#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yjm n GLY 5 N 0.00 -0.43 0.13 0.00 0.00 -1.26 -5.02 105.19 98.61 1yjm n GLY 5 Ca 0.00 -0.83 -0.16 0.00 0.00 0.00 0.00 46.02 45.03 1yjm n GLY 5 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1yjm h SER 6 N 0.00 0.43 -3.24 1.61 0.87 -2.00 -3.45 113.55 107.78 1yjm h SER 6 Ca 0.00 -0.74 -0.68 0.00 -1.23 0.00 0.00 61.79 59.15 1yjm h SER 6 Cb 0.00 -0.13 -0.14 0.00 -0.44 0.00 0.00 62.40 61.69 1yjm h SER 6 CO 0.00 1.11 -0.60 -0.13 -0.53 0.00 0.00 176.83 176.68 1yjm s ARG 7 N -3.29 3.09 0.00 2.24 0.52 -1.26 -4.87 118.95 115.39 1yjm s ARG 7 Ca -0.14 -0.37 0.00 0.00 -0.52 0.00 0.00 55.73 54.70 1yjm s ARG 7 Cb 0.03 -2.86 0.00 0.00 0.52 0.00 0.00 34.95 32.64 1yjm s ARG 7 CO 0.79 0.68 0.00 0.41 0.02 0.00 0.00 175.30 177.21 1yjm n GLY 8 N 2.21 -0.68 3.54 -3.53 0.00 -1.26 -3.58 105.19 101.88 1yjm n GLY 8 Ca -0.19 -1.10 -0.31 0.00 0.00 0.00 0.00 46.02 44.42 1yjm n GLY 8 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1yjm s ARG 9 N -2.00 2.34 -0.07 1.61 0.52 0.21 -4.93 118.95 116.63 1yjm s ARG 9 Ca 0.00 -0.84 -0.13 0.00 -0.52 0.00 0.00 55.73 54.24 1yjm s ARG 9 Cb 0.00 -2.36 -0.05 0.00 0.52 0.00 0.00 34.95 33.06 1yjm s ARG 9 CO 0.00 0.57 0.32 -0.51 0.02 0.00 0.00 175.30 175.70 1yjm s LEU 10 N -1.47 4.40 0.11 2.53 1.43 -1.26 -1.08 118.68 123.34 1yjm s LEU 10 Ca 0.16 0.74 -0.07 0.00 -1.03 0.00 0.00 54.13 53.93 1yjm s LEU 10 Cb -0.11 -2.41 -0.01 0.00 0.03 0.00 0.00 46.19 43.69 1yjm s LEU 10 CO 0.07 0.29 0.19 -1.66 0.23 0.00 0.00 176.35 175.47 1yjm s TRP 11 N -0.69 0.31 -0.19 0.29 1.48 -0.84 -1.18 118.94 118.12 1yjm s TRP 11 Ca 0.20 -0.73 -0.04 0.00 -1.06 0.00 0.00 56.10 54.47 1yjm s TRP 11 Cb -0.15 -0.12 -0.02 0.00 -1.16 0.00 0.00 33.47 32.02 1yjm s TRP 11 CO 0.09 -0.58 -0.02 -0.51 -4.06 0.00 0.00 176.95 171.87 1yjm s LEU 12 N -2.91 3.20 -0.17 -4.66 1.43 0.15 -0.43 118.68 115.30 1yjm s LEU 12 Ca 0.10 -0.20 -0.15 0.00 -1.03 0.00 0.00 54.13 52.85 1yjm s LEU 12 Cb 0.05 -1.80 -0.04 0.00 0.03 0.00 0.00 46.19 44.42 1yjm s LEU 12 CO -0.07 0.09 0.34 -1.58 0.23 0.00 0.00 176.35 175.36 1yjm s GLN 13 N 0.85 4.25 0.39 1.70 0.74 0.13 -2.34 119.66 125.38 1yjm s GLN 13 Ca 0.00 0.16 0.00 0.00 0.05 0.00 0.00 55.36 55.57 1yjm s GLN 13 Cb -0.14 -3.45 -0.02 0.00 1.10 0.00 0.00 33.01 30.49 1yjm s GLN 13 CO 0.02 0.16 0.60 -1.12 -0.55 0.00 0.00 175.29 174.40 1yjm s SER 14 N 0.64 6.16 0.84 6.67 0.01 -1.26 -1.27 113.70 125.48 1yjm s SER 14 Ca 0.18 0.43 -0.13 0.00 1.31 0.00 0.00 55.95 57.74 1yjm s SER 14 Cb -0.14 -1.90 0.07 0.00 0.21 0.00 0.00 66.02 64.27 1yjm s SER 14 CO 0.06 -0.43 0.97 -2.65 0.41 0.00 0.00 173.24 171.59 1yjm n PRO 15 N -1.90 -0.01 -1.63 12.44 -0.02 -1.26 -4.79 135.00 137.83 1yjm n PRO 15 Ca -0.03 0.07 -0.47 0.00 -2.02 0.00 0.00 63.50 61.05 1yjm n PRO 15 Cb 0.57 -2.25 -0.03 0.00 -0.02 0.00 0.00 33.50 31.76 1yjm n PRO 15 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1yjm n THR 16 N -3.42 0.81 -1.89 3.45 -1.04 -1.26 -1.25 114.28 109.68 1yjm n THR 16 Ca 0.12 -0.20 -0.08 0.00 -2.04 0.00 0.00 64.05 61.85 1yjm n THR 16 Cb 0.51 -1.20 -0.01 0.00 -1.82 0.00 0.00 70.33 67.81 1yjm n THR 16 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1yjm n GLY 17 N 2.21 0.30 0.00 3.41 0.00 -1.26 -5.03 105.19 104.82 1yjm n GLY 17 Ca 0.14 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.56 1yjm n GLY 17 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yjm n GLY 18 N -1.29 3.71 3.58 -0.02 0.00 -0.38 -5.11 105.19 105.68 1yjm n GLY 18 Ca -0.09 -2.14 -0.34 0.00 0.00 0.00 0.00 46.02 43.46 1yjm n GLY 18 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1yjm n PRO 19 N -0.33 0.05 -1.01 1.61 -0.02 -1.26 -5.00 135.00 129.04 1yjm n PRO 19 Ca 0.00 0.08 -0.30 0.00 -2.02 0.00 0.00 63.50 61.27 1yjm n PRO 19 Cb 0.00 -2.18 0.17 0.00 -0.02 0.00 0.00 33.50 31.46 1yjm n PRO 19 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 1yjm s PRO 20 N -3.78 0.73 0.08 0.52 0.02 -1.26 -4.58 135.00 126.73 1yjm s PRO 20 Ca 0.68 0.89 -0.37 0.00 0.02 0.00 0.00 61.00 62.22 1yjm s PRO 20 Cb -0.28 -1.74 -0.17 0.00 0.02 0.00 0.00 34.50 32.33 1yjm s PRO 20 CO 0.56 -2.63 1.25 -2.30 -0.33 0.00 0.00 177.00 173.56 1yjm n PRO 21 N -4.16 0.91 -3.36 5.54 -0.02 -1.26 -4.86 135.00 127.80 1yjm n PRO 21 Ca 0.07 0.33 -0.45 0.00 -2.02 0.00 0.00 63.50 61.42 1yjm n PRO 21 Cb 0.55 -1.91 -0.04 0.00 -0.02 0.00 0.00 33.50 32.07 1yjm n PRO 21 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1yjm s ILE 22 N 0.27 5.21 0.33 4.25 1.01 -0.99 -4.95 121.20 126.33 1yjm s ILE 22 Ca 0.84 -1.99 -0.26 0.00 0.00 0.00 0.00 60.65 59.23 1yjm s ILE 22 Cb -1.00 -4.30 -0.10 0.00 0.01 0.00 0.00 42.46 37.08 1yjm s ILE 22 CO 0.50 -0.93 0.98 -0.36 0.00 0.00 0.00 174.94 175.13 1yjm s PHE 23 N 0.92 3.63 -0.08 3.97 0.40 -1.26 -0.67 117.98 124.88 1yjm s PHE 23 Ca 0.10 1.76 -0.03 0.00 -0.60 0.00 0.00 56.93 58.16 1yjm s PHE 23 Cb -0.21 -3.00 -0.04 0.00 0.51 0.00 0.00 43.02 40.28 1yjm s PHE 23 CO -0.02 0.01 0.05 -0.51 0.70 0.00 0.00 175.22 175.45 1yjm s LEU 24 N -2.04 3.86 0.09 -0.37 1.43 -0.32 -4.97 118.68 116.36 1yjm s LEU 24 Ca 0.50 0.23 -0.35 0.00 -1.03 0.00 0.00 54.13 53.49 1yjm s LEU 24 Cb -0.21 -1.97 -0.15 0.00 0.03 0.00 0.00 46.19 43.90 1yjm s LEU 24 CO 0.27 0.37 1.54 -2.65 0.23 0.00 0.00 176.35 176.11 1yjm n PRO 25 N 1.93 1.80 -0.08 1.29 -0.02 -1.26 -4.63 135.00 134.02 1yjm n PRO 25 Ca -0.18 0.65 0.11 0.00 -2.02 0.00 0.00 63.50 62.06 1yjm n PRO 25 Cb 0.54 -2.38 0.35 0.00 -0.02 0.00 0.00 33.50 31.99 1yjm n PRO 25 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1yjm n SER 26 N 3.55 1.99 -1.02 2.55 7.64 -1.26 -4.11 113.62 122.96 1yjm n SER 26 Ca 0.18 -1.74 0.10 0.00 1.01 0.00 0.00 58.87 58.43 1yjm n SER 26 Cb 0.25 -0.11 0.19 0.00 -1.01 0.00 0.00 64.21 63.53 1yjm n SER 26 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1yjm n ASP 27 N 0.54 3.25 0.00 6.43 3.85 -1.26 -4.81 116.55 124.55 1yjm n ASP 27 Ca 0.17 -1.94 0.00 0.00 -0.71 0.00 0.00 54.79 52.31 1yjm n ASP 27 Cb 0.39 -0.23 0.00 0.00 -1.35 0.00 0.00 41.12 39.93 1yjm n ASP 27 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1yjm n GLY 28 N 1.29 0.59 3.76 6.12 0.00 -1.26 -5.06 105.19 110.63 1yjm n GLY 28 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 1yjm n GLY 28 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1yjm s GLN 29 N -0.88 3.49 0.38 1.61 -0.21 -1.26 -4.79 119.66 118.00 1yjm s GLN 29 Ca 0.00 1.95 -0.23 0.00 0.02 0.00 0.00 55.36 57.09 1yjm s GLN 29 Cb 0.00 -2.33 -0.10 0.00 1.00 0.00 0.00 33.01 31.58 1yjm s GLN 29 CO 0.00 -0.82 0.95 0.00 -2.12 0.00 0.00 175.29 173.30 1yjm s ALA 30 N -1.46 3.12 -0.15 6.09 0.00 -1.26 -4.60 121.76 123.50 1yjm s ALA 30 Ca 0.67 0.46 -0.00 0.00 0.00 0.00 0.00 51.96 53.09 1yjm s ALA 30 Cb -0.33 -3.17 0.04 0.00 0.00 0.00 0.00 23.12 19.66 1yjm s ALA 30 CO 0.39 0.15 -0.07 -1.17 0.00 0.00 0.00 175.76 175.06 1yjm s LEU 31 N -2.66 1.52 0.03 0.00 2.96 -0.24 -4.96 118.68 115.34 1yjm s LEU 31 Ca 0.57 -0.55 -0.23 0.00 -0.22 0.00 0.00 54.13 53.69 1yjm s LEU 31 Cb -0.14 -0.92 -0.05 0.00 0.50 0.00 0.00 46.19 45.58 1yjm s LEU 31 CO 0.18 -0.15 0.71 -0.69 -1.32 0.00 0.00 176.35 175.07 1yjm s VAL 32 N 1.64 4.79 0.16 1.68 1.01 -1.26 -0.65 120.40 127.76 1yjm s VAL 32 Ca 0.02 1.50 0.10 0.00 0.00 0.00 0.00 61.98 63.60 1yjm s VAL 32 Cb -0.14 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.14 1yjm s VAL 32 CO -0.08 0.38 -0.23 -0.76 0.00 0.00 0.00 175.10 174.41 1yjm s LEU 33 N -0.11 2.39 0.00 3.92 1.43 0.11 -4.99 118.68 121.43 1yjm s LEU 33 Ca 0.36 -0.81 0.00 0.00 -1.03 0.00 0.00 54.13 52.65 1yjm s LEU 33 Cb -0.20 -1.09 0.00 0.00 0.03 0.00 0.00 46.19 44.94 1yjm s LEU 33 CO 0.21 0.10 0.00 0.61 0.23 0.00 0.00 176.35 177.50 1yjm n GLY 34 N 0.54 -0.60 3.65 -3.19 0.00 -1.26 -1.37 105.19 102.96 1yjm n GLY 34 Ca -0.15 -0.62 -0.43 0.00 0.00 0.00 0.00 46.02 44.82 1yjm n GLY 34 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1yjm s ARG 35 N -0.51 4.02 0.00 1.61 3.52 0.22 -4.49 118.95 123.32 1yjm s ARG 35 Ca 0.00 2.01 0.00 0.00 -0.13 0.00 0.00 55.73 57.61 1yjm s ARG 35 Cb 0.00 -4.01 0.00 0.00 -1.56 0.00 0.00 34.95 29.38 1yjm s ARG 35 CO 0.00 -1.04 0.00 0.41 -0.81 0.00 0.00 175.30 173.86 1yjm n GLY 36 N 4.36 -0.55 0.29 8.12 0.00 -1.18 -4.54 105.19 111.67 1yjm n GLY 36 Ca 0.18 -1.15 0.17 0.00 0.00 0.00 0.00 46.02 45.22 1yjm n GLY 36 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1yjm h PRO 37 N 0.00 0.00 -0.29 1.61 0.13 -1.90 0.32 132.00 131.87 1yjm h PRO 37 Ca 0.00 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.95 1yjm h PRO 37 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1yjm h PRO 37 CO 0.00 0.05 -0.53 1.25 -0.23 0.00 0.00 178.00 178.54 1yjm h LEU 38 N 0.00 0.97 0.00 1.56 5.85 -1.95 -3.27 115.31 118.47 1yjm h LEU 38 Ca -0.00 -0.53 0.00 0.00 0.84 0.00 0.00 57.88 58.19 1yjm h LEU 38 Cb 0.35 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.10 1yjm h LEU 38 CO 0.01 1.32 -1.53 0.35 -0.34 0.00 0.00 178.44 178.24 1yjm n THR 39 N -4.03 0.08 -1.50 1.05 -2.24 -1.16 -4.78 114.28 101.69 1yjm n THR 39 Ca -0.04 -0.35 -0.17 0.00 -2.27 0.00 0.00 64.05 61.21 1yjm n THR 39 Cb 0.62 0.23 -0.07 0.00 -2.10 0.00 0.00 70.33 69.00 1yjm n THR 39 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1yjm n GLN 40 N -2.08 -1.54 -2.79 -0.78 6.02 0.11 -4.70 117.38 111.62 1yjm n GLN 40 Ca -0.01 1.11 -0.42 0.00 -0.01 0.00 0.00 57.00 57.68 1yjm n GLN 40 Cb 0.49 -5.51 -0.03 0.00 1.02 0.00 0.00 30.24 26.21 1yjm n GLN 40 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1yjm s VAL 41 N -2.48 4.89 -0.90 5.09 1.01 -1.23 -4.93 120.40 121.85 1yjm s VAL 41 Ca 0.00 1.88 0.08 0.00 0.00 0.00 0.00 61.98 63.94 1yjm s VAL 41 Cb 0.00 -4.24 0.13 0.00 0.00 0.00 0.00 36.38 32.27 1yjm s VAL 41 CO 0.00 0.13 0.93 0.35 0.00 0.00 0.00 175.10 176.51 1yjm n THR 42 N 4.12 0.40 -1.96 3.92 -2.24 -1.26 -3.11 114.28 114.14 1yjm n THR 42 Ca 0.05 -0.70 -0.42 0.00 -2.27 0.00 0.00 64.05 60.71 1yjm n THR 42 Cb 0.50 0.91 -0.03 0.00 -2.10 0.00 0.00 70.33 69.61 1yjm n THR 42 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1yjm s ASP 43 N -0.81 6.64 0.52 3.42 -1.08 -1.26 -4.89 116.67 119.21 1yjm s ASP 43 Ca 0.13 2.36 0.28 0.00 -0.52 0.00 0.00 52.55 54.79 1yjm s ASP 43 Cb 0.08 -2.55 1.45 0.00 -1.46 0.00 0.00 42.92 40.44 1yjm s ASP 43 CO 0.11 -0.91 2.07 -0.09 0.52 0.00 0.00 175.17 176.87 1yjm h ARG 44 N 9.05 0.00 0.00 4.34 2.43 -2.02 -1.61 114.38 126.57 1yjm h ARG 44 Ca -0.41 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 58.74 1yjm h ARG 44 Cb 1.19 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.74 1yjm h ARG 44 CO 0.94 0.12 -0.06 0.87 -1.51 0.00 0.00 179.97 180.32 1yjm h LYS 45 N 0.00 0.00 -6.25 0.20 1.57 -2.02 -3.42 116.57 106.65 1yjm h LYS 45 Ca -0.00 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.23 1yjm h LYS 45 Cb 0.34 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.61 1yjm h LYS 45 CO 0.02 0.06 0.23 0.00 -0.57 0.00 0.00 179.45 179.18 1yjm s SER 47 N 0.73 5.82 0.47 0.00 0.15 -1.26 -4.56 113.70 115.05 1yjm s SER 47 Ca 0.44 1.98 0.24 0.00 0.70 0.00 0.00 55.95 59.31 1yjm s SER 47 Cb -0.20 -2.56 1.15 0.00 -1.71 0.00 0.00 66.02 62.70 1yjm s SER 47 CO 0.23 -1.14 1.94 0.03 1.20 0.00 0.00 173.24 175.50 1yjm h ARG 48 N 0.91 0.00 -3.07 5.44 3.08 -1.92 0.64 114.38 119.47 1yjm h ARG 48 Ca -0.48 0.00 -0.62 0.00 0.07 0.00 0.00 59.98 58.94 1yjm h ARG 48 Cb 1.24 0.00 -0.42 0.00 0.08 0.00 0.00 29.97 30.87 1yjm h ARG 48 CO 0.57 0.20 -0.61 -0.80 -1.07 0.00 0.00 179.97 178.26 1yjm s ASN 49 N -6.27 4.48 -0.18 7.04 -0.87 -1.26 -4.07 114.94 113.81 1yjm s ASN 49 Ca -0.02 -3.66 -0.22 0.00 -1.57 0.00 0.00 52.86 47.40 1yjm s ASN 49 Cb 0.12 -1.53 -0.19 0.00 -0.02 0.00 0.00 41.25 39.63 1yjm s ASN 49 CO 0.62 -0.11 0.32 -0.61 -2.57 0.00 0.00 177.10 174.75 1yjm h GLN 50 N 5.59 0.00 -4.34 -0.60 5.75 -1.26 -2.93 115.11 117.31 1yjm h GLN 50 Ca 0.12 0.00 -0.24 0.00 -0.15 0.00 0.00 58.65 58.38 1yjm h GLN 50 Cb 0.79 0.00 -0.22 0.00 1.07 0.00 0.00 27.48 29.12 1yjm h GLN 50 CO 0.68 0.88 -0.72 0.14 -2.65 0.00 0.00 178.83 177.16 1yjm s VAL 51 N -2.28 0.38 -0.16 2.39 -7.23 -0.77 -0.22 120.40 112.52 1yjm s VAL 51 Ca -0.24 -0.97 -0.04 0.00 -1.81 0.00 0.00 61.98 58.92 1yjm s VAL 51 Cb 0.03 -0.47 -0.03 0.00 0.56 0.00 0.00 36.38 36.47 1yjm s VAL 51 CO 0.56 -0.39 -0.02 -0.70 -0.31 0.00 0.00 175.10 174.23 1yjm s GLU 52 N -1.45 3.68 -0.08 4.82 2.12 0.17 -0.71 118.70 127.25 1yjm s GLU 52 Ca -0.11 -0.49 0.02 0.00 0.36 0.00 0.00 54.97 54.74 1yjm s GLU 52 Cb -0.09 -2.94 -0.02 0.00 0.26 0.00 0.00 34.13 31.33 1yjm s GLU 52 CO -0.00 0.27 -0.14 -0.51 -0.54 0.00 0.00 175.26 174.34 1yjm s LEU 53 N 0.31 2.74 -0.17 2.70 1.43 0.18 -1.43 118.68 124.44 1yjm s LEU 53 Ca -0.03 -0.24 -0.00 0.00 -1.03 0.00 0.00 54.13 52.83 1yjm s LEU 53 Cb -0.14 -1.58 0.04 0.00 0.03 0.00 0.00 46.19 44.54 1yjm s LEU 53 CO 0.03 0.28 -0.07 -0.63 0.23 0.00 0.00 176.35 176.18 1yjm s ILE 54 N -0.32 1.30 0.20 -0.59 1.01 -0.66 -1.08 121.20 121.07 1yjm s ILE 54 Ca 0.03 -0.74 -0.17 0.00 0.00 0.00 0.00 60.65 59.77 1yjm s ILE 54 Cb -0.13 -1.43 -0.08 0.00 0.01 0.00 0.00 42.46 40.84 1yjm s ILE 54 CO 0.03 0.17 0.65 0.00 0.00 0.00 0.00 174.94 175.79 1yjm s ALA 55 N 1.55 3.47 -0.48 9.38 0.00 -1.26 -1.40 121.76 133.03 1yjm s ALA 55 Ca 0.00 0.03 0.03 0.00 0.00 0.00 0.00 51.96 52.02 1yjm s ALA 55 Cb -0.15 -2.69 0.14 0.00 0.00 0.00 0.00 23.12 20.42 1yjm s ALA 55 CO -0.08 0.38 0.29 0.34 0.00 0.00 0.00 175.76 176.69 1yjm s ASP 56 N -1.74 3.63 0.49 0.00 2.15 -0.11 -4.49 116.67 116.59 1yjm s ASP 56 Ca 0.42 -2.87 0.23 0.00 0.43 0.00 0.00 52.55 50.75 1yjm s ASP 56 Cb -0.15 -1.10 1.27 0.00 -0.30 0.00 0.00 42.92 42.64 1yjm s ASP 56 CO 0.20 -0.23 1.94 -0.65 -0.17 0.00 0.00 175.17 176.26 1yjm h PRO 57 N 6.41 0.16 -0.48 4.34 0.11 -1.87 0.15 132.00 140.82 1yjm h PRO 57 Ca 0.04 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 66.06 1yjm h PRO 57 Cb 0.90 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 31.95 1yjm h PRO 57 CO 0.52 0.11 -0.02 0.93 -0.21 0.00 0.00 178.00 179.33 1yjm h GLU 58 N 0.17 0.86 -0.00 1.05 5.08 -1.94 -2.98 114.58 116.82 1yjm h GLU 58 Ca 0.34 -0.28 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1yjm h GLU 58 Cb 1.09 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.26 1yjm h GLU 58 CO -0.06 0.91 -0.58 -1.13 -1.00 0.00 0.00 179.01 177.16 1yjm n SER 59 N -4.32 0.83 -3.61 1.42 3.41 -1.04 -4.98 113.62 105.32 1yjm n SER 59 Ca 0.01 -0.64 -0.22 0.00 -0.26 0.00 0.00 58.87 57.75 1yjm n SER 59 Cb 0.32 0.43 0.07 0.00 -0.26 0.00 0.00 64.21 64.77 1yjm n SER 59 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1yjm n ARG 60 N -1.25 -6.62 -4.33 4.33 1.74 0.02 -5.00 116.66 105.55 1yjm n ARG 60 Ca 0.07 0.76 -0.17 0.00 -0.77 0.00 0.00 57.85 57.74 1yjm n ARG 60 Cb 0.35 -5.70 -0.10 0.00 -1.02 0.00 0.00 32.46 25.99 1yjm n ARG 60 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1yjm s THR 61 N -3.39 1.12 -0.06 0.55 -4.23 -1.06 -3.91 115.64 104.66 1yjm s THR 61 Ca 0.31 -2.05 -0.01 0.00 -1.18 0.00 0.00 61.69 58.76 1yjm s THR 61 Cb -0.14 -2.28 0.03 0.00 1.34 0.00 0.00 72.50 71.45 1yjm s THR 61 CO 0.76 -0.38 0.00 -0.69 -0.54 0.00 0.00 174.62 173.77 1yjm s VAL 62 N -3.36 0.30 0.09 2.29 1.01 -0.50 -0.93 120.40 119.29 1yjm s VAL 62 Ca 0.27 0.12 -0.30 0.00 0.00 0.00 0.00 61.98 62.07 1yjm s VAL 62 Cb 0.05 -0.44 -0.05 0.00 0.00 0.00 0.00 36.38 35.94 1yjm s VAL 62 CO 0.08 0.22 0.96 0.00 0.00 0.00 0.00 175.10 176.36 1yjm s ALA 63 N 1.67 3.23 -0.21 5.51 0.00 -0.49 -0.78 121.76 130.69 1yjm s ALA 63 Ca 0.00 0.57 0.01 0.00 0.00 0.00 0.00 51.96 52.53 1yjm s ALA 63 Cb -0.13 -3.29 0.05 0.00 0.00 0.00 0.00 23.12 19.76 1yjm s ALA 63 CO -0.04 -0.06 -0.08 0.08 0.00 0.00 0.00 175.76 175.67 1yjm s VAL 64 N 0.17 1.56 -0.20 0.00 1.01 -0.06 -1.65 120.40 121.23 1yjm s VAL 64 Ca 0.48 -1.08 -0.09 0.00 0.00 0.00 0.00 61.98 61.29 1yjm s VAL 64 Cb -0.23 -1.73 -0.04 0.00 0.00 0.00 0.00 36.38 34.38 1yjm s VAL 64 CO 0.29 0.04 0.10 -0.75 0.00 0.00 0.00 175.10 174.78 1yjm s LYS 65 N 1.41 4.03 -0.01 2.72 2.20 -0.51 -1.18 119.74 128.40 1yjm s LYS 65 Ca -0.03 -0.31 -0.29 0.00 -0.36 0.00 0.00 55.97 54.98 1yjm s LYS 65 Cb -0.17 -3.33 -0.03 0.00 -1.51 0.00 0.00 37.83 32.79 1yjm s LYS 65 CO -0.07 0.22 0.95 -1.14 -0.36 0.00 0.00 175.35 174.95 1yjm s GLN 66 N 0.56 4.54 -0.03 4.03 0.74 -0.67 -0.66 119.66 128.17 1yjm s GLN 66 Ca 0.05 1.36 0.07 0.00 0.05 0.00 0.00 55.36 56.89 1yjm s GLN 66 Cb -0.12 -3.46 -0.10 0.00 1.10 0.00 0.00 33.01 30.42 1yjm s GLN 66 CO 0.01 -0.05 0.12 1.28 -0.55 0.00 0.00 175.29 176.09 1yjm n LEU 67 N 3.94 0.00 -4.84 3.68 4.77 0.70 -1.65 117.00 123.60 1yjm n LEU 67 Ca 0.05 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.72 1yjm n LEU 67 Cb 0.51 0.05 0.04 0.00 -2.33 0.00 0.00 43.42 41.68 1yjm n LEU 67 CO 0.51 0.05 0.71 -0.83 -1.33 0.00 0.00 177.39 176.50 1yjm s GLY 68 N -3.09 1.66 0.17 -0.72 0.00 -0.58 -4.89 107.32 99.86 1yjm s GLY 68 Ca -0.03 0.00 -0.08 0.00 0.00 0.00 0.00 44.72 44.61 1yjm s GLY 68 CO 0.29 0.31 1.53 -0.24 0.00 0.00 0.00 173.10 174.99 1yjm h VAL 69 N -0.61 1.27 -3.14 1.40 3.04 -1.91 -3.39 116.25 112.92 1yjm h VAL 69 Ca -0.44 -1.48 -0.59 0.00 -1.01 0.00 0.00 66.70 63.18 1yjm h VAL 69 Cb 1.21 1.31 -0.04 0.00 -2.01 0.00 0.00 31.29 31.76 1yjm h VAL 69 CO 0.59 0.50 -0.29 0.20 -1.01 0.00 0.00 177.57 177.55 1yjm s ASN 70 N -6.80 6.54 -0.00 3.17 0.01 -1.26 -4.81 114.94 111.79 1yjm s ASN 70 Ca -0.10 0.66 -0.30 0.00 -0.71 0.00 0.00 52.86 52.40 1yjm s ASN 70 Cb 0.12 -2.12 -0.06 0.00 0.41 0.00 0.00 41.25 39.60 1yjm s ASN 70 CO 0.86 0.10 1.46 -2.16 -1.51 0.00 0.00 177.10 175.86 1yjm s PRO 71 N -2.37 4.25 0.43 -0.60 0.04 -1.26 -4.84 135.00 130.65 1yjm s PRO 71 Ca 0.38 2.04 -0.08 0.00 0.04 0.00 0.00 61.00 63.38 1yjm s PRO 71 Cb -0.13 -3.63 -0.05 0.00 0.04 0.00 0.00 34.50 30.73 1yjm s PRO 71 CO 0.22 -0.64 0.77 -1.12 0.04 0.00 0.00 177.00 176.26 1yjm s SER 72 N 2.13 6.40 -0.13 6.66 0.01 -1.26 -1.70 113.70 125.82 1yjm s SER 72 Ca 0.66 1.02 0.01 0.00 1.31 0.00 0.00 55.95 58.95 1yjm s SER 72 Cb -0.33 -2.28 0.02 0.00 0.21 0.00 0.00 66.02 63.64 1yjm s SER 72 CO 0.27 -0.47 -0.13 -0.89 0.41 0.00 0.00 173.24 172.43 1yjm s THR 73 N -2.52 1.42 -0.43 1.44 2.01 -0.47 -0.90 115.64 116.18 1yjm s THR 73 Ca 0.49 -0.55 -0.07 0.00 0.31 0.00 0.00 61.69 61.87 1yjm s THR 73 Cb -0.10 -1.34 0.11 0.00 0.01 0.00 0.00 72.50 71.18 1yjm s THR 73 CO 0.37 0.43 0.27 -0.69 -0.69 0.00 0.00 174.62 174.31 1yjm s VAL 74 N 1.39 3.85 0.00 3.82 1.01 -0.34 -0.66 120.40 129.47 1yjm s VAL 74 Ca 0.02 -1.79 0.00 0.00 0.00 0.00 0.00 61.98 60.20 1yjm s VAL 74 Cb -0.13 -3.52 0.00 0.00 0.00 0.00 0.00 36.38 32.72 1yjm s VAL 74 CO -0.08 -0.67 0.00 0.61 0.00 0.00 0.00 175.10 174.96 1yjm n GLY 75 N 4.79 2.96 1.03 4.51 0.00 -0.35 -2.26 105.19 115.87 1yjm n GLY 75 Ca -0.07 -0.21 0.09 0.00 0.00 0.00 0.00 46.02 45.83 1yjm n GLY 75 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1yjm n VAL 76 N 0.00 0.90 -3.71 1.61 0.24 -1.26 -4.88 118.33 111.23 1yjm n VAL 76 Ca 0.00 -0.95 -0.38 0.00 -2.04 0.00 0.00 64.34 60.97 1yjm n VAL 76 Cb 0.00 0.59 -0.12 0.00 -1.47 0.00 0.00 33.84 32.84 1yjm n VAL 76 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 1yjm s HIS 77 N -1.06 3.26 -0.01 6.34 0.09 -0.96 -5.07 115.29 117.88 1yjm s HIS 77 Ca 0.37 -1.33 -0.30 0.00 -0.00 0.00 0.00 55.06 53.79 1yjm s HIS 77 Cb 0.20 -2.35 -0.03 0.00 -0.00 0.00 0.00 32.58 30.39 1yjm s HIS 77 CO 0.26 -0.72 1.10 -2.00 -0.00 0.00 0.00 174.74 173.38 1yjm s GLU 78 N 1.44 4.45 0.61 1.40 2.12 -1.26 -1.19 118.70 126.27 1yjm s GLU 78 Ca -0.01 1.57 0.03 0.00 0.36 0.00 0.00 54.97 56.93 1yjm s GLU 78 Cb -0.20 -3.46 0.08 0.00 0.26 0.00 0.00 34.13 30.81 1yjm s GLU 78 CO 0.04 -0.24 0.85 -0.51 -0.54 0.00 0.00 175.26 174.85 1yjm s LEU 79 N 1.47 3.15 0.16 2.70 1.43 -0.08 -4.99 118.68 122.53 1yjm s LEU 79 Ca 0.54 -0.39 0.00 0.00 -1.03 0.00 0.00 54.13 53.25 1yjm s LEU 79 Cb -0.24 -2.19 -0.04 0.00 0.03 0.00 0.00 46.19 43.75 1yjm s LEU 79 CO 0.25 -1.45 0.04 -0.54 0.23 0.00 0.00 176.35 174.88 1yjm s LYS 80 N -4.86 1.06 0.20 1.70 1.02 -1.26 -4.45 119.74 113.15 1yjm s LYS 80 Ca 0.62 -1.52 -0.32 0.00 0.02 0.00 0.00 55.97 54.77 1yjm s LYS 80 Cb -0.07 -0.03 -0.12 0.00 -0.52 0.00 0.00 37.83 37.09 1yjm s LYS 80 CO 0.40 -0.21 1.70 -2.30 -0.92 0.00 0.00 175.35 174.02 1yjm n PRO 81 N -0.20 2.66 0.00 -1.68 -0.02 -1.26 -1.28 135.00 133.22 1yjm n PRO 81 Ca -0.05 0.96 0.00 0.00 -2.02 0.00 0.00 63.50 62.39 1yjm n PRO 81 Cb 0.64 -2.79 0.00 0.00 -0.02 0.00 0.00 33.50 31.33 1yjm n PRO 81 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1yjm n GLY 82 N 3.86 2.40 3.94 -1.23 0.00 -0.66 -5.03 105.19 108.48 1yjm n GLY 82 Ca 0.16 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.94 1yjm n GLY 82 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1yjm s LEU 83 N 0.00 4.07 0.06 0.99 1.43 -0.40 -4.89 118.68 119.94 1yjm s LEU 83 Ca 0.00 0.43 0.04 0.00 -1.03 0.00 0.00 54.13 53.57 1yjm s LEU 83 Cb 0.00 -3.27 -0.03 0.00 0.03 0.00 0.00 46.19 42.92 1yjm s LEU 83 CO 0.00 -0.23 -0.11 -0.44 0.23 0.00 0.00 176.35 175.79 1yjm s SER 84 N -3.84 1.33 0.41 2.29 0.01 -1.26 -1.67 113.70 110.97 1yjm s SER 84 Ca 0.40 -0.61 0.04 0.00 1.31 0.00 0.00 55.95 57.09 1yjm s SER 84 Cb -0.10 -0.01 -0.02 0.00 0.21 0.00 0.00 66.02 66.10 1yjm s SER 84 CO 0.34 -0.14 0.15 -0.83 0.41 0.00 0.00 173.24 173.17 1yjm s GLY 85 N -1.73 2.62 -0.00 3.44 0.00 -0.33 -4.98 107.32 106.34 1yjm s GLY 85 Ca -0.05 -1.29 0.06 0.00 0.00 0.00 0.00 44.72 43.44 1yjm s GLY 85 CO 0.01 -1.79 -0.18 -0.45 0.00 0.00 0.00 173.10 170.70 1yjm s SER 86 N -3.59 2.11 -0.20 1.64 0.15 -1.26 -0.88 113.70 111.68 1yjm s SER 86 Ca 0.25 -0.36 -0.05 0.00 0.70 0.00 0.00 55.95 56.49 1yjm s SER 86 Cb 0.02 -0.22 -0.02 0.00 -1.71 0.00 0.00 66.02 64.09 1yjm s SER 86 CO 0.16 0.20 -0.01 -0.76 1.20 0.00 0.00 173.24 174.03 1yjm s LEU 87 N -0.58 3.22 0.39 3.45 1.43 0.04 -4.75 118.68 121.88 1yjm s LEU 87 Ca 0.07 -0.21 0.08 0.00 -1.03 0.00 0.00 54.13 53.03 1yjm s LEU 87 Cb -0.07 -1.81 0.00 0.00 0.03 0.00 0.00 46.19 44.34 1yjm s LEU 87 CO -0.00 0.07 0.54 -0.44 0.23 0.00 0.00 176.35 176.75 1yjm s SER 88 N 0.95 5.76 0.21 2.29 0.01 -1.26 -1.42 113.70 120.24 1yjm s SER 88 Ca 0.01 -0.35 -0.32 0.00 1.31 0.00 0.00 55.95 56.60 1yjm s SER 88 Cb -0.14 -0.84 -0.13 0.00 0.21 0.00 0.00 66.02 65.12 1yjm s SER 88 CO 0.02 -0.66 1.61 0.18 0.41 0.00 0.00 173.24 174.79 1yjm n LEU 89 N -1.79 3.63 0.00 2.44 4.77 -1.25 -1.39 117.00 123.41 1yjm n LEU 89 Ca 0.05 1.10 0.00 0.00 -0.03 0.00 0.00 56.01 57.13 1yjm n LEU 89 Cb 0.59 -1.51 0.00 0.00 -2.33 0.00 0.00 43.42 40.17 1yjm n LEU 89 CO 0.40 -0.08 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 1yjm n GLY 90 N 3.19 3.06 3.77 -0.72 0.00 -0.41 -5.01 105.19 109.07 1yjm n GLY 90 Ca 0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 1yjm n GLY 90 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1yjm s ASP 91 N -1.20 5.46 -0.06 1.61 1.01 -0.48 -4.70 116.67 118.32 1yjm s ASP 91 Ca 0.00 2.15 -0.01 0.00 0.71 0.00 0.00 52.55 55.40 1yjm s ASP 91 Cb 0.00 -2.57 -0.03 0.00 1.01 0.00 0.00 42.92 41.32 1yjm s ASP 91 CO 0.00 -1.40 0.01 0.54 0.21 0.00 0.00 175.17 174.53 1yjm s VAL 92 N -1.92 4.29 -0.28 -1.27 0.11 -1.26 -1.91 120.40 118.15 1yjm s VAL 92 Ca 0.72 -0.36 -0.07 0.00 -2.93 0.00 0.00 61.98 59.34 1yjm s VAL 92 Cb -0.24 -2.84 0.00 0.00 -1.53 0.00 0.00 36.38 31.77 1yjm s VAL 92 CO 0.32 0.53 0.08 -0.22 -3.33 0.00 0.00 175.10 172.47 1yjm s LEU 93 N -1.13 3.75 -0.36 2.54 2.96 0.98 -1.21 118.68 126.22 1yjm s LEU 93 Ca 0.16 -0.59 -0.20 0.00 -0.22 0.00 0.00 54.13 53.28 1yjm s LEU 93 Cb -0.11 -1.89 0.00 0.00 0.50 0.00 0.00 46.19 44.69 1yjm s LEU 93 CO 0.05 -0.16 0.61 -0.31 -1.32 0.00 0.00 176.35 175.22 1yjm s TYR 94 N 1.53 3.15 0.17 5.38 1.51 0.16 -0.01 117.35 129.24 1yjm s TYR 94 Ca 0.04 0.28 -0.14 0.00 -1.01 0.00 0.00 57.07 56.23 1yjm s TYR 94 Cb -0.17 -3.10 0.09 0.00 -0.11 0.00 0.00 41.96 38.67 1yjm s TYR 94 CO 0.03 -0.62 1.79 -0.07 -1.11 0.00 0.00 175.55 175.56 1yjm h LEU 95 N 9.33 0.36 -7.11 -1.29 3.38 -1.10 -1.23 115.31 117.64 1yjm h LEU 95 Ca -0.27 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.65 1yjm h LEU 95 Cb 1.11 -0.05 -0.22 0.00 0.09 0.00 0.00 40.66 41.59 1yjm h LEU 95 CO 0.82 0.25 0.01 0.54 0.09 0.00 0.00 178.44 180.16 1yjm s VAL 96 N -6.14 0.00 -1.48 1.22 0.11 -1.19 -4.03 120.40 108.88 1yjm s VAL 96 Ca -0.13 -0.01 -0.13 0.00 -2.93 0.00 0.00 61.98 58.78 1yjm s VAL 96 Cb 0.13 -0.86 0.10 0.00 -1.53 0.00 0.00 36.38 34.21 1yjm s VAL 96 CO 0.73 -0.01 0.74 0.59 -3.33 0.00 0.00 175.10 173.82 1yjm n ASN 97 N 2.58 -4.14 -0.97 3.54 3.02 -0.69 -0.80 115.26 117.80 1yjm n ASN 97 Ca -0.14 -0.66 -0.11 0.00 -0.03 0.00 0.00 54.58 53.64 1yjm n ASN 97 Cb 0.56 -3.36 -0.04 0.00 -0.61 0.00 0.00 39.78 36.33 1yjm n ASN 97 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1yjm n GLY 98 N -1.41 0.87 3.44 7.41 0.00 -1.26 -5.02 105.19 109.22 1yjm n GLY 98 Ca 0.02 -0.49 -0.22 0.00 0.00 0.00 0.00 46.02 45.34 1yjm n GLY 98 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1yjm s LEU 99 N -2.73 2.57 -0.71 0.99 1.43 0.02 -4.92 118.68 115.33 1yjm s LEU 99 Ca 0.00 -1.13 -0.01 0.00 -1.03 0.00 0.00 54.13 51.96 1yjm s LEU 99 Cb 0.00 -0.80 -0.01 0.00 0.03 0.00 0.00 46.19 45.42 1yjm s LEU 99 CO 0.00 -0.22 0.66 -1.22 0.23 0.00 0.00 176.35 175.80 1yjm n TYR 100 N -0.59 -2.66 -2.66 0.29 4.02 -1.26 -2.22 117.16 112.08 1yjm n TYR 100 Ca -0.06 1.00 -0.40 0.00 -0.01 0.00 0.00 57.90 58.44 1yjm n TYR 100 Cb 0.62 -3.89 -0.05 0.00 -0.02 0.00 0.00 39.34 36.00 1yjm n TYR 100 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 176.86 174.60 1yjm s PRO 101 N -3.15 4.77 -0.10 -0.72 0.04 -1.26 -2.45 135.00 132.12 1yjm s PRO 101 Ca 0.05 1.58 0.01 0.00 0.04 0.00 0.00 61.00 62.68 1yjm s PRO 101 Cb -0.01 -3.22 0.02 0.00 0.04 0.00 0.00 34.50 31.34 1yjm s PRO 101 CO 0.68 0.40 -0.10 -0.51 0.04 0.00 0.00 177.00 177.51 1yjm s LEU 102 N -1.33 1.42 -0.16 -3.56 1.43 0.98 -4.26 118.68 113.20 1yjm s LEU 102 Ca 0.43 -0.33 -0.09 0.00 -1.03 0.00 0.00 54.13 53.10 1yjm s LEU 102 Cb -0.27 -0.90 -0.05 0.00 0.03 0.00 0.00 46.19 45.00 1yjm s LEU 102 CO 0.34 -0.06 0.14 -0.89 0.23 0.00 0.00 176.35 176.12 1yjm s THR 103 N 1.32 5.44 -0.06 5.49 2.01 -0.40 -0.01 115.64 129.43 1yjm s THR 103 Ca -0.02 0.21 -0.30 0.00 0.31 0.00 0.00 61.69 61.90 1yjm s THR 103 Cb -0.14 -3.45 -0.02 0.00 0.01 0.00 0.00 72.50 68.90 1yjm s THR 103 CO -0.05 0.51 1.02 -0.22 -0.69 0.00 0.00 174.62 175.20 1yjm s LEU 104 N -0.22 4.29 0.34 4.42 2.96 -0.80 0.17 118.68 129.83 1yjm s LEU 104 Ca 0.11 1.61 0.03 0.00 -0.22 0.00 0.00 54.13 55.67 1yjm s LEU 104 Cb -0.12 -3.56 -0.05 0.00 0.50 0.00 0.00 46.19 42.97 1yjm s LEU 104 CO 0.01 -0.40 0.10 -0.13 -1.32 0.00 0.00 176.35 174.60 1yjm s ARG 105 N 1.70 1.69 -0.08 1.98 0.52 0.43 -1.28 118.95 123.90 1yjm s ARG 105 Ca 0.50 -1.97 -0.01 0.00 -0.52 0.00 0.00 55.73 53.74 1yjm s ARG 105 Cb -0.20 -0.62 0.03 0.00 0.52 0.00 0.00 34.95 34.68 1yjm s ARG 105 CO 0.22 -0.32 -0.03 -0.46 0.02 0.00 0.00 175.30 174.73 1yjm s TRP 106 N -3.38 0.94 -0.24 -0.53 -0.11 -1.26 -1.98 118.94 112.38 1yjm s TRP 106 Ca 0.33 -0.35 -0.07 0.00 1.22 0.00 0.00 56.10 57.22 1yjm s TRP 106 Cb 0.06 -0.93 -0.03 0.00 -1.50 0.00 0.00 33.47 31.08 1yjm s TRP 106 CO 0.15 -0.37 0.07 -2.00 -4.62 0.00 0.00 176.95 170.18 1yjm s GLU 107 N 1.77 3.69 0.73 5.86 2.12 -0.24 -4.98 118.70 127.64 1yjm s GLU 107 Ca 0.03 -0.46 -0.11 0.00 0.36 0.00 0.00 54.97 54.79 1yjm s GLU 107 Cb -0.13 -3.32 0.03 0.00 0.26 0.00 0.00 34.13 30.97 1yjm s GLU 107 CO -0.06 -0.15 1.07 -1.21 -0.54 0.00 0.00 175.26 174.38 1yjm s GLU 108 N 1.51 2.62 -0.13 4.30 2.02 -1.26 -0.62 118.70 127.14 1yjm s GLU 108 Ca 0.06 1.00 -0.13 0.00 0.02 0.00 0.00 54.97 55.92 1yjm s GLU 108 Cb -0.15 -1.95 -0.25 0.00 0.10 0.00 0.00 34.13 31.88 1yjm s GLU 108 CO 0.04 -1.34 0.41 -0.07 0.02 0.00 0.00 175.26 174.32 1yjm h LEU 109 N -0.90 0.34 0.00 1.80 3.38 -1.94 -3.46 115.31 114.53 1yjm h LEU 109 Ca -0.44 -0.84 0.00 0.00 0.09 0.00 0.00 57.88 56.69 1yjm h LEU 109 Cb 1.22 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.86 1yjm h LEU 109 CO 0.55 1.72 0.00 -1.54 0.09 0.00 0.00 178.44 179.26