#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h9n s ILE 9 N 0.00 2.07 -0.01 1.59 1.01 -1.26 -3.23 121.20 121.37 3h9n s ILE 9 Ca 0.00 0.06 0.01 0.00 0.00 0.00 0.00 60.65 60.72 3h9n s ILE 9 Cb 0.00 -3.04 0.00 0.00 0.01 0.00 0.00 42.46 39.43 3h9n s ILE 9 CO 0.00 0.01 -0.04 -1.61 0.00 0.00 0.00 174.94 173.29 3h9n s GLU 10 N -0.41 0.44 0.31 2.79 2.02 -0.73 -4.92 118.70 118.19 3h9n s GLU 10 Ca 0.64 -0.15 -0.29 0.00 0.02 0.00 0.00 54.97 55.19 3h9n s GLU 10 Cb -0.48 -0.44 -0.11 0.00 0.10 0.00 0.00 34.13 33.20 3h9n s GLU 10 CO 0.47 0.07 1.49 0.08 0.02 0.00 0.00 175.26 177.39 3h9n s VAL 11 N 0.09 2.29 0.00 2.63 1.01 -1.26 -2.45 120.40 122.71 3h9n s VAL 11 Ca -0.01 0.26 0.00 0.00 0.00 0.00 0.00 61.98 62.24 3h9n s VAL 11 Cb -0.04 -3.17 0.00 0.00 0.00 0.00 0.00 36.38 33.17 3h9n s VAL 11 CO -0.00 0.05 0.13 1.33 0.00 0.00 0.00 175.10 176.60 3h9n n VAL 12 N 1.60 0.02 -3.26 2.92 0.24 -0.34 -4.92 118.33 114.59 3h9n n VAL 12 Ca 0.05 -0.07 0.00 0.00 -2.04 0.00 0.00 64.34 62.28 3h9n n VAL 12 Cb 0.39 1.75 0.00 0.00 -1.47 0.00 0.00 33.84 34.51 3h9n n VAL 12 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3h9n n GLY 13 N -0.01 0.79 3.64 7.63 0.00 -1.19 0.13 105.19 116.17 3h9n n GLY 13 Ca 0.00 -0.68 -0.08 0.00 0.00 0.00 0.00 46.02 45.26 3h9n n GLY 13 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3h9n s LYS 14 N -0.07 0.61 0.41 1.61 2.20 0.24 -2.60 119.74 122.14 3h9n s LYS 14 Ca 0.00 0.89 -0.23 0.00 -0.36 0.00 0.00 55.97 56.27 3h9n s LYS 14 Cb 0.00 0.21 -0.10 0.00 -1.51 0.00 0.00 37.83 36.43 3h9n s LYS 14 CO 0.00 -0.10 0.98 -0.51 -0.36 0.00 0.00 175.35 175.36 3h9n s LEU 15 N 0.94 4.06 0.00 5.43 1.43 -0.70 -0.50 118.68 129.35 3h9n s LEU 15 Ca -0.04 1.82 0.00 0.00 -1.03 0.00 0.00 54.13 54.87 3h9n s LEU 15 Cb -0.05 -4.35 0.00 0.00 0.03 0.00 0.00 46.19 41.82 3h9n s LEU 15 CO -0.11 -0.37 0.00 0.61 0.23 0.00 0.00 176.35 176.71 3h9n n GLY 16 N -0.12 4.18 3.79 -3.19 0.00 -0.00 -0.56 105.19 109.28 3h9n n GLY 16 Ca 0.06 -1.76 -0.34 0.00 0.00 0.00 0.00 46.02 43.97 3h9n n GLY 16 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3h9n s SER 17 N 0.42 6.08 0.32 1.61 0.15 -1.26 -4.23 113.70 116.79 3h9n s SER 17 Ca 0.00 2.00 -0.29 0.00 0.70 0.00 0.00 55.95 58.36 3h9n s SER 17 Cb 0.00 -2.56 -0.10 0.00 -1.71 0.00 0.00 66.02 61.64 3h9n s SER 17 CO 0.00 -0.96 1.25 0.28 1.20 0.00 0.00 173.24 175.01 3h9n s THR 18 N -1.96 2.91 0.09 6.45 -1.32 -1.26 -0.96 115.64 119.59 3h9n s THR 18 Ca 0.69 0.92 0.10 0.00 -1.21 0.00 0.00 61.69 62.18 3h9n s THR 18 Cb -0.19 -3.58 -0.03 0.00 -1.51 0.00 0.00 72.50 67.18 3h9n s THR 18 CO 0.24 0.22 -0.25 -0.47 -2.21 0.00 0.00 174.62 172.14 3h9n s TYR 19 N -1.15 2.20 0.00 9.09 5.04 0.49 -4.87 117.35 128.16 3h9n s TYR 19 Ca 0.48 -0.39 0.00 0.00 -2.44 0.00 0.00 57.07 54.71 3h9n s TYR 19 Cb -0.38 -1.24 0.00 0.00 0.35 0.00 0.00 41.96 40.69 3h9n s TYR 19 CO 0.50 0.23 0.00 0.41 -1.34 0.00 0.00 175.55 175.35 3h9n n GLY 20 N 1.28 0.21 0.00 8.97 0.00 -1.26 -3.74 105.19 110.64 3h9n n GLY 20 Ca -0.18 -0.94 0.00 0.00 0.00 0.00 0.00 46.02 44.90 3h9n n GLY 20 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3h9n n ILE 21 N -0.36 0.00 -0.52 -0.61 3.06 -1.26 -4.76 119.36 114.91 3h9n n ILE 21 Ca 0.00 -0.38 0.11 0.00 -2.50 0.00 0.00 62.75 59.98 3h9n n ILE 21 Cb 0.00 1.20 0.35 0.00 0.54 0.00 0.00 39.64 41.73 3h9n n ILE 21 CO 0.00 0.00 0.00 0.54 -2.50 0.00 0.00 176.55 174.59 3h9n n ARG 22 N -0.15 3.30 0.00 9.51 1.74 -1.26 -3.10 116.66 126.70 3h9n n ARG 22 Ca 0.00 -2.81 0.00 0.00 -0.77 0.00 0.00 57.85 54.27 3h9n n ARG 22 Cb 0.05 -1.76 0.00 0.00 -1.02 0.00 0.00 32.46 29.73 3h9n n ARG 22 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h9n n GLY 23 N 1.40 2.49 3.74 -0.13 0.00 -1.26 -3.29 105.19 108.15 3h9n n GLY 23 Ca 0.26 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.92 3h9n n GLY 23 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3h9n s TRP 24 N -2.31 2.26 -0.02 1.61 0.52 -1.25 -4.70 118.94 115.06 3h9n s TRP 24 Ca 0.00 1.54 -0.19 0.00 0.02 0.00 0.00 56.10 57.47 3h9n s TRP 24 Cb 0.00 -3.49 0.04 0.00 -1.15 0.00 0.00 33.47 28.87 3h9n s TRP 24 CO 0.00 -2.40 0.41 -0.48 0.02 0.00 0.00 176.95 174.50 3h9n s LEU 25 N -4.48 0.44 1.06 2.99 2.34 -0.70 -0.38 118.68 119.95 3h9n s LEU 25 Ca 0.77 0.23 -0.13 0.00 0.06 0.00 0.00 54.13 55.06 3h9n s LEU 25 Cb -0.30 1.63 0.23 0.00 -0.56 0.00 0.00 46.19 47.18 3h9n s LEU 25 CO 0.38 -0.51 1.07 -0.13 -1.06 0.00 0.00 176.35 176.10 3h9n s ARG 26 N -1.41 -0.10 0.04 1.48 0.52 -0.14 -0.92 118.95 118.42 3h9n s ARG 26 Ca -0.12 0.65 -0.08 0.00 -0.52 0.00 0.00 55.73 55.66 3h9n s ARG 26 Cb -0.03 -1.66 -0.00 0.00 0.52 0.00 0.00 34.95 33.77 3h9n s ARG 26 CO 0.05 -3.12 0.16 -1.50 0.02 0.00 0.00 175.30 170.91 3h9n s ILE 27 N -2.77 0.12 -0.14 1.52 2.07 -1.15 -0.82 121.20 120.02 3h9n s ILE 27 Ca 0.66 -0.96 -0.03 0.00 -1.41 0.00 0.00 60.65 58.91 3h9n s ILE 27 Cb -0.21 -0.90 0.05 0.00 0.13 0.00 0.00 42.46 41.53 3h9n s ILE 27 CO 0.60 -0.53 0.06 -0.31 -1.91 0.00 0.00 174.94 172.85 3h9n s TYR 28 N -2.57 0.49 -0.17 3.50 2.02 0.35 -4.72 117.35 116.25 3h9n s TYR 28 Ca -0.05 -0.36 -0.07 0.00 -0.37 0.00 0.00 57.07 56.21 3h9n s TYR 28 Cb -0.01 -0.78 -0.04 0.00 -0.40 0.00 0.00 41.96 40.73 3h9n s TYR 28 CO -0.04 -0.46 0.08 -1.54 -1.57 0.00 0.00 175.55 172.01 3h9n s SER 29 N 2.03 5.80 0.00 2.29 1.04 -1.26 0.83 113.70 124.43 3h9n s SER 29 Ca 0.02 0.17 0.28 0.00 0.48 0.00 0.00 55.95 56.91 3h9n s SER 29 Cb -0.15 -1.95 1.14 0.00 0.10 0.00 0.00 66.02 65.16 3h9n s SER 29 CO -0.07 0.23 1.84 -1.20 0.98 0.00 0.00 173.24 175.02 3h9n n SER 30 N 3.14 0.14 -4.55 7.02 7.64 0.12 -4.88 113.62 122.26 3h9n n SER 30 Ca -0.17 0.16 -0.53 0.00 1.01 0.00 0.00 58.87 59.34 3h9n n SER 30 Cb 0.53 -0.29 -0.06 0.00 -1.01 0.00 0.00 64.21 63.38 3h9n n SER 30 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 3h9n n THR 31 N -1.41 0.23 -0.21 0.44 5.66 -1.07 -4.76 114.28 113.15 3h9n n THR 31 Ca 0.08 -0.06 0.19 0.00 -3.05 0.00 0.00 64.05 61.21 3h9n n THR 31 Cb 0.32 -0.54 0.32 0.00 -1.55 0.00 0.00 70.33 68.88 3h9n n THR 31 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 3h9n n GLU 32 N 2.02 -0.02 0.01 1.09 -0.58 -1.26 -3.34 120.64 118.56 3h9n n GLU 32 Ca 0.18 0.66 -0.01 0.00 -0.42 0.00 0.00 57.16 57.57 3h9n n GLU 32 Cb 0.17 -1.25 -0.00 0.00 -0.57 0.00 0.00 31.44 29.78 3h9n n GLU 32 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3h9n n GLN 33 N -3.87 0.06 0.00 3.49 -0.00 -1.26 -5.14 117.38 110.67 3h9n n GLN 33 Ca 0.20 0.02 0.00 0.00 -0.00 0.00 0.00 57.00 57.22 3h9n n GLN 33 Cb 0.74 -0.42 0.00 0.00 -0.00 0.00 0.00 30.24 30.56 3h9n n GLN 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3h9n n ALA 34 N -3.11 0.00 0.46 2.61 0.00 -1.21 -4.94 120.51 114.31 3h9n n ALA 34 Ca -0.02 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.47 3h9n n ALA 34 Cb 0.06 0.00 0.24 0.00 0.00 0.00 0.00 19.45 19.75 3h9n n ALA 34 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3h9n n GLU 35 N 0.00 0.14 0.31 0.00 1.02 -1.26 -3.22 120.64 117.63 3h9n n GLU 35 Ca 0.00 0.18 0.19 0.00 -0.02 0.00 0.00 57.16 57.52 3h9n n GLU 35 Cb 0.00 -1.50 0.97 0.00 -0.02 0.00 0.00 31.44 30.89 3h9n n GLU 35 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3h9n h SER 36 N 0.00 0.00 0.49 1.62 0.87 -1.93 -1.91 113.55 112.70 3h9n h SER 36 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 3h9n h SER 36 Cb 0.08 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.04 3h9n h SER 36 CO 0.00 0.02 0.00 -0.29 -0.53 0.00 0.00 176.83 176.03 3h9n h ILE 37 N 0.00 0.00 -0.00 2.23 2.10 -1.91 -2.30 117.51 117.62 3h9n h ILE 37 Ca -0.00 -0.24 0.00 0.00 1.08 0.00 0.00 64.86 65.70 3h9n h ILE 37 Cb 0.21 1.17 0.00 0.00 -1.09 0.00 0.00 36.82 37.11 3h9n h ILE 37 CO 0.00 0.00 -0.00 0.49 -1.08 0.00 0.00 178.15 177.56 3h9n n PHE 38 N -2.94 0.00 0.89 2.19 3.72 -0.72 -3.31 117.46 117.30 3h9n n PHE 38 Ca -0.01 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.44 3h9n n PHE 38 Cb 0.18 -0.30 0.15 0.00 -0.94 0.00 0.00 39.48 38.56 3h9n n PHE 38 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 3h9n n ASP 39 N -1.30 1.86 -4.14 4.37 8.00 -0.87 -4.87 116.55 119.60 3h9n n ASP 39 Ca 0.14 -2.02 -0.25 0.00 0.71 0.00 0.00 54.79 53.36 3h9n n ASP 39 Cb 0.25 -0.24 -0.16 0.00 -0.02 0.00 0.00 41.12 40.95 3h9n n ASP 39 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3h9n s TYR 40 N -1.57 1.57 -0.08 1.24 2.02 -1.21 -5.13 117.35 114.20 3h9n s TYR 40 Ca 0.23 -0.38 -0.12 0.00 -0.37 0.00 0.00 57.07 56.43 3h9n s TYR 40 Cb 0.12 -1.04 0.03 0.00 -0.40 0.00 0.00 41.96 40.67 3h9n s TYR 40 CO 0.15 -0.09 0.31 -0.65 -1.57 0.00 0.00 175.55 173.70 3h9n s GLN 41 N -0.16 0.48 0.25 -0.62 -1.52 -1.26 -4.63 119.66 112.20 3h9n s GLN 41 Ca 0.01 0.21 -0.04 0.00 -1.95 0.00 0.00 55.36 53.59 3h9n s GLN 41 Cb -0.09 0.22 0.06 0.00 -0.22 0.00 0.00 33.01 32.98 3h9n s GLN 41 CO 0.01 -0.09 0.35 -0.35 -0.25 0.00 0.00 175.29 174.95 3h9n n PRO 42 N 2.30 -0.28 -3.84 2.91 -0.04 -1.26 -4.97 135.00 129.82 3h9n n PRO 42 Ca -0.16 -0.56 -0.21 0.00 -0.04 0.00 0.00 63.50 62.52 3h9n n PRO 42 Cb 0.57 -0.35 -0.04 0.00 -0.04 0.00 0.00 33.50 33.64 3h9n n PRO 42 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 3h9n s TRP 43 N -1.67 2.87 -0.08 0.54 0.52 -0.06 -4.72 118.94 116.34 3h9n s TRP 43 Ca 0.20 -0.32 -0.01 0.00 0.02 0.00 0.00 56.10 55.99 3h9n s TRP 43 Cb -0.01 -1.79 0.03 0.00 -1.15 0.00 0.00 33.47 30.55 3h9n s TRP 43 CO 0.14 0.19 -0.03 -0.06 0.02 0.00 0.00 176.95 177.21 3h9n s PHE 44 N -2.33 0.93 -0.18 -1.98 0.08 0.26 -0.78 117.98 113.98 3h9n s PHE 44 Ca 0.41 -0.34 -0.08 0.00 0.12 0.00 0.00 56.93 57.04 3h9n s PHE 44 Cb -0.05 -0.90 -0.04 0.00 -0.57 0.00 0.00 43.02 41.45 3h9n s PHE 44 CO 0.26 -0.35 0.09 -0.51 -0.10 0.00 0.00 175.22 174.61 3h9n s LEU 45 N 1.67 4.00 -0.54 -0.37 1.43 -0.15 0.36 118.68 125.07 3h9n s LEU 45 Ca 0.01 0.17 -0.24 0.00 -1.03 0.00 0.00 54.13 53.05 3h9n s LEU 45 Cb -0.13 -2.01 0.04 0.00 0.03 0.00 0.00 46.19 44.12 3h9n s LEU 45 CO -0.05 0.21 0.95 -0.75 0.23 0.00 0.00 176.35 176.94 3h9n s LYS 46 N 0.16 3.36 -0.08 1.70 2.20 -0.76 -0.28 119.74 126.03 3h9n s LYS 46 Ca 0.06 -0.20 0.03 0.00 -0.36 0.00 0.00 55.97 55.51 3h9n s LYS 46 Cb -0.12 -4.04 0.00 0.00 -1.51 0.00 0.00 37.83 32.17 3h9n s LYS 46 CO -0.00 -1.47 -0.19 0.42 -0.36 0.00 0.00 175.35 173.76 3h9n s ILE 47 N 3.97 1.62 -1.49 5.43 1.01 0.37 -4.46 121.20 127.65 3h9n s ILE 47 Ca 0.32 -0.77 -0.11 0.00 0.00 0.00 0.00 60.65 60.09 3h9n s ILE 47 Cb -0.12 -1.42 0.07 0.00 0.01 0.00 0.00 42.46 41.00 3h9n s ILE 47 CO 0.20 0.46 0.92 0.29 0.00 0.00 0.00 174.94 176.81 3h9n n LYS 48 N 3.58 -5.35 -1.57 2.79 4.01 -1.26 -1.10 118.16 119.26 3h9n n LYS 48 Ca -0.20 0.60 -0.18 0.00 -0.51 0.00 0.00 58.31 58.01 3h9n n LYS 48 Cb 0.52 -5.40 -0.07 0.00 -0.51 0.00 0.00 35.03 29.57 3h9n n LYS 48 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3h9n n GLY 49 N -1.68 1.62 3.19 0.72 0.00 -1.26 -4.98 105.19 102.80 3h9n n GLY 49 Ca -0.03 -0.16 -0.19 0.00 0.00 0.00 0.00 46.02 45.63 3h9n n GLY 49 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3h9n s GLU 50 N -3.60 0.87 -0.34 1.61 2.12 -0.26 -5.10 118.70 114.00 3h9n s GLU 50 Ca 0.00 -0.99 -0.24 0.00 0.36 0.00 0.00 54.97 54.10 3h9n s GLU 50 Cb 0.00 -0.92 0.01 0.00 0.26 0.00 0.00 34.13 33.48 3h9n s GLU 50 CO 0.00 0.21 0.84 -1.58 -0.54 0.00 0.00 175.26 174.19 3h9n s TRP 51 N -1.25 3.14 -0.22 5.30 0.23 -1.26 -0.48 118.94 124.40 3h9n s TRP 51 Ca -0.01 0.76 -0.05 0.00 -2.03 0.00 0.00 56.10 54.77 3h9n s TRP 51 Cb -0.10 -3.42 -0.02 0.00 0.03 0.00 0.00 33.47 29.97 3h9n s TRP 51 CO 0.03 -0.70 -0.01 -0.65 0.96 0.00 0.00 176.95 176.58 3h9n s GLN 52 N 3.18 3.49 0.41 4.98 -1.52 0.61 -4.88 119.66 125.94 3h9n s GLN 52 Ca 0.34 -0.57 -0.26 0.00 -1.95 0.00 0.00 55.36 52.93 3h9n s GLN 52 Cb -0.13 -3.10 -0.09 0.00 -0.22 0.00 0.00 33.01 29.47 3h9n s GLN 52 CO 0.16 -0.15 1.37 0.45 -0.25 0.00 0.00 175.29 176.86 3h9n s SER 53 N 1.40 6.21 -0.22 5.90 0.15 -1.26 -0.98 113.70 124.90 3h9n s SER 53 Ca 0.05 2.79 -0.20 0.00 0.70 0.00 0.00 55.95 59.29 3h9n s SER 53 Cb -0.15 -2.65 0.06 0.00 -1.71 0.00 0.00 66.02 61.57 3h9n s SER 53 CO -0.00 -0.93 0.58 -0.51 1.20 0.00 0.00 173.24 173.57 3h9n s ILE 54 N -1.22 -0.00 -0.15 6.45 2.07 0.04 -4.90 121.20 123.50 3h9n s ILE 54 Ca 0.57 0.00 -0.16 0.00 -1.41 0.00 0.00 60.65 59.65 3h9n s ILE 54 Cb -0.41 -0.80 -0.04 0.00 0.13 0.00 0.00 42.46 41.33 3h9n s ILE 54 CO 0.53 0.00 0.37 -0.70 -1.91 0.00 0.00 174.94 173.24 3h9n s GLU 55 N 0.31 4.28 0.17 3.50 2.12 -1.26 -0.88 118.70 126.94 3h9n s GLU 55 Ca -0.00 0.24 -0.30 0.00 0.36 0.00 0.00 54.97 55.27 3h9n s GLU 55 Cb -0.04 -3.44 -0.07 0.00 0.26 0.00 0.00 34.13 30.84 3h9n s GLU 55 CO 0.01 0.18 0.94 -1.17 -0.54 0.00 0.00 175.26 174.68 3h9n s LEU 56 N 0.61 4.57 -0.20 2.70 2.96 -1.26 -0.55 118.68 127.51 3h9n s LEU 56 Ca 0.20 1.85 0.02 0.00 -0.22 0.00 0.00 54.13 55.99 3h9n s LEU 56 Cb -0.14 -3.58 -0.13 0.00 0.50 0.00 0.00 46.19 42.84 3h9n s LEU 56 CO 0.07 0.05 -0.17 -0.62 -1.32 0.00 0.00 176.35 174.35 3h9n n GLU 57 N 2.15 0.51 -3.69 1.98 1.02 -0.06 -4.83 120.64 117.72 3h9n n GLU 57 Ca -0.00 0.11 -0.01 0.00 -0.02 0.00 0.00 57.16 57.24 3h9n n GLU 57 Cb 0.48 -1.40 -0.01 0.00 -0.02 0.00 0.00 31.44 30.49 3h9n n GLU 57 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 3h9n s ASN 58 N -5.92 -0.13 0.09 1.62 2.47 -1.14 -5.03 114.94 106.90 3h9n s ASN 58 Ca -0.27 -0.28 -0.26 0.00 0.42 0.00 0.00 52.86 52.48 3h9n s ASN 58 Cb 0.07 0.35 0.08 0.00 -1.45 0.00 0.00 41.25 40.30 3h9n s ASN 58 CO 0.46 -0.64 0.73 -1.66 -3.72 0.00 0.00 177.10 172.27 3h9n s TRP 59 N -2.92 -0.45 0.17 0.43 1.48 -1.26 -1.74 118.94 114.65 3h9n s TRP 59 Ca 0.13 0.27 -0.24 0.00 -1.06 0.00 0.00 56.10 55.20 3h9n s TRP 59 Cb 0.01 0.55 0.07 0.00 -1.16 0.00 0.00 33.47 32.95 3h9n s TRP 59 CO -0.01 -0.72 1.01 -0.98 -4.06 0.00 0.00 176.95 172.20 3h9n s ARG 60 N -3.47 1.24 -0.11 3.25 1.70 -0.80 -5.02 118.95 115.74 3h9n s ARG 60 Ca 0.03 -0.75 -0.17 0.00 -0.47 0.00 0.00 55.73 54.38 3h9n s ARG 60 Cb -0.01 0.38 -0.05 0.00 -0.57 0.00 0.00 34.95 34.70 3h9n s ARG 60 CO -0.11 -0.57 0.42 0.71 -1.08 0.00 0.00 175.30 174.67 3h9n s TYR 61 N -2.69 3.54 -0.59 5.89 2.02 -1.26 -1.32 117.35 122.93 3h9n s TYR 61 Ca 0.17 0.84 0.05 0.00 -0.37 0.00 0.00 57.07 57.76 3h9n s TYR 61 Cb -0.02 -2.46 0.20 0.00 -0.40 0.00 0.00 41.96 39.28 3h9n s TYR 61 CO 0.04 0.27 0.52 1.58 -1.57 0.00 0.00 175.55 176.39 3h9n n HIS 62 N 3.32 2.02 -2.75 2.71 -0.00 0.01 -4.93 115.22 115.62 3h9n n HIS 62 Ca -0.09 -3.97 -0.04 0.00 -0.00 0.00 0.00 57.72 53.61 3h9n n HIS 62 Cb 0.52 -0.38 0.01 0.00 -0.00 0.00 0.00 29.99 30.13 3h9n n HIS 62 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.34 176.43 3h9n n ASN 63 N 1.83 -7.14 -2.85 0.26 3.02 -1.26 -3.28 115.26 105.85 3h9n n ASN 63 Ca 0.25 0.26 -0.16 0.00 -0.03 0.00 0.00 54.58 54.89 3h9n n ASN 63 Cb 0.41 -4.81 -0.00 0.00 -0.61 0.00 0.00 39.78 34.77 3h9n n ASN 63 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3h9n n HIS 64 N -0.87 -1.63 -3.47 3.10 8.25 -1.26 -4.91 115.22 114.44 3h9n n HIS 64 Ca 0.06 0.21 -0.17 0.00 -0.26 0.00 0.00 57.72 57.57 3h9n n HIS 64 Cb 0.44 -2.77 -0.12 0.00 1.12 0.00 0.00 29.99 28.66 3h9n n HIS 64 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 3h9n s GLU 65 N -5.46 0.22 0.27 -0.41 2.12 -1.20 -5.14 118.70 109.10 3h9n s GLU 65 Ca 0.18 0.23 -0.29 0.00 0.36 0.00 0.00 54.97 55.44 3h9n s GLU 65 Cb -0.09 -1.09 -0.09 0.00 0.26 0.00 0.00 34.13 33.12 3h9n s GLU 65 CO 0.22 -0.67 1.20 0.42 -0.54 0.00 0.00 175.26 175.89 3h9n s ILE 66 N 2.36 3.24 -0.02 -3.70 1.01 -1.26 -0.81 121.20 122.02 3h9n s ILE 66 Ca 0.08 1.18 0.04 0.00 0.00 0.00 0.00 60.65 61.95 3h9n s ILE 66 Cb -0.16 -3.75 -0.01 0.00 0.01 0.00 0.00 42.46 38.56 3h9n s ILE 66 CO -0.14 0.25 -0.13 -0.51 0.00 0.00 0.00 174.94 174.42 3h9n s ILE 67 N -0.80 1.04 0.24 2.92 2.07 -0.44 -2.95 121.20 123.29 3h9n s ILE 67 Ca 0.49 -0.54 0.10 0.00 -1.41 0.00 0.00 60.65 59.29 3h9n s ILE 67 Cb -0.35 -0.89 -0.04 0.00 0.13 0.00 0.00 42.46 41.31 3h9n s ILE 67 CO 0.43 0.30 -0.11 -0.69 -1.91 0.00 0.00 174.94 172.97 3h9n s VAL 68 N -0.13 3.00 -0.23 4.00 1.01 -0.10 -1.91 120.40 126.04 3h9n s VAL 68 Ca 0.02 -1.99 -0.02 0.00 0.00 0.00 0.00 61.98 59.99 3h9n s VAL 68 Cb -0.07 -2.55 0.07 0.00 0.00 0.00 0.00 36.38 33.83 3h9n s VAL 68 CO 0.00 -0.28 0.04 -0.75 0.00 0.00 0.00 175.10 174.11 3h9n s LYS 69 N -3.29 0.76 0.31 2.72 2.47 -0.71 -1.73 119.74 120.27 3h9n s LYS 69 Ca 0.28 -0.64 -0.05 0.00 -1.56 0.00 0.00 55.97 54.01 3h9n s LYS 69 Cb -0.07 -2.11 -0.05 0.00 -1.46 0.00 0.00 37.83 34.14 3h9n s LYS 69 CO 0.16 -0.73 0.57 -0.51 0.16 0.00 0.00 175.35 175.01 3h9n s LEU 70 N 1.76 4.03 0.02 5.43 1.43 -1.26 -0.88 118.68 129.20 3h9n s LEU 70 Ca 0.01 0.73 -0.05 0.00 -1.03 0.00 0.00 54.13 53.79 3h9n s LEU 70 Cb -0.17 -3.55 -0.02 0.00 0.03 0.00 0.00 46.19 42.48 3h9n s LEU 70 CO -0.13 -0.23 1.07 0.11 0.23 0.00 0.00 176.35 177.41 3h9n h LYS 71 N 1.54 -0.08 0.00 1.70 1.79 -1.14 -3.03 116.57 117.35 3h9n h LYS 71 Ca -0.48 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.00 3h9n h LYS 71 Cb 1.19 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.86 3h9n h LYS 71 CO 0.65 -0.05 0.00 0.41 -1.08 0.00 0.00 179.45 179.38 3h9n n GLY 72 N -1.06 -1.11 3.61 3.86 0.00 -1.26 -4.70 105.19 104.53 3h9n n GLY 72 Ca -0.01 -0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 3h9n n GLY 72 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h9n s VAL 73 N -3.12 5.13 -0.04 1.61 1.01 -1.14 -4.94 120.40 118.92 3h9n s VAL 73 Ca 0.06 0.69 0.05 0.00 0.00 0.00 0.00 61.98 62.79 3h9n s VAL 73 Cb 0.10 -3.75 0.08 0.00 0.00 0.00 0.00 36.38 32.81 3h9n s VAL 73 CO 0.32 0.13 0.99 0.47 0.00 0.00 0.00 175.10 177.01 3h9n n ASP 74 N 5.39 0.77 -3.54 3.32 9.92 -1.26 -4.58 116.55 126.57 3h9n n ASP 74 Ca -0.07 -2.21 -0.08 0.00 -0.53 0.00 0.00 54.79 51.90 3h9n n ASP 74 Cb 0.50 -0.23 -0.02 0.00 -0.64 0.00 0.00 41.12 40.73 3h9n n ASP 74 CO 0.00 0.00 0.00 1.51 0.13 0.00 0.00 177.20 178.84 3h9n s ASP 75 N -1.43 -0.38 0.28 -2.24 1.47 -1.21 -3.98 116.67 109.19 3h9n s ASP 75 Ca 0.09 -0.10 0.02 0.00 1.18 0.00 0.00 52.55 53.74 3h9n s ASP 75 Cb 0.08 0.48 0.64 0.00 -0.34 0.00 0.00 42.92 43.77 3h9n s ASP 75 CO 0.01 -0.80 1.76 -0.09 0.68 0.00 0.00 175.17 176.73 3h9n h ARG 76 N 2.00 0.62 -0.33 2.11 2.43 -1.84 -1.34 114.38 118.04 3h9n h ARG 76 Ca -0.25 -0.04 -0.15 0.00 -0.81 0.00 0.00 59.98 58.73 3h9n h ARG 76 Cb 1.26 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 30.66 3h9n h ARG 76 CO 0.31 0.41 -0.37 1.49 -1.51 0.00 0.00 179.97 180.30 3h9n h GLU 77 N 0.64 0.83 0.00 0.20 4.81 -1.97 -0.77 114.58 118.33 3h9n h GLU 77 Ca 0.52 -0.46 -0.06 0.00 -0.13 0.00 0.00 59.36 59.23 3h9n h GLU 77 Cb 0.80 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.20 3h9n h GLU 77 CO -0.39 1.09 -0.31 0.00 -0.73 0.00 0.00 179.01 178.67 3h9n h ALA 78 N 0.73 1.20 0.11 2.92 0.00 -1.81 -2.74 119.26 119.66 3h9n h ALA 78 Ca 0.05 -0.28 -0.29 0.00 0.00 0.00 0.00 54.91 54.39 3h9n h ALA 78 Cb 0.96 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 3h9n h ALA 78 CO 0.09 0.39 -1.42 0.00 0.00 0.00 0.00 179.25 178.30 3h9n h ALA 79 N 1.69 0.25 -0.74 0.00 0.00 -1.19 -3.31 119.26 115.96 3h9n h ALA 79 Ca -0.00 -1.05 0.12 0.00 0.00 0.00 0.00 54.91 53.98 3h9n h ALA 79 Cb 0.67 0.18 -0.09 0.00 0.00 0.00 0.00 17.79 18.56 3h9n h ALA 79 CO 0.04 1.12 0.33 0.37 0.00 0.00 0.00 179.25 181.11 3h9n h GLN 80 N 0.06 0.50 -0.30 0.00 5.75 -0.84 0.36 115.11 120.65 3h9n h GLN 80 Ca -0.20 -0.03 0.08 0.00 -0.15 0.00 0.00 58.65 58.35 3h9n h GLN 80 Cb 1.99 -0.11 -0.01 0.00 1.07 0.00 0.00 27.48 30.41 3h9n h GLN 80 CO 0.17 0.33 0.21 0.82 -2.65 0.00 0.00 178.83 177.71 3h9n h ILE 81 N 0.51 0.88 0.00 2.39 2.04 -1.61 -2.31 117.51 119.42 3h9n h ILE 81 Ca 0.39 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 66.23 3h9n h ILE 81 Cb 0.53 0.82 0.00 0.00 -0.74 0.00 0.00 36.82 37.43 3h9n h ILE 81 CO -0.35 0.01 -0.51 0.18 0.00 0.00 0.00 178.15 177.49 3h9n n LEU 82 N -4.46 0.52 -4.58 1.44 4.77 0.09 -4.96 117.00 109.82 3h9n n LEU 82 Ca 0.04 0.11 -0.51 0.00 -0.03 0.00 0.00 56.01 55.62 3h9n n LEU 82 Cb 0.34 -0.25 -0.05 0.00 -2.33 0.00 0.00 43.42 41.13 3h9n n LEU 82 CO 0.35 0.06 0.81 0.00 -1.33 0.00 0.00 177.39 177.28 3h9n n ALA 83 N -1.61 -1.13 -2.09 -1.18 0.00 -0.87 -2.43 120.51 111.20 3h9n n ALA 83 Ca 0.05 0.51 -0.14 0.00 0.00 0.00 0.00 53.44 53.85 3h9n n ALA 83 Cb 0.37 -2.03 -0.02 0.00 0.00 0.00 0.00 19.45 17.77 3h9n n ALA 83 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3h9n n ASN 84 N 2.28 -4.37 -4.87 0.00 3.02 0.28 -4.97 115.26 106.63 3h9n n ASN 84 Ca 0.17 0.06 -0.32 0.00 -0.03 0.00 0.00 54.58 54.47 3h9n n ASN 84 Cb 0.20 -3.45 -0.05 0.00 -0.61 0.00 0.00 39.78 35.87 3h9n n ASN 84 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 3h9n s VAL 85 N -2.66 5.13 0.32 2.41 -7.23 -1.02 -4.81 120.40 112.54 3h9n s VAL 85 Ca 0.00 -0.41 -0.28 0.00 -1.81 0.00 0.00 61.98 59.49 3h9n s VAL 85 Cb 0.00 -3.45 -0.09 0.00 0.56 0.00 0.00 36.38 33.40 3h9n s VAL 85 CO 0.00 0.22 1.10 -1.61 -0.31 0.00 0.00 175.10 174.50 3h9n s GLU 86 N -2.22 4.46 -0.11 4.82 2.02 -1.26 -1.72 118.70 124.68 3h9n s GLU 86 Ca 0.30 1.75 -0.03 0.00 0.02 0.00 0.00 54.97 57.02 3h9n s GLU 86 Cb -0.13 -2.98 -0.03 0.00 0.10 0.00 0.00 34.13 31.09 3h9n s GLU 86 CO 0.22 0.06 -0.01 0.42 0.02 0.00 0.00 175.26 175.98 3h9n s ILE 87 N -1.30 4.21 0.11 -1.63 1.01 -1.07 -1.84 121.20 120.68 3h9n s ILE 87 Ca 0.49 -0.27 0.02 0.00 0.00 0.00 0.00 60.65 60.89 3h9n s ILE 87 Cb -0.30 -2.80 -0.04 0.00 0.01 0.00 0.00 42.46 39.33 3h9n s ILE 87 CO 0.38 0.56 -0.07 -0.83 0.00 0.00 0.00 174.94 174.98 3h9n s GLY 88 N -0.45 0.82 0.05 6.18 0.00 0.16 -1.20 107.32 112.88 3h9n s GLY 88 Ca 0.08 -1.36 -0.00 0.00 0.00 0.00 0.00 44.72 43.44 3h9n s GLY 88 CO 0.02 -1.46 -0.04 -1.34 0.00 0.00 0.00 173.10 170.28 3h9n s VAL 89 N -3.50 0.28 -0.69 1.40 -7.23 -1.03 -0.58 120.40 109.07 3h9n s VAL 89 Ca 0.12 -1.56 -0.23 0.00 -1.81 0.00 0.00 61.98 58.50 3h9n s VAL 89 Cb 0.04 -1.18 0.07 0.00 0.56 0.00 0.00 36.38 35.87 3h9n s VAL 89 CO -0.04 -0.82 1.01 -0.62 -0.31 0.00 0.00 175.10 174.33 3h9n s ASP 90 N -2.49 6.20 -0.15 4.85 -1.08 -1.26 -1.78 116.67 120.95 3h9n s ASP 90 Ca 0.01 -1.00 0.08 0.00 -0.52 0.00 0.00 52.55 51.13 3h9n s ASP 90 Cb 0.02 -2.43 0.51 0.00 -1.46 0.00 0.00 42.92 39.56 3h9n s ASP 90 CO -0.06 -1.47 1.30 0.18 0.52 0.00 0.00 175.17 175.64 3h9n n LEU 91 N 7.85 4.04 -4.77 -1.34 7.99 -1.20 -4.97 117.00 124.60 3h9n n LEU 91 Ca -0.01 -2.05 -0.30 0.00 -0.01 0.00 0.00 56.01 53.64 3h9n n LEU 91 Cb 0.46 -0.62 0.12 0.00 -0.11 0.00 0.00 43.42 43.26 3h9n n LEU 91 CO 0.64 0.50 0.70 -0.94 -1.51 0.00 0.00 177.39 176.78 3h9n s SER 92 N -0.48 3.96 0.65 -1.43 1.04 -1.26 -4.95 113.70 111.23 3h9n s SER 92 Ca 0.34 1.27 -0.17 0.00 0.48 0.00 0.00 55.95 57.87 3h9n s SER 92 Cb 0.26 -1.95 -0.00 0.00 0.10 0.00 0.00 66.02 64.42 3h9n s SER 92 CO 0.10 -2.30 1.22 0.68 0.98 0.00 0.00 173.24 173.92 3h9n s VAL 93 N -3.12 2.41 0.34 5.02 -7.23 -1.26 -5.03 120.40 111.54 3h9n s VAL 93 Ca 0.62 0.23 -0.03 0.00 -1.81 0.00 0.00 61.98 61.00 3h9n s VAL 93 Cb -0.15 -2.98 -0.04 0.00 0.56 0.00 0.00 36.38 33.77 3h9n s VAL 93 CO 0.55 -0.08 0.59 -0.36 -0.31 0.00 0.00 175.10 175.50 3h9n s PHE 94 N -1.71 3.50 0.46 2.82 0.08 -1.26 -5.04 117.98 116.83 3h9n s PHE 94 Ca 0.77 0.57 -0.24 0.00 0.12 0.00 0.00 56.93 58.15 3h9n s PHE 94 Cb -0.31 -2.07 -0.09 0.00 -0.57 0.00 0.00 43.02 39.99 3h9n s PHE 94 CO 0.39 0.07 1.26 -0.35 -0.10 0.00 0.00 175.22 176.49 3h9n n PRO 95 N -1.47 1.81 -1.99 0.24 -0.04 -1.26 -4.88 135.00 127.41 3h9n n PRO 95 Ca -0.02 0.65 -0.42 0.00 -0.04 0.00 0.00 63.50 63.66 3h9n n PRO 95 Cb 0.55 -2.40 -0.03 0.00 -0.04 0.00 0.00 33.50 31.58 3h9n n PRO 95 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 3h9n s GLU 96 N -2.37 4.14 0.31 0.54 2.12 -1.26 -4.94 118.70 117.24 3h9n s GLU 96 Ca 0.64 2.17 -0.29 0.00 0.36 0.00 0.00 54.97 57.84 3h9n s GLU 96 Cb -0.48 -4.00 -0.11 0.00 0.26 0.00 0.00 34.13 29.80 3h9n s GLU 96 CO 0.56 -0.90 1.50 -0.51 -0.54 0.00 0.00 175.26 175.36 3h9n s LEU 97 N 4.20 4.35 0.00 2.70 1.02 -1.26 -4.91 118.68 124.78 3h9n s LEU 97 Ca 0.74 2.89 0.25 0.00 0.02 0.00 0.00 54.13 58.03 3h9n s LEU 97 Cb -0.33 -3.64 1.10 0.00 0.02 0.00 0.00 46.19 43.33 3h9n s LEU 97 CO 0.30 -0.81 1.75 -0.62 0.02 0.00 0.00 176.35 176.99 3h9n n GLU 98 N 1.52 1.48 -3.60 1.70 1.02 -1.26 -4.79 120.64 116.72 3h9n n GLU 98 Ca 0.05 -0.71 -0.03 0.00 -0.02 0.00 0.00 57.16 56.45 3h9n n GLU 98 Cb 0.39 -1.43 -0.05 0.00 -0.02 0.00 0.00 31.44 30.33 3h9n n GLU 98 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 3h9n s GLU 99 N -1.93 0.53 3.19 3.49 2.12 -1.26 -5.14 118.70 119.70 3h9n s GLU 99 Ca 0.36 1.10 0.00 0.00 0.36 0.00 0.00 54.97 56.79 3h9n s GLU 99 Cb 0.19 0.41 0.00 0.00 0.26 0.00 0.00 34.13 34.99 3h9n s GLU 99 CO 0.30 -0.14 0.00 0.41 -0.54 0.00 0.00 175.26 175.29 3h9n n GLY 100 N 4.66 0.40 3.21 -1.50 0.00 -1.26 -4.94 105.19 105.76 3h9n n GLY 100 Ca -0.15 -0.87 -0.12 0.00 0.00 0.00 0.00 46.02 44.88 3h9n n GLY 100 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3h9n s ASP 101 N -4.00 0.35 0.51 1.61 -4.77 -1.26 -4.83 116.67 104.29 3h9n s ASP 101 Ca 0.00 -1.35 0.19 0.00 -3.30 0.00 0.00 52.55 48.08 3h9n s ASP 101 Cb 0.00 0.33 1.31 0.00 -1.09 0.00 0.00 42.92 43.47 3h9n s ASP 101 CO 0.00 -0.80 2.12 1.88 0.70 0.00 0.00 175.17 179.07 3h9n h TYR 102 N 2.63 0.00 0.00 2.11 -1.99 -1.99 -2.03 116.97 115.70 3h9n h TYR 102 Ca -0.36 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.34 3h9n h TYR 102 Cb 1.24 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.97 3h9n h TYR 102 CO 0.38 0.06 -0.11 -0.92 -0.00 0.00 0.00 178.16 177.57 3h9n h TYR 103 N 0.00 0.00 -0.89 4.88 5.03 -2.02 -2.07 116.97 121.90 3h9n h TYR 103 Ca -0.00 0.00 0.12 0.00 2.58 0.00 0.00 58.73 61.43 3h9n h TYR 103 Cb 0.11 0.00 -0.08 0.00 1.55 0.00 0.00 36.73 38.30 3h9n h TYR 103 CO 0.00 0.11 0.51 -1.49 -1.32 0.00 0.00 178.16 175.97 3h9n h TRP 104 N 0.00 0.92 -0.94 -3.82 4.06 -1.79 -0.84 115.95 113.54 3h9n h TRP 104 Ca -0.00 0.03 0.27 0.00 2.06 0.00 0.00 58.89 61.25 3h9n h TRP 104 Cb 0.24 -0.28 -0.04 0.00 -1.00 0.00 0.00 29.16 28.09 3h9n h TRP 104 CO 0.00 0.32 0.70 0.45 -3.56 0.00 0.00 178.44 176.35 3h9n h HIS 105 N 0.79 0.00 0.00 0.49 3.86 -1.54 0.26 115.15 119.01 3h9n h HIS 105 Ca 0.45 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.66 3h9n h HIS 105 Cb 0.51 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.98 3h9n h HIS 105 CO -0.05 0.00 0.00 -0.44 0.86 0.00 0.00 177.93 178.30 3h9n h ASP 106 N 0.00 0.00 1.11 2.45 3.32 -1.30 -3.19 116.42 118.80 3h9n h ASP 106 Ca 0.44 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 57.34 3h9n h ASP 106 Cb 1.83 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 41.36 3h9n h ASP 106 CO -0.00 0.00 -0.93 -0.07 -1.72 0.00 0.00 179.24 176.51 3h9n h LEU 107 N 0.00 0.00 -9.66 1.55 3.38 -0.57 -3.44 115.31 106.58 3h9n h LEU 107 Ca 0.00 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.45 3h9n h LEU 107 Cb 0.72 0.00 0.06 0.00 0.09 0.00 0.00 40.66 41.53 3h9n h LEU 107 CO 0.00 0.68 1.01 -0.38 0.09 0.00 0.00 178.44 179.84 3h9n n ILE 108 N -3.16 0.01 -0.13 1.22 2.08 -1.20 -1.50 119.36 116.69 3h9n n ILE 108 Ca -0.03 -0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.28 3h9n n ILE 108 Cb 0.83 -1.99 0.00 0.00 -0.75 0.00 0.00 39.64 37.74 3h9n n ILE 108 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 3h9n n GLY 109 N 3.96 1.08 3.84 7.39 0.00 0.45 -5.02 105.19 116.89 3h9n n GLY 109 Ca 0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.87 3h9n n GLY 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h9n s THR 111 N -3.11 4.64 -0.20 0.00 2.01 -0.40 -1.42 115.64 117.16 3h9n s THR 111 Ca 0.57 -0.10 -0.12 0.00 0.31 0.00 0.00 61.69 62.35 3h9n s THR 111 Cb -0.13 -3.05 -0.05 0.00 0.01 0.00 0.00 72.50 69.28 3h9n s THR 111 CO 0.55 0.51 0.22 -0.69 -0.69 0.00 0.00 174.62 174.52 3h9n s VAL 112 N -0.01 5.34 -0.04 3.82 1.01 -0.51 -0.60 120.40 129.40 3h9n s VAL 112 Ca 0.05 0.36 0.01 0.00 0.00 0.00 0.00 61.98 62.41 3h9n s VAL 112 Cb -0.12 -3.56 0.02 0.00 0.00 0.00 0.00 36.38 32.71 3h9n s VAL 112 CO 0.01 0.37 -0.06 0.68 0.00 0.00 0.00 175.10 176.11 3h9n s VAL 113 N 0.73 0.61 0.91 2.92 -7.23 -0.43 -3.58 120.40 114.34 3h9n s VAL 113 Ca 0.12 -0.18 -0.14 0.00 -1.81 0.00 0.00 61.98 59.97 3h9n s VAL 113 Cb -0.13 -0.61 0.17 0.00 0.56 0.00 0.00 36.38 36.37 3h9n s VAL 113 CO 0.03 0.24 1.26 0.54 -0.31 0.00 0.00 175.10 176.85 3h9n s ASN 114 N 0.80 3.48 0.60 4.85 2.20 -0.58 -2.36 114.94 123.94 3h9n s ASN 114 Ca -0.11 0.27 0.36 0.00 -0.94 0.00 0.00 52.86 52.44 3h9n s ASN 114 Cb -0.14 -0.43 1.96 0.00 -2.00 0.00 0.00 41.25 40.64 3h9n s ASN 114 CO 0.01 -2.50 2.10 -0.07 -2.94 0.00 0.00 177.10 173.70 3h9n h LEU 115 N -1.41 0.00 -0.86 3.54 4.07 -1.66 0.19 115.31 119.17 3h9n h LEU 115 Ca -0.44 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.52 3h9n h LEU 115 Cb 1.25 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.99 3h9n h LEU 115 CO 0.43 0.00 -0.07 -0.62 -1.08 0.00 0.00 178.44 177.10 3h9n n GLU 116 N -2.86 1.46 -0.81 1.13 4.71 -1.26 -4.93 120.64 118.09 3h9n n GLU 116 Ca -0.02 -0.86 0.00 0.00 -0.01 0.00 0.00 57.16 56.26 3h9n n GLU 116 Cb 0.16 -1.48 0.00 0.00 -1.01 0.00 0.00 31.44 29.11 3h9n n GLU 116 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3h9n n GLY 117 N 1.22 0.54 3.75 0.62 0.00 0.65 -5.04 105.19 106.93 3h9n n GLY 117 Ca 0.17 -0.51 -0.39 0.00 0.00 0.00 0.00 46.02 45.29 3h9n n GLY 117 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3h9n s TYR 118 N -2.00 3.66 0.82 1.61 6.14 -1.26 -4.85 117.35 121.47 3h9n s TYR 118 Ca 0.00 1.24 -0.11 0.00 0.64 0.00 0.00 57.07 58.84 3h9n s TYR 118 Cb 0.00 -2.69 0.12 0.00 0.42 0.00 0.00 41.96 39.81 3h9n s TYR 118 CO 0.00 0.26 1.16 0.99 0.64 0.00 0.00 175.55 178.60 3h9n s THR 119 N 0.12 2.09 0.00 4.34 2.01 -1.26 -1.53 115.64 121.41 3h9n s THR 119 Ca 0.34 -0.14 0.00 0.00 0.31 0.00 0.00 61.69 62.19 3h9n s THR 119 Cb -0.18 -2.95 0.00 0.00 0.01 0.00 0.00 72.50 69.38 3h9n s THR 119 CO 0.18 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.72 3h9n n GLY 121 N -3.30 4.36 3.56 4.40 0.00 -1.23 -4.74 105.19 108.24 3h9n n GLY 121 Ca 0.11 -2.03 -0.36 0.00 0.00 0.00 0.00 46.02 43.74 3h9n n GLY 121 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h9n s THR 122 N -1.18 4.65 -0.13 2.61 2.01 -0.68 -1.42 115.64 121.51 3h9n s THR 122 Ca 0.00 -0.07 -0.29 0.00 0.31 0.00 0.00 61.69 61.64 3h9n s THR 122 Cb 0.00 -3.13 -0.03 0.00 0.01 0.00 0.00 72.50 69.34 3h9n s THR 122 CO 0.00 0.40 1.52 0.54 -0.69 0.00 0.00 174.62 176.38 3h9n s VAL 123 N 0.94 3.84 -0.32 3.82 0.11 -0.51 -0.89 120.40 127.40 3h9n s VAL 123 Ca 0.04 1.00 0.22 0.00 -2.93 0.00 0.00 61.98 60.31 3h9n s VAL 123 Cb -0.14 -3.70 -0.28 0.00 -1.53 0.00 0.00 36.38 30.74 3h9n s VAL 123 CO 0.03 -0.15 0.65 0.35 -3.33 0.00 0.00 175.10 172.66 3h9n n THR 124 N 5.67 0.04 -1.53 5.04 -2.24 0.63 -0.42 114.28 121.47 3h9n n THR 124 Ca 0.16 -0.36 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 3h9n n THR 124 Cb 0.44 0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.91 3h9n n THR 124 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 3h9n n GLU 125 N -2.07 0.00 -3.66 -0.78 2.13 -1.21 -4.89 120.64 110.15 3h9n n GLU 125 Ca -0.01 0.00 -0.07 0.00 0.66 0.00 0.00 57.16 57.73 3h9n n GLU 125 Cb 0.50 0.00 -0.08 0.00 0.27 0.00 0.00 31.44 32.13 3h9n n GLU 125 CO 0.00 0.00 0.00 -2.00 -0.41 0.00 0.00 177.13 174.72 3h9n s GLU 128 N 1.83 0.43 -0.12 5.31 2.12 -1.26 0.10 118.70 127.12 3h9n s GLU 128 Ca 0.00 1.09 0.16 0.00 0.36 0.00 0.00 54.97 56.59 3h9n s GLU 128 Cb 0.00 0.35 -0.23 0.00 0.26 0.00 0.00 34.13 34.51 3h9n s GLU 128 CO 0.00 -0.21 0.17 -2.37 -0.54 0.00 0.00 175.26 172.31 3h9n n THR 129 N 5.05 0.77 0.00 -1.70 5.66 -0.81 -5.01 114.28 118.24 3h9n n THR 129 Ca -0.14 -0.62 0.00 0.00 -3.05 0.00 0.00 64.05 60.25 3h9n n THR 129 Cb 0.52 -0.34 0.00 0.00 -1.55 0.00 0.00 70.33 68.96 3h9n n THR 129 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3h9n n GLY 130 N 1.79 -1.90 0.00 1.09 0.00 -1.26 -4.91 105.19 100.00 3h9n n GLY 130 Ca -0.19 0.63 0.00 0.00 0.00 0.00 0.00 46.02 46.46 3h9n n GLY 130 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3h9n n SER 131 N -0.61 1.23 -4.34 1.61 7.64 -1.26 -4.99 113.62 112.90 3h9n n SER 131 Ca 0.00 -1.36 -0.35 0.00 1.01 0.00 0.00 58.87 58.17 3h9n n SER 131 Cb 0.00 0.00 -0.14 0.00 -1.01 0.00 0.00 64.21 63.06 3h9n n SER 131 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 3h9n s ASN 132 N -0.36 4.50 -0.11 6.43 0.01 -1.26 -5.10 114.94 119.05 3h9n s ASN 132 Ca 0.00 -0.35 -0.08 0.00 -0.71 0.00 0.00 52.86 51.72 3h9n s ASN 132 Cb 0.00 -1.78 -0.04 0.00 0.41 0.00 0.00 41.25 39.84 3h9n s ASN 132 CO 0.00 -0.03 0.17 -1.81 -1.51 0.00 0.00 177.10 173.92 3h9n s ASP 133 N 1.51 6.43 -0.00 -1.22 1.01 -1.26 -1.93 116.67 121.20 3h9n s ASP 133 Ca 0.06 0.52 0.00 0.00 0.71 0.00 0.00 52.55 53.84 3h9n s ASP 133 Cb -0.14 -2.09 0.00 0.00 1.01 0.00 0.00 42.92 41.70 3h9n s ASP 133 CO -0.02 0.40 -0.01 -0.69 0.21 0.00 0.00 175.17 175.06 3h9n s VAL 134 N -1.03 0.11 -0.10 -1.27 1.01 -1.26 -1.24 120.40 116.62 3h9n s VAL 134 Ca 0.16 -0.04 -0.26 0.00 0.00 0.00 0.00 61.98 61.84 3h9n s VAL 134 Cb -0.12 -0.12 -0.02 0.00 0.00 0.00 0.00 36.38 36.12 3h9n s VAL 134 CO 0.05 0.04 0.83 -0.76 0.00 0.00 0.00 175.10 175.27 3h9n s LEU 135 N 0.10 4.26 -0.42 3.92 1.43 0.20 -4.75 118.68 123.42 3h9n s LEU 135 Ca -0.01 1.30 -0.20 0.00 -1.03 0.00 0.00 54.13 54.19 3h9n s LEU 135 Cb -0.02 -3.28 0.02 0.00 0.03 0.00 0.00 46.19 42.94 3h9n s LEU 135 CO -0.00 -0.29 0.60 -0.69 0.23 0.00 0.00 176.35 176.19 3h9n s VAL 136 N 1.53 4.89 -0.20 -1.59 1.01 0.12 -1.44 120.40 124.71 3h9n s VAL 136 Ca 0.41 0.12 -0.07 0.00 0.00 0.00 0.00 61.98 62.45 3h9n s VAL 136 Cb -0.18 -4.14 -0.04 0.00 0.00 0.00 0.00 36.38 32.02 3h9n s VAL 136 CO 0.17 -0.50 0.05 -0.69 0.00 0.00 0.00 175.10 174.14 3h9n s VAL 137 N 2.67 4.51 -0.51 2.92 1.01 -0.00 -0.27 120.40 130.73 3h9n s VAL 137 Ca 0.21 -0.12 -0.23 0.00 0.00 0.00 0.00 61.98 61.84 3h9n s VAL 137 Cb -0.15 -3.05 0.04 0.00 0.00 0.00 0.00 36.38 33.22 3h9n s VAL 137 CO 0.17 0.42 0.82 -0.75 0.00 0.00 0.00 175.10 175.76 3h9n s LYS 138 N 0.78 3.31 0.77 2.72 2.47 -0.06 -0.89 119.74 128.83 3h9n s LYS 138 Ca 0.03 -0.35 -0.14 0.00 -1.56 0.00 0.00 55.97 53.94 3h9n s LYS 138 Cb -0.14 -4.03 0.06 0.00 -1.46 0.00 0.00 37.83 32.27 3h9n s LYS 138 CO 0.02 -1.31 1.22 0.00 0.16 0.00 0.00 175.35 175.44 3h9n s ALA 139 N 3.44 1.95 0.91 3.13 0.00 0.36 -1.68 121.76 129.87 3h9n s ALA 139 Ca 0.27 0.90 -0.11 0.00 0.00 0.00 0.00 51.96 53.01 3h9n s ALA 139 Cb -0.14 -3.50 0.14 0.00 0.00 0.00 0.00 23.12 19.62 3h9n s ALA 139 CO 0.19 -2.14 1.09 -0.80 0.00 0.00 0.00 175.76 174.10 3h9n s ASN 140 N -2.04 3.32 -0.12 0.00 0.02 -1.26 -4.87 114.94 109.98 3h9n s ASN 140 Ca 0.75 1.60 -0.31 0.00 -1.02 0.00 0.00 52.86 53.88 3h9n s ASN 140 Cb -0.30 -2.26 -0.08 0.00 0.02 0.00 0.00 41.25 38.62 3h9n s ASN 140 CO 0.48 -2.75 2.08 0.41 0.02 0.00 0.00 177.10 177.34 3h9n n THR 141 N -3.97 0.51 -3.41 1.60 -1.04 -1.26 -3.17 114.28 103.55 3h9n n THR 141 Ca 0.07 -0.27 -0.14 0.00 -2.04 0.00 0.00 64.05 61.68 3h9n n THR 141 Cb 0.55 -2.26 0.00 0.00 -1.82 0.00 0.00 70.33 66.80 3h9n n THR 141 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 3h9n n LYS 142 N 7.90 -1.51 -2.84 -2.82 4.76 -1.26 -4.95 118.16 117.42 3h9n n LYS 142 Ca 0.27 1.19 -0.31 0.00 -2.87 0.00 0.00 58.31 56.58 3h9n n LYS 142 Cb 0.38 -3.97 -0.04 0.00 -1.84 0.00 0.00 35.03 29.56 3h9n n LYS 142 CO 0.00 0.00 0.00 0.16 -1.37 0.00 0.00 177.40 176.19 3h9n s ASP 143 N -2.89 6.65 0.39 4.39 3.84 -1.19 -4.95 116.67 122.90 3h9n s ASP 143 Ca 0.04 1.30 0.30 0.00 -0.00 0.00 0.00 52.55 54.19 3h9n s ASP 143 Cb -0.01 -2.39 1.30 0.00 -1.38 0.00 0.00 42.92 40.44 3h9n s ASP 143 CO 0.83 -0.38 1.31 0.00 -0.00 0.00 0.00 175.17 176.93 3h9n n ALA 144 N -1.03 1.24 -1.12 2.11 0.00 -1.26 -0.84 120.51 119.60 3h9n n ALA 144 Ca 0.04 0.69 -0.04 0.00 0.00 0.00 0.00 53.44 54.13 3h9n n ALA 144 Cb 0.54 -0.91 0.27 0.00 0.00 0.00 0.00 19.45 19.35 3h9n n ALA 144 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3h9n n PHE 145 N -4.22 1.98 -1.49 0.00 3.72 -1.26 -4.96 117.46 111.22 3h9n n PHE 145 Ca 0.35 -1.26 -0.17 0.00 -0.05 0.00 0.00 57.45 56.31 3h9n n PHE 145 Cb 1.40 -0.60 -0.07 0.00 -0.94 0.00 0.00 39.48 39.26 3h9n n PHE 145 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3h9n n GLY 146 N -0.47 1.64 3.87 1.37 0.00 -0.02 -4.98 105.19 106.60 3h9n n GLY 146 Ca 0.37 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.05 3h9n n GLY 146 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h9n s LYS 147 N -3.45 3.75 -0.18 1.61 1.02 -1.26 -4.98 119.74 116.24 3h9n s LYS 147 Ca 0.00 0.15 0.02 0.00 0.02 0.00 0.00 55.97 56.16 3h9n s LYS 147 Cb 0.00 -2.96 -0.22 0.00 -0.52 0.00 0.00 37.83 34.13 3h9n s LYS 147 CO 0.00 0.54 0.10 1.04 -0.92 0.00 0.00 175.35 176.10 3h9n n GLN 148 N 0.77 0.69 -3.90 1.68 1.13 -1.26 -4.53 117.38 111.96 3h9n n GLN 148 Ca -0.07 0.18 -0.11 0.00 -1.94 0.00 0.00 57.00 55.07 3h9n n GLN 148 Cb 0.52 -1.61 -0.10 0.00 0.11 0.00 0.00 30.24 29.16 3h9n n GLN 148 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 3h9n s GLU 149 N -2.54 0.43 -0.00 -1.09 2.12 -1.26 -0.49 118.70 115.87 3h9n s GLU 149 Ca -0.25 -0.44 0.05 0.00 0.36 0.00 0.00 54.97 54.69 3h9n s GLU 149 Cb 0.08 0.17 -0.01 0.00 0.26 0.00 0.00 34.13 34.63 3h9n s GLU 149 CO 0.71 -0.10 -0.14 1.03 -0.54 0.00 0.00 175.26 176.22 3h9n s ARG 150 N -1.37 1.12 -0.36 4.30 0.52 -0.07 -4.91 118.95 118.18 3h9n s ARG 150 Ca -0.15 -0.56 -0.07 0.00 -0.52 0.00 0.00 55.73 54.44 3h9n s ARG 150 Cb -0.08 -1.09 0.05 0.00 0.52 0.00 0.00 34.95 34.35 3h9n s ARG 150 CO 0.01 0.30 0.14 -0.51 0.02 0.00 0.00 175.30 175.26 3h9n s LEU 151 N -0.49 4.54 -0.24 2.53 1.43 -1.26 -0.82 118.68 124.37 3h9n s LEU 151 Ca 0.05 -1.26 -0.06 0.00 -1.03 0.00 0.00 54.13 51.82 3h9n s LEU 151 Cb -0.06 -1.89 -0.02 0.00 0.03 0.00 0.00 46.19 44.25 3h9n s LEU 151 CO -0.00 -0.38 0.03 -0.63 0.23 0.00 0.00 176.35 175.60 3h9n s ILE 152 N 1.39 4.00 0.15 -0.59 1.01 -0.52 -4.92 121.20 121.73 3h9n s ILE 152 Ca -0.00 -0.28 -0.32 0.00 0.00 0.00 0.00 60.65 60.05 3h9n s ILE 152 Cb -0.20 -2.86 -0.12 0.00 0.01 0.00 0.00 42.46 39.29 3h9n s ILE 152 CO 0.02 0.37 1.76 -2.65 0.00 0.00 0.00 174.94 174.45 3h9n n PRO 153 N 4.86 2.69 -2.65 2.79 -0.02 -1.26 0.61 135.00 142.02 3h9n n PRO 153 Ca -0.17 0.97 -0.43 0.00 -2.02 0.00 0.00 63.50 61.85 3h9n n PRO 153 Cb 0.51 -2.83 0.00 0.00 -0.02 0.00 0.00 33.50 31.16 3h9n n PRO 153 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3h9n n PHE 154 N 4.74 4.64 -4.08 6.00 -0.00 -0.37 -4.46 117.46 123.93 3h9n n PHE 154 Ca 0.17 -3.04 -0.32 0.00 -0.00 0.00 0.00 57.45 54.26 3h9n n PHE 154 Cb 0.35 -2.44 -0.15 0.00 -0.00 0.00 0.00 39.48 37.24 3h9n n PHE 154 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 3h9n s LEU 155 N 2.95 3.13 0.18 -2.13 1.02 -1.26 -4.82 118.68 117.75 3h9n s LEU 155 Ca 0.49 -1.22 -0.30 0.00 0.02 0.00 0.00 54.13 53.11 3h9n s LEU 155 Cb 0.02 -1.53 -0.09 0.00 0.02 0.00 0.00 46.19 44.61 3h9n s LEU 155 CO 0.04 -0.14 1.36 -0.31 0.02 0.00 0.00 176.35 177.31 3h9n s TYR 156 N 1.15 3.22 0.00 0.29 2.02 -1.26 -0.65 117.35 122.11 3h9n s TYR 156 Ca -0.06 1.09 0.00 0.00 -0.37 0.00 0.00 57.07 57.74 3h9n s TYR 156 Cb -0.18 -3.66 0.00 0.00 -0.40 0.00 0.00 41.96 37.71 3h9n s TYR 156 CO -0.07 -2.18 0.00 0.39 -1.57 0.00 0.00 175.55 172.12 3h9n n GLU 157 N 3.07 0.00 0.14 -0.62 -0.58 -0.39 -4.69 120.64 117.57 3h9n n GLU 157 Ca 0.08 0.00 0.02 0.00 -0.42 0.00 0.00 57.16 56.84 3h9n n GLU 157 Cb 0.42 0.00 0.10 0.00 -0.57 0.00 0.00 31.44 31.39 3h9n n GLU 157 CO 0.00 0.00 0.00 -0.56 -0.48 0.00 0.00 177.13 176.09 3h9n h GLN 158 N 0.00 0.00 0.00 3.49 -0.00 -1.99 -3.42 115.11 113.19 3h9n h GLN 158 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 3h9n h GLN 158 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.48 3h9n h GLN 158 CO 0.00 0.53 0.00 0.28 -0.00 0.00 0.00 178.83 179.64 3h9n n VAL 159 N -3.33 0.99 -2.92 1.86 0.31 -1.01 -4.68 118.33 109.54 3h9n n VAL 159 Ca 0.01 0.33 -0.43 0.00 -0.01 0.00 0.00 64.34 64.24 3h9n n VAL 159 Cb 0.70 -1.41 -0.05 0.00 -0.91 0.00 0.00 33.84 32.17 3h9n n VAL 159 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 3h9n s VAL 160 N -1.90 4.54 -0.10 2.52 1.01 0.18 -0.48 120.40 126.17 3h9n s VAL 160 Ca 0.00 0.24 -0.27 0.00 0.00 0.00 0.00 61.98 61.95 3h9n s VAL 160 Cb 0.00 -4.43 -0.26 0.00 0.00 0.00 0.00 36.38 31.69 3h9n s VAL 160 CO 0.00 -0.94 0.88 0.11 0.00 0.00 0.00 175.10 175.15 3h9n h LYS 161 N 9.15 0.07 -3.06 2.72 1.79 -1.03 -1.02 116.57 125.20 3h9n h LYS 161 Ca -0.26 -0.10 -0.08 0.00 -2.18 0.00 0.00 60.65 58.03 3h9n h LYS 161 Cb 1.08 0.03 -0.17 0.00 -1.58 0.00 0.00 32.23 31.60 3h9n h LYS 161 CO 1.03 0.97 -0.13 1.03 -1.08 0.00 0.00 179.45 181.27 3h9n s ARG 162 N -2.60 0.90 -0.06 3.15 0.52 -1.07 -4.66 118.95 115.14 3h9n s ARG 162 Ca -0.17 -0.37 0.05 0.00 -0.52 0.00 0.00 55.73 54.72 3h9n s ARG 162 Cb -0.01 0.40 -0.00 0.00 0.52 0.00 0.00 34.95 35.85 3h9n s ARG 162 CO 0.72 -0.30 -0.21 0.08 0.02 0.00 0.00 175.30 175.61 3h9n s VAL 163 N -2.42 1.73 -0.31 3.52 1.01 -1.26 -1.02 120.40 121.65 3h9n s VAL 163 Ca -0.06 -0.87 -0.02 0.00 0.00 0.00 0.00 61.98 61.03 3h9n s VAL 163 Cb -0.01 -1.48 0.10 0.00 0.00 0.00 0.00 36.38 34.99 3h9n s VAL 163 CO -0.02 0.49 0.12 -0.62 0.00 0.00 0.00 175.10 175.07 3h9n s ASP 164 N 0.04 3.73 0.45 3.32 -1.08 -0.02 -4.99 116.67 118.12 3h9n s ASP 164 Ca -0.06 -1.54 0.29 0.00 -0.52 0.00 0.00 52.55 50.73 3h9n s ASP 164 Cb -0.13 -0.60 1.10 0.00 -1.46 0.00 0.00 42.92 41.83 3h9n s ASP 164 CO 0.04 -0.42 1.86 -0.07 0.52 0.00 0.00 175.17 177.10 3h9n h LEU 165 N 8.14 0.00 -1.25 -1.34 4.07 -1.94 -0.04 115.31 122.94 3h9n h LEU 165 Ca -0.15 0.00 0.17 0.00 0.08 0.00 0.00 57.88 57.98 3h9n h LEU 165 Cb 1.01 0.00 -0.08 0.00 1.08 0.00 0.00 40.66 42.67 3h9n h LEU 165 CO 0.45 0.00 0.60 0.74 -1.08 0.00 0.00 178.44 179.14 3h9n h THR 166 N 0.00 0.77 -0.03 0.22 2.02 -1.95 -2.22 112.91 111.72 3h9n h THR 166 Ca 0.00 -0.23 -0.12 0.00 0.77 0.00 0.00 66.41 66.84 3h9n h THR 166 Cb 0.56 0.05 -0.24 0.00 -1.74 0.00 0.00 68.15 66.78 3h9n h THR 166 CO 0.00 0.12 -0.82 0.35 0.37 0.00 0.00 175.52 175.54 3h9n n THR 167 N -4.60 0.97 -4.03 3.16 -2.24 -1.17 -5.02 114.28 101.35 3h9n n THR 167 Ca 0.20 -2.01 -0.38 0.00 -2.27 0.00 0.00 64.05 59.58 3h9n n THR 167 Cb 0.55 0.47 0.01 0.00 -2.10 0.00 0.00 70.33 69.26 3h9n n THR 167 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3h9n n LYS 168 N -0.20 -0.40 -4.30 -0.78 5.02 -0.79 -4.87 118.16 111.85 3h9n n LYS 168 Ca 0.12 -0.05 -0.18 0.00 -2.02 0.00 0.00 58.31 56.18 3h9n n LYS 168 Cb 0.95 -1.90 -0.13 0.00 -0.02 0.00 0.00 35.03 33.93 3h9n n LYS 168 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 3h9n s THR 169 N -3.83 0.86 -0.17 -0.18 -1.32 -0.10 -1.28 115.64 109.62 3h9n s THR 169 Ca 0.37 -0.80 0.01 0.00 -1.21 0.00 0.00 61.69 60.06 3h9n s THR 169 Cb -0.21 -0.79 0.02 0.00 -1.51 0.00 0.00 72.50 70.01 3h9n s THR 169 CO 0.80 -0.00 -0.20 -0.63 -2.21 0.00 0.00 174.62 172.38 3h9n s ILE 170 N -0.73 2.03 -0.21 5.08 1.01 0.23 -0.84 121.20 127.78 3h9n s ILE 170 Ca 0.00 -0.93 -0.13 0.00 0.00 0.00 0.00 60.65 59.60 3h9n s ILE 170 Cb -0.07 -1.83 -0.05 0.00 0.01 0.00 0.00 42.46 40.52 3h9n s ILE 170 CO 0.01 0.54 0.25 -0.70 0.00 0.00 0.00 174.94 175.03 3h9n s GLU 171 N 1.25 4.16 0.10 2.79 2.12 -0.19 -1.31 118.70 127.62 3h9n s GLU 171 Ca 0.04 -0.06 0.03 0.00 0.36 0.00 0.00 54.97 55.33 3h9n s GLU 171 Cb -0.13 -3.50 -0.04 0.00 0.26 0.00 0.00 34.13 30.72 3h9n s GLU 171 CO -0.12 0.11 -0.08 0.14 -0.54 0.00 0.00 175.26 174.77 3h9n s VAL 172 N 0.89 0.80 -1.00 3.70 -7.23 -0.99 -0.49 120.40 116.08 3h9n s VAL 172 Ca 0.13 -1.84 -0.04 0.00 -1.81 0.00 0.00 61.98 58.41 3h9n s VAL 172 Cb -0.13 -1.58 0.26 0.00 0.56 0.00 0.00 36.38 35.50 3h9n s VAL 172 CO 0.04 -0.76 1.06 -0.67 -0.31 0.00 0.00 175.10 174.45 3h9n n ASP 173 N 0.14 5.14 -3.69 4.85 2.03 0.36 -1.66 116.55 123.73 3h9n n ASP 173 Ca -0.13 -3.18 -0.26 0.00 0.52 0.00 0.00 54.79 51.74 3h9n n ASP 173 Cb 0.60 -1.19 -0.17 0.00 -0.72 0.00 0.00 41.12 39.63 3h9n n ASP 173 CO 0.00 0.00 0.00 0.86 -1.92 0.00 0.00 177.20 176.14 3h9n s TRP 174 N -1.73 0.60 0.24 -0.67 -0.11 -1.26 -4.78 118.94 111.24 3h9n s TRP 174 Ca 0.31 -0.49 -0.29 0.00 1.22 0.00 0.00 56.10 56.84 3h9n s TRP 174 Cb -0.04 -0.83 -0.15 0.00 -1.50 0.00 0.00 33.47 30.95 3h9n s TRP 174 CO -0.05 -0.51 1.01 -0.25 -4.62 0.00 0.00 176.95 172.53 3h9n n ASP 175 N 5.16 1.07 -0.03 5.86 9.92 -1.26 -4.81 116.55 132.47 3h9n n ASP 175 Ca -0.08 1.16 -0.16 0.00 -0.53 0.00 0.00 54.79 55.19 3h9n n ASP 175 Cb 0.48 -1.23 -0.09 0.00 -0.64 0.00 0.00 41.12 39.64 3h9n n ASP 175 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3h9n h ALA 176 N 2.33 0.19 -2.90 2.24 0.00 -1.98 -3.48 119.26 115.64 3h9n h ALA 176 Ca -0.40 -0.49 0.06 0.00 0.00 0.00 0.00 54.91 54.08 3h9n h ALA 176 Cb 1.35 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 19.10 3h9n h ALA 176 CO 0.63 0.35 0.29 0.20 0.00 0.00 0.00 179.25 180.72 3h9n s GLY 177 N -3.89 0.06 0.18 0.00 0.00 -1.26 -4.93 107.32 97.48 3h9n s GLY 177 Ca -0.13 -0.41 -0.14 0.00 0.00 0.00 0.00 44.72 44.05 3h9n s GLY 177 CO 0.82 -0.02 1.72 -2.75 0.00 0.00 0.00 173.10 172.87 3h9n h PHE 178 N 2.00 0.15 -0.20 1.90 3.57 -1.98 -2.75 116.94 119.64 3h9n h PHE 178 Ca -0.24 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.29 3h9n h PHE 178 Cb 1.25 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.99 3h9n h PHE 178 CO 0.78 0.00 0.00 1.28 -2.23 0.00 0.00 178.31 178.14 3h9n n LEU 179 N -5.11 1.79 -4.74 0.59 4.77 -1.26 -4.94 117.00 108.10 3h9n n LEU 179 Ca 0.05 -0.90 -0.41 0.00 -0.03 0.00 0.00 56.01 54.71 3h9n n LEU 179 Cb 0.22 -0.35 -0.02 0.00 -2.33 0.00 0.00 43.42 40.94 3h9n n LEU 179 CO 0.21 0.33 1.14 -0.70 -1.33 0.00 0.00 177.39 177.04 3h9n s GLU 180 N -1.62 4.24 0.31 3.23 2.12 -1.04 -4.97 118.70 120.97 3h9n s GLU 180 Ca 0.16 2.35 -0.28 0.00 0.36 0.00 0.00 54.97 57.56 3h9n s GLU 180 Cb 0.10 -3.10 -0.09 0.00 0.26 0.00 0.00 34.13 31.30 3h9n s GLU 180 CO 0.07 -0.47 1.05 -1.58 -0.54 0.00 0.00 175.26 173.80 3h9n s HIS 181 N 0.06 3.55 -0.11 5.30 5.65 -1.26 -5.02 115.29 123.46 3h9n s HIS 181 Ca 0.61 1.72 0.00 0.00 0.25 0.00 0.00 55.06 57.64 3h9n s HIS 181 Cb -0.43 -3.17 -0.02 0.00 -1.18 0.00 0.00 32.58 27.77 3h9n s HIS 181 CO 0.43 -0.39 -0.10 -1.01 -0.65 0.00 0.00 174.74 173.02 3h9n s HIS 182 N -1.34 2.85 0.00 3.88 0.09 -1.26 -5.00 115.29 114.51 3h9n s HIS 182 Ca 0.48 -0.36 0.00 0.00 -0.00 0.00 0.00 55.06 55.19 3h9n s HIS 182 Cb -0.27 -1.80 0.00 0.00 -0.00 0.00 0.00 32.58 30.51 3h9n s HIS 182 CO 0.35 0.00 0.00 0.72 -0.00 0.00 0.00 174.74 175.81 3h9n n HIS 183 N 3.04 0.00 -0.77 1.40 8.25 -1.26 -5.19 115.22 120.70 3h9n n HIS 183 Ca -0.18 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.28 3h9n n HIS 183 Cb 0.53 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.64 3h9n n HIS 183 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56