71 2rl8 s PHE 34 CO -0.00 0.00 0.12 -2.00 -0.10 0.00 0.00 175.22 173.24 2rl8 s GLU 35 N -0.68 0.47 -0.26 0.44 -6.30 -1.26 -0.45 118.70 110.65 2rl8 s GLU 35 Ca 0.03 -0.42 -0.16 0.00 -2.50 0.00 0.00 54.97 51.92 2rl8 s GLU 35 Cb -0.06 0.19 0.08 0.00 0.00 0.00 0.00 34.13 34.34 2rl8 s GLU 35 CO 0.00 -0.11 0.66 0.45 0.02 0.00 0.00 175.26 176.28 2rl8 s SER 36 N -1.39 -0.88 -0.18 -1.70 0.15 -0.65 -4.90 113.70 104.16 2rl8 s SER 36 Ca -0.15 1.43 -0.07 0.00 0.70 0.00 0.00 55.95 57.87 2rl8 s SER 36 Cb -0.08 1.32 -0.04 0.00 -1.71 0.00 0.00 66.02 65.51 2rl8 s SER 36 CO 0.01 -0.23 0.04 -0.89 1.20 0.00 0.00 173.24 173.37 2rl8 s THR 37 N 1.50 4.59 0.15 6.45 2.01 -1.26 -0.90 115.64 128.18 2rl8 s THR 37 Ca -0.09 -0.10 -0.03 0.00 0.31 0.00 0.00 61.69 61.78 2rl8 s THR 37 Cb -0.05 -3.07 -0.03 0.00 0.01 0.00 0.00 72.50 69.36 2rl8 s THR 37 CO -0.17 0.46 0.12 0.68 -0.69 0.00 0.00 174.62 175.01 2rl8 s VAL 38 N 0.46 0.08 0.00 3.82 -7.23 -0.29 -5.00 120.40 112.24 2rl8 s VAL 38 Ca 0.02 -1.83 0.00 0.00 -1.81 0.00 0.00 61.98 58.36 2rl8 s VAL 38 Cb -0.13 -2.10 0.00 0.00 0.56 0.00 0.00 36.38 34.71 2rl8 s VAL 38 CO 0.01 -0.34 0.00 0.61 -0.31 0.00 0.00 175.10 175.07 2rl8 n GLY 39 N -0.15 -0.71 3.46 2.32 0.00 -1.26 -0.90 105.19 107.94 2rl8 n GLY 39 Ca -0.04 -1.67 -0.31 0.00 0.00 0.00 0.00 46.02 43.99 2rl8 n GLY 39 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2rl8 s GLN 40 N -2.27 2.18 0.58 1.61 -0.21 -1.25 -4.54 119.66 115.77 2rl8 s GLN 40 Ca 0.00 -0.91 -0.19 0.00 0.02 0.00 0.00 55.36 54.28 2rl8 s GLN 40 Cb 0.00 -2.23 -0.05 0.00 1.00 0.00 0.00 33.01 31.73 2rl8 s GLN 40 CO 0.00 0.56 1.01 0.43 -2.12 0.00 0.00 175.29 175.17 2rl8 n SER 41 N 1.77 0.99 -0.82 5.90 7.64 -1.26 -0.01 113.62 127.84 2rl8 n SER 41 Ca -0.16 0.84 0.01 0.00 1.01 0.00 0.00 58.87 60.57 2rl8 n SER 41 Cb 0.52 -1.40 0.08 0.00 -1.01 0.00 0.00 64.21 62.40 2rl8 n SER 41 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2rl8 n PRO 42 N -0.91 1.75 -1.60 1.43 -0.04 -1.26 -4.84 135.00 129.54 2rl8 n PRO 42 Ca 0.13 -0.63 -0.19 0.00 -0.04 0.00 0.00 63.50 62.76 2rl8 n PRO 42 Cb 0.46 -1.62 0.07 0.00 -0.04 0.00 0.00 33.50 32.37 2rl8 n PRO 42 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2rl8 n ASP 43 N 0.13 4.60 -4.70 3.54 8.00 0.99 -4.90 116.55 124.20 2rl8 n ASP 43 Ca 0.06 -3.78 -0.39 0.00 0.71 0.00 0.00 54.79 51.39 2rl8 n ASP 43 Cb 0.46 -0.49 -0.05 0.00 -0.02 0.00 0.00 41.12 41.02 2rl8 n ASP 43 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 2rl8 s MET 44 N -3.54 4.35 0.12 -1.24 1.75 -1.15 -3.92 119.30 115.66 2rl8 s MET 44 Ca 0.51 0.69 0.08 0.00 -1.25 0.00 0.00 55.69 55.72 2rl8 s MET 44 Cb 0.42 -3.48 -0.04 0.00 2.84 0.00 0.00 34.83 34.57 2rl8 s MET 44 CO 0.01 -0.00 -0.20 0.71 -0.65 0.00 0.00 175.02 174.89 2rl8 s TYR 45 N 1.08 1.79 -0.23 4.11 2.02 -0.08 -1.82 117.35 124.21 2rl8 s TYR 45 Ca 0.32 -0.43 -0.02 0.00 -0.37 0.00 0.00 57.07 56.57 2rl8 s TYR 45 Cb -0.16 -0.96 0.02 0.00 -0.40 0.00 0.00 41.96 40.45 2rl8 s TYR 45 CO 0.14 0.24 -0.07 0.45 -1.57 0.00 0.00 175.55 174.73 2rl8 s SER 46 N -2.10 4.19 -0.19 2.29 0.15 -0.17 -1.14 113.70 116.73 2rl8 s SER 46 Ca 0.09 -0.72 -0.12 0.00 0.70 0.00 0.00 55.95 55.90 2rl8 s SER 46 Cb -0.09 -1.67 -0.05 0.00 -1.71 0.00 0.00 66.02 62.51 2rl8 s SER 46 CO 0.05 -0.09 0.20 -0.31 1.20 0.00 0.00 173.24 174.29 2rl8 s TYR 47 N 1.36 3.42 -0.12 3.44 2.02 -0.08 -0.18 117.35 127.22 2rl8 s TYR 47 Ca 0.02 0.42 0.03 0.00 -0.37 0.00 0.00 57.07 57.18 2rl8 s TYR 47 Cb -0.16 -2.24 0.01 0.00 -0.40 0.00 0.00 41.96 39.17 2rl8 s TYR 47 CO -0.05 0.25 -0.22 0.08 -1.57 0.00 0.00 175.55 174.04 2rl8 s VAL 48 N 0.47 2.00 -0.02 0.71 1.01 -0.59 -1.64 120.40 122.35 2rl8 s VAL 48 Ca 0.11 -0.96 0.05 0.00 0.00 0.00 0.00 61.98 61.18 2rl8 s VAL 48 Cb -0.12 -1.75 -0.01 0.00 0.00 0.00 0.00 36.38 34.50 2rl8 s VAL 48 CO 0.01 0.54 -0.16 0.12 0.00 0.00 0.00 175.10 175.61 2rl8 s PHE 49 N 0.58 1.46 0.02 5.22 5.36 0.40 -1.06 117.98 129.95 2rl8 s PHE 49 Ca -0.13 -0.29 -0.01 0.00 -0.96 0.00 0.00 56.93 55.54 2rl8 s PHE 49 Cb -0.17 -0.95 -0.02 0.00 -0.34 0.00 0.00 43.02 41.55 2rl8 s PHE 49 CO 0.04 -0.04 -0.01 1.03 -1.46 0.00 0.00 175.22 174.78 2rl8 s ARG 50 N -0.33 0.34 -0.40 10.12 0.52 -0.60 -1.03 118.95 127.57 2rl8 s ARG 50 Ca 0.05 -0.60 -0.17 0.00 -0.52 0.00 0.00 55.73 54.49 2rl8 s ARG 50 Cb -0.07 0.12 0.01 0.00 0.52 0.00 0.00 34.95 35.54 2rl8 s ARG 50 CO -0.00 -0.06 0.46 0.08 0.02 0.00 0.00 175.30 175.80 2rl8 s VAL 51 N -1.51 5.06 -1.90 3.52 1.01 -1.26 -4.39 120.40 120.92 2rl8 s VAL 51 Ca -0.15 -0.15 0.00 0.00 0.00 0.00 0.00 61.98 61.68 2rl8 s VAL 51 Cb -0.09 -4.02 0.00 0.00 0.00 0.00 0.00 36.38 32.27 2rl8 s VAL 51 CO -0.01 -0.37 0.00 0.00 0.00 0.00 0.00 175.10 174.72 2rl8 s ARG 53 N -4.28 0.72 0.04 0.00 1.81 -1.26 -4.08 118.95 111.90 2rl8 s ARG 53 Ca 0.00 -0.93 -0.30 0.00 -1.72 0.00 0.00 55.73 52.78 2rl8 s ARG 53 Cb 0.00 0.28 -0.09 0.00 -0.45 0.00 0.00 34.95 34.69 2rl8 s ARG 53 CO 0.00 -0.20 1.89 -2.00 -0.68 0.00 0.00 175.30 174.31 2rl8 s GLU 54 N -3.43 4.15 -0.05 3.54 2.56 -1.26 -4.53 118.70 119.68 2rl8 s GLU 54 Ca 0.02 2.54 0.20 0.00 0.00 0.00 0.00 54.97 57.74 2rl8 s GLU 54 Cb 0.03 -4.00 -0.31 0.00 2.00 0.00 0.00 34.13 31.85 2rl8 s GLU 54 CO -0.08 -0.91 0.40 0.00 -0.56 0.00 0.00 175.26 174.11 2rl8 n ALA 55 N 7.03 2.59 -1.79 6.30 0.00 0.11 -4.95 120.51 129.80 2rl8 n ALA 55 Ca 0.19 -0.61 -0.33 0.00 0.00 0.00 0.00 53.44 52.70 2rl8 n ALA 55 Cb 0.41 -0.64 -0.03 0.00 0.00 0.00 0.00 19.45 19.20 2rl8 n ALA 55 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2rl8 s GLY 56 N -4.54 2.18 0.00 0.00 0.00 -1.26 -4.84 107.32 98.86 2rl8 s GLY 56 Ca -0.08 0.32 0.00 0.00 0.00 0.00 0.00 44.72 44.96 2rl8 s GLY 56 CO 0.86 0.61 0.90 -0.18 0.00 0.00 0.00 173.10 175.29 2rl8 n GLN 57 N -1.51 0.99 -3.79 2.90 -0.06 -1.26 -4.72 117.38 109.92 2rl8 n GLN 57 Ca 0.08 0.00 -0.13 0.00 -2.00 0.00 0.00 57.00 54.95 2rl8 n GLN 57 Cb 0.53 -1.09 -0.09 0.00 -4.06 0.00 0.00 30.24 25.54 2rl8 n GLN 57 CO 0.00 0.00 0.00 -1.01 -0.20 0.00 0.00 177.06 175.85 2rl8 s HIS 58 N -1.83 -0.12 -0.66 3.69 3.76 -1.26 -5.08 115.29 113.80 2rl8 s HIS 58 Ca 0.00 0.18 -0.26 0.00 -0.15 0.00 0.00 55.06 54.83 2rl8 s HIS 58 Cb 0.00 0.05 -0.23 0.00 1.11 0.00 0.00 32.58 33.51 2rl8 s HIS 58 CO 0.00 -0.34 1.85 0.43 -0.85 0.00 0.00 174.74 175.83 2rl8 n SER 59 N 1.44 1.95 -0.20 1.40 7.64 -1.26 -4.43 113.62 120.15 2rl8 n SER 59 Ca -0.21 -2.60 0.04 0.00 1.01 0.00 0.00 58.87 57.11 2rl8 n SER 59 Cb 0.56 -1.14 -0.00 0.00 -1.01 0.00 0.00 64.21 62.62 2rl8 n SER 59 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2rl8 n SER 60 N 11.38 1.13 -0.34 6.43 7.64 -1.26 -4.99 113.62 133.60 2rl8 n SER 60 Ca 0.46 -1.07 -0.04 0.00 1.01 0.00 0.00 58.87 59.24 2rl8 n SER 60 Cb 0.43 0.46 -0.01 0.00 -1.01 0.00 0.00 64.21 64.08 2rl8 n SER 60 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2rl8 n GLY 61 N 0.82 0.52 3.74 0.23 0.00 -1.26 -5.00 105.19 104.24 2rl8 n GLY 61 Ca 0.04 -0.84 -0.41 0.00 0.00 0.00 0.00 46.02 44.81 2rl8 n GLY 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rl8 s ALA 62 N -2.16 3.37 -0.11 4.61 0.00 -1.26 -2.81 121.76 123.39 2rl8 s ALA 62 Ca 0.00 0.81 0.20 0.00 0.00 0.00 0.00 51.96 52.97 2rl8 s ALA 62 Cb 0.00 -3.35 -0.26 0.00 0.00 0.00 0.00 23.12 19.51 2rl8 s ALA 62 CO 0.00 -0.21 0.43 0.41 0.00 0.00 0.00 175.76 176.39 2rl8 n GLY 63 N 2.07 -1.06 3.21 0.00 0.00 0.88 -0.71 105.19 109.58 2rl8 n GLY 63 Ca 0.03 -0.39 -0.11 0.00 0.00 0.00 0.00 46.02 45.55 2rl8 n GLY 63 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2rl8 s LEU 64 N -5.06 -0.11 0.17 0.99 0.20 -1.07 -1.55 118.68 112.26 2rl8 s LEU 64 Ca -0.07 0.82 0.10 0.00 0.69 0.00 0.00 54.13 55.66 2rl8 s LEU 64 Cb 0.10 1.18 -0.04 0.00 -0.43 0.00 0.00 46.19 47.01 2rl8 s LEU 64 CO 0.86 -0.20 -0.21 0.68 -0.29 0.00 0.00 176.35 177.20 2rl8 s VAL 65 N 1.65 2.02 -0.23 1.68 -7.23 -0.23 -1.10 120.40 116.95 2rl8 s VAL 65 Ca -0.07 -1.93 -0.01 0.00 -1.81 0.00 0.00 61.98 58.16 2rl8 s VAL 65 Cb -0.10 -1.93 0.02 0.00 0.56 0.00 0.00 36.38 34.94 2rl8 s VAL 65 CO -0.12 -0.21 -0.09 -1.58 -0.31 0.00 0.00 175.10 172.79 2rl8 s GLN 66 N -2.66 2.92 -0.24 4.82 0.74 0.46 -1.54 119.66 124.17 2rl8 s GLN 66 Ca 0.17 -0.91 -0.09 0.00 0.05 0.00 0.00 55.36 54.57 2rl8 s GLN 66 Cb -0.07 -2.89 -0.04 0.00 1.10 0.00 0.00 33.01 31.11 2rl8 s GLN 66 CO 0.08 -0.34 0.12 0.42 -0.55 0.00 0.00 175.29 175.02 2rl8 s ILE 67 N 1.33 4.97 -0.31 -2.34 1.01 0.75 -0.75 121.20 125.85 2rl8 s ILE 67 Ca 0.02 0.04 -0.29 0.00 0.00 0.00 0.00 60.65 60.42 2rl8 s ILE 67 Cb -0.16 -3.31 0.00 0.00 0.01 0.00 0.00 42.46 39.00 2rl8 s ILE 67 CO -0.06 0.35 1.31 -1.58 0.00 0.00 0.00 174.94 174.95 2rl8 s GLN 68 N 1.17 3.89 0.59 2.79 2.00 -0.23 -1.00 119.66 128.87 2rl8 s GLN 68 Ca 0.06 1.21 0.35 0.00 -2.00 0.00 0.00 55.36 54.98 2rl8 s GLN 68 Cb -0.14 -3.89 1.88 0.00 0.80 0.00 0.00 33.01 31.66 2rl8 s GLN 68 CO 0.05 -1.16 2.21 0.87 -0.50 0.00 0.00 175.29 176.76 2rl8 h LYS 69 N 9.39 0.00 -0.01 1.67 1.79 -1.69 0.68 116.57 128.39 2rl8 h LYS 69 Ca -0.26 0.00 -0.15 0.00 -2.18 0.00 0.00 60.65 58.06 2rl8 h LYS 69 Cb 1.10 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.73 2rl8 h LYS 69 CO 1.04 0.03 -0.67 0.66 -1.08 0.00 0.00 179.45 179.44 2rl8 h SER 70 N 0.00 0.08 0.00 0.86 4.64 -1.91 -3.38 113.55 113.85 2rl8 h SER 70 Ca -0.00 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.27 2rl8 h SER 70 Cb 0.17 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 2rl8 h SER 70 CO 0.00 0.72 0.00 -0.46 -0.87 0.00 0.00 176.83 176.23 2rl8 n ASN 71 N -3.77 0.12 0.00 4.97 0.23 -1.10 -5.02 115.26 110.68 2rl8 n ASN 71 Ca -0.02 -0.45 0.00 0.00 -0.53 0.00 0.00 54.58 53.58 2rl8 n ASN 71 Cb 0.66 0.23 0.00 0.00 -2.08 0.00 0.00 39.78 38.59 2rl8 n ASN 71 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2rl8 n GLY 72 N 0.23 0.47 3.75 4.83 0.00 0.24 -5.00 105.19 109.71 2rl8 n GLY 72 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2rl8 n GLY 72 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2rl8 s LYS 73 N -0.23 4.43 -0.15 1.61 2.47 -1.23 -4.71 119.74 121.93 2rl8 s LYS 73 Ca 0.00 2.04 -0.07 0.00 -1.56 0.00 0.00 55.97 56.38 2rl8 s LYS 73 Cb 0.00 -3.17 -0.04 0.00 -1.46 0.00 0.00 37.83 33.16 2rl8 s LYS 73 CO 0.00 -0.14 0.10 -1.21 0.16 0.00 0.00 175.35 174.25 2rl8 s GLU 74 N -0.76 3.66 -0.12 4.03 2.02 -1.26 -1.07 118.70 125.20 2rl8 s GLU 74 Ca 0.52 -0.25 0.03 0.00 0.02 0.00 0.00 54.97 55.29 2rl8 s GLU 74 Cb -0.36 -3.18 0.00 0.00 0.10 0.00 0.00 34.13 30.69 2rl8 s GLU 74 CO 0.42 0.54 -0.22 0.99 0.02 0.00 0.00 175.26 177.01 2rl8 s THR 75 N -0.36 2.20 -0.22 3.63 2.01 0.07 -4.97 115.64 118.00 2rl8 s THR 75 Ca 0.10 -0.95 -0.28 0.00 0.31 0.00 0.00 61.69 60.87 2rl8 s THR 75 Cb -0.12 -1.87 0.00 0.00 0.01 0.00 0.00 72.50 70.53 2rl8 s THR 75 CO 0.01 0.55 0.98 -0.69 -0.69 0.00 0.00 174.62 174.79 2rl8 s VAL 76 N 0.56 4.73 -0.04 3.82 1.01 -1.26 -0.40 120.40 128.82 2rl8 s VAL 76 Ca -0.13 1.92 -0.07 0.00 0.00 0.00 0.00 61.98 63.70 2rl8 s VAL 76 Cb -0.17 -4.26 -0.29 0.00 0.00 0.00 0.00 36.38 31.66 2rl8 s VAL 76 CO 0.04 -0.13 0.69 0.58 0.00 0.00 0.00 175.10 176.28 2rl8 h VAL 77 N 5.39 0.96 -2.16 2.92 2.07 -1.46 0.20 116.25 124.17 2rl8 h VAL 77 Ca -0.22 -2.59 -0.07 0.00 0.82 0.00 0.00 66.70 64.65 2rl8 h VAL 77 Cb 1.08 2.71 -0.19 0.00 -1.52 0.00 0.00 31.29 33.37 2rl8 h VAL 77 CO 0.94 0.83 0.13 -0.83 0.02 0.00 0.00 177.57 178.66 2rl8 s GLY 78 N -5.12 -0.53 -0.09 2.17 0.00 -1.11 -2.22 107.32 100.42 2rl8 s GLY 78 Ca -0.14 1.17 0.00 0.00 0.00 0.00 0.00 44.72 45.76 2rl8 s GLY 78 CO 0.84 0.83 -0.09 0.50 0.00 0.00 0.00 173.10 175.18 2rl8 s ARG 79 N -1.28 2.98 0.00 2.90 0.52 -0.18 -0.08 118.95 123.81 2rl8 s ARG 79 Ca -0.11 -0.60 0.22 0.00 -0.52 0.00 0.00 55.73 54.72 2rl8 s ARG 79 Cb -0.01 -2.61 1.28 0.00 0.52 0.00 0.00 34.95 34.13 2rl8 s ARG 79 CO 0.09 0.50 1.72 1.97 0.02 0.00 0.00 175.30 179.59 2rl8 n PHE 80 N 2.72 0.00 1.53 -0.53 1.16 -1.12 -1.85 117.46 119.37 2rl8 n PHE 80 Ca -0.18 0.00 0.15 0.00 -1.87 0.00 0.00 57.45 55.55 2rl8 n PHE 80 Cb 0.53 -0.08 0.77 0.00 -1.61 0.00 0.00 39.48 39.08 2rl8 n PHE 80 CO 0.00 0.00 0.00 0.27 -1.87 0.00 0.00 176.76 175.16 2rl8 n ASN 81 N -1.08 0.08 -3.22 5.98 0.23 -1.26 -1.35 115.26 114.64 2rl8 n ASN 81 Ca 0.15 -0.38 -0.24 0.00 -0.53 0.00 0.00 54.58 53.59 2rl8 n ASN 81 Cb 0.11 -0.20 -0.06 0.00 -2.08 0.00 0.00 39.78 37.55 2rl8 n ASN 81 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 2rl8 n GLU 82 N -1.17 1.38 -3.95 -3.83 1.02 -0.77 -4.44 120.64 108.88 2rl8 n GLU 82 Ca 0.16 -3.72 -0.35 0.00 -0.02 0.00 0.00 57.16 53.23 2rl8 n GLU 82 Cb 0.22 -1.62 -0.06 0.00 -0.02 0.00 0.00 31.44 29.96 2rl8 n GLU 82 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2rl8 s THR 83 N -1.97 5.31 -0.02 2.62 2.01 -0.65 -1.41 115.64 121.52 2rl8 s THR 83 Ca 0.38 -0.02 0.03 0.00 0.31 0.00 0.00 61.69 62.39 2rl8 s THR 83 Cb 0.21 -3.38 0.00 0.00 0.01 0.00 0.00 72.50 69.34 2rl8 s THR 83 CO -0.08 0.49 -0.09 -1.58 -0.69 0.00 0.00 174.62 172.66 2rl8 s GLN 84 N -1.40 0.95 -0.09 4.92 0.74 -0.38 -4.16 119.66 120.24 2rl8 s GLN 84 Ca 0.20 -0.32 -0.06 0.00 0.05 0.00 0.00 55.36 55.23 2rl8 s GLN 84 Cb -0.12 -0.89 0.03 0.00 1.10 0.00 0.00 33.01 33.13 2rl8 s GLN 84 CO 0.10 0.13 0.21 0.96 -0.55 0.00 0.00 175.29 176.14 2rl8 s ILE 85 N 0.12 -0.03 0.11 -2.34 -4.36 -1.26 -0.64 121.20 112.80 2rl8 s ILE 85 Ca -0.02 0.10 -0.13 0.00 -0.26 0.00 0.00 60.65 60.33 2rl8 s ILE 85 Cb -0.08 -0.32 0.02 0.00 1.25 0.00 0.00 42.46 43.33 2rl8 s ILE 85 CO 0.00 0.04 0.32 0.72 0.24 0.00 0.00 174.94 176.26 2rl8 s PHE 86 N 0.79 -0.07 0.09 1.37 -0.71 -0.74 -4.67 117.98 114.05 2rl8 s PHE 86 Ca -0.06 -0.27 0.03 0.00 -1.04 0.00 0.00 56.93 55.59 2rl8 s PHE 86 Cb -0.07 0.14 -0.04 0.00 -1.21 0.00 0.00 43.02 41.84 2rl8 s PHE 86 CO -0.05 -0.63 -0.09 1.14 -1.34 0.00 0.00 175.22 174.26 2rl8 s GLN 87 N -3.73 0.82 0.00 1.99 -2.07 -1.26 -0.50 119.66 114.91 2rl8 s GLN 87 Ca 0.03 -1.19 0.00 0.00 -1.82 0.00 0.00 55.36 52.38 2rl8 s GLN 87 Cb 0.03 -0.41 0.00 0.00 -1.09 0.00 0.00 33.01 31.54 2rl8 s GLN 87 CO -0.11 0.05 0.00 0.41 -1.32 0.00 0.00 175.29 174.32 2rl8 n GLY 88 N 0.42 7.38 0.28 2.60 0.00 -0.15 -5.00 105.19 110.71 2rl8 n GLY 88 Ca -0.15 -2.03 -0.01 0.00 0.00 0.00 0.00 46.02 43.82 2rl8 n GLY 88 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2rl8 h SER 89 N 0.00 0.58 -0.02 1.61 4.64 -2.01 -3.34 113.55 115.00 2rl8 h SER 89 Ca 0.00 -0.12 -0.17 0.00 -0.47 0.00 0.00 61.79 61.03 2rl8 h SER 89 Cb 0.00 -0.15 -0.33 0.00 -0.31 0.00 0.00 62.40 61.61 2rl8 h SER 89 CO 0.00 0.65 -0.87 -0.46 -0.87 0.00 0.00 176.83 175.28 2rl8 n ASN 90 N -4.26 0.55 -3.55 4.97 6.94 -1.26 -3.63 115.26 115.02 2rl8 n ASN 90 Ca 0.02 -2.00 -0.11 0.00 -0.02 0.00 0.00 54.58 52.46 2rl8 n ASN 90 Cb 0.26 -0.16 -0.03 0.00 -2.36 0.00 0.00 39.78 37.49 2rl8 n ASN 90 CO 0.00 0.00 0.00 -1.66 -1.03 0.00 0.00 177.26 174.57 2rl8 s TRP 91 N -0.19 -0.34 -0.02 -2.53 1.48 -1.16 -1.56 118.94 114.63 2rl8 s TRP 91 Ca 0.26 0.06 0.01 0.00 -1.06 0.00 0.00 56.10 55.37 2rl8 s TRP 91 Cb 0.30 0.40 0.01 0.00 -1.16 0.00 0.00 33.47 33.02 2rl8 s TRP 91 CO -0.13 -0.78 -0.03 0.42 -4.06 0.00 0.00 176.95 172.37 2rl8 s ILE 92 N -3.79 0.33 -0.16 0.66 1.01 0.17 -0.98 121.20 118.45 2rl8 s ILE 92 Ca 0.03 -0.08 -0.03 0.00 0.00 0.00 0.00 60.65 60.57 2rl8 s ILE 92 Cb 0.00 -0.35 -0.02 0.00 0.01 0.00 0.00 42.46 42.10 2rl8 s ILE 92 CO -0.12 0.14 -0.05 -0.32 0.00 0.00 0.00 174.94 174.59 2rl8 s MET 93 N 0.51 3.58 -0.07 2.79 1.75 0.35 -0.32 119.30 127.89 2rl8 s MET 93 Ca -0.06 -0.56 0.05 0.00 -1.25 0.00 0.00 55.69 53.87 2rl8 s MET 93 Cb -0.09 -2.89 -0.01 0.00 2.84 0.00 0.00 34.83 34.69 2rl8 s MET 93 CO -0.01 0.17 -0.25 -1.17 -0.65 0.00 0.00 175.02 173.12 2rl8 s LEU 94 N 0.54 2.08 -0.06 4.11 2.96 -0.23 -1.78 118.68 126.30 2rl8 s LEU 94 Ca -0.04 -0.53 0.02 0.00 -0.22 0.00 0.00 54.13 53.36 2rl8 s LEU 94 Cb -0.15 -1.39 0.02 0.00 0.50 0.00 0.00 46.19 45.17 2rl8 s LEU 94 CO 0.03 0.21 -0.10 -0.63 -1.32 0.00 0.00 176.35 174.54 2rl8 s ILE 95 N 0.03 0.98 -0.22 6.68 1.01 0.19 -0.19 121.20 129.68 2rl8 s ILE 95 Ca -0.09 -0.38 -0.02 0.00 0.00 0.00 0.00 60.65 60.15 2rl8 s ILE 95 Cb -0.15 -0.92 0.01 0.00 0.01 0.00 0.00 42.46 41.41 2rl8 s ILE 95 CO 0.06 0.32 -0.08 -0.31 0.00 0.00 0.00 174.94 174.93 2rl8 s TYR 96 N 0.76 2.95 0.26 3.97 2.02 -0.09 -1.25 117.35 125.97 2rl8 s TYR 96 Ca -0.13 -1.27 0.04 0.00 -0.37 0.00 0.00 57.07 55.34 2rl8 s TYR 96 Cb -0.15 -2.05 0.04 0.00 -0.40 0.00 0.00 41.96 39.40 2rl8 s TYR 96 CO 0.02 -0.66 0.34 1.63 -1.57 0.00 0.00 175.55 175.31 2rl8 n LYS 97 N 4.72 0.87 -1.41 -0.62 5.02 -0.50 -0.89 118.16 125.35 2rl8 n LYS 97 Ca -0.18 -1.47 -0.04 0.00 -2.02 0.00 0.00 58.31 54.60 2rl8 n LYS 97 Cb 0.50 -0.06 -0.01 0.00 -0.02 0.00 0.00 35.03 35.43 2rl8 n LYS 97 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2rl8 n GLY 98 N 1.78 0.55 3.77 0.72 0.00 -1.24 -1.01 105.19 109.76 2rl8 n GLY 98 Ca 0.06 -0.83 -0.30 0.00 0.00 0.00 0.00 46.02 44.95 2rl8 n GLY 98 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2rl8 s GLY 99 N -2.91 1.69 0.45 -0.02 0.00 -0.34 -4.35 107.32 101.84 2rl8 s GLY 99 Ca 0.00 -1.12 -0.25 0.00 0.00 0.00 0.00 44.72 43.35 2rl8 s GLY 99 CO 0.00 -0.27 1.35 0.99 0.00 0.00 0.00 173.10 175.17 2rl8 s ASP 100 N -4.44 5.95 0.42 1.64 1.01 0.69 -3.32 116.67 118.63 2rl8 s ASP 100 Ca 0.73 2.75 -0.25 0.00 0.71 0.00 0.00 52.55 56.49 2rl8 s ASP 100 Cb -0.06 -2.64 -0.08 0.00 1.01 0.00 0.00 42.92 41.15 2rl8 s ASP 100 CO 0.55 -1.10 1.24 -1.61 0.21 0.00 0.00 175.17 174.45 2rl8 s GLU 101 N -2.47 3.90 0.55 8.23 2.02 -1.26 -1.56 118.70 128.11 2rl8 s GLU 101 Ca 0.61 1.99 -0.19 0.00 0.02 0.00 0.00 54.97 57.41 2rl8 s GLU 101 Cb -0.40 -2.63 -0.05 0.00 0.10 0.00 0.00 34.13 31.14 2rl8 s GLU 101 CO 0.51 -0.50 1.09 0.71 0.02 0.00 0.00 175.26 177.09 2rl8 s TYR 102 N -1.36 2.79 -0.13 1.61 2.02 -0.73 -4.89 117.35 116.66 2rl8 s TYR 102 Ca 0.59 1.55 0.19 0.00 -0.37 0.00 0.00 57.07 59.03 2rl8 s TYR 102 Cb -0.34 -3.18 -0.26 0.00 -0.40 0.00 0.00 41.96 37.78 2rl8 s TYR 102 CO 0.43 -1.34 0.33 -0.25 -1.57 0.00 0.00 175.55 173.16 2rl8 n ASP 103 N -1.46 0.14 -0.05 2.29 8.00 -1.26 -4.36 116.55 119.84 2rl8 n ASP 103 Ca 0.10 0.06 0.00 0.00 0.71 0.00 0.00 54.79 55.67 2rl8 n ASP 103 Cb 0.52 1.21 0.00 0.00 -0.02 0.00 0.00 41.12 42.83 2rl8 n ASP 103 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2rl8 n ASN 104 N -2.60 0.14 -4.30 -2.24 3.02 -1.26 -4.87 115.26 103.14 2rl8 n ASN 104 Ca -0.19 -1.17 -0.16 0.00 -0.03 0.00 0.00 54.58 53.03 2rl8 n ASN 104 Cb 0.90 -0.02 -0.10 0.00 -0.61 0.00 0.00 39.78 39.95 2rl8 n ASN 104 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 2rl8 s HIS 105 N -0.08 1.45 -1.53 3.10 3.76 -1.26 -4.89 115.29 115.85 2rl8 s HIS 105 Ca 0.00 -0.84 -0.15 0.00 -0.15 0.00 0.00 55.06 53.92 2rl8 s HIS 105 Cb 0.00 -0.79 0.13 0.00 1.11 0.00 0.00 32.58 33.03 2rl8 s HIS 105 CO 0.00 0.03 0.69 0.00 -0.85 0.00 0.00 174.74 174.62 2rl8 n GLY 107 N -1.31 0.40 2.40 0.00 0.00 -1.26 -2.16 105.19 103.26 2rl8 n GLY 107 Ca 0.05 -0.03 -0.20 0.00 0.00 0.00 0.00 46.02 45.84 2rl8 n GLY 107 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2rl8 n ARG 108 N -2.76 -1.71 -1.53 1.61 1.74 0.54 -4.98 116.66 109.56 2rl8 n ARG 108 Ca -0.23 0.97 -0.31 0.00 -0.77 0.00 0.00 57.85 57.52 2rl8 n ARG 108 Cb 0.68 -5.59 0.07 0.00 -1.02 0.00 0.00 32.46 26.60 2rl8 n ARG 108 CO 0.00 0.00 0.00 -1.83 -1.52 0.00 0.00 177.63 174.28 2rl8 s GLU 109 N -5.03 2.49 0.36 5.56 -1.05 -0.92 -4.13 118.70 115.98 2rl8 s GLU 109 Ca 0.01 0.83 -0.27 0.00 -0.15 0.00 0.00 54.97 55.39 2rl8 s GLU 109 Cb -0.00 -1.95 -0.09 0.00 -0.44 0.00 0.00 34.13 31.64 2rl8 s GLU 109 CO 0.01 -1.39 1.24 -0.65 0.95 0.00 0.00 175.26 175.43 2rl8 s GLN 110 N -5.08 4.23 0.92 -4.83 -0.21 -1.26 -1.77 119.66 111.65 2rl8 s GLN 110 Ca 0.60 2.04 -0.11 0.00 0.02 0.00 0.00 55.36 57.91 2rl8 s GLN 110 Cb -0.14 -2.91 0.14 0.00 1.00 0.00 0.00 33.01 31.10 2rl8 s GLN 110 CO 0.55 -0.24 1.11 1.03 -2.12 0.00 0.00 175.29 175.62 2rl8 s ARG 111 N -1.98 1.05 -0.05 2.91 0.52 -0.60 -4.67 118.95 116.13 2rl8 s ARG 111 Ca 0.52 1.24 -0.08 0.00 -0.52 0.00 0.00 55.73 56.90 2rl8 s ARG 111 Cb -0.36 -1.75 0.01 0.00 0.52 0.00 0.00 34.95 33.37 2rl8 s ARG 111 CO 0.47 -2.51 0.19 0.50 0.02 0.00 0.00 175.30 173.96 2rl8 s ARG 112 N -4.73 0.33 -0.14 3.54 3.52 -0.94 -1.20 118.95 119.34 2rl8 s ARG 112 Ca 0.65 0.05 -0.01 0.00 -0.13 0.00 0.00 55.73 56.29 2rl8 s ARG 112 Cb -0.21 0.15 -0.02 0.00 -1.56 0.00 0.00 34.95 33.31 2rl8 s ARG 112 CO 0.58 -0.06 -0.11 0.00 -0.81 0.00 0.00 175.30 174.90 2rl8 s ALA 113 N -0.42 2.71 -0.18 6.12 0.00 -0.07 -1.20 121.76 128.73 2rl8 s ALA 113 Ca -0.05 -0.87 0.01 0.00 0.00 0.00 0.00 51.96 51.05 2rl8 s ALA 113 Cb -0.03 -1.30 0.02 0.00 0.00 0.00 0.00 23.12 21.80 2rl8 s ALA 113 CO 0.01 0.24 -0.19 0.08 0.00 0.00 0.00 175.76 175.90 2rl8 s VAL 114 N 0.35 2.15 -0.19 0.00 1.01 0.30 -0.91 120.40 123.12 2rl8 s VAL 114 Ca -0.09 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 60.98 2rl8 s VAL 114 Cb -0.15 -1.90 0.02 0.00 0.00 0.00 0.00 36.38 34.34 2rl8 s VAL 114 CO 0.05 0.53 -0.18 -0.69 0.00 0.00 0.00 175.10 174.82 2rl8 s VAL 115 N 1.22 2.22 -0.39 2.92 1.01 0.73 -0.47 120.40 127.64 2rl8 s VAL 115 Ca 0.03 -0.92 -0.16 0.00 0.00 0.00 0.00 61.98 60.93 2rl8 s VAL 115 Cb -0.14 -1.95 0.01 0.00 0.00 0.00 0.00 36.38 34.30 2rl8 s VAL 115 CO -0.10 0.50 0.40 -0.32 0.00 0.00 0.00 175.10 175.58 2rl8 s MET 116 N 1.30 3.30 -0.33 2.72 1.75 0.27 -1.06 119.30 127.25 2rl8 s MET 116 Ca 0.05 -0.62 -0.12 0.00 -1.25 0.00 0.00 55.69 53.75 2rl8 s MET 116 Cb -0.13 -3.90 -0.01 0.00 2.84 0.00 0.00 34.83 33.63 2rl8 s MET 116 CO -0.12 -0.70 0.21 0.42 -0.65 0.00 0.00 175.02 174.18 2rl8 s ILE 117 N 2.07 5.04 0.07 10.11 1.01 0.56 -1.74 121.20 138.32 2rl8 s ILE 117 Ca 0.12 -0.29 -0.02 0.00 0.00 0.00 0.00 60.65 60.46 2rl8 s ILE 117 Cb -0.17 -3.58 -0.04 0.00 0.01 0.00 0.00 42.46 38.67 2rl8 s ILE 117 CO 0.13 0.02 0.24 -0.44 0.00 0.00 0.00 174.94 174.89 2rl8 s SER 118 N 1.68 6.40 0.27 3.58 0.01 0.01 -0.65 113.70 124.99 2rl8 s SER 118 Ca 0.06 0.36 -0.30 0.00 1.31 0.00 0.00 55.95 57.38 2rl8 s SER 118 Cb -0.17 -2.00 -0.10 0.00 0.21 0.00 0.00 66.02 63.96 2rl8 s SER 118 CO 0.09 0.16 1.45 0.00 0.41 0.00 0.00 173.24 175.35 2rl8 s ASN 120 N 0.25 0.36 0.00 0.00 3.84 -1.09 -4.77 114.94 113.54 2rl8 s ASN 120 Ca 0.58 0.25 0.19 0.00 0.21 0.00 0.00 52.86 54.09 2rl8 s ASN 120 Cb -0.43 1.01 0.92 0.00 -0.55 0.00 0.00 41.25 42.21 2rl8 s ASN 120 CO 0.46 -0.29 1.61 0.54 -2.79 0.00 0.00 177.10 176.63 2rl8 n ARG 121 N 5.36 0.17 0.00 0.43 1.74 -1.26 -2.09 116.66 121.01 2rl8 n ARG 121 Ca -0.04 0.13 0.12 0.00 -0.77 0.00 0.00 57.85 57.29 2rl8 n ARG 121 Cb 0.50 -1.50 0.25 0.00 -1.02 0.00 0.00 32.46 30.69 2rl8 n ARG 121 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 2rl8 n HIS 122 N -1.37 0.00 -3.66 -1.55 8.25 -1.26 -4.93 115.22 110.70 2rl8 n HIS 122 Ca 0.07 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.39 2rl8 n HIS 122 Cb 0.18 -0.04 -0.07 0.00 1.12 0.00 0.00 29.99 31.19 2rl8 n HIS 122 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 2rl8 s THR 123 N -2.28 0.04 0.14 1.59 -1.32 -1.22 -5.02 115.64 107.57 2rl8 s THR 123 Ca 0.26 -0.36 0.08 0.00 -1.21 0.00 0.00 61.69 60.46 2rl8 s THR 123 Cb 0.19 -0.86 -0.17 0.00 -1.51 0.00 0.00 72.50 70.16 2rl8 s THR 123 CO 0.45 -0.20 1.34 0.25 -2.21 0.00 0.00 174.62 174.25 2rl8 h LEU 124 N 3.26 0.00 -6.73 9.08 5.85 -1.89 0.74 115.31 125.63 2rl8 h LEU 124 Ca -0.30 0.00 0.19 0.00 0.84 0.00 0.00 57.88 58.62 2rl8 h LEU 124 Cb 1.18 0.00 -0.29 0.00 0.37 0.00 0.00 40.66 41.92 2rl8 h LEU 124 CO 0.41 0.93 0.56 0.00 -0.34 0.00 0.00 178.44 180.00 2rl8 s ALA 125 N -2.87 -2.73 0.21 1.25 0.00 -1.25 -3.86 121.76 112.50 2rl8 s ALA 125 Ca 0.01 1.99 -0.23 0.00 0.00 0.00 0.00 51.96 53.74 2rl8 s ALA 125 Cb 0.10 -2.01 0.06 0.00 0.00 0.00 0.00 23.12 21.27 2rl8 s ALA 125 CO 0.81 -0.55 0.92 0.34 0.00 0.00 0.00 175.76 177.28 2rl8 s ASP 126 N 1.51 -0.13 -1.35 0.00 -1.08 -0.68 -5.00 116.67 109.94 2rl8 s ASP 126 Ca -0.06 -0.59 -0.08 0.00 -0.52 0.00 0.00 52.55 51.30 2rl8 s ASP 126 Cb -0.03 0.58 0.02 0.00 -1.46 0.00 0.00 42.92 42.03 2rl8 s ASP 126 CO -0.13 -1.10 1.13 0.59 0.52 0.00 0.00 175.17 176.18 2rl8 n ASN 127 N -0.75 -5.40 -4.69 -0.34 3.02 -1.26 -0.71 115.26 105.13 2rl8 n ASN 127 Ca -0.05 -0.58 -0.42 0.00 -0.03 0.00 0.00 54.58 53.49 2rl8 n ASN 127 Cb 0.60 -4.92 -0.03 0.00 -0.61 0.00 0.00 39.78 34.82 2rl8 n ASN 127 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 2rl8 s PHE 128 N -3.33 2.48 -0.09 3.10 5.36 -1.26 -4.17 117.98 120.07 2rl8 s PHE 128 Ca 0.48 0.41 -0.04 0.00 -0.96 0.00 0.00 56.93 56.83 2rl8 s PHE 128 Cb -0.22 -3.90 0.05 0.00 -0.34 0.00 0.00 43.02 38.61 2rl8 s PHE 128 CO 0.74 -3.59 0.18 1.21 -1.46 0.00 0.00 175.22 172.30 2rl8 s ASN 129 N 2.36 0.26 0.21 6.13 3.04 0.49 -4.75 114.94 122.67 2rl8 s ASN 129 Ca 0.72 0.38 -0.30 0.00 0.04 0.00 0.00 52.86 53.70 2rl8 s ASN 129 Cb -0.38 0.32 -0.09 0.00 -1.54 0.00 0.00 41.25 39.56 2rl8 s ASN 129 CO 0.31 -0.20 1.28 -2.84 -3.04 0.00 0.00 177.10 172.61 2rl8 s PRO 130 N 1.78 4.42 -0.24 0.43 0.02 -1.26 -1.08 135.00 139.07 2rl8 s PRO 130 Ca -0.03 2.02 -0.13 0.00 0.02 0.00 0.00 61.00 62.88 2rl8 s PRO 130 Cb -0.12 -3.20 -0.10 0.00 0.02 0.00 0.00 34.50 31.11 2rl8 s PRO 130 CO -0.07 -0.20 -0.32 0.28 -0.33 0.00 0.00 177.00 176.37 2rl8 n VAL 131 N 2.43 1.38 -3.67 3.83 0.31 0.61 -4.91 118.33 118.30 2rl8 n VAL 131 Ca 0.05 -0.28 -0.02 0.00 -0.01 0.00 0.00 64.34 64.08 2rl8 n VAL 131 Cb 0.43 -1.90 -0.01 0.00 -0.91 0.00 0.00 33.84 31.45 2rl8 n VAL 131 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 2rl8 s SER 132 N -7.05 -0.15 -0.09 4.52 1.04 -1.11 -5.01 113.70 105.85 2rl8 s SER 132 Ca -0.33 -0.24 0.01 0.00 0.48 0.00 0.00 55.95 55.87 2rl8 s SER 132 Cb 0.12 0.34 0.02 0.00 0.10 0.00 0.00 66.02 66.59 2rl8 s SER 132 CO 0.43 -0.61 -0.12 -0.70 0.98 0.00 0.00 173.24 173.22 2rl8 s GLU 133 N -2.90 1.77 -0.40 4.02 2.12 -1.26 -0.39 118.70 121.66 2rl8 s GLU 133 Ca 0.12 -0.40 -0.11 0.00 0.36 0.00 0.00 54.97 54.94 2rl8 s GLU 133 Cb 0.01 -1.55 0.05 0.00 0.26 0.00 0.00 34.13 32.89 2rl8 s GLU 133 CO -0.02 -0.07 0.24 -2.00 -0.54 0.00 0.00 175.26 172.87 2rl8 s GLU 134 N 0.99 2.76 -0.06 4.30 2.56 0.19 -4.88 118.70 124.57 2rl8 s GLU 134 Ca -0.08 -1.22 0.08 0.00 0.00 0.00 0.00 54.97 53.75 2rl8 s GLU 134 Cb -0.15 -3.77 0.12 0.00 2.00 0.00 0.00 34.13 32.33 2rl8 s GLU 134 CO -0.00 -0.80 1.02 2.89 -0.56 0.00 0.00 175.26 177.80 2rl8 n ARG 135 N 4.99 0.89 -0.54 4.30 1.85 -1.26 -1.79 116.66 125.09 2rl8 n ARG 135 Ca -0.11 -1.68 0.08 0.00 -1.00 0.00 0.00 57.85 55.14 2rl8 n ARG 135 Cb 0.45 -0.98 0.31 0.00 -1.05 0.00 0.00 32.46 31.18 2rl8 n ARG 135 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2rl8 n GLY 136 N -0.67 3.14 3.78 2.89 0.00 -1.26 -4.29 105.19 108.78 2rl8 n GLY 136 Ca 0.07 -0.84 -0.22 0.00 0.00 0.00 0.00 46.02 45.03 2rl8 n GLY 136 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2rl8 s LYS 137 N -2.10 2.59 0.26 1.61 1.02 -1.26 -5.01 119.74 116.85 2rl8 s LYS 137 Ca 0.45 -1.34 0.26 0.00 0.02 0.00 0.00 55.97 55.35 2rl8 s LYS 137 Cb 0.31 -2.35 0.78 0.00 -0.52 0.00 0.00 37.83 36.05 2rl8 s LYS 137 CO 0.18 0.21 1.75 -0.39 -0.92 0.00 0.00 175.35 176.17 2rl8 h VAL 138 N 1.49 0.00 -2.51 3.17 -1.51 -1.94 -3.30 116.25 111.65 2rl8 h VAL 138 Ca -0.45 -0.52 0.12 0.00 -1.23 0.00 0.00 66.70 64.62 2rl8 h VAL 138 Cb 1.25 1.49 -0.10 0.00 -2.13 0.00 0.00 31.29 31.80 2rl8 h VAL 138 CO 0.61 0.00 0.41 0.00 -1.23 0.00 0.00 177.57 177.36 2rl8 s GLN 139 N -3.16 1.22 -1.29 5.19 -2.07 -1.26 -4.10 119.66 114.19 2rl8 s GLN 139 Ca 0.09 -0.61 -0.05 0.00 -1.82 0.00 0.00 55.36 52.97 2rl8 s GLN 139 Cb 0.11 0.46 0.01 0.00 -1.09 0.00 0.00 33.01 32.49 2rl8 s GLN 139 CO 0.58 -0.55 1.09 -0.25 -1.32 0.00 0.00 175.29 174.84 2rl8 n ASP 140 N -0.41 -4.24 -4.91 12.60 8.00 -1.26 -5.01 116.55 121.33 2rl8 n ASP 140 Ca -0.08 -0.59 -0.28 0.00 0.71 0.00 0.00 54.79 54.56 2rl8 n ASP 140 Cb 0.61 -5.04 0.04 0.00 -0.02 0.00 0.00 41.12 36.71 2rl8 n ASP 140 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2rl8 s PHE 142 N -3.13 -0.15 -0.17 0.00 -0.71 -0.74 -4.56 117.98 108.53 2rl8 s PHE 142 Ca 0.55 0.10 -0.07 0.00 -1.04 0.00 0.00 56.93 56.47 2rl8 s PHE 142 Cb -0.11 0.52 -0.04 0.00 -1.21 0.00 0.00 43.02 42.18 2rl8 s PHE 142 CO 0.47 -0.23 0.06 0.71 -1.34 0.00 0.00 175.22 174.89 2rl8 s TYR 143 N -2.44 3.25 -0.11 3.49 1.51 -0.34 -0.64 117.35 122.07 2rl8 s TYR 143 Ca 0.09 0.09 -0.02 0.00 -1.01 0.00 0.00 57.07 56.23 2rl8 s TYR 143 Cb -0.01 -2.03 -0.03 0.00 -0.11 0.00 0.00 41.96 39.78 2rl8 s TYR 143 CO -0.05 0.22 -0.04 -1.17 -1.11 0.00 0.00 175.55 173.39 2rl8 s LEU 144 N 0.15 3.28 0.10 -1.29 2.96 0.48 -0.54 118.68 123.81 2rl8 s LEU 144 Ca 0.04 -0.04 0.03 0.00 -0.22 0.00 0.00 54.13 53.94 2rl8 s LEU 144 Cb -0.12 -1.75 -0.04 0.00 0.50 0.00 0.00 46.19 44.77 2rl8 s LEU 144 CO 0.01 0.28 -0.08 -0.36 -1.32 0.00 0.00 176.35 174.87 2rl8 s PHE 145 N -0.29 0.95 0.12 5.38 0.40 0.38 -0.28 117.98 124.64 2rl8 s PHE 145 Ca 0.05 -0.77 0.05 0.00 -0.60 0.00 0.00 56.93 55.66 2rl8 s PHE 145 Cb -0.13 -0.53 -0.04 0.00 0.51 0.00 0.00 43.02 42.83 2rl8 s PHE 145 CO 0.02 -0.07 -0.12 -1.21 0.70 0.00 0.00 175.22 174.54 2rl8 s GLU 146 N -3.23 0.97 0.08 0.44 2.02 -0.24 -0.57 118.70 118.17 2rl8 s GLU 146 Ca 0.08 -1.23 -0.26 0.00 0.02 0.00 0.00 54.97 53.59 2rl8 s GLU 146 Cb 0.01 -0.76 0.08 0.00 0.10 0.00 0.00 34.13 33.56 2rl8 s GLU 146 CO -0.02 0.14 0.71 1.41 0.02 0.00 0.00 175.26 177.51 2rl8 s MET 147 N -2.78 1.10 0.03 1.61 1.75 -0.71 -0.38 119.30 119.91 2rl8 s MET 147 Ca 0.08 -0.35 0.01 0.00 -1.25 0.00 0.00 55.69 54.19 2rl8 s MET 147 Cb -0.04 0.51 -0.04 0.00 2.84 0.00 0.00 34.83 38.10 2rl8 s MET 147 CO 0.02 -0.47 0.05 -0.51 -0.65 0.00 0.00 175.02 173.46 2rl8 s ASP 148 N -2.51 5.42 -0.28 1.11 1.01 0.12 -0.81 116.67 120.72 2rl8 s ASP 148 Ca 0.01 0.04 -0.22 0.00 0.71 0.00 0.00 52.55 53.09 2rl8 s ASP 148 Cb -0.01 -1.47 0.10 0.00 1.01 0.00 0.00 42.92 42.55 2rl8 s ASP 148 CO -0.10 0.24 0.84 -0.55 0.21 0.00 0.00 175.17 175.81 2rl8 s SER 149 N -1.89 -0.68 0.38 0.27 0.15 -0.43 -1.69 113.70 109.81 2rl8 s SER 149 Ca 0.24 1.21 0.28 0.00 0.70 0.00 0.00 55.95 58.38 2rl8 s SER 149 Cb -0.12 1.25 1.21 0.00 -1.71 0.00 0.00 66.02 66.66 2rl8 s SER 149 CO 0.15 -0.20 1.83 0.77 1.20 0.00 0.00 173.24 176.99 2rl8 h SER 150 N 5.36 0.00 0.83 5.45 4.64 -0.28 -2.27 113.55 127.29 2rl8 h SER 150 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 2rl8 h SER 150 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 2rl8 h SER 150 CO 0.11 0.00 0.00 -0.07 -0.87 0.00 0.00 176.83 176.00 2rl8 h LEU 151 N 0.00 0.00 -0.89 5.97 3.38 -1.83 -2.14 115.31 119.79 2rl8 h LEU 151 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2rl8 h LEU 151 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 2rl8 h LEU 151 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.53 2rl8 n ALA 152 N -2.04 2.57 -2.16 1.53 0.00 -0.88 -4.88 120.51 114.65 2rl8 n ALA 152 Ca 0.00 -0.44 -0.38 0.00 0.00 0.00 0.00 53.44 52.62 2rl8 n ALA 152 Cb 0.26 -1.18 -0.06 0.00 0.00 0.00 0.00 19.45 18.47 2rl8 n ALA 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50