#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o63 s LYS 3 N 0.00 3.22 -0.05 3.23 1.02 -1.26 -1.89 119.74 124.00 1o63 s LYS 3 Ca 0.00 -0.75 0.05 0.00 0.02 0.00 0.00 55.97 55.29 1o63 s LYS 3 Cb 0.00 -2.51 -0.02 0.00 -0.52 0.00 0.00 37.83 34.78 1o63 s LYS 3 CO 0.00 0.23 -0.19 -0.51 -0.92 0.00 0.00 175.35 173.96 1o63 s LEU 4 N 0.27 2.43 -0.39 3.17 1.02 0.85 0.17 118.68 126.20 1o63 s LEU 4 Ca -0.12 -0.34 -0.13 0.00 0.02 0.00 0.00 54.13 53.56 1o63 s LEU 4 Cb -0.16 -1.47 0.02 0.00 0.02 0.00 0.00 46.19 44.60 1o63 s LEU 4 CO 0.06 0.30 0.25 0.00 0.02 0.00 0.00 176.35 176.98 1o63 s ALA 5 N -0.44 3.39 -0.17 4.21 0.00 -0.28 -0.17 121.76 128.30 1o63 s ALA 5 Ca 0.05 -1.69 -0.07 0.00 0.00 0.00 0.00 51.96 50.25 1o63 s ALA 5 Cb -0.12 -2.73 -0.04 0.00 0.00 0.00 0.00 23.12 20.23 1o63 s ALA 5 CO 0.02 -1.38 0.06 0.42 0.00 0.00 0.00 175.76 174.87 1o63 s ILE 6 N 1.62 4.75 -0.34 0.00 -1.09 0.79 -2.53 121.20 124.41 1o63 s ILE 6 Ca 0.04 -0.05 -0.29 0.00 -2.23 0.00 0.00 60.65 58.12 1o63 s ILE 6 Cb -0.19 -3.13 -0.00 0.00 -1.58 0.00 0.00 42.46 37.56 1o63 s ILE 6 CO 0.08 0.48 1.50 -2.16 -1.23 0.00 0.00 174.94 173.62 1o63 s PRO 7 N 0.20 3.64 0.53 2.79 0.04 -1.26 -1.02 135.00 139.92 1o63 s PRO 7 Ca 0.04 1.22 -0.22 0.00 0.04 0.00 0.00 61.00 62.09 1o63 s PRO 7 Cb -0.12 -4.03 -0.05 0.00 0.04 0.00 0.00 34.50 30.33 1o63 s PRO 7 CO 0.01 -1.48 1.29 0.15 0.04 0.00 0.00 177.00 177.00 1o63 s LYS 8 N 4.87 3.26 0.00 4.56 -0.14 0.11 -3.47 119.74 128.94 1o63 s LYS 8 Ca 0.66 2.05 0.00 0.00 -1.36 0.00 0.00 55.97 57.32 1o63 s LYS 8 Cb -0.18 -2.24 0.00 0.00 -1.68 0.00 0.00 37.83 33.73 1o63 s LYS 8 CO 0.30 -1.03 0.00 0.41 -0.76 0.00 0.00 175.35 174.27 1o63 n GLY 9 N 0.63 0.28 0.32 -3.33 0.00 -1.26 -4.54 105.19 97.29 1o63 n GLY 9 Ca 0.10 -1.79 0.10 0.00 0.00 0.00 0.00 46.02 44.44 1o63 n GLY 9 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1o63 h ARG 10 N 0.00 0.05 -0.35 1.61 -0.00 -2.03 -2.53 114.38 111.13 1o63 h ARG 10 Ca 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.98 1o63 h ARG 10 Cb 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 29.97 29.96 1o63 h ARG 10 CO 0.00 0.04 0.00 1.28 -0.00 0.00 0.00 179.97 181.29 1o63 n LEU 11 N -5.44 3.23 -0.05 0.08 4.77 -1.26 -4.64 117.00 113.69 1o63 n LEU 11 Ca 0.19 -1.52 -0.13 0.00 -0.03 0.00 0.00 56.01 54.52 1o63 n LEU 11 Cb 0.63 -0.22 -0.09 0.00 -2.33 0.00 0.00 43.42 41.41 1o63 n LEU 11 CO -0.02 0.71 0.50 -0.08 -1.33 0.00 0.00 177.39 177.16 1o63 h GLU 12 N 3.88 -0.45 -0.86 3.23 4.81 -1.48 -1.62 114.58 122.10 1o63 h GLU 12 Ca 0.00 0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.28 1o63 h GLU 12 Cb 0.89 0.10 -0.05 0.00 0.63 0.00 0.00 28.75 30.33 1o63 h GLU 12 CO 0.00 -0.30 0.56 1.49 -0.73 0.00 0.00 179.01 180.04 1o63 h GLU 13 N -0.46 1.10 -0.10 1.92 4.22 -1.82 -2.86 114.58 116.58 1o63 h GLU 13 Ca 0.04 -0.07 0.02 0.00 0.08 0.00 0.00 59.36 59.44 1o63 h GLU 13 Cb 0.58 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 1o63 h GLU 13 CO -0.44 0.73 -0.05 -0.22 -2.18 0.00 0.00 179.01 176.84 1o63 h LYS 14 N 1.13 -0.04 -1.56 1.92 3.64 -1.76 0.20 116.57 120.10 1o63 h LYS 14 Ca 0.33 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.71 1o63 h LYS 14 Cb -0.08 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.75 1o63 h LYS 14 CO -0.09 -0.03 0.00 0.28 -2.27 0.00 0.00 179.45 177.35 1o63 n VAL 15 N -5.18 0.39 0.00 2.00 0.31 -0.65 -1.92 118.33 113.29 1o63 n VAL 15 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.29 1o63 n VAL 15 Cb 0.11 -0.69 0.00 0.00 -0.91 0.00 0.00 33.84 32.35 1o63 n VAL 15 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1o63 n THR 17 N 0.78 0.00 -0.11 2.52 -1.04 0.06 -0.91 114.28 115.58 1o63 n THR 17 Ca 0.00 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 61.96 1o63 n THR 17 Cb 0.20 0.00 0.02 0.00 -1.82 0.00 0.00 70.33 68.73 1o63 n THR 17 CO 0.00 0.00 0.00 1.88 -0.64 0.00 0.00 175.07 176.31 1o63 h TYR 18 N 0.00 -0.04 -0.18 -1.42 0.05 -1.64 0.42 116.97 114.16 1o63 h TYR 18 Ca 0.00 0.03 0.04 0.00 0.05 0.00 0.00 58.73 58.85 1o63 h TYR 18 Cb 0.00 0.07 -0.04 0.00 1.01 0.00 0.00 36.73 37.77 1o63 h TYR 18 CO 0.00 -0.08 -0.09 -0.07 -1.05 0.00 0.00 178.16 176.87 1o63 h LEU 19 N 0.09 -0.29 -0.72 3.88 3.38 -1.30 0.15 115.31 120.49 1o63 h LEU 19 Ca 0.18 0.07 0.10 0.00 0.09 0.00 0.00 57.88 58.32 1o63 h LEU 19 Cb 0.25 0.16 -0.08 0.00 0.09 0.00 0.00 40.66 41.09 1o63 h LEU 19 CO -0.31 -0.12 0.35 0.11 0.09 0.00 0.00 178.44 178.56 1o63 h LYS 20 N -0.07 0.56 0.00 1.13 1.79 -1.62 -0.30 116.57 118.05 1o63 h LYS 20 Ca 0.10 -0.03 -0.03 0.00 -2.18 0.00 0.00 60.65 58.51 1o63 h LYS 20 Cb 0.22 -0.13 -0.00 0.00 -1.58 0.00 0.00 32.23 30.74 1o63 h LYS 20 CO -0.22 0.37 -0.14 0.87 -1.08 0.00 0.00 179.45 179.25 1o63 h LYS 21 N 0.58 0.00 0.00 3.15 1.57 0.12 0.33 116.57 122.32 1o63 h LYS 21 Ca 0.36 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.14 1o63 h LYS 21 Cb 0.42 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.73 1o63 h LYS 21 CO -0.29 0.14 0.00 1.79 -0.57 0.00 0.00 179.45 180.51 1o63 h THR 22 N 0.00 0.00 0.00 -0.16 1.35 0.10 -3.47 112.91 110.74 1o63 h THR 22 Ca -0.00 -0.31 0.00 0.00 -0.55 0.00 0.00 66.41 65.55 1o63 h THR 22 Cb 0.37 1.12 0.00 0.00 -1.73 0.00 0.00 68.15 67.91 1o63 h THR 22 CO 0.02 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.90 1o63 n GLY 23 N 0.23 0.86 3.88 5.82 0.00 0.12 -5.00 105.19 111.08 1o63 n GLY 23 Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 1o63 n GLY 23 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1o63 s VAL 24 N -1.59 5.35 -0.08 1.61 0.11 -1.14 -5.02 120.40 119.64 1o63 s VAL 24 Ca 0.00 -0.08 0.02 0.00 -2.93 0.00 0.00 61.98 59.00 1o63 s VAL 24 Cb 0.00 -3.44 0.01 0.00 -1.53 0.00 0.00 36.38 31.42 1o63 s VAL 24 CO 0.00 0.42 -0.14 -0.63 -3.33 0.00 0.00 175.10 171.42 1o63 s ILE 25 N -1.21 1.34 -0.13 7.04 1.01 -1.26 -4.63 121.20 123.37 1o63 s ILE 25 Ca 0.23 -0.59 -0.07 0.00 0.00 0.00 0.00 60.65 60.22 1o63 s ILE 25 Cb -0.12 -1.22 -0.04 0.00 0.01 0.00 0.00 42.46 41.09 1o63 s ILE 25 CO 0.13 0.40 0.12 -0.36 0.00 0.00 0.00 174.94 175.23 1o63 s PHE 26 N 0.72 3.50 -0.10 3.97 0.40 -1.26 -3.46 117.98 121.75 1o63 s PHE 26 Ca -0.13 0.44 0.05 0.00 -0.60 0.00 0.00 56.93 56.69 1o63 s PHE 26 Cb -0.16 -1.96 -0.24 0.00 0.51 0.00 0.00 43.02 41.17 1o63 s PHE 26 CO 0.03 0.62 0.43 0.39 0.70 0.00 0.00 175.22 177.39 1o63 n GLU 27 N 2.28 0.69 -3.80 0.44 1.02 0.13 -4.90 120.64 116.50 1o63 n GLU 27 Ca -0.19 0.25 -0.13 0.00 -0.02 0.00 0.00 57.16 57.07 1o63 n GLU 27 Cb 0.54 -1.72 -0.11 0.00 -0.02 0.00 0.00 31.44 30.13 1o63 n GLU 27 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 1o63 s ARG 28 N -2.57 0.33 0.01 3.49 3.52 -0.96 -5.04 118.95 117.73 1o63 s ARG 28 Ca -0.14 0.23 0.02 0.00 -0.13 0.00 0.00 55.73 55.70 1o63 s ARG 28 Cb 0.07 0.15 -0.01 0.00 -1.56 0.00 0.00 34.95 33.61 1o63 s ARG 28 CO 0.79 -0.05 -0.05 -1.21 -0.81 0.00 0.00 175.30 173.96 1o63 s GLU 29 N -0.12 0.40 0.13 5.12 2.02 -1.26 -1.54 118.70 123.45 1o63 s GLU 29 Ca -0.02 -0.40 0.02 0.00 0.02 0.00 0.00 54.97 54.59 1o63 s GLU 29 Cb -0.02 -0.28 -0.01 0.00 0.10 0.00 0.00 34.13 33.92 1o63 s GLU 29 CO 0.01 0.06 0.08 -1.13 0.02 0.00 0.00 175.26 174.31 1o63 n SER 30 N 2.32 0.15 0.22 -0.19 3.41 0.49 -4.99 113.62 115.03 1o63 n SER 30 Ca -0.17 -1.77 0.08 0.00 -0.26 0.00 0.00 58.87 56.74 1o63 n SER 30 Cb 0.57 0.52 0.49 0.00 -0.26 0.00 0.00 64.21 65.53 1o63 n SER 30 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 1o63 h SER 31 N 0.68 0.00 -0.00 4.04 0.87 -2.01 -3.28 113.55 113.84 1o63 h SER 31 Ca -0.09 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.47 1o63 h SER 31 Cb 0.43 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.39 1o63 h SER 31 CO 0.14 0.27 -0.02 2.30 -0.53 0.00 0.00 176.83 178.99 1o63 n ILE 32 N -3.72 0.00 -3.72 2.23 -5.35 -1.26 -4.94 119.36 102.60 1o63 n ILE 32 Ca -0.01 -0.49 -0.12 0.00 -0.27 0.00 0.00 62.75 61.86 1o63 n ILE 32 Cb 0.38 1.01 -0.11 0.00 -1.74 0.00 0.00 39.64 39.18 1o63 n ILE 32 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 1o63 s LEU 33 N -1.15 0.24 -0.11 7.28 2.96 -1.24 -4.52 118.68 122.15 1o63 s LEU 33 Ca 0.01 0.83 -0.01 0.00 -0.22 0.00 0.00 54.13 54.73 1o63 s LEU 33 Cb 0.01 1.34 0.03 0.00 0.50 0.00 0.00 46.19 48.07 1o63 s LEU 33 CO 0.02 -0.16 -0.01 -0.13 -1.32 0.00 0.00 176.35 174.75 1o63 s ARG 34 N 0.73 0.86 0.20 1.98 0.52 -0.48 -0.38 118.95 122.37 1o63 s ARG 34 Ca -0.04 -0.12 0.11 0.00 -0.52 0.00 0.00 55.73 55.16 1o63 s ARG 34 Cb -0.05 -1.41 -0.04 0.00 0.52 0.00 0.00 34.95 33.96 1o63 s ARG 34 CO -0.05 -0.38 -0.23 -1.21 0.02 0.00 0.00 175.30 173.45 1o63 s GLU 35 N 1.87 1.51 0.00 3.54 2.02 -0.59 -0.02 118.70 127.03 1o63 s GLU 35 Ca 0.03 -1.53 0.00 0.00 0.02 0.00 0.00 54.97 53.49 1o63 s GLU 35 Cb -0.14 -1.80 0.00 0.00 0.10 0.00 0.00 34.13 32.30 1o63 s GLU 35 CO -0.07 0.38 0.00 0.41 0.02 0.00 0.00 175.26 176.01 1o63 n GLY 36 N 0.21 2.35 3.63 -1.39 0.00 -0.23 0.22 105.19 109.97 1o63 n GLY 36 Ca -0.12 -0.91 -0.43 0.00 0.00 0.00 0.00 46.02 44.56 1o63 n GLY 36 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1o63 s LYS 37 N -0.86 3.84 0.00 1.61 2.36 -1.23 -3.09 119.74 122.37 1o63 s LYS 37 Ca 0.00 1.86 0.00 0.00 -2.55 0.00 0.00 55.97 55.28 1o63 s LYS 37 Cb 0.00 -4.06 0.00 0.00 -1.05 0.00 0.00 37.83 32.72 1o63 s LYS 37 CO 0.00 -1.25 0.00 -0.25 1.55 0.00 0.00 175.35 175.40 1o63 n ASP 38 N 8.41 -4.01 -3.77 1.43 10.43 -1.26 -4.86 116.55 122.93 1o63 n ASP 38 Ca 0.19 0.00 -0.13 0.00 2.57 0.00 0.00 54.79 57.42 1o63 n ASP 38 Cb 0.44 -2.04 -0.14 0.00 1.84 0.00 0.00 41.12 41.23 1o63 n ASP 38 CO 0.00 0.00 0.00 -0.51 -1.07 0.00 0.00 177.20 175.62 1o63 s ILE 39 N -1.58 -0.04 -0.08 0.53 2.07 -1.18 -1.19 121.20 119.74 1o63 s ILE 39 Ca 0.00 0.13 0.01 0.00 -1.41 0.00 0.00 60.65 59.38 1o63 s ILE 39 Cb 0.00 -0.23 0.02 0.00 0.13 0.00 0.00 42.46 42.38 1o63 s ILE 39 CO 0.00 0.05 -0.09 -0.69 -1.91 0.00 0.00 174.94 172.31 1o63 s VAL 40 N 0.89 0.96 -0.22 4.00 1.01 -0.79 -1.07 120.40 125.19 1o63 s VAL 40 Ca -0.07 -0.33 -0.03 0.00 0.00 0.00 0.00 61.98 61.55 1o63 s VAL 40 Cb -0.09 -0.94 -0.00 0.00 0.00 0.00 0.00 36.38 35.35 1o63 s VAL 40 CO -0.04 0.33 -0.05 0.00 0.00 0.00 0.00 175.10 175.33 1o63 n PHE 42 N 4.78 0.00 0.00 0.00 3.01 0.77 -1.39 117.46 124.62 1o63 n PHE 42 Ca -0.18 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.28 1o63 n PHE 42 Cb 0.50 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.97 1o63 n PHE 42 CO 0.00 0.00 0.00 1.33 1.01 0.00 0.00 176.76 179.10 1o63 n VAL 44 N 0.00 0.00 -2.01 -4.37 0.24 -0.19 -0.15 118.33 111.85 1o63 n VAL 44 Ca 0.00 0.00 -0.41 0.00 -2.04 0.00 0.00 64.34 61.89 1o63 n VAL 44 Cb 0.00 0.00 -0.01 0.00 -1.47 0.00 0.00 33.84 32.36 1o63 n VAL 44 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 1o63 s ARG 45 N -1.98 4.21 0.28 7.34 1.81 -1.26 0.09 118.95 129.44 1o63 s ARG 45 Ca 0.00 2.31 0.01 0.00 -1.72 0.00 0.00 55.73 56.33 1o63 s ARG 45 Cb 0.00 -2.98 0.68 0.00 -0.45 0.00 0.00 34.95 32.20 1o63 s ARG 45 CO 0.00 -0.35 1.67 -1.35 -0.68 0.00 0.00 175.30 174.59 1o63 h PRO 46 N 3.13 0.26 0.00 3.54 0.11 -1.90 0.41 132.00 137.55 1o63 h PRO 46 Ca -0.50 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1o63 h PRO 46 Cb 1.23 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1o63 h PRO 46 CO 0.64 0.17 0.00 0.74 -0.21 0.00 0.00 178.00 179.35 1o63 h PHE 47 N 0.27 0.00 -0.00 0.65 -1.00 -1.98 -2.15 116.94 112.72 1o63 h PHE 47 Ca 0.53 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.31 1o63 h PHE 47 Cb 1.03 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.59 1o63 h PHE 47 CO -0.23 0.00 -0.26 -0.25 -1.61 0.00 0.00 178.31 175.96 1o63 n ASP 48 N -2.84 0.45 0.10 2.17 8.00 0.14 -4.39 116.55 120.18 1o63 n ASP 48 Ca 0.00 -0.24 -0.13 0.00 0.71 0.00 0.00 54.79 55.13 1o63 n ASP 48 Cb 0.24 -0.01 -0.06 0.00 -0.02 0.00 0.00 41.12 41.27 1o63 n ASP 48 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 1o63 h VAL 49 N 0.29 0.29 -0.70 2.53 2.07 -1.23 -1.75 116.25 117.75 1o63 h VAL 49 Ca 0.00 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.58 1o63 h VAL 49 Cb 0.47 0.29 -0.04 0.00 -1.52 0.00 0.00 31.29 30.48 1o63 h VAL 49 CO 0.00 0.00 0.46 -0.65 0.02 0.00 0.00 177.57 177.40 1o63 h PRO 50 N -0.54 0.70 0.00 1.57 0.11 -1.80 -1.55 132.00 130.49 1o63 h PRO 50 Ca 0.04 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 66.03 1o63 h PRO 50 Cb 0.59 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.53 1o63 h PRO 50 CO -0.22 0.46 -0.37 1.79 -0.21 0.00 0.00 178.00 179.45 1o63 h THR 51 N 0.72 1.16 0.00 -1.15 1.35 -1.62 1.00 112.91 114.37 1o63 h THR 51 Ca 0.30 -1.32 -0.13 0.00 -0.55 0.00 0.00 66.41 64.72 1o63 h THR 51 Cb 0.26 1.73 -0.02 0.00 -1.73 0.00 0.00 68.15 68.39 1o63 h THR 51 CO -0.10 0.36 -0.61 1.88 -0.25 0.00 0.00 175.52 176.80 1o63 h TYR 52 N 0.00 0.00 0.04 4.73 -1.99 -0.46 -2.21 116.97 117.08 1o63 h TYR 52 Ca -0.00 0.00 -0.07 0.00 2.00 0.00 0.00 58.73 60.66 1o63 h TYR 52 Cb 0.70 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.43 1o63 h TYR 52 CO 0.00 0.61 -0.33 -0.07 -0.00 0.00 0.00 178.16 178.37 1o63 h LEU 53 N 0.00 0.14 -0.67 3.88 3.38 -0.80 -1.51 115.31 119.72 1o63 h LEU 53 Ca -0.01 -0.96 0.13 0.00 0.09 0.00 0.00 57.88 57.14 1o63 h LEU 53 Cb 1.17 -0.05 -0.13 0.00 0.09 0.00 0.00 40.66 41.74 1o63 h LEU 53 CO 0.08 1.15 -0.19 0.58 0.09 0.00 0.00 178.44 180.15 1o63 h VAL 54 N -0.81 0.30 0.00 1.22 2.07 0.98 0.28 116.25 120.29 1o63 h VAL 54 Ca -0.07 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.45 1o63 h VAL 54 Cb 1.21 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 31.28 1o63 h VAL 54 CO 0.03 0.00 0.00 1.41 0.02 0.00 0.00 177.57 179.03 1o63 n HIS 55 N -5.46 0.00 -1.13 1.57 8.25 -0.83 -4.88 115.22 112.75 1o63 n HIS 55 Ca 0.08 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.50 1o63 n HIS 55 Cb 0.35 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.44 1o63 n HIS 55 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1o63 n GLY 56 N 0.61 0.70 0.09 -1.41 0.00 0.99 -4.90 105.19 101.28 1o63 n GLY 56 Ca 0.16 -0.48 -0.02 0.00 0.00 0.00 0.00 46.02 45.68 1o63 n GLY 56 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1o63 h VAL 57 N 0.00 0.63 -3.22 1.61 -1.51 -1.55 -3.46 116.25 108.75 1o63 h VAL 57 Ca -0.09 -2.19 -0.65 0.00 -1.23 0.00 0.00 66.70 62.54 1o63 h VAL 57 Cb 0.40 2.16 -0.17 0.00 -2.13 0.00 0.00 31.29 31.55 1o63 h VAL 57 CO 0.13 0.36 -0.78 0.00 -1.23 0.00 0.00 177.57 176.05 1o63 s ALA 58 N -2.86 2.71 -0.23 5.19 0.00 -0.65 -4.82 121.76 121.11 1o63 s ALA 58 Ca -0.03 -1.53 -0.02 0.00 0.00 0.00 0.00 51.96 50.39 1o63 s ALA 58 Cb 0.08 -0.54 -0.19 0.00 0.00 0.00 0.00 23.12 22.48 1o63 s ALA 58 CO 0.81 0.47 -0.09 -0.25 0.00 0.00 0.00 175.76 176.70 1o63 n ASP 59 N 0.28 2.01 -4.06 0.00 8.00 0.13 -4.53 116.55 118.37 1o63 n ASP 59 Ca -0.12 -0.01 -0.18 0.00 0.71 0.00 0.00 54.79 55.19 1o63 n ASP 59 Cb 0.55 -0.56 -0.14 0.00 -0.02 0.00 0.00 41.12 40.96 1o63 n ASP 59 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1o63 s ILE 60 N -2.52 0.77 0.26 0.53 1.01 -0.95 -0.23 121.20 120.06 1o63 s ILE 60 Ca -0.32 -0.71 -0.01 0.00 0.00 0.00 0.00 60.65 59.61 1o63 s ILE 60 Cb 0.09 -0.71 -0.03 0.00 0.01 0.00 0.00 42.46 41.83 1o63 s ILE 60 CO 0.63 0.01 0.27 -0.83 0.00 0.00 0.00 174.94 175.02 1o63 s GLY 61 N -0.79 1.55 -0.06 6.18 0.00 -0.10 -1.12 107.32 112.98 1o63 s GLY 61 Ca -0.00 -1.66 0.02 0.00 0.00 0.00 0.00 44.72 43.08 1o63 s GLY 61 CO 0.00 -1.25 -0.11 -1.36 0.00 0.00 0.00 173.10 170.38 1o63 s PHE 62 N -3.79 1.34 -0.04 1.90 0.40 -1.05 -0.98 117.98 115.76 1o63 s PHE 62 Ca 0.36 -0.49 -0.29 0.00 -0.60 0.00 0.00 56.93 55.90 1o63 s PHE 62 Cb 0.04 -1.01 0.11 0.00 0.51 0.00 0.00 43.02 42.66 1o63 s PHE 62 CO 0.17 -0.27 0.93 0.00 0.70 0.00 0.00 175.22 176.74 1o63 s GLY 64 N -2.27 1.67 0.30 0.00 0.00 -1.26 -0.85 107.32 104.91 1o63 s GLY 64 Ca 0.04 0.20 0.04 0.00 0.00 0.00 0.00 44.72 45.00 1o63 s GLY 64 CO -0.07 0.55 1.82 -0.84 0.00 0.00 0.00 173.10 174.55 1o63 h THR 65 N -1.06 0.84 -0.39 0.90 2.02 -1.69 -0.44 112.91 113.09 1o63 h THR 65 Ca -0.44 -0.30 0.05 0.00 0.77 0.00 0.00 66.41 66.48 1o63 h THR 65 Cb 1.23 -0.13 -0.04 0.00 -1.74 0.00 0.00 68.15 67.47 1o63 h THR 65 CO 0.53 0.16 0.14 -2.24 0.37 0.00 0.00 175.52 174.48 1o63 h ASP 66 N 0.89 0.15 -0.02 4.18 -0.00 -1.91 -0.28 116.42 119.43 1o63 h ASP 66 Ca 0.52 0.04 -0.00 0.00 -0.00 0.00 0.00 57.03 57.60 1o63 h ASP 66 Cb 0.66 0.03 -0.00 0.00 -0.00 0.00 0.00 39.33 40.01 1o63 h ASP 66 CO -0.30 0.12 0.01 0.58 -0.00 0.00 0.00 179.24 179.65 1o63 h VAL 67 N 0.30 1.04 -0.58 4.15 2.07 -1.45 -1.21 116.25 120.56 1o63 h VAL 67 Ca 0.18 -0.10 -0.04 0.00 0.82 0.00 0.00 66.70 67.56 1o63 h VAL 67 Cb 0.16 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.98 1o63 h VAL 67 CO -0.18 0.03 0.20 -0.07 0.02 0.00 0.00 177.57 177.57 1o63 h LEU 68 N -0.02 0.79 0.00 2.57 3.38 -1.22 -1.14 115.31 119.66 1o63 h LEU 68 Ca 0.01 -0.11 -0.14 0.00 0.09 0.00 0.00 57.88 57.72 1o63 h LEU 68 Cb 0.04 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1o63 h LEU 68 CO -0.00 0.73 -0.71 -0.07 0.09 0.00 0.00 178.44 178.48 1o63 h LEU 69 N 0.84 0.00 -0.12 1.67 3.38 -0.98 -3.32 115.31 116.78 1o63 h LEU 69 Ca 0.20 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.94 1o63 h LEU 69 Cb 0.21 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 1o63 h LEU 69 CO -0.01 0.64 -1.00 -0.08 0.09 0.00 0.00 178.44 178.08 1o63 h GLU 70 N 0.00 0.30 -3.14 1.13 4.57 -1.02 -3.39 114.58 113.03 1o63 h GLU 70 Ca -0.02 -0.37 -0.63 0.00 -1.18 0.00 0.00 59.36 57.16 1o63 h GLU 70 Cb 1.51 0.12 -0.41 0.00 -0.16 0.00 0.00 28.75 29.80 1o63 h GLU 70 CO 0.08 1.09 -0.54 0.21 -1.18 0.00 0.00 179.01 178.67 1o63 s LYS 71 N -3.08 2.46 -0.41 1.92 2.47 -0.45 -4.71 119.74 117.94 1o63 s LYS 71 Ca -0.04 -3.25 -0.37 0.00 -1.56 0.00 0.00 55.97 50.75 1o63 s LYS 71 Cb 0.09 -3.45 -0.16 0.00 -1.46 0.00 0.00 37.83 32.85 1o63 s LYS 71 CO 0.86 -1.26 1.68 -0.85 0.16 0.00 0.00 175.35 175.94 1o63 n GLU 72 N 2.15 0.00 -0.11 4.03 -0.00 -1.25 -4.75 120.64 120.71 1o63 n GLU 72 Ca 0.18 0.00 -0.19 0.00 -0.00 0.00 0.00 57.16 57.14 1o63 n GLU 72 Cb 0.35 -1.24 -0.07 0.00 -0.00 0.00 0.00 31.44 30.48 1o63 n GLU 72 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 1o63 n THR 73 N 4.98 1.51 -2.79 3.84 -2.24 -1.26 -5.03 114.28 113.29 1o63 n THR 73 Ca 0.42 -0.12 -0.09 0.00 -2.27 0.00 0.00 64.05 61.98 1o63 n THR 73 Cb -0.04 -2.12 0.05 0.00 -2.10 0.00 0.00 70.33 66.13 1o63 n THR 73 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1o63 n SER 74 N -4.36 -2.09 -4.84 3.42 3.41 -1.26 -5.04 113.62 102.85 1o63 n SER 74 Ca -0.34 -0.34 -0.25 0.00 -0.26 0.00 0.00 58.87 57.68 1o63 n SER 74 Cb 0.70 -3.03 -0.05 0.00 -0.26 0.00 0.00 64.21 61.57 1o63 n SER 74 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1o63 s LEU 75 N -4.39 3.95 0.08 1.04 1.43 -1.26 -4.83 118.68 114.70 1o63 s LEU 75 Ca 0.01 -0.08 -0.30 0.00 -1.03 0.00 0.00 54.13 52.72 1o63 s LEU 75 Cb -0.00 -2.53 -0.06 0.00 0.03 0.00 0.00 46.19 43.63 1o63 s LEU 75 CO 0.40 0.03 1.16 -0.63 0.23 0.00 0.00 176.35 177.54 1o63 s ILE 76 N -1.84 4.09 -0.69 -0.59 1.01 -0.62 -4.88 121.20 117.68 1o63 s ILE 76 Ca 0.32 1.55 0.01 0.00 0.00 0.00 0.00 60.65 62.53 1o63 s ILE 76 Cb -0.10 -3.99 0.17 0.00 0.01 0.00 0.00 42.46 38.55 1o63 s ILE 76 CO 0.25 0.15 0.50 -1.10 0.00 0.00 0.00 174.94 174.74 1o63 s GLN 77 N 0.77 2.60 0.09 2.79 -0.21 -1.26 -0.06 119.66 124.37 1o63 s GLN 77 Ca 0.56 -2.92 -0.21 0.00 0.02 0.00 0.00 55.36 52.81 1o63 s GLN 77 Cb -0.29 -3.64 -0.11 0.00 1.00 0.00 0.00 33.01 29.98 1o63 s GLN 77 CO 0.30 -1.21 1.65 -1.00 -2.12 0.00 0.00 175.29 172.91 1o63 h PRO 78 N 6.31 0.20 0.00 2.91 0.13 -1.95 -3.48 132.00 136.12 1o63 h PRO 78 Ca 0.05 -0.03 0.16 0.00 -0.87 0.00 0.00 66.00 65.31 1o63 h PRO 78 Cb 0.86 -0.04 -0.03 0.00 0.13 0.00 0.00 31.00 31.93 1o63 h PRO 78 CO 0.74 0.26 0.50 1.97 -0.23 0.00 0.00 178.00 181.24 1o63 n PHE 79 N -4.91 -0.87 -4.23 1.56 1.16 -1.26 -5.09 117.46 103.83 1o63 n PHE 79 Ca -0.05 -0.78 -0.13 0.00 -1.87 0.00 0.00 57.45 54.62 1o63 n PHE 79 Cb 0.10 0.37 -0.10 0.00 -1.61 0.00 0.00 39.48 38.24 1o63 n PHE 79 CO 0.00 0.00 0.00 -0.59 -1.87 0.00 0.00 176.76 174.30 1o63 s PHE 80 N -2.93 1.24 -0.02 2.97 -0.12 -1.26 -1.47 117.98 116.39 1o63 s PHE 80 Ca 0.18 -1.31 -0.25 0.00 -0.05 0.00 0.00 56.93 55.50 1o63 s PHE 80 Cb -0.02 -0.64 -0.04 0.00 -0.63 0.00 0.00 43.02 41.69 1o63 s PHE 80 CO 0.03 -0.55 0.76 0.42 -0.05 0.00 0.00 175.22 175.82 1o63 s ILE 81 N -4.04 4.93 0.36 -4.49 1.01 0.62 -4.91 121.20 114.67 1o63 s ILE 81 Ca 0.38 1.58 0.04 0.00 0.00 0.00 0.00 60.65 62.65 1o63 s ILE 81 Cb 0.07 -4.10 0.23 0.00 0.01 0.00 0.00 42.46 38.67 1o63 s ILE 81 CO 0.12 0.28 1.98 -0.65 0.00 0.00 0.00 174.94 176.66 1o63 h PRO 82 N 6.42 0.65 -6.27 2.79 0.11 -1.94 -3.37 132.00 130.39 1o63 h PRO 82 Ca -0.42 -0.07 -0.66 0.00 0.11 0.00 0.00 66.00 64.96 1o63 h PRO 82 Cb 1.20 -0.13 0.03 0.00 0.11 0.00 0.00 31.00 32.21 1o63 h PRO 82 CO 0.74 0.50 0.86 -2.37 -0.21 0.00 0.00 178.00 177.52 1o63 n THR 83 N -4.40 0.28 -2.48 -1.15 5.66 -1.26 -4.88 114.28 106.06 1o63 n THR 83 Ca 0.04 -0.05 -0.41 0.00 -3.05 0.00 0.00 64.05 60.58 1o63 n THR 83 Cb 0.11 -1.40 -0.03 0.00 -1.55 0.00 0.00 70.33 67.46 1o63 n THR 83 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 175.07 172.22 1o63 s ASN 84 N 2.70 6.06 0.07 1.09 0.01 -1.26 -4.60 114.94 119.01 1o63 s ASN 84 Ca 0.91 -0.41 -0.04 0.00 -0.71 0.00 0.00 52.86 52.61 1o63 s ASN 84 Cb -0.87 -2.56 -0.28 0.00 0.41 0.00 0.00 41.25 37.95 1o63 s ASN 84 CO 0.53 -1.90 1.12 0.16 -1.51 0.00 0.00 177.10 175.50 1o63 h ILE 85 N 6.19 1.48 -2.12 0.60 3.07 -1.81 -3.50 117.51 121.42 1o63 h ILE 85 Ca -0.25 -3.05 0.11 0.00 1.55 0.00 0.00 64.86 63.23 1o63 h ILE 85 Cb 1.06 2.94 -0.02 0.00 -0.27 0.00 0.00 36.82 40.53 1o63 h ILE 85 CO 1.28 0.89 0.39 -1.54 -1.05 0.00 0.00 178.15 178.12 1o63 n SER 86 N -3.53 -1.02 0.00 2.16 3.41 -1.21 -4.82 113.62 108.61 1o63 n SER 86 Ca -0.09 -1.50 0.00 0.00 -0.26 0.00 0.00 58.87 57.02 1o63 n SER 86 Cb 1.03 1.64 0.00 0.00 -0.26 0.00 0.00 64.21 66.62 1o63 n SER 86 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1o63 n ARG 87 N -0.46 0.00 0.00 4.33 1.74 -0.47 -0.31 116.66 121.49 1o63 n ARG 87 Ca -0.01 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.07 1o63 n ARG 87 Cb 0.36 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.80 1o63 n ARG 87 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 1o63 n VAL 89 N 0.00 0.00 -3.52 1.55 0.24 -0.57 -0.62 118.33 115.42 1o63 n VAL 89 Ca 0.00 0.00 -0.37 0.00 -2.04 0.00 0.00 64.34 61.93 1o63 n VAL 89 Cb 0.00 0.00 -0.07 0.00 -1.47 0.00 0.00 33.84 32.30 1o63 n VAL 89 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1o63 s LEU 90 N 0.00 4.28 0.07 1.34 2.96 -0.36 -1.56 118.68 125.41 1o63 s LEU 90 Ca 0.00 0.59 -0.01 0.00 -0.22 0.00 0.00 54.13 54.49 1o63 s LEU 90 Cb 0.00 -2.42 -0.04 0.00 0.50 0.00 0.00 46.19 44.23 1o63 s LEU 90 CO 0.00 0.12 -0.03 0.00 -1.32 0.00 0.00 176.35 175.12 1o63 s ALA 91 N 0.27 0.62 0.20 5.97 0.00 0.46 -0.80 121.76 128.47 1o63 s ALA 91 Ca 0.18 -1.26 -0.23 0.00 0.00 0.00 0.00 51.96 50.65 1o63 s ALA 91 Cb -0.14 0.31 0.05 0.00 0.00 0.00 0.00 23.12 23.35 1o63 s ALA 91 CO 0.06 -0.36 0.77 0.20 0.00 0.00 0.00 175.76 176.42 1o63 s GLY 92 N -2.95 -0.28 0.09 0.00 0.00 -0.83 -1.12 107.32 102.23 1o63 s GLY 92 Ca 0.09 0.10 -0.35 0.00 0.00 0.00 0.00 44.72 44.56 1o63 s GLY 92 CO -0.08 0.03 1.56 -1.05 0.00 0.00 0.00 173.10 173.56 1o63 n PRO 93 N -0.42 1.85 -1.54 2.90 -0.02 -1.26 0.07 135.00 136.56 1o63 n PRO 93 Ca -0.08 0.67 -0.53 0.00 -2.02 0.00 0.00 63.50 61.54 1o63 n PRO 93 Cb 0.61 -2.41 -0.06 0.00 -0.02 0.00 0.00 33.50 31.62 1o63 n PRO 93 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1o63 n LYS 94 N 3.70 0.69 0.00 -0.52 5.02 -0.60 -1.48 118.16 124.98 1o63 n LYS 94 Ca 0.19 0.25 0.00 0.00 -2.02 0.00 0.00 58.31 56.72 1o63 n LYS 94 Cb 0.26 -1.75 0.00 0.00 -0.02 0.00 0.00 35.03 33.52 1o63 n LYS 94 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1o63 n GLY 95 N 2.01 1.74 0.22 0.72 0.00 -1.26 -4.75 105.19 103.87 1o63 n GLY 95 Ca 0.18 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.35 1o63 n GLY 95 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1o63 h ARG 96 N 1.10 0.00 0.00 1.61 0.11 -1.62 -3.48 114.38 112.11 1o63 h ARG 96 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1o63 h ARG 96 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 1o63 h ARG 96 CO 0.00 0.00 0.00 0.41 0.10 0.00 0.00 179.97 180.48 1o63 n GLY 97 N 0.17 2.73 2.91 0.08 0.00 -1.26 -4.49 105.19 105.33 1o63 n GLY 97 Ca 0.02 -0.32 -0.29 0.00 0.00 0.00 0.00 46.02 45.43 1o63 n GLY 97 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1o63 s ILE 98 N 0.00 1.24 0.27 -0.61 1.01 -1.26 -4.85 121.20 117.00 1o63 s ILE 98 Ca 0.00 -0.77 -0.28 0.00 0.00 0.00 0.00 60.65 59.59 1o63 s ILE 98 Cb 0.00 -1.42 -0.15 0.00 0.01 0.00 0.00 42.46 40.90 1o63 s ILE 98 CO 0.00 0.09 0.93 -2.65 0.00 0.00 0.00 174.94 173.31 1o63 n PRO 99 N 4.82 1.12 -0.97 2.79 -0.02 -1.26 -4.94 135.00 136.54 1o63 n PRO 99 Ca -0.12 0.39 -0.31 0.00 -2.02 0.00 0.00 63.50 61.44 1o63 n PRO 99 Cb 0.47 -1.70 0.13 0.00 -0.02 0.00 0.00 33.50 32.38 1o63 n PRO 99 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1o63 s GLU 100 N -1.45 1.58 4.08 -0.52 2.02 -1.26 -4.79 118.70 118.37 1o63 s GLU 100 Ca 0.60 1.35 0.00 0.00 0.02 0.00 0.00 54.97 56.93 1o63 s GLU 100 Cb -0.74 -1.81 0.00 0.00 0.10 0.00 0.00 34.13 31.68 1o63 s GLU 100 CO 0.59 -2.17 0.00 0.41 0.02 0.00 0.00 175.26 174.11 1o63 n GLY 101 N -0.48 0.96 3.68 -1.39 0.00 -1.26 -4.72 105.19 101.98 1o63 n GLY 101 Ca 0.10 -0.71 -0.42 0.00 0.00 0.00 0.00 46.02 44.99 1o63 n GLY 101 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1o63 s GLU 102 N 0.00 4.21 -0.15 1.61 2.12 -1.26 -4.65 118.70 120.58 1o63 s GLU 102 Ca 0.00 2.23 -0.18 0.00 0.36 0.00 0.00 54.97 57.38 1o63 s GLU 102 Cb 0.00 -3.67 -0.04 0.00 0.26 0.00 0.00 34.13 30.68 1o63 s GLU 102 CO 0.00 -0.72 0.49 0.15 -0.54 0.00 0.00 175.26 174.64 1o63 s LYS 103 N 2.87 4.27 -0.33 4.30 3.01 0.12 -4.88 119.74 129.10 1o63 s LYS 103 Ca 0.72 0.43 -0.20 0.00 -1.01 0.00 0.00 55.97 55.90 1o63 s LYS 103 Cb -0.37 -3.49 -0.00 0.00 -1.01 0.00 0.00 37.83 32.96 1o63 s LYS 103 CO 0.31 0.02 0.64 1.03 0.51 0.00 0.00 175.35 177.86 1o63 s ARG 104 N 1.07 3.78 -0.13 1.68 0.52 -1.26 -0.32 118.95 124.30 1o63 s ARG 104 Ca 0.25 0.18 0.02 0.00 -0.52 0.00 0.00 55.73 55.66 1o63 s ARG 104 Cb -0.15 -3.77 0.01 0.00 0.52 0.00 0.00 34.95 31.56 1o63 s ARG 104 CO 0.10 -0.67 -0.18 0.42 0.02 0.00 0.00 175.30 175.00 1o63 s ILE 105 N 2.68 1.73 -0.03 1.52 1.01 -0.24 -0.65 121.20 127.22 1o63 s ILE 105 Ca 0.25 -0.77 -0.10 0.00 0.00 0.00 0.00 60.65 60.02 1o63 s ILE 105 Cb -0.15 -1.56 -0.05 0.00 0.01 0.00 0.00 42.46 40.71 1o63 s ILE 105 CO 0.13 0.49 0.30 0.00 0.00 0.00 0.00 174.94 175.86 1o63 s ALA 106 N 1.01 3.78 0.08 9.38 0.00 -0.76 -0.88 121.76 134.38 1o63 s ALA 106 Ca -0.05 -0.43 -0.26 0.00 0.00 0.00 0.00 51.96 51.23 1o63 s ALA 106 Cb -0.15 -2.19 0.08 0.00 0.00 0.00 0.00 23.12 20.87 1o63 s ALA 106 CO -0.04 0.56 0.75 -0.08 0.00 0.00 0.00 175.76 176.96 1o63 s THR 107 N -1.13 0.00 -2.07 0.00 -1.32 -0.60 -2.56 115.64 107.96 1o63 s THR 107 Ca 0.23 -0.05 0.24 0.00 -1.21 0.00 0.00 61.69 60.89 1o63 s THR 107 Cb -0.14 -1.07 0.13 0.00 -1.51 0.00 0.00 72.50 69.91 1o63 s THR 107 CO 0.11 0.00 1.30 0.29 -2.21 0.00 0.00 174.62 174.12 1o63 n LYS 108 N -0.32 1.22 -3.55 7.08 5.02 -1.26 -0.13 118.16 126.24 1o63 n LYS 108 Ca -0.12 -0.92 -0.27 0.00 -2.02 0.00 0.00 58.31 54.98 1o63 n LYS 108 Cb 0.63 -1.48 -0.09 0.00 -0.02 0.00 0.00 35.03 34.07 1o63 n LYS 108 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1o63 n PHE 109 N -0.08 2.30 0.01 2.13 3.72 -1.26 -4.89 117.46 119.39 1o63 n PHE 109 Ca 0.11 -4.01 -0.05 0.00 -0.05 0.00 0.00 57.45 53.46 1o63 n PHE 109 Cb 0.44 -0.44 0.16 0.00 -0.94 0.00 0.00 39.48 38.70 1o63 n PHE 109 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1o63 h PRO 110 N 4.75 0.49 -0.18 -1.08 0.13 -1.96 -0.90 132.00 133.25 1o63 h PRO 110 Ca 0.17 -0.21 -0.08 0.00 -0.87 0.00 0.00 66.00 65.01 1o63 h PRO 110 Cb 0.76 -0.01 -0.00 0.00 0.13 0.00 0.00 31.00 31.87 1o63 h PRO 110 CO 0.68 0.76 -0.21 -0.91 -0.23 0.00 0.00 178.00 178.09 1o63 h ASN 111 N 0.42 0.49 -0.67 1.44 2.35 -1.93 -0.12 115.58 117.57 1o63 h ASN 111 Ca 0.05 -0.49 0.05 0.00 -0.55 0.00 0.00 56.30 55.35 1o63 h ASN 111 Cb 0.78 -0.14 -0.05 0.00 0.05 0.00 0.00 38.32 38.96 1o63 h ASN 111 CO 0.06 0.89 0.39 0.58 -1.65 0.00 0.00 177.43 177.70 1o63 h VAL 112 N 0.11 1.01 -0.46 2.81 2.07 -1.79 -1.38 116.25 118.62 1o63 h VAL 112 Ca 0.03 -0.25 -0.07 0.00 0.82 0.00 0.00 66.70 67.22 1o63 h VAL 112 Cb 0.76 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 1o63 h VAL 112 CO 0.05 0.13 0.00 0.74 0.02 0.00 0.00 177.57 178.52 1o63 h THR 113 N 0.73 1.26 -0.63 2.57 2.02 -1.02 -0.37 112.91 117.46 1o63 h THR 113 Ca 0.29 -1.05 -0.02 0.00 0.77 0.00 0.00 66.41 66.40 1o63 h THR 113 Cb 0.13 1.02 -0.03 0.00 -1.74 0.00 0.00 68.15 67.53 1o63 h THR 113 CO -0.15 0.36 0.32 -0.61 0.37 0.00 0.00 175.52 175.81 1o63 h GLN 114 N 0.67 0.90 -0.30 6.66 5.75 -0.65 0.26 115.11 128.40 1o63 h GLN 114 Ca 0.13 -0.12 -0.12 0.00 -0.15 0.00 0.00 58.65 58.39 1o63 h GLN 114 Cb 0.50 -0.17 -0.01 0.00 1.07 0.00 0.00 27.48 28.87 1o63 h GLN 114 CO 0.02 0.71 -0.31 0.00 -2.65 0.00 0.00 178.83 176.61 1o63 h ARG 115 N 0.87 0.63 -0.29 1.69 3.08 -1.10 -0.80 114.38 118.46 1o63 h ARG 115 Ca 0.22 -0.28 0.00 0.00 0.07 0.00 0.00 59.98 59.99 1o63 h ARG 115 Cb 0.10 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 1o63 h ARG 115 CO -0.03 0.86 0.18 -0.92 -1.07 0.00 0.00 179.97 179.00 1o63 h TYR 116 N 0.54 0.38 -0.65 3.04 5.03 -0.71 -0.76 116.97 123.83 1o63 h TYR 116 Ca 0.06 0.00 -0.02 0.00 2.58 0.00 0.00 58.73 61.35 1o63 h TYR 116 Cb 0.80 -0.13 -0.03 0.00 1.55 0.00 0.00 36.73 38.92 1o63 h TYR 116 CO 0.03 0.26 0.31 0.00 -1.32 0.00 0.00 178.16 177.45 1o63 h GLU 118 N 0.90 0.87 -0.00 0.00 5.08 -0.96 0.87 114.58 121.33 1o63 h GLU 118 Ca 0.22 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.48 1o63 h GLU 118 Cb 0.12 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 1o63 h GLU 118 CO -0.03 0.57 -0.24 0.66 -1.00 0.00 0.00 179.01 178.97 1o63 h SER 119 N 0.89 0.01 0.73 1.42 4.64 -0.35 -1.44 113.55 119.45 1o63 h SER 119 Ca 0.27 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 1o63 h SER 119 Cb -0.03 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.06 1o63 h SER 119 CO -0.09 0.25 -0.48 0.29 -0.87 0.00 0.00 176.83 175.94 1o63 n LYS 120 N -4.25 0.13 -2.34 4.77 4.76 -0.66 -4.95 118.16 115.62 1o63 n LYS 120 Ca -0.02 0.04 -0.03 0.00 -2.87 0.00 0.00 58.31 55.42 1o63 n LYS 120 Cb 0.30 -1.58 0.00 0.00 -1.84 0.00 0.00 35.03 31.91 1o63 n LYS 120 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1o63 n GLY 121 N 1.43 0.46 3.83 0.72 0.00 -0.30 -5.03 105.19 106.29 1o63 n GLY 121 Ca 0.05 -0.65 -0.32 0.00 0.00 0.00 0.00 46.02 45.09 1o63 n GLY 121 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1o63 s TRP 122 N -2.57 3.36 -0.20 1.61 0.51 0.15 -5.03 118.94 116.78 1o63 s TRP 122 Ca 0.04 0.23 -0.20 0.00 -2.12 0.00 0.00 56.10 54.05 1o63 s TRP 122 Cb -0.02 -1.75 -0.03 0.00 -0.81 0.00 0.00 33.47 30.87 1o63 s TRP 122 CO 0.05 0.58 0.60 -1.01 -0.51 0.00 0.00 176.95 176.66 1o63 s HIS 123 N -1.29 3.37 0.03 -1.98 3.76 -1.26 -4.47 115.29 113.45 1o63 s HIS 123 Ca 0.26 0.89 0.03 0.00 -0.15 0.00 0.00 55.06 56.10 1o63 s HIS 123 Cb -0.12 -2.77 -0.02 0.00 1.11 0.00 0.00 32.58 30.78 1o63 s HIS 123 CO 0.18 -0.16 -0.10 0.00 -0.85 0.00 0.00 174.74 173.81 1o63 s ARG 125 N -0.96 2.47 -0.22 0.00 6.06 0.57 -4.90 118.95 121.97 1o63 s ARG 125 Ca -0.01 -1.24 -0.15 0.00 -2.50 0.00 0.00 55.73 51.83 1o63 s ARG 125 Cb -0.07 -3.21 -0.04 0.00 0.06 0.00 0.00 34.95 31.69 1o63 s ARG 125 CO 0.01 -0.62 0.35 0.42 -2.50 0.00 0.00 175.30 172.96 1o63 s ILE 126 N 1.27 5.23 -0.41 4.11 1.01 -1.26 -1.08 121.20 130.08 1o63 s ILE 126 Ca -0.05 0.58 -0.02 0.00 0.00 0.00 0.00 60.65 61.16 1o63 s ILE 126 Cb -0.20 -3.68 0.11 0.00 0.01 0.00 0.00 42.46 38.71 1o63 s ILE 126 CO -0.01 0.26 0.19 -0.63 0.00 0.00 0.00 174.94 174.76 1o63 s ILE 127 N 1.35 3.19 0.24 2.92 1.01 -0.06 -4.97 121.20 124.88 1o63 s ILE 127 Ca 0.16 -2.11 -0.30 0.00 0.00 0.00 0.00 60.65 58.40 1o63 s ILE 127 Cb -0.15 -3.20 -0.10 0.00 0.01 0.00 0.00 42.46 39.03 1o63 s ILE 127 CO 0.07 -0.69 1.35 -2.84 0.00 0.00 0.00 174.94 172.83 1o63 s PRO 128 N 1.09 4.35 0.35 2.79 0.02 -1.26 -1.56 135.00 140.77 1o63 s PRO 128 Ca 0.09 2.16 0.03 0.00 0.02 0.00 0.00 61.00 63.30 1o63 s PRO 128 Cb -0.22 -3.14 -0.05 0.00 0.02 0.00 0.00 34.50 31.11 1o63 s PRO 128 CO -0.05 -0.28 0.09 -0.51 -0.33 0.00 0.00 177.00 175.92 1o63 s LEU 129 N -0.56 2.01 -0.01 -5.54 1.43 0.82 -4.84 118.68 112.00 1o63 s LEU 129 Ca 0.56 -1.50 0.16 0.00 -1.03 0.00 0.00 54.13 52.32 1o63 s LEU 129 Cb -0.39 -0.21 -0.22 0.00 0.03 0.00 0.00 46.19 45.40 1o63 s LEU 129 CO 0.43 -0.76 0.48 0.29 0.23 0.00 0.00 176.35 177.02 1o63 n LYS 130 N -0.74 0.99 0.00 1.70 4.76 -1.26 -4.01 118.16 119.59 1o63 n LYS 130 Ca -0.03 -0.09 0.00 0.00 -2.87 0.00 0.00 58.31 55.31 1o63 n LYS 130 Cb 0.66 -1.33 0.00 0.00 -1.84 0.00 0.00 35.03 32.52 1o63 n LYS 130 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1o63 n GLY 131 N 1.50 -0.02 3.92 0.72 0.00 -1.26 -5.01 105.19 105.04 1o63 n GLY 131 Ca -0.01 -0.89 -0.25 0.00 0.00 0.00 0.00 46.02 44.87 1o63 n GLY 131 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1o63 n SER 132 N 0.00 -0.85 0.22 1.61 7.64 -1.26 -4.83 113.62 116.15 1o63 n SER 132 Ca 0.00 -0.96 0.07 0.00 1.01 0.00 0.00 58.87 58.99 1o63 n SER 132 Cb 0.00 -3.28 0.52 0.00 -1.01 0.00 0.00 64.21 60.44 1o63 n SER 132 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1o63 h VAL 133 N -1.83 1.00 0.00 0.44 2.07 -1.97 -2.22 116.25 113.74 1o63 h VAL 133 Ca -0.62 -0.79 0.00 0.00 0.82 0.00 0.00 66.70 66.11 1o63 h VAL 133 Cb 1.37 1.45 0.00 0.00 -1.52 0.00 0.00 31.29 32.59 1o63 h VAL 133 CO 0.62 0.21 0.00 1.05 0.02 0.00 0.00 177.57 179.48 1o63 h GLU 134 N 0.00 0.00 0.00 1.57 9.09 -1.96 -1.63 114.58 121.64 1o63 h GLU 134 Ca -0.00 0.00 -0.04 0.00 0.05 0.00 0.00 59.36 59.36 1o63 h GLU 134 Cb 0.43 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.52 1o63 h GLU 134 CO 0.03 0.00 -0.20 1.25 0.05 0.00 0.00 179.01 180.13 1o63 h LEU 135 N 0.00 0.00 -0.29 3.06 5.85 -1.77 -3.34 115.31 118.82 1o63 h LEU 135 Ca 0.00 0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.77 1o63 h LEU 135 Cb 0.10 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.09 1o63 h LEU 135 CO 0.00 0.20 0.02 0.00 -0.34 0.00 0.00 178.44 178.33 1o63 h ALA 136 N 1.80 0.28 -0.71 1.25 0.00 -1.49 -1.07 119.26 119.31 1o63 h ALA 136 Ca -0.00 0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 1o63 h ALA 136 Cb 0.75 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.62 1o63 h ALA 136 CO 0.03 -0.39 0.19 -1.35 0.00 0.00 0.00 179.25 177.73 1o63 h PRO 137 N 0.12 1.12 -0.83 0.00 0.11 -1.69 0.15 132.00 130.98 1o63 h PRO 137 Ca 0.14 -0.26 -0.02 0.00 0.11 0.00 0.00 66.00 65.97 1o63 h PRO 137 Cb 0.17 -0.15 -0.04 0.00 0.11 0.00 0.00 31.00 31.09 1o63 h PRO 137 CO -0.22 0.98 0.43 0.82 -0.21 0.00 0.00 178.00 179.81 1o63 h ILE 138 N 1.07 1.25 -0.00 4.15 5.03 -1.57 -2.83 117.51 124.61 1o63 h ILE 138 Ca 0.23 -0.65 0.00 0.00 -0.12 0.00 0.00 64.86 64.31 1o63 h ILE 138 Cb 0.34 0.15 0.00 0.00 -3.03 0.00 0.00 36.82 34.29 1o63 h ILE 138 CO -0.00 0.29 -0.13 0.00 -0.68 0.00 0.00 178.15 177.62 1o63 n ALA 139 N -2.40 2.69 -0.69 1.87 0.00 -0.46 -4.90 120.51 116.63 1o63 n ALA 139 Ca 0.08 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1o63 n ALA 139 Cb 0.11 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.19 1o63 n ALA 139 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1o63 n GLY 140 N 1.45 0.67 0.24 0.00 0.00 -0.78 -4.93 105.19 101.83 1o63 n GLY 140 Ca 0.08 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.97 1o63 n GLY 140 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1o63 h LEU 141 N 0.00 0.88 -8.64 0.99 5.85 -0.98 -3.47 115.31 109.94 1o63 h LEU 141 Ca 0.00 -0.48 -0.26 0.00 0.84 0.00 0.00 57.88 57.98 1o63 h LEU 141 Cb 0.00 -0.25 -0.15 0.00 0.37 0.00 0.00 40.66 40.63 1o63 h LEU 141 CO 0.00 1.26 -0.63 -0.94 -0.34 0.00 0.00 178.44 177.79 1o63 s SER 142 N -6.96 0.58 -0.05 1.25 1.04 -1.11 -4.92 113.70 103.53 1o63 s SER 142 Ca -0.10 -1.32 -0.02 0.00 0.48 0.00 0.00 55.95 54.99 1o63 s SER 142 Cb 0.10 0.27 -0.27 0.00 0.10 0.00 0.00 66.02 66.23 1o63 s SER 142 CO 0.88 -0.75 0.64 0.44 0.98 0.00 0.00 173.24 175.42 1o63 h ASP 143 N 2.62 0.36 -5.24 7.02 3.32 -1.23 -3.34 116.42 119.93 1o63 h ASP 143 Ca -0.36 -0.63 -0.32 0.00 0.02 0.00 0.00 57.03 55.74 1o63 h ASP 143 Cb 1.23 -0.12 -0.15 0.00 0.22 0.00 0.00 39.33 40.52 1o63 h ASP 143 CO 0.58 1.55 -0.60 -0.76 -1.72 0.00 0.00 179.24 178.29 1o63 s LEU 144 N -6.88 1.40 0.08 1.55 1.43 -0.73 -4.37 118.68 111.16 1o63 s LEU 144 Ca -0.13 -1.45 0.03 0.00 -1.03 0.00 0.00 54.13 51.54 1o63 s LEU 144 Cb 0.07 0.29 -0.03 0.00 0.03 0.00 0.00 46.19 46.54 1o63 s LEU 144 CO 0.82 -0.85 -0.09 0.27 0.23 0.00 0.00 176.35 176.73 1o63 s ILE 145 N -3.91 0.78 -0.25 -0.59 -4.36 -0.27 -1.82 121.20 110.77 1o63 s ILE 145 Ca 0.38 -1.50 0.02 0.00 -0.26 0.00 0.00 60.65 59.29 1o63 s ILE 145 Cb 0.06 -1.17 0.06 0.00 1.25 0.00 0.00 42.46 42.67 1o63 s ILE 145 CO 0.15 -0.54 -0.06 -0.69 0.24 0.00 0.00 174.94 174.04 1o63 s VAL 146 N -2.27 1.79 0.27 8.37 1.01 -1.06 -0.41 120.40 128.11 1o63 s VAL 146 Ca 0.01 -1.47 -0.11 0.00 0.00 0.00 0.00 61.98 60.42 1o63 s VAL 146 Cb -0.04 -2.03 -0.00 0.00 0.00 0.00 0.00 36.38 34.31 1o63 s VAL 146 CO -0.01 -0.14 0.48 -0.62 0.00 0.00 0.00 175.10 174.81 1o63 s ASP 147 N 1.26 0.10 0.10 3.32 2.15 -0.60 -4.26 116.67 118.74 1o63 s ASP 147 Ca -0.05 -1.06 -0.25 0.00 0.43 0.00 0.00 52.55 51.62 1o63 s ASP 147 Cb -0.19 0.61 -0.07 0.00 -0.30 0.00 0.00 42.92 42.97 1o63 s ASP 147 CO -0.07 -1.19 0.78 -0.63 -0.17 0.00 0.00 175.17 173.90 1o63 s ILE 148 N -3.76 4.57 -0.01 4.11 1.01 -1.26 -1.51 121.20 124.34 1o63 s ILE 148 Ca 0.24 1.68 0.05 0.00 0.00 0.00 0.00 60.65 62.62 1o63 s ILE 148 Cb -0.01 -4.13 -0.01 0.00 0.01 0.00 0.00 42.46 38.32 1o63 s ILE 148 CO 0.11 0.43 -0.17 0.28 0.00 0.00 0.00 174.94 175.59 1o63 s THR 149 N -0.52 1.33 -0.01 2.92 -1.32 0.21 -4.96 115.64 113.29 1o63 s THR 149 Ca 0.38 -0.72 -0.04 0.00 -1.21 0.00 0.00 61.69 60.09 1o63 s THR 149 Cb -0.22 -1.11 -0.01 0.00 -1.51 0.00 0.00 72.50 69.65 1o63 s THR 149 CO 0.25 0.38 -0.09 -0.62 -2.21 0.00 0.00 174.62 172.33 1o63 n GLU 150 N 2.66 0.13 -0.01 7.08 4.71 -1.26 -1.37 120.64 132.59 1o63 n GLU 150 Ca -0.15 0.05 0.10 0.00 -0.01 0.00 0.00 57.16 57.15 1o63 n GLU 150 Cb 0.54 -0.61 -0.14 0.00 -1.01 0.00 0.00 31.44 30.22 1o63 n GLU 150 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 1o63 n THR 151 N -3.33 0.00 -0.65 2.62 -2.24 -1.26 -4.92 114.28 104.50 1o63 n THR 151 Ca -0.03 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 1o63 n THR 151 Cb 0.13 0.44 0.00 0.00 -2.10 0.00 0.00 70.33 68.80 1o63 n THR 151 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1o63 n GLY 152 N 1.40 0.80 0.27 3.38 0.00 -1.26 -4.94 105.19 104.83 1o63 n GLY 152 Ca -0.01 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.85 1o63 n GLY 152 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1o63 h ARG 153 N 3.36 -0.59 -0.96 1.61 -0.00 -1.99 0.15 114.38 115.97 1o63 h ARG 153 Ca 0.00 0.04 0.11 0.00 -0.00 0.00 0.00 59.98 60.13 1o63 h ARG 153 Cb 0.00 0.13 -0.08 0.00 -0.00 0.00 0.00 29.97 30.03 1o63 h ARG 153 CO 0.00 -0.40 0.61 1.15 -0.00 0.00 0.00 179.97 181.34 1o63 h THR 154 N -0.62 0.94 0.13 0.08 2.02 -1.98 0.48 112.91 113.96 1o63 h THR 154 Ca -0.06 -0.32 -0.01 0.00 0.77 0.00 0.00 66.41 66.79 1o63 h THR 154 Cb 0.48 -0.09 0.00 0.00 -1.74 0.00 0.00 68.15 66.80 1o63 h THR 154 CO 0.09 0.17 -0.06 -0.07 0.37 0.00 0.00 175.52 176.02 1o63 h LEU 155 N 0.95 -0.15 -0.47 2.58 3.38 -1.82 -3.20 115.31 116.58 1o63 h LEU 155 Ca 0.46 -0.35 0.03 0.00 0.09 0.00 0.00 57.88 58.11 1o63 h LEU 155 Cb 0.46 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 1o63 h LEU 155 CO -0.22 0.30 0.26 0.07 0.09 0.00 0.00 178.44 178.94 1o63 h LYS 156 N -0.63 0.51 0.00 1.13 2.10 -0.35 -0.59 116.57 118.73 1o63 h LYS 156 Ca -0.02 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.60 1o63 h LYS 156 Cb 0.49 -0.11 0.00 0.00 -0.90 0.00 0.00 32.23 31.70 1o63 h LYS 156 CO 0.03 0.34 0.00 0.93 -2.00 0.00 0.00 179.45 178.74 1o63 h GLU 157 N 0.52 0.00 -0.20 0.07 5.08 -1.03 -2.31 114.58 116.71 1o63 h GLU 157 Ca 0.20 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.54 1o63 h GLU 157 Cb 0.06 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 1o63 h GLU 157 CO -0.11 0.00 -0.01 0.09 -1.00 0.00 0.00 179.01 177.98 1o63 n ASN 158 N -2.65 3.33 -3.82 1.42 3.02 -0.98 -4.98 115.26 110.59 1o63 n ASN 158 Ca -0.00 -3.12 -0.26 0.00 -0.03 0.00 0.00 54.58 51.16 1o63 n ASN 158 Cb 0.16 -0.52 0.03 0.00 -0.61 0.00 0.00 39.78 38.83 1o63 n ASN 158 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1o63 n ASN 159 N -0.82 -3.18 -4.50 6.41 3.02 -0.87 -4.95 115.26 110.37 1o63 n ASN 159 Ca 0.21 -0.80 -0.31 0.00 -0.03 0.00 0.00 54.58 53.65 1o63 n ASN 159 Cb 0.84 -3.96 -0.12 0.00 -0.61 0.00 0.00 39.78 35.93 1o63 n ASN 159 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1o63 s LEU 160 N -7.02 2.78 0.09 3.41 1.43 -0.27 -1.56 118.68 117.55 1o63 s LEU 160 Ca 0.37 -0.34 0.08 0.00 -1.03 0.00 0.00 54.13 53.21 1o63 s LEU 160 Cb -0.18 -1.62 -0.03 0.00 0.03 0.00 0.00 46.19 44.39 1o63 s LEU 160 CO 0.82 0.26 -0.20 -1.83 0.23 0.00 0.00 176.35 175.63 1o63 s GLU 161 N -1.44 1.14 -0.05 1.70 -1.05 0.11 -3.92 118.70 115.19 1o63 s GLU 161 Ca 0.15 -1.11 -0.30 0.00 -0.15 0.00 0.00 54.97 53.57 1o63 s GLU 161 Cb -0.11 -1.37 -0.04 0.00 -0.44 0.00 0.00 34.13 32.17 1o63 s GLU 161 CO 0.06 0.32 1.37 0.42 0.95 0.00 0.00 175.26 178.39 1o63 s ILE 162 N -1.10 3.90 -0.14 1.83 1.01 -1.26 -1.97 121.20 123.46 1o63 s ILE 162 Ca 0.06 1.21 0.18 0.00 0.00 0.00 0.00 60.65 62.10 1o63 s ILE 162 Cb -0.10 -3.78 -0.25 0.00 0.01 0.00 0.00 42.46 38.35 1o63 s ILE 162 CO 0.04 -0.04 0.33 0.18 0.00 0.00 0.00 174.94 175.45 1o63 n LEU 163 N 5.84 0.23 -3.62 2.97 4.77 0.02 -4.97 117.00 122.24 1o63 n LEU 163 Ca 0.13 0.10 -0.15 0.00 -0.03 0.00 0.00 56.01 56.07 1o63 n LEU 163 Cb 0.44 0.30 -0.07 0.00 -2.33 0.00 0.00 43.42 41.76 1o63 n LEU 163 CO 0.58 0.34 0.40 -0.62 -1.33 0.00 0.00 177.39 176.76 1o63 s ASP 164 N -5.41 -0.71 -0.31 -1.43 2.15 -1.09 -4.99 116.67 104.87 1o63 s ASP 164 Ca -0.08 1.28 -0.17 0.00 0.43 0.00 0.00 52.55 54.01 1o63 s ASP 164 Cb 0.08 1.26 -0.02 0.00 -0.30 0.00 0.00 42.92 43.95 1o63 s ASP 164 CO 0.84 -0.31 0.46 -1.61 -0.17 0.00 0.00 175.17 174.38 1o63 s GLU 165 N 0.08 3.80 -0.20 4.34 0.41 -1.26 -1.22 118.70 124.65 1o63 s GLU 165 Ca -0.02 -0.05 -0.22 0.00 -0.41 0.00 0.00 54.97 54.28 1o63 s GLU 165 Cb -0.04 -3.74 -0.20 0.00 -1.78 0.00 0.00 34.13 28.37 1o63 s GLU 165 CO 0.03 -0.48 0.26 0.82 -0.49 0.00 0.00 175.26 175.39 1o63 h ILE 166 N 5.51 0.97 -1.84 -1.63 2.04 -1.96 -3.49 117.51 117.10 1o63 h ILE 166 Ca -0.29 -2.20 0.09 0.00 1.00 0.00 0.00 64.86 63.46 1o63 h ILE 166 Cb 1.14 2.31 -0.20 0.00 -0.74 0.00 0.00 36.82 39.33 1o63 h ILE 166 CO 0.72 0.35 0.51 0.72 0.00 0.00 0.00 178.15 180.45 1o63 s PHE 167 N -2.36 -0.37 0.24 1.37 -0.12 -1.26 -5.06 117.98 110.42 1o63 s PHE 167 Ca -0.28 0.50 -0.20 0.00 -0.05 0.00 0.00 56.93 56.90 1o63 s PHE 167 Cb 0.05 0.48 -0.08 0.00 -0.63 0.00 0.00 43.02 42.84 1o63 s PHE 167 CO 0.60 -0.43 0.75 0.08 -0.05 0.00 0.00 175.22 176.18 1o63 s VAL 168 N -1.86 4.53 -0.19 -2.49 1.01 -1.26 -4.53 120.40 115.60 1o63 s VAL 168 Ca 0.00 1.34 -0.05 0.00 0.00 0.00 0.00 61.98 63.27 1o63 s VAL 168 Cb -0.01 -3.87 -0.03 0.00 0.00 0.00 0.00 36.38 32.48 1o63 s VAL 168 CO -0.02 0.18 0.01 -0.63 0.00 0.00 0.00 175.10 174.64 1o63 s ILE 169 N -1.56 4.14 0.15 2.22 1.01 0.58 -4.88 121.20 122.85 1o63 s ILE 169 Ca 0.44 -0.26 0.02 0.00 0.00 0.00 0.00 60.65 60.86 1o63 s ILE 169 Cb -0.17 -2.86 -0.04 0.00 0.01 0.00 0.00 42.46 39.40 1o63 s ILE 169 CO 0.21 0.44 -0.03 -0.13 0.00 0.00 0.00 174.94 175.43 1o63 s ARG 170 N 0.77 1.01 -0.44 2.79 0.52 -1.26 -2.42 118.95 119.92 1o63 s ARG 170 Ca 0.01 -1.46 -0.27 0.00 -0.52 0.00 0.00 55.73 53.49 1o63 s ARG 170 Cb -0.14 -0.28 0.02 0.00 0.52 0.00 0.00 34.95 35.07 1o63 s ARG 170 CO 0.02 -0.07 0.99 0.99 0.02 0.00 0.00 175.30 177.25 1o63 s THR 171 N -3.61 4.43 0.29 0.02 2.01 -1.26 -1.79 115.64 115.72 1o63 s THR 171 Ca 0.19 1.01 -0.12 0.00 0.31 0.00 0.00 61.69 63.09 1o63 s THR 171 Cb 0.05 -4.46 -0.08 0.00 0.01 0.00 0.00 72.50 68.03 1o63 s THR 171 CO 0.01 -0.80 0.65 -1.00 -0.69 0.00 0.00 174.62 172.79 1o63 s HIS 172 N 3.88 3.41 -0.21 4.92 0.09 -0.03 -0.28 115.29 127.08 1o63 s HIS 172 Ca 0.41 1.02 -0.14 0.00 -0.00 0.00 0.00 55.06 56.35 1o63 s HIS 172 Cb -0.10 -2.39 -0.04 0.00 -0.00 0.00 0.00 32.58 30.05 1o63 s HIS 172 CO 0.26 0.14 0.30 0.08 -0.00 0.00 0.00 174.74 175.52 1o63 s VAL 173 N -1.97 5.27 0.06 -0.90 1.01 -0.55 -1.49 120.40 121.84 1o63 s VAL 173 Ca 0.51 0.51 0.08 0.00 0.00 0.00 0.00 61.98 63.07 1o63 s VAL 173 Cb -0.11 -3.64 -0.03 0.00 0.00 0.00 0.00 36.38 32.61 1o63 s VAL 173 CO 0.21 0.31 -0.21 0.68 0.00 0.00 0.00 175.10 176.09 1o63 s VAL 174 N 1.05 1.69 -0.02 2.92 -7.23 -0.15 -3.71 120.40 114.95 1o63 s VAL 174 Ca 0.15 -1.32 0.06 0.00 -1.81 0.00 0.00 61.98 59.05 1o63 s VAL 174 Cb -0.14 -1.49 -0.01 0.00 0.56 0.00 0.00 36.38 35.29 1o63 s VAL 174 CO 0.06 0.11 -0.20 -0.69 -0.31 0.00 0.00 175.10 174.08 1o63 s VAL 175 N -0.93 1.57 0.02 1.32 1.01 0.91 -0.92 120.40 123.38 1o63 s VAL 175 Ca 0.07 -0.83 -0.30 0.00 0.00 0.00 0.00 61.98 60.92 1o63 s VAL 175 Cb -0.09 -1.31 -0.07 0.00 0.00 0.00 0.00 36.38 34.91 1o63 s VAL 175 CO 0.03 0.44 1.58 0.21 0.00 0.00 0.00 175.10 177.36 1o63 s ASN 176 N -0.34 6.69 0.41 3.32 3.84 0.67 -1.59 114.94 127.94 1o63 s ASN 176 Ca 0.04 2.32 0.09 0.00 0.21 0.00 0.00 52.86 55.53 1o63 s ASN 176 Cb -0.09 -2.56 0.90 0.00 -0.55 0.00 0.00 41.25 38.96 1o63 s ASN 176 CO 0.00 -0.85 2.01 -0.65 -2.79 0.00 0.00 177.10 174.83 1o63 h PRO 177 N 8.47 0.52 0.01 0.43 0.11 -1.89 -1.02 132.00 138.62 1o63 h PRO 177 Ca -0.40 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.67 1o63 h PRO 177 Cb 1.19 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1o63 h PRO 177 CO 0.93 0.34 -0.00 0.28 -0.21 0.00 0.00 178.00 179.34 1o63 h VAL 178 N 0.53 1.17 -0.38 3.15 2.07 -1.96 -2.59 116.25 118.24 1o63 h VAL 178 Ca 0.22 -0.53 -0.01 0.00 0.82 0.00 0.00 66.70 67.20 1o63 h VAL 178 Cb 0.22 1.53 -0.02 0.00 -1.52 0.00 0.00 31.29 31.50 1o63 h VAL 178 CO -0.06 0.14 0.18 0.28 0.02 0.00 0.00 177.57 178.13 1o63 h SER 179 N -0.23 0.47 -0.13 0.57 0.02 -1.80 -0.30 113.55 112.14 1o63 h SER 179 Ca -0.00 -0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 60.90 1o63 h SER 179 Cb 0.23 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 1o63 h SER 179 CO 0.00 0.41 0.05 0.22 -1.14 0.00 0.00 176.83 176.37 1o63 h TYR 180 N 0.53 0.26 0.05 3.45 5.03 -0.99 0.28 116.97 125.58 1o63 h TYR 180 Ca 0.14 -0.01 -0.15 0.00 2.58 0.00 0.00 58.73 61.29 1o63 h TYR 180 Cb 0.06 -0.08 -0.00 0.00 1.55 0.00 0.00 36.73 38.26 1o63 h TYR 180 CO 0.00 0.23 -0.76 0.00 -1.32 0.00 0.00 178.16 176.31 1o63 h ARG 181 N 0.26 0.11 0.00 1.82 3.08 -0.87 -3.22 114.38 115.57 1o63 h ARG 181 Ca 0.07 -0.19 -0.20 0.00 0.07 0.00 0.00 59.98 59.72 1o63 h ARG 181 Cb 0.10 0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.20 1o63 h ARG 181 CO -0.00 1.09 -0.96 1.79 -1.07 0.00 0.00 179.97 180.82 1o63 h THR 182 N -0.72 1.67 -0.34 2.04 1.35 -1.09 -3.33 112.91 112.48 1o63 h THR 182 Ca -0.18 -3.30 -0.24 0.00 -0.55 0.00 0.00 66.41 62.14 1o63 h THR 182 Cb 1.36 2.79 -0.18 0.00 -1.73 0.00 0.00 68.15 70.39 1o63 h THR 182 CO -0.01 0.94 -0.54 0.29 -0.25 0.00 0.00 175.52 175.96 1o63 n LYS 183 N -3.37 2.40 -0.27 4.72 5.02 0.99 -4.90 118.16 122.74 1o63 n LYS 183 Ca 0.00 -3.62 -0.07 0.00 -2.02 0.00 0.00 58.31 52.60 1o63 n LYS 183 Cb 0.91 -1.90 -0.06 0.00 -0.02 0.00 0.00 35.03 33.95 1o63 n LYS 183 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1o63 n ARG 184 N -0.96 -0.28 -0.09 1.97 0.00 -1.22 -1.41 116.66 114.67 1o63 n ARG 184 Ca 0.31 1.20 -0.07 0.00 -0.00 0.00 0.00 57.85 59.28 1o63 n ARG 184 Cb 0.83 -1.76 0.10 0.00 0.00 0.00 0.00 32.46 31.63 1o63 n ARG 184 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 1o63 h GLU 185 N 0.00 0.77 -0.49 -0.14 5.08 -1.90 -1.68 114.58 116.21 1o63 h GLU 185 Ca 0.10 -0.30 -0.06 0.00 -1.00 0.00 0.00 59.36 58.11 1o63 h GLU 185 Cb 0.27 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 1o63 h GLU 185 CO -0.61 0.91 0.09 1.49 -1.00 0.00 0.00 179.01 179.89 1o63 h GLU 186 N 0.68 0.81 -0.02 2.33 4.81 -1.78 -1.47 114.58 119.94 1o63 h GLU 186 Ca 0.10 -0.21 -0.00 0.00 -0.13 0.00 0.00 59.36 59.11 1o63 h GLU 186 Cb 0.70 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.98 1o63 h GLU 186 CO 0.05 0.81 0.00 0.28 -0.73 0.00 0.00 179.01 179.42 1o63 h VAL 187 N 0.69 1.20 -1.00 0.32 2.07 -1.16 -2.37 116.25 116.00 1o63 h VAL 187 Ca 0.15 -0.60 0.05 0.00 0.82 0.00 0.00 66.70 67.12 1o63 h VAL 187 Cb 0.38 1.56 -0.06 0.00 -1.52 0.00 0.00 31.29 31.65 1o63 h VAL 187 CO 0.01 0.16 0.65 0.58 0.02 0.00 0.00 177.57 178.99 1o63 h VAL 188 N -0.20 1.13 -0.49 2.57 2.07 -1.26 -0.09 116.25 119.98 1o63 h VAL 188 Ca 0.01 -0.42 -0.02 0.00 0.82 0.00 0.00 66.70 67.09 1o63 h VAL 188 Cb 0.26 -0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 29.81 1o63 h VAL 188 CO 0.00 0.22 0.24 -1.28 0.02 0.00 0.00 177.57 176.77 1o63 h SER 189 N 1.21 0.65 -0.40 0.57 0.87 -1.19 0.59 113.55 115.86 1o63 h SER 189 Ca 0.41 -0.13 -0.05 0.00 -1.23 0.00 0.00 61.79 60.80 1o63 h SER 189 Cb 0.09 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 61.87 1o63 h SER 189 CO -0.15 0.60 0.07 0.15 -0.53 0.00 0.00 176.83 176.96 1o63 h PHE 190 N 0.65 0.70 -0.82 2.24 3.04 -0.90 -2.94 116.94 118.92 1o63 h PHE 190 Ca 0.17 -0.10 0.01 0.00 3.98 0.00 0.00 57.97 62.03 1o63 h PHE 190 Cb 0.12 -0.19 -0.04 0.00 2.56 0.00 0.00 35.95 38.40 1o63 h PHE 190 CO -0.01 0.69 0.54 -0.07 -2.02 0.00 0.00 178.31 177.45 1o63 h LEU 191 N 0.51 0.93 -0.21 0.59 3.38 -0.72 -0.07 115.31 119.74 1o63 h LEU 191 Ca 0.12 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 1o63 h LEU 191 Cb 0.37 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1o63 h LEU 191 CO 0.01 0.67 0.03 -0.33 0.09 0.00 0.00 178.44 178.91 1o63 h GLU 192 N 1.10 0.35 -0.52 1.13 5.08 -0.85 0.33 114.58 121.20 1o63 h GLU 192 Ca 0.30 -0.10 0.01 0.00 -1.00 0.00 0.00 59.36 58.58 1o63 h GLU 192 Cb -0.12 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.06 1o63 h GLU 192 CO -0.07 0.50 0.34 0.87 -1.00 0.00 0.00 179.01 179.65 1o63 h LYS 193 N 0.14 0.66 -0.21 2.33 1.57 -1.26 -1.40 116.57 118.40 1o63 h LYS 193 Ca 0.06 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.81 1o63 h LYS 193 Cb 0.33 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 1o63 h LYS 193 CO 0.00 0.44 0.12 1.25 -0.57 0.00 0.00 179.45 180.70 1o63 h LEU 194 N 0.68 0.20 -1.37 2.94 5.85 -0.86 -2.33 115.31 120.42 1o63 h LEU 194 Ca 0.20 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.95 1o63 h LEU 194 Cb -0.05 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 40.90 1o63 h LEU 194 CO -0.06 0.15 0.44 -0.61 -0.34 0.00 0.00 178.44 178.03 1o63 h GLN 195 N 0.26 0.81 -0.56 1.25 4.15 -0.53 -1.14 115.11 119.34 1o63 h GLN 195 Ca 0.08 -0.05 -0.02 0.00 0.77 0.00 0.00 58.65 59.44 1o63 h GLN 195 Cb -0.01 -0.18 -0.03 0.00 0.21 0.00 0.00 27.48 27.48 1o63 h GLN 195 CO -0.04 0.53 0.28 0.93 -1.93 0.00 0.00 178.83 178.61 1o63 h GLU 196 N 0.83 0.80 -0.59 1.69 5.08 -0.90 -0.68 114.58 120.81 1o63 h GLU 196 Ca 0.26 -0.11 -0.07 0.00 -1.00 0.00 0.00 59.36 58.44 1o63 h GLU 196 Cb 0.03 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.10 1o63 h GLU 196 CO -0.07 0.65 0.10 0.28 -1.00 0.00 0.00 179.01 178.97 1o63 h VAL 197 N 0.76 1.26 -0.30 3.13 2.07 -0.87 -1.26 116.25 121.04 1o63 h VAL 197 Ca 0.19 -0.98 -0.01 0.00 0.82 0.00 0.00 66.70 66.72 1o63 h VAL 197 Cb 0.10 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 1o63 h VAL 197 CO -0.03 0.36 0.15 0.40 0.02 0.00 0.00 177.57 178.48 1o63 h ILE 198 N 0.88 1.14 0.62 4.57 2.04 -1.04 0.17 117.51 125.88 1o63 h ILE 198 Ca 0.18 -0.37 -0.03 0.00 1.00 0.00 0.00 64.86 65.64 1o63 h ILE 198 Cb 0.42 0.85 0.01 0.00 -0.74 0.00 0.00 36.82 37.35 1o63 h ILE 198 CO 0.01 0.14 -0.30 -0.08 0.00 0.00 0.00 178.15 177.92 1o63 h GLU 199 N 0.35 -0.80 -0.21 2.37 4.81 -1.05 -3.11 114.58 116.94 1o63 h GLU 199 Ca 0.10 0.05 0.06 0.00 -0.13 0.00 0.00 59.36 59.45 1o63 h GLU 199 Cb 0.08 0.18 -0.07 0.00 0.63 0.00 0.00 28.75 29.58 1o63 h GLU 199 CO -0.02 -0.52 -0.26 1.25 -0.73 0.00 0.00 179.01 178.74 1o63 h HIS 200 N -0.88 -0.69 0.00 0.92 2.76 -1.17 -3.52 115.15 112.58 1o63 h HIS 200 Ca -0.09 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.12 1o63 h HIS 200 Cb 0.65 0.34 0.00 0.00 1.55 0.00 0.00 27.41 29.95 1o63 h HIS 200 CO -0.02 -0.33 0.00 -3.47 -1.30 0.00 0.00 177.93 172.80