#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h2s s ARG 3 N 0.00 1.93 -0.28 7.34 3.52 0.45 -4.97 118.95 126.94 2h2s s ARG 3 Ca 0.00 -0.87 0.03 0.00 -0.13 0.00 0.00 55.73 54.77 2h2s s ARG 3 Cb 0.00 -1.87 0.07 0.00 -1.56 0.00 0.00 34.95 31.59 2h2s s ARG 3 CO 0.00 0.51 -0.07 -0.51 -0.81 0.00 0.00 175.30 174.42 2h2s s LEU 4 N -0.60 3.73 -0.18 -0.88 1.43 -1.26 -1.55 118.68 119.37 2h2s s LEU 4 Ca 0.09 -1.57 -0.06 0.00 -1.03 0.00 0.00 54.13 51.56 2h2s s LEU 4 Cb -0.09 -1.55 -0.03 0.00 0.03 0.00 0.00 46.19 44.54 2h2s s LEU 4 CO -0.01 -0.24 0.03 -0.22 0.23 0.00 0.00 176.35 176.15 2h2s s LEU 5 N 1.06 3.59 0.03 1.79 2.96 -0.66 -3.57 118.68 123.88 2h2s s LEU 5 Ca -0.04 -0.02 0.09 0.00 -0.22 0.00 0.00 54.13 53.93 2h2s s LEU 5 Cb -0.20 -1.90 -0.03 0.00 0.50 0.00 0.00 46.19 44.57 2h2s s LEU 5 CO -0.06 0.14 -0.26 -1.83 -1.32 0.00 0.00 176.35 173.02 2h2s s GLU 6 N 0.53 1.87 0.22 1.98 -1.05 -1.26 0.30 118.70 121.30 2h2s s GLU 6 Ca 0.01 -1.06 0.04 0.00 -0.15 0.00 0.00 54.97 53.81 2h2s s GLU 6 Cb -0.13 -1.98 -0.01 0.00 -0.44 0.00 0.00 34.13 31.56 2h2s s GLU 6 CO 0.02 0.52 0.14 -1.13 0.95 0.00 0.00 175.26 175.76 2h2s n SER 7 N 1.94 0.18 0.00 0.83 3.41 0.49 -4.71 113.62 115.76 2h2s n SER 7 Ca -0.17 -2.35 0.00 0.00 -0.26 0.00 0.00 58.87 56.09 2h2s n SER 7 Cb 0.52 0.88 0.00 0.00 -0.26 0.00 0.00 64.21 65.35 2h2s n SER 7 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2h2s n GLY 8 N -0.09 1.83 3.75 5.00 0.00 -1.26 -1.68 105.19 112.75 2h2s n GLY 8 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 2h2s n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2h2s s GLY 9 N -2.08 2.76 0.00 -0.02 0.00 -1.26 -4.72 107.32 101.99 2h2s s GLY 9 Ca 0.00 1.04 0.00 0.00 0.00 0.00 0.00 44.72 45.76 2h2s s GLY 9 CO 0.00 1.43 0.00 0.61 0.00 0.00 0.00 173.10 175.14 2h2s n GLY 10 N 0.55 0.81 3.83 0.20 0.00 0.76 -4.83 105.19 106.52 2h2s n GLY 10 Ca 0.14 -0.47 -0.35 0.00 0.00 0.00 0.00 46.02 45.33 2h2s n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2h2s s LEU 11 N 0.00 4.16 0.04 0.99 2.96 -1.25 0.19 118.68 125.76 2h2s s LEU 11 Ca 0.00 0.34 -0.09 0.00 -0.22 0.00 0.00 54.13 54.16 2h2s s LEU 11 Cb 0.00 -2.14 0.00 0.00 0.50 0.00 0.00 46.19 44.55 2h2s s LEU 11 CO 0.00 0.36 0.18 0.68 -1.32 0.00 0.00 176.35 176.25 2h2s s VAL 12 N -1.08 0.11 0.24 1.68 -7.23 -0.38 -4.93 120.40 108.81 2h2s s VAL 12 Ca 0.18 -0.91 -0.30 0.00 -1.81 0.00 0.00 61.98 59.14 2h2s s VAL 12 Cb -0.12 -0.88 -0.09 0.00 0.56 0.00 0.00 36.38 35.86 2h2s s VAL 12 CO 0.08 -0.50 1.00 -1.10 -0.31 0.00 0.00 175.10 174.26 2h2s s GLN 13 N -2.49 4.77 0.37 4.82 -1.52 -1.25 -0.90 119.66 123.46 2h2s s GLN 13 Ca -0.06 1.60 -0.28 0.00 -1.95 0.00 0.00 55.36 54.67 2h2s s GLN 13 Cb -0.02 -3.26 -0.11 0.00 -0.22 0.00 0.00 33.01 29.41 2h2s s GLN 13 CO -0.04 0.38 1.51 -2.14 -0.25 0.00 0.00 175.29 174.76 2h2s s PRO 14 N -1.16 4.10 0.00 2.91 0.02 -1.26 -0.19 135.00 139.42 2h2s s PRO 14 Ca 0.43 2.59 0.00 0.00 0.02 0.00 0.00 61.00 64.04 2h2s s PRO 14 Cb -0.28 -2.97 0.00 0.00 0.02 0.00 0.00 34.50 31.27 2h2s s PRO 14 CO 0.35 -0.57 0.00 0.41 -0.33 0.00 0.00 177.00 176.86 2h2s n GLY 15 N 0.71 2.90 0.00 0.52 0.00 -0.03 -4.95 105.19 104.34 2h2s n GLY 15 Ca 0.02 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.92 2h2s n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2h2s n GLY 16 N 0.00 -2.50 3.15 -0.02 0.00 0.74 -3.94 105.19 102.61 2h2s n GLY 16 Ca 0.00 -0.85 0.05 0.00 0.00 0.00 0.00 46.02 45.22 2h2s n GLY 16 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2h2s s SER 17 N -2.27 -0.81 0.36 1.61 0.01 -1.26 -2.59 113.70 108.75 2h2s s SER 17 Ca 0.00 0.30 0.07 0.00 1.31 0.00 0.00 55.95 57.64 2h2s s SER 17 Cb 0.00 1.60 -0.02 0.00 0.21 0.00 0.00 66.02 67.81 2h2s s SER 17 CO 0.00 -0.15 0.38 -1.48 0.41 0.00 0.00 173.24 172.40 2h2s s LEU 18 N 2.92 3.64 -0.11 2.44 2.34 -1.15 -4.93 118.68 123.83 2h2s s LEU 18 Ca 0.13 -0.47 0.01 0.00 0.06 0.00 0.00 54.13 53.86 2h2s s LEU 18 Cb -0.09 -2.35 0.02 0.00 -0.56 0.00 0.00 46.19 43.21 2h2s s LEU 18 CO -0.19 -0.48 -0.13 -0.75 -1.06 0.00 0.00 176.35 173.74 2h2s s LYS 19 N -4.10 2.04 -0.02 1.48 2.20 -1.26 -2.02 119.74 118.05 2h2s s LYS 19 Ca 0.45 -0.49 -0.02 0.00 -0.36 0.00 0.00 55.97 55.55 2h2s s LYS 19 Cb -0.06 -1.79 -0.04 0.00 -1.51 0.00 0.00 37.83 34.43 2h2s s LYS 19 CO 0.29 -0.10 0.11 -0.51 -0.36 0.00 0.00 175.35 174.78 2h2s s LEU 20 N 1.09 4.07 0.16 5.43 1.43 -0.11 -4.59 118.68 126.16 2h2s s LEU 20 Ca -0.05 0.23 0.09 0.00 -1.03 0.00 0.00 54.13 53.37 2h2s s LEU 20 Cb -0.14 -2.34 -0.04 0.00 0.03 0.00 0.00 46.19 43.69 2h2s s LEU 20 CO -0.03 0.28 -0.21 -0.44 0.23 0.00 0.00 176.35 176.19 2h2s s SER 21 N -1.72 2.89 -0.15 2.29 0.01 -0.67 -0.38 113.70 115.97 2h2s s SER 21 Ca 0.23 -0.83 -0.00 0.00 1.31 0.00 0.00 55.95 56.66 2h2s s SER 21 Cb -0.12 -0.18 0.03 0.00 0.21 0.00 0.00 66.02 65.96 2h2s s SER 21 CO 0.14 0.03 -0.08 0.00 0.41 0.00 0.00 173.24 173.74 2h2s s ALA 23 N 1.60 3.43 -0.28 0.00 0.00 0.87 0.20 121.76 127.58 2h2s s ALA 23 Ca 0.02 -1.52 -0.16 0.00 0.00 0.00 0.00 51.96 50.30 2h2s s ALA 23 Cb -0.14 -2.67 -0.03 0.00 0.00 0.00 0.00 23.12 20.27 2h2s s ALA 23 CO -0.08 -1.15 0.43 0.00 0.00 0.00 0.00 175.76 174.96 2h2s s ALA 24 N 1.67 3.56 -0.10 0.00 0.00 0.09 -1.65 121.76 125.34 2h2s s ALA 24 Ca 0.05 -0.79 0.03 0.00 0.00 0.00 0.00 51.96 51.25 2h2s s ALA 24 Cb -0.18 -2.81 0.01 0.00 0.00 0.00 0.00 23.12 20.14 2h2s s ALA 24 CO 0.09 -0.77 -0.19 -1.54 0.00 0.00 0.00 175.76 173.35 2h2s s SER 25 N 1.63 2.59 0.00 0.00 1.04 -0.59 -4.82 113.70 113.55 2h2s s SER 25 Ca 0.17 -0.46 0.00 0.00 0.48 0.00 0.00 55.95 56.14 2h2s s SER 25 Cb -0.16 -1.19 0.00 0.00 0.10 0.00 0.00 66.02 64.78 2h2s s SER 25 CO 0.10 0.09 0.00 0.61 0.98 0.00 0.00 173.24 175.02 2h2s n GLY 26 N 3.79 0.98 3.55 7.32 0.00 -1.26 0.17 105.19 119.74 2h2s n GLY 26 Ca -0.20 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.70 2h2s n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2h2s s PHE 27 N -2.00 -0.43 -0.60 1.61 -0.71 -1.26 -3.56 117.98 111.04 2h2s s PHE 27 Ca 0.00 0.65 -0.27 0.00 -1.04 0.00 0.00 56.93 56.27 2h2s s PHE 27 Cb 0.00 0.46 -0.10 0.00 -1.21 0.00 0.00 43.02 42.17 2h2s s PHE 27 CO 0.00 -0.45 2.48 -3.47 -1.34 0.00 0.00 175.22 172.44 2h2s n ASP 28 N 0.56 1.89 -0.35 1.98 2.03 -1.26 -4.74 116.55 116.66 2h2s n ASP 28 Ca -0.12 -0.38 0.14 0.00 0.52 0.00 0.00 54.79 54.95 2h2s n ASP 28 Cb 0.59 -1.45 0.34 0.00 -0.72 0.00 0.00 41.12 39.87 2h2s n ASP 28 CO 0.00 0.00 0.00 0.22 -1.92 0.00 0.00 177.20 175.50 2h2s h TYR 29 N 18.04 1.03 -0.17 -0.67 3.20 -1.97 -3.40 116.97 133.03 2h2s h TYR 29 Ca -0.20 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.71 2h2s h TYR 29 Cb 1.28 -0.30 0.00 0.00 1.54 0.00 0.00 36.73 39.24 2h2s h TYR 29 CO 0.99 0.17 0.00 0.43 -1.64 0.00 0.00 178.16 178.11 2h2s n SER 30 N -4.82 0.00 0.00 -2.11 7.64 -1.26 -3.23 113.62 109.84 2h2s n SER 30 Ca 0.24 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.12 2h2s n SER 30 Cb 0.63 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.83 2h2s n SER 30 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 2h2s n ARG 31 N 0.00 0.00 -3.77 1.43 0.63 -1.26 -4.78 116.66 108.90 2h2s n ARG 31 Ca 0.00 0.00 -0.20 0.00 -0.92 0.00 0.00 57.85 56.73 2h2s n ARG 31 Cb 0.00 -2.03 -0.02 0.00 0.45 0.00 0.00 32.46 30.86 2h2s n ARG 31 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 2h2s s TYR 32 N 0.00 3.17 0.15 -0.14 1.51 -1.20 -4.94 117.35 115.90 2h2s s TYR 32 Ca 0.00 -0.16 0.08 0.00 -1.01 0.00 0.00 57.07 55.97 2h2s s TYR 32 Cb 0.00 -1.75 -0.04 0.00 -0.11 0.00 0.00 41.96 40.06 2h2s s TYR 32 CO 0.00 0.23 -0.06 -1.58 -1.11 0.00 0.00 175.55 173.03 2h2s s TRP 33 N -2.14 2.74 0.03 2.71 0.52 -1.26 -2.80 118.94 118.74 2h2s s TRP 33 Ca 0.39 -0.17 0.02 0.00 0.02 0.00 0.00 56.10 56.37 2h2s s TRP 33 Cb -0.08 -1.36 -0.02 0.00 -1.15 0.00 0.00 33.47 30.85 2h2s s TRP 33 CO 0.29 0.49 -0.08 -1.64 0.02 0.00 0.00 176.95 176.03 2h2s s MET 34 N -2.68 0.56 0.11 4.98 -1.94 -0.54 -2.14 119.30 117.66 2h2s s MET 34 Ca 0.25 -0.64 -0.12 0.00 -1.71 0.00 0.00 55.69 53.47 2h2s s MET 34 Cb -0.10 -0.41 0.01 0.00 2.01 0.00 0.00 34.83 36.35 2h2s s MET 34 CO 0.16 0.09 0.29 -1.54 -0.01 0.00 0.00 175.02 174.01 2h2s s SER 35 N -1.22 -0.03 -0.13 3.03 1.04 -0.86 0.37 113.70 115.90 2h2s s SER 35 Ca -0.06 -0.54 -0.01 0.00 0.48 0.00 0.00 55.95 55.83 2h2s s SER 35 Cb -0.08 0.41 -0.02 0.00 0.10 0.00 0.00 66.02 66.43 2h2s s SER 35 CO 0.00 -0.80 -0.11 0.26 0.98 0.00 0.00 173.24 173.57 2h2s s TRP 36 N -3.85 2.85 0.09 5.02 0.52 0.12 -1.62 118.94 122.06 2h2s s TRP 36 Ca 0.06 -0.54 0.09 0.00 0.02 0.00 0.00 56.10 55.73 2h2s s TRP 36 Cb 0.03 -1.85 -0.03 0.00 -1.15 0.00 0.00 33.47 30.47 2h2s s TRP 36 CO -0.10 -0.14 -0.23 0.08 0.02 0.00 0.00 176.95 176.57 2h2s s VAL 37 N 0.26 1.90 0.02 4.03 1.01 0.10 0.06 120.40 127.79 2h2s s VAL 37 Ca -0.08 -1.50 0.01 0.00 0.00 0.00 0.00 61.98 60.42 2h2s s VAL 37 Cb -0.15 -1.68 -0.02 0.00 0.00 0.00 0.00 36.38 34.53 2h2s s VAL 37 CO 0.05 0.10 -0.05 0.00 0.00 0.00 0.00 175.10 175.20 2h2s s ARG 38 N -1.68 0.40 -0.19 2.72 1.70 0.18 0.27 118.95 122.36 2h2s s ARG 38 Ca 0.09 -0.51 0.01 0.00 -0.47 0.00 0.00 55.73 54.85 2h2s s ARG 38 Cb -0.10 -0.21 0.04 0.00 -0.57 0.00 0.00 34.95 34.11 2h2s s ARG 38 CO 0.04 0.04 -0.12 -1.14 -1.08 0.00 0.00 175.30 173.04 2h2s s GLN 39 N -1.03 2.17 0.80 3.89 0.74 0.93 0.28 119.66 127.44 2h2s s GLN 39 Ca -0.07 -0.78 -0.12 0.00 0.05 0.00 0.00 55.36 54.44 2h2s s GLN 39 Cb -0.07 -2.36 0.07 0.00 1.10 0.00 0.00 33.01 31.76 2h2s s GLN 39 CO -0.00 -0.37 1.13 0.00 -0.55 0.00 0.00 175.29 175.50 2h2s s ALA 40 N 1.40 2.02 -0.66 1.58 0.00 -1.24 0.04 121.76 124.90 2h2s s ALA 40 Ca 0.01 0.49 -0.08 0.00 0.00 0.00 0.00 51.96 52.37 2h2s s ALA 40 Cb -0.15 -3.36 -0.21 0.00 0.00 0.00 0.00 23.12 19.40 2h2s s ALA 40 CO -0.09 -2.03 1.79 -2.30 0.00 0.00 0.00 175.76 173.13 2h2s n PRO 41 N -3.49 0.04 -2.75 0.00 -0.02 -1.26 -1.46 135.00 126.05 2h2s n PRO 41 Ca 0.11 -0.12 -0.09 0.00 -2.02 0.00 0.00 63.50 61.38 2h2s n PRO 41 Cb 0.52 -1.29 0.04 0.00 -0.02 0.00 0.00 33.50 32.75 2h2s n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2h2s n GLY 42 N 5.28 -0.69 3.77 -1.23 0.00 -1.26 -5.04 105.19 106.02 2h2s n GLY 42 Ca 0.43 0.34 -0.10 0.00 0.00 0.00 0.00 46.02 46.70 2h2s n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2h2s s LYS 43 N -3.80 2.26 0.88 1.61 1.02 -0.53 -5.17 119.74 116.01 2h2s s LYS 43 Ca 0.26 -1.52 -0.11 0.00 0.02 0.00 0.00 55.97 54.62 2h2s s LYS 43 Cb -0.03 0.61 0.12 0.00 -0.52 0.00 0.00 37.83 38.01 2h2s s LYS 43 CO 0.54 -1.05 1.12 0.41 -0.92 0.00 0.00 175.35 175.45 2h2s n GLY 44 N -0.54 -0.35 3.78 -3.33 0.00 -1.26 -4.39 105.19 99.09 2h2s n GLY 44 Ca -0.08 -0.64 -0.39 0.00 0.00 0.00 0.00 46.02 44.91 2h2s n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2h2s s LEU 45 N -5.93 4.49 0.01 0.99 1.43 -1.26 -3.67 118.68 114.73 2h2s s LEU 45 Ca 0.69 1.32 0.04 0.00 -1.03 0.00 0.00 54.13 55.15 2h2s s LEU 45 Cb -0.25 -3.03 -0.01 0.00 0.03 0.00 0.00 46.19 42.93 2h2s s LEU 45 CO 0.56 0.16 -0.12 -0.54 0.23 0.00 0.00 176.35 176.64 2h2s s LYS 46 N -0.63 0.94 -0.45 1.70 -0.14 0.14 -4.95 119.74 116.36 2h2s s LYS 46 Ca 0.32 -0.54 -0.24 0.00 -1.36 0.00 0.00 55.97 54.15 2h2s s LYS 46 Cb -0.20 -0.92 0.03 0.00 -1.68 0.00 0.00 37.83 35.06 2h2s s LYS 46 CO 0.20 0.24 0.86 -0.46 -0.76 0.00 0.00 175.35 175.43 2h2s s TRP 47 N -0.50 2.96 -0.04 3.18 -0.00 -1.26 0.51 118.94 123.79 2h2s s TRP 47 Ca 0.03 0.29 -0.23 0.00 -0.00 0.00 0.00 56.10 56.20 2h2s s TRP 47 Cb -0.06 -3.81 -0.17 0.00 -0.00 0.00 0.00 33.47 29.43 2h2s s TRP 47 CO 0.00 -1.04 1.01 0.82 -0.00 0.00 0.00 176.95 177.75 2h2s h ILE 48 N 6.02 0.95 0.00 5.86 1.08 -0.71 -3.33 117.51 127.39 2h2s h ILE 48 Ca -0.24 -1.07 0.00 0.00 -0.39 0.00 0.00 64.86 63.16 2h2s h ILE 48 Cb 1.08 1.55 0.00 0.00 -3.07 0.00 0.00 36.82 36.38 2h2s h ILE 48 CO 0.99 0.23 0.00 0.61 -0.69 0.00 0.00 178.15 179.29 2h2s n GLY 49 N 0.39 -0.13 3.14 5.37 0.00 -1.02 -0.49 105.19 112.45 2h2s n GLY 49 Ca -0.08 -0.94 -0.10 0.00 0.00 0.00 0.00 46.02 44.89 2h2s n GLY 49 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2h2s s GLU 50 N -2.00 0.74 -0.16 1.61 -1.05 -0.23 0.11 118.70 117.72 2h2s s GLU 50 Ca 0.00 -1.21 -0.07 0.00 -0.15 0.00 0.00 54.97 53.53 2h2s s GLU 50 Cb 0.00 -0.14 0.07 0.00 -0.44 0.00 0.00 34.13 33.61 2h2s s GLU 50 CO 0.00 -0.02 0.36 -1.50 0.95 0.00 0.00 175.26 175.04 2h2s s ILE 51 N -3.29 -0.25 0.00 1.83 1.10 0.16 -2.13 121.20 118.63 2h2s s ILE 51 Ca 0.07 0.15 0.00 0.00 -0.51 0.00 0.00 60.65 60.37 2h2s s ILE 51 Cb 0.03 -0.55 0.00 0.00 0.15 0.00 0.00 42.46 42.09 2h2s s ILE 51 CO -0.05 0.06 0.00 -0.46 -2.11 0.00 0.00 174.94 172.39 2h2s n ASN 52 N 4.72 -0.53 0.00 4.50 6.94 -1.03 -1.46 115.26 128.39 2h2s n ASN 52 Ca -0.17 -0.66 0.00 0.00 -0.02 0.00 0.00 54.58 53.72 2h2s n ASN 52 Cb 0.52 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.94 2h2s n ASN 52 CO 0.00 0.00 0.00 -2.65 -1.03 0.00 0.00 177.26 173.58 2h2s n PRO 53 N -1.20 0.00 0.00 -0.53 -0.02 -1.12 -3.49 135.00 128.64 2h2s n PRO 53 Ca 0.00 0.39 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 2h2s n PRO 53 Cb 0.00 -1.14 0.00 0.00 -0.02 0.00 0.00 33.50 32.34 2h2s n PRO 53 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 2h2s n VAL 54 N -1.67 0.00 -0.95 -1.45 0.24 -1.26 -4.68 118.33 108.56 2h2s n VAL 54 Ca 0.00 0.00 -0.04 0.00 -2.04 0.00 0.00 64.34 62.26 2h2s n VAL 54 Cb 0.00 -0.21 -0.02 0.00 -1.47 0.00 0.00 33.84 32.14 2h2s n VAL 54 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 2h2s n SER 55 N 0.07 -1.29 -0.62 -1.34 7.64 -1.23 -4.73 113.62 112.13 2h2s n SER 55 Ca 0.00 0.09 0.08 0.00 1.01 0.00 0.00 58.87 60.05 2h2s n SER 55 Cb 0.00 -1.43 0.26 0.00 -1.01 0.00 0.00 64.21 62.02 2h2s n SER 55 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2h2s n SER 56 N 0.79 1.82 -3.56 6.43 3.41 -1.26 -4.76 113.62 116.50 2h2s n SER 56 Ca -0.04 -1.87 -0.14 0.00 -0.26 0.00 0.00 58.87 56.57 2h2s n SER 56 Cb 0.15 -0.18 -0.12 0.00 -0.26 0.00 0.00 64.21 63.80 2h2s n SER 56 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2h2s s THR 57 N -1.64 -0.43 -0.05 6.66 2.01 -1.26 -5.07 115.64 115.86 2h2s s THR 57 Ca 0.28 0.09 0.02 0.00 0.31 0.00 0.00 61.69 62.40 2h2s s THR 57 Cb 0.15 -0.59 0.01 0.00 0.01 0.00 0.00 72.50 72.08 2h2s s THR 57 CO 0.21 -0.02 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.38 2h2s s ILE 58 N 2.42 0.99 0.01 1.82 1.01 -1.26 -2.47 121.20 123.72 2h2s s ILE 58 Ca 0.05 -0.42 0.03 0.00 0.00 0.00 0.00 60.65 60.31 2h2s s ILE 58 Cb -0.14 -0.90 -0.01 0.00 0.01 0.00 0.00 42.46 41.42 2h2s s ILE 58 CO -0.11 0.31 -0.10 0.20 0.00 0.00 0.00 174.94 175.24 2h2s s ASN 59 N 0.51 1.16 0.06 3.58 0.01 -0.90 -5.01 114.94 114.34 2h2s s ASN 59 Ca -0.10 -0.30 0.04 0.00 -0.71 0.00 0.00 52.86 51.79 2h2s s ASN 59 Cb -0.13 -0.09 -0.03 0.00 0.41 0.00 0.00 41.25 41.41 2h2s s ASN 59 CO 0.02 0.03 -0.12 -0.31 -1.51 0.00 0.00 177.10 175.22 2h2s s TYR 60 N -0.57 1.01 0.85 2.20 1.51 -1.26 -1.07 117.35 120.03 2h2s s TYR 60 Ca 0.01 -0.49 -0.13 0.00 -1.01 0.00 0.00 57.07 55.45 2h2s s TYR 60 Cb -0.06 -0.58 0.07 0.00 -0.11 0.00 0.00 41.96 41.29 2h2s s TYR 60 CO 0.00 0.00 0.93 -2.37 -1.11 0.00 0.00 175.55 173.00 2h2s n THR 61 N 1.29 1.11 -1.54 -0.71 5.66 0.36 -4.72 114.28 115.72 2h2s n THR 61 Ca -0.21 -0.18 -0.49 0.00 -3.05 0.00 0.00 64.05 60.11 2h2s n THR 61 Cb 0.55 -0.97 -0.06 0.00 -1.55 0.00 0.00 70.33 68.30 2h2s n THR 61 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 175.07 169.37 2h2s n PRO 62 N -2.81 1.47 -3.65 1.09 -0.02 -1.26 -4.91 135.00 124.90 2h2s n PRO 62 Ca 0.11 0.45 -0.00 0.00 -2.02 0.00 0.00 63.50 62.04 2h2s n PRO 62 Cb 0.51 -2.61 -0.06 0.00 -0.02 0.00 0.00 33.50 31.33 2h2s n PRO 62 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2h2s s SER 63 N 6.52 -0.19 0.00 2.55 0.15 -1.26 -5.14 113.70 116.33 2h2s s SER 63 Ca 1.04 0.31 0.00 0.00 0.70 0.00 0.00 55.95 58.00 2h2s s SER 63 Cb -0.75 0.94 0.00 0.00 -1.71 0.00 0.00 66.02 64.50 2h2s s SER 63 CO 0.49 -0.05 0.00 0.18 1.20 0.00 0.00 173.24 175.06 2h2s n LEU 64 N 3.00 0.00 0.00 3.45 4.32 -1.26 -4.48 117.00 122.03 2h2s n LEU 64 Ca -0.16 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.83 2h2s n LEU 64 Cb 0.57 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.37 2h2s n LEU 64 CO 0.04 0.00 0.00 0.29 -1.22 0.00 0.00 177.39 176.50 2h2s n LYS 65 N 0.00 0.00 -0.09 3.23 4.01 -1.26 0.19 118.16 124.24 2h2s n LYS 65 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 2h2s n LYS 65 Cb 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.52 2h2s n LYS 65 CO 0.00 0.00 0.00 -3.47 -1.11 0.00 0.00 177.40 172.82 2h2s n ASP 66 N 0.00 2.64 0.25 4.39 -0.08 -1.26 -3.87 116.55 118.62 2h2s n ASP 66 Ca 0.00 -1.62 0.08 0.00 -1.51 0.00 0.00 54.79 51.74 2h2s n ASP 66 Cb 0.00 -0.48 0.62 0.00 2.34 0.00 0.00 41.12 43.60 2h2s n ASP 66 CO 0.00 0.00 0.00 0.50 0.12 0.00 0.00 177.20 177.82 2h2s h LYS 67 N 0.81 0.00 -3.29 -0.67 1.63 0.19 -3.39 116.57 111.84 2h2s h LYS 67 Ca 0.00 0.00 -0.17 0.00 -0.85 0.00 0.00 60.65 59.63 2h2s h LYS 67 Cb 0.74 0.00 -0.25 0.00 -0.60 0.00 0.00 32.23 32.13 2h2s h LYS 67 CO 0.00 0.07 -0.48 -0.06 -3.45 0.00 0.00 179.45 175.53 2h2s s PHE 68 N -4.82 -0.17 -0.27 1.91 0.40 -1.25 -2.88 117.98 110.90 2h2s s PHE 68 Ca -0.04 0.40 -0.00 0.00 -0.60 0.00 0.00 56.93 56.68 2h2s s PHE 68 Cb 0.16 0.05 0.08 0.00 0.51 0.00 0.00 43.02 43.82 2h2s s PHE 68 CO 0.66 -0.15 0.04 0.42 0.70 0.00 0.00 175.22 176.89 2h2s s ILE 69 N -0.22 1.19 -0.09 0.64 -1.09 0.69 -4.94 121.20 117.38 2h2s s ILE 69 Ca -0.03 -1.32 -0.13 0.00 -2.23 0.00 0.00 60.65 56.94 2h2s s ILE 69 Cb -0.03 -1.72 -0.05 0.00 -1.58 0.00 0.00 42.46 39.08 2h2s s ILE 69 CO 0.01 -0.41 0.33 -0.63 -1.23 0.00 0.00 174.94 173.00 2h2s s ILE 70 N 1.50 5.22 0.14 2.92 1.01 -1.26 0.30 121.20 131.04 2h2s s ILE 70 Ca 0.03 0.63 -0.10 0.00 0.00 0.00 0.00 60.65 61.22 2h2s s ILE 70 Cb -0.18 -3.64 -0.00 0.00 0.01 0.00 0.00 42.46 38.65 2h2s s ILE 70 CO -0.14 0.50 0.28 -0.94 0.00 0.00 0.00 174.94 174.64 2h2s s SER 71 N -0.41 0.02 -0.07 3.58 1.04 -0.83 -5.01 113.70 112.02 2h2s s SER 71 Ca 0.20 -0.75 -0.05 0.00 0.48 0.00 0.00 55.95 55.83 2h2s s SER 71 Cb -0.14 0.42 0.03 0.00 0.10 0.00 0.00 66.02 66.42 2h2s s SER 71 CO 0.08 -0.86 0.17 -0.60 0.98 0.00 0.00 173.24 173.02 2h2s s ARG 72 N -3.92 0.17 -0.52 4.02 3.52 -1.26 -0.11 118.95 120.85 2h2s s ARG 72 Ca 0.12 0.30 -0.08 0.00 -0.13 0.00 0.00 55.73 55.95 2h2s s ARG 72 Cb 0.03 0.01 0.13 0.00 -1.56 0.00 0.00 34.95 33.56 2h2s s ARG 72 CO -0.04 -0.07 0.39 0.34 -0.81 0.00 0.00 175.30 175.11 2h2s s ASP 73 N 0.48 5.70 0.00 -2.12 -1.08 -0.27 -4.93 116.67 114.46 2h2s s ASP 73 Ca -0.03 -2.13 0.00 0.00 -0.52 0.00 0.00 52.55 49.86 2h2s s ASP 73 Cb -0.05 -1.99 0.00 0.00 -1.46 0.00 0.00 42.92 39.42 2h2s s ASP 73 CO -0.02 -0.63 1.13 0.59 0.52 0.00 0.00 175.17 176.76 2h2s n ASN 74 N 4.59 3.11 0.00 -0.34 3.02 -1.26 -1.34 115.26 123.04 2h2s n ASN 74 Ca -0.03 -1.76 0.00 0.00 -0.03 0.00 0.00 54.58 52.76 2h2s n ASN 74 Cb 0.41 -0.62 0.00 0.00 -0.61 0.00 0.00 39.78 38.96 2h2s n ASN 74 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2h2s n ALA 75 N 1.22 0.94 -1.27 5.41 0.00 -1.26 -4.65 120.51 120.90 2h2s n ALA 75 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.07 2h2s n ALA 75 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.81 2h2s n ALA 75 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2h2s n LYS 76 N -0.06 0.00 -3.89 0.00 5.02 -0.69 -5.01 118.16 113.52 2h2s n LYS 76 Ca 0.00 0.00 -0.26 0.00 -2.02 0.00 0.00 58.31 56.03 2h2s n LYS 76 Cb 0.31 -0.33 -0.01 0.00 -0.02 0.00 0.00 35.03 34.99 2h2s n LYS 76 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2h2s n ASP 77 N 0.00 -1.08 -4.24 4.39 9.92 -0.45 -4.67 116.55 120.42 2h2s n ASP 77 Ca 0.00 -0.99 -0.25 0.00 -0.53 0.00 0.00 54.79 53.02 2h2s n ASP 77 Cb 0.24 -3.20 -0.14 0.00 -0.64 0.00 0.00 41.12 37.39 2h2s n ASP 77 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 2h2s s THR 78 N -3.86 1.61 -0.12 -3.53 2.01 -1.12 -0.73 115.64 109.90 2h2s s THR 78 Ca 0.07 -1.23 0.01 0.00 0.31 0.00 0.00 61.69 60.85 2h2s s THR 78 Cb -0.03 -1.41 -0.01 0.00 0.01 0.00 0.00 72.50 71.06 2h2s s THR 78 CO 0.88 0.14 -0.16 -0.22 -0.69 0.00 0.00 174.62 174.57 2h2s s LEU 79 N -1.29 2.54 0.22 4.42 2.96 0.13 -1.11 118.68 126.56 2h2s s LEU 79 Ca 0.07 -0.39 0.10 0.00 -0.22 0.00 0.00 54.13 53.68 2h2s s LEU 79 Cb -0.09 -1.56 -0.04 0.00 0.50 0.00 0.00 46.19 45.00 2h2s s LEU 79 CO 0.02 0.16 -0.09 -0.31 -1.32 0.00 0.00 176.35 174.82 2h2s s TYR 80 N 0.37 2.59 -0.09 5.38 1.51 0.84 0.17 117.35 128.11 2h2s s TYR 80 Ca -0.13 -0.24 -0.02 0.00 -1.01 0.00 0.00 57.07 55.67 2h2s s TYR 80 Cb -0.16 -1.21 0.04 0.00 -0.11 0.00 0.00 41.96 40.51 2h2s s TYR 80 CO 0.06 0.57 0.03 -1.17 -1.11 0.00 0.00 175.55 173.94 2h2s s LEU 81 N -3.18 0.55 -0.33 -1.29 2.96 0.49 -1.97 118.68 115.92 2h2s s LEU 81 Ca 0.27 -0.22 -0.11 0.00 -0.22 0.00 0.00 54.13 53.85 2h2s s LEU 81 Cb -0.07 -0.38 -0.02 0.00 0.50 0.00 0.00 46.19 46.22 2h2s s LEU 81 CO 0.16 -0.24 0.20 -1.10 -1.32 0.00 0.00 176.35 174.06 2h2s s GLN 82 N 2.02 3.46 -0.14 1.98 -0.21 0.15 -0.94 119.66 125.98 2h2s s GLN 82 Ca 0.04 -0.66 -0.04 0.00 0.02 0.00 0.00 55.36 54.72 2h2s s GLN 82 Cb -0.13 -3.71 -0.03 0.00 1.00 0.00 0.00 33.01 30.14 2h2s s GLN 82 CO -0.06 -0.42 0.01 0.42 -2.12 0.00 0.00 175.29 173.13 2h2s s ILE 83 N 1.68 4.36 0.35 1.08 1.01 -0.86 -0.23 121.20 128.61 2h2s s ILE 83 Ca 0.06 -0.20 0.09 0.00 0.00 0.00 0.00 60.65 60.59 2h2s s ILE 83 Cb -0.17 -2.90 -0.06 0.00 0.01 0.00 0.00 42.46 39.34 2h2s s ILE 83 CO 0.09 0.53 -0.02 -0.44 0.00 0.00 0.00 174.94 175.10 2h2s s SER 84 N -0.16 3.98 -1.34 3.58 0.01 -1.14 -2.93 113.70 115.69 2h2s s SER 84 Ca 0.05 -1.12 -0.01 0.00 1.31 0.00 0.00 55.95 56.18 2h2s s SER 84 Cb -0.12 -0.44 0.00 0.00 0.21 0.00 0.00 66.02 65.67 2h2s s SER 84 CO 0.02 -0.26 0.02 0.29 0.41 0.00 0.00 173.24 173.72 2h2s n LYS 85 N -0.91 -0.92 -1.68 12.44 4.76 -1.12 -4.68 118.16 126.05 2h2s n LYS 85 Ca -0.04 0.07 -0.56 0.00 -2.87 0.00 0.00 58.31 54.91 2h2s n LYS 85 Cb 0.63 -3.08 -0.07 0.00 -1.84 0.00 0.00 35.03 30.68 2h2s n LYS 85 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 2h2s n VAL 86 N -4.15 0.23 -0.98 -0.18 0.31 -1.07 -4.64 118.33 107.85 2h2s n VAL 86 Ca -0.28 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.01 2h2s n VAL 86 Cb 0.61 -1.13 0.00 0.00 -0.91 0.00 0.00 33.84 32.41 2h2s n VAL 86 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2h2s n ARG 87 N 4.62 3.82 -0.08 5.55 1.74 -1.26 -0.85 116.66 130.20 2h2s n ARG 87 Ca 0.24 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 57.24 2h2s n ARG 87 Cb 0.15 0.00 -0.15 0.00 -1.02 0.00 0.00 32.46 31.44 2h2s n ARG 87 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2h2s n SER 88 N 0.00 0.17 -0.32 0.55 3.41 -1.26 -4.22 113.62 111.96 2h2s n SER 88 Ca 0.00 0.08 -0.04 0.00 -0.26 0.00 0.00 58.87 58.65 2h2s n SER 88 Cb 0.00 0.87 0.08 0.00 -0.26 0.00 0.00 64.21 64.90 2h2s n SER 88 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2h2s h GLU 89 N 0.00 1.14 0.00 4.33 3.07 -1.96 -1.44 114.58 119.71 2h2s h GLU 89 Ca -0.46 -0.08 0.00 0.00 -0.50 0.00 0.00 59.36 58.32 2h2s h GLU 89 Cb 2.10 -0.25 0.00 0.00 -0.84 0.00 0.00 28.75 29.77 2h2s h GLU 89 CO 0.04 0.78 0.00 -0.25 -1.40 0.00 0.00 179.01 178.17 2h2s n ASP 90 N -4.46 0.00 -4.56 1.42 8.00 -1.26 -4.37 116.55 111.32 2h2s n ASP 90 Ca 0.09 -0.12 -0.41 0.00 0.71 0.00 0.00 54.79 55.06 2h2s n ASP 90 Cb 0.03 -0.06 -0.03 0.00 -0.02 0.00 0.00 41.12 41.05 2h2s n ASP 90 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2h2s s THR 91 N -2.11 3.80 0.31 -3.53 2.01 -0.54 -4.77 115.64 110.81 2h2s s THR 91 Ca 0.09 0.56 -0.14 0.00 0.31 0.00 0.00 61.69 62.50 2h2s s THR 91 Cb 0.04 -4.84 0.06 0.00 0.01 0.00 0.00 72.50 67.77 2h2s s THR 91 CO 0.08 -1.68 0.75 0.00 -0.69 0.00 0.00 174.62 173.08 2h2s n ALA 92 N 9.16 -1.75 -2.56 7.40 0.00 -1.02 -4.33 120.51 127.41 2h2s n ALA 92 Ca 0.05 -1.07 -0.40 0.00 0.00 0.00 0.00 53.44 52.03 2h2s n ALA 92 Cb 0.49 0.80 -0.11 0.00 0.00 0.00 0.00 19.45 20.63 2h2s n ALA 92 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2h2s s LEU 93 N 0.00 4.37 -0.23 0.00 2.96 0.11 -1.89 118.68 123.99 2h2s s LEU 93 Ca 0.15 -0.32 -0.15 0.00 -0.22 0.00 0.00 54.13 53.60 2h2s s LEU 93 Cb -0.04 -2.13 -0.04 0.00 0.50 0.00 0.00 46.19 44.48 2h2s s LEU 93 CO 0.09 -0.18 0.35 -0.31 -1.32 0.00 0.00 176.35 174.97 2h2s s TYR 94 N 1.73 3.32 -0.05 5.38 2.02 -0.83 -0.05 117.35 128.87 2h2s s TYR 94 Ca 0.06 0.47 0.03 0.00 -0.37 0.00 0.00 57.07 57.26 2h2s s TYR 94 Cb -0.17 -2.50 -0.03 0.00 -0.40 0.00 0.00 41.96 38.87 2h2s s TYR 94 CO 0.10 -0.08 -0.12 0.71 -1.57 0.00 0.00 175.55 174.60 2h2s s TYR 95 N 1.54 2.77 0.07 2.71 2.02 0.14 -2.18 117.35 124.43 2h2s s TYR 95 Ca 0.15 -0.11 0.05 0.00 -0.37 0.00 0.00 57.07 56.80 2h2s s TYR 95 Cb -0.15 -1.64 -0.04 0.00 -0.40 0.00 0.00 41.96 39.73 2h2s s TYR 95 CO 0.08 0.24 -0.07 0.00 -1.57 0.00 0.00 175.55 174.23 2h2s s ALA 97 N -1.17 -0.44 -0.07 0.00 0.00 -0.64 -2.52 121.76 116.91 2h2s s ALA 97 Ca 0.21 -0.34 -0.15 0.00 0.00 0.00 0.00 51.96 51.68 2h2s s ALA 97 Cb -0.11 0.44 -0.05 0.00 0.00 0.00 0.00 23.12 23.39 2h2s s ALA 97 CO 0.13 -0.48 0.39 0.50 0.00 0.00 0.00 175.76 176.30 2h2s s ARG 98 N -3.31 4.09 -0.06 0.00 3.52 -0.66 -2.03 118.95 120.51 2h2s s ARG 98 Ca 0.01 0.33 -0.17 0.00 -0.13 0.00 0.00 55.73 55.76 2h2s s ARG 98 Cb 0.02 -3.33 -0.05 0.00 -1.56 0.00 0.00 34.95 30.03 2h2s s ARG 98 CO -0.08 0.45 0.46 -0.51 -0.81 0.00 0.00 175.30 174.80 2h2s s LEU 99 N -0.25 4.37 0.16 -0.88 1.02 -0.91 -1.01 118.68 121.19 2h2s s LEU 99 Ca 0.22 0.91 -0.23 0.00 0.02 0.00 0.00 54.13 55.05 2h2s s LEU 99 Cb -0.15 -2.67 0.07 0.00 0.02 0.00 0.00 46.19 43.45 2h2s s LEU 99 CO 0.10 0.15 0.64 -0.47 0.02 0.00 0.00 176.35 176.78 2h2s s TYR 100 N -0.16 -0.48 0.33 0.29 5.04 -1.07 -4.23 117.35 117.07 2h2s s TYR 100 Ca 0.25 0.25 0.07 0.00 -2.44 0.00 0.00 57.07 55.20 2h2s s TYR 100 Cb -0.16 0.58 -0.03 0.00 0.35 0.00 0.00 41.96 42.70 2h2s s TYR 100 CO 0.12 -0.88 0.28 1.52 -1.34 0.00 0.00 175.55 175.25 2h2s s TYR 101 N -3.72 1.76 0.00 4.97 1.13 -1.26 -2.41 117.35 117.82 2h2s s TYR 101 Ca 0.03 -1.66 0.00 0.00 -1.41 0.00 0.00 57.07 54.03 2h2s s TYR 101 Cb -0.02 -0.72 0.00 0.00 -1.10 0.00 0.00 41.96 40.12 2h2s s TYR 101 CO -0.10 -0.86 0.00 0.41 -2.51 0.00 0.00 175.55 172.49 2h2s n GLY 102 N -0.62 -0.10 0.14 5.49 0.00 -1.26 -4.89 105.19 103.94 2h2s n GLY 102 Ca 0.07 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.87 2h2s n GLY 102 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2h2s h TYR 103 N 0.00 0.72 0.00 1.61 0.05 -2.04 -3.48 116.97 113.83 2h2s h TYR 103 Ca 0.00 -0.52 0.00 0.00 0.05 0.00 0.00 58.73 58.26 2h2s h TYR 103 Cb 0.00 -0.03 0.00 0.00 1.01 0.00 0.00 36.73 37.71 2h2s h TYR 103 CO 0.00 1.55 0.00 0.41 -1.05 0.00 0.00 178.16 179.07 2h2s n GLY 104 N 1.76 0.00 2.91 3.88 0.00 -1.26 -5.05 105.19 107.43 2h2s n GLY 104 Ca -0.20 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.54 2h2s n GLY 104 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2h2s n TYR 105 N 0.00 3.98 -0.03 1.61 4.02 -1.26 -5.08 117.16 120.40 2h2s n TYR 105 Ca 0.00 -3.92 -0.01 0.00 -0.01 0.00 0.00 57.90 53.96 2h2s n TYR 105 Cb 0.00 -0.54 -0.00 0.00 -0.02 0.00 0.00 39.34 38.78 2h2s n TYR 105 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 176.86 176.76 2h2s n TRP 106 N -0.20 -0.00 -4.27 -0.72 7.02 -1.26 -4.95 117.44 113.06 2h2s n TRP 106 Ca 0.32 0.02 -0.15 0.00 -1.02 0.00 0.00 57.50 56.67 2h2s n TRP 106 Cb 0.38 -0.04 -0.10 0.00 -2.42 0.00 0.00 31.31 29.14 2h2s n TRP 106 CO 0.00 0.00 0.00 1.52 -2.02 0.00 0.00 177.69 177.19 2h2s s TYR 107 N -0.01 1.35 -1.07 -5.99 -0.85 -1.01 -5.01 117.35 104.75 2h2s s TYR 107 Ca 0.01 -0.83 -0.19 0.00 -0.52 0.00 0.00 57.07 55.54 2h2s s TYR 107 Cb -0.02 -0.73 0.10 0.00 0.38 0.00 0.00 41.96 41.70 2h2s s TYR 107 CO 0.01 0.02 1.38 -0.06 -1.52 0.00 0.00 175.55 175.38 2h2s s PHE 108 N -3.38 2.96 0.00 -3.49 0.40 -1.26 -2.61 117.98 110.60 2h2s s PHE 108 Ca 0.21 -1.41 0.00 0.00 -0.60 0.00 0.00 56.93 55.13 2h2s s PHE 108 Cb 0.04 -4.49 0.00 0.00 0.51 0.00 0.00 43.02 39.08 2h2s s PHE 108 CO 0.03 -1.66 0.36 -3.47 0.70 0.00 0.00 175.22 171.19 2h2s n ASP 109 N 7.36 0.00 -4.27 1.36 -0.08 -0.18 -4.59 116.55 116.15 2h2s n ASP 109 Ca 0.33 0.36 -0.33 0.00 -1.51 0.00 0.00 54.79 53.64 2h2s n ASP 109 Cb 0.48 0.00 -0.15 0.00 2.34 0.00 0.00 41.12 43.79 2h2s n ASP 109 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 2h2s s VAL 110 N -0.77 2.71 0.00 5.18 1.01 -1.20 -4.97 120.40 122.36 2h2s s VAL 110 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 61.98 61.23 2h2s s VAL 110 Cb 0.00 -2.15 0.00 0.00 0.00 0.00 0.00 36.38 34.23 2h2s s VAL 110 CO 0.00 0.51 0.00 0.79 0.00 0.00 0.00 175.10 176.40 2h2s n TRP 111 N 4.07 -1.00 -4.14 5.22 7.02 -1.26 -1.65 117.44 125.70 2h2s n TRP 111 Ca -0.19 0.00 -0.11 0.00 -1.02 0.00 0.00 57.50 56.18 2h2s n TRP 111 Cb 0.52 0.00 -0.09 0.00 -2.42 0.00 0.00 31.31 29.32 2h2s n TRP 111 CO 0.00 0.00 0.00 0.20 -2.02 0.00 0.00 177.69 175.87 2h2s s GLY 112 N -1.44 1.19 0.13 6.99 0.00 -1.05 -4.49 107.32 108.66 2h2s s GLY 112 Ca 0.00 -1.47 -0.24 0.00 0.00 0.00 0.00 44.72 43.00 2h2s s GLY 112 CO 0.00 -1.19 1.63 0.00 0.00 0.00 0.00 173.10 173.55 2h2s h ALA 113 N 2.52 -0.25 0.00 3.20 0.00 -1.90 -3.45 119.26 119.38 2h2s h ALA 113 Ca -0.33 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2h2s h ALA 113 Cb 1.25 0.47 0.00 0.00 0.00 0.00 0.00 17.79 19.51 2h2s h ALA 113 CO 0.48 -0.72 0.00 0.41 0.00 0.00 0.00 179.25 179.42 2h2s n GLY 114 N -1.37 2.78 2.95 0.00 0.00 -1.26 -4.99 105.19 103.29 2h2s n GLY 114 Ca -0.03 -1.87 -0.17 0.00 0.00 0.00 0.00 46.02 43.95 2h2s n GLY 114 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2h2s s THR 115 N -2.64 0.48 0.01 2.61 -4.23 -0.93 -4.88 115.64 106.07 2h2s s THR 115 Ca 0.00 -0.22 -0.21 0.00 -1.18 0.00 0.00 61.69 60.08 2h2s s THR 115 Cb 0.00 -0.44 -0.05 0.00 1.34 0.00 0.00 72.50 73.35 2h2s s THR 115 CO 0.00 0.16 0.62 -0.89 -0.54 0.00 0.00 174.62 173.97 2h2s s THR 116 N 0.12 4.86 -0.28 3.99 2.01 -1.26 -1.96 115.64 123.11 2h2s s THR 116 Ca -0.01 1.31 -0.04 0.00 0.31 0.00 0.00 61.69 63.26 2h2s s THR 116 Cb -0.05 -3.96 0.02 0.00 0.01 0.00 0.00 72.50 68.52 2h2s s THR 116 CO -0.00 0.42 0.02 -0.69 -0.69 0.00 0.00 174.62 173.68 2h2s s VAL 117 N -0.23 3.43 -0.28 3.82 1.01 -0.79 -0.17 120.40 127.18 2h2s s VAL 117 Ca 0.32 -0.94 -0.08 0.00 0.00 0.00 0.00 61.98 61.28 2h2s s VAL 117 Cb -0.19 -2.80 -0.02 0.00 0.00 0.00 0.00 36.38 33.38 2h2s s VAL 117 CO 0.18 0.08 0.11 -0.89 0.00 0.00 0.00 175.10 174.59 2h2s s THR 118 N 1.40 4.46 -0.46 3.92 2.01 0.50 -2.44 115.64 125.02 2h2s s THR 118 Ca 0.00 -0.31 -0.12 0.00 0.31 0.00 0.00 61.69 61.57 2h2s s THR 118 Cb -0.17 -3.19 0.10 0.00 0.01 0.00 0.00 72.50 69.24 2h2s s THR 118 CO -0.01 0.19 0.35 -0.69 -0.69 0.00 0.00 174.62 173.77 2h2s s VAL 119 N 1.61 4.58 0.10 3.82 1.01 -1.26 -1.25 120.40 129.01 2h2s s VAL 119 Ca 0.05 -1.44 -0.18 0.00 0.00 0.00 0.00 61.98 60.42 2h2s s VAL 119 Cb -0.16 -3.86 0.04 0.00 0.00 0.00 0.00 36.38 32.40 2h2s s VAL 119 CO 0.05 -0.64 0.43 -0.55 0.00 0.00 0.00 175.10 174.39 2h2s s SER 120 N 2.58 -0.29 0.00 3.32 0.15 -0.07 -4.85 113.70 114.53 2h2s s SER 120 Ca 0.04 -0.17 0.26 0.00 0.70 0.00 0.00 55.95 56.78 2h2s s SER 120 Cb -0.25 0.47 0.73 0.00 -1.71 0.00 0.00 66.02 65.27 2h2s s SER 120 CO 0.02 -0.81 1.55 -1.54 1.20 0.00 0.00 173.24 173.67 2h2s n SER 121 N -0.01 1.43 -4.79 5.45 3.41 -1.26 -3.84 113.62 114.02 2h2s n SER 121 Ca -0.17 -1.24 -0.34 0.00 -0.26 0.00 0.00 58.87 56.86 2h2s n SER 121 Cb 0.63 0.12 -0.00 0.00 -0.26 0.00 0.00 64.21 64.69 2h2s n SER 121 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2h2s s ALA 122 N -2.30 2.74 0.05 7.33 0.00 -1.26 -5.03 121.76 123.29 2h2s s ALA 122 Ca 0.29 0.66 -0.06 0.00 0.00 0.00 0.00 51.96 52.85 2h2s s ALA 122 Cb 0.20 -3.30 -0.05 0.00 0.00 0.00 0.00 23.12 19.97 2h2s s ALA 122 CO 0.45 -0.67 0.30 0.15 0.00 0.00 0.00 175.76 175.99 2h2s s LYS 123 N -3.46 3.60 0.24 0.00 -0.14 -1.26 -5.00 119.74 113.73 2h2s s LYS 123 Ca 0.69 -0.07 -0.31 0.00 -1.36 0.00 0.00 55.97 54.92 2h2s s LYS 123 Cb -0.20 -3.02 -0.13 0.00 -1.68 0.00 0.00 37.83 32.79 2h2s s LYS 123 CO 0.27 0.60 1.37 2.41 -0.76 0.00 0.00 175.35 179.24 2h2s n THR 124 N 0.83 1.05 -3.68 2.17 -1.04 -1.26 -4.82 114.28 107.53 2h2s n THR 124 Ca -0.09 -0.26 -0.14 0.00 -2.04 0.00 0.00 64.05 61.53 2h2s n THR 124 Cb 0.52 -1.42 -0.13 0.00 -1.82 0.00 0.00 70.33 67.48 2h2s n THR 124 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2h2s s THR 125 N -0.17 -0.31 0.67 12.58 2.01 0.87 -4.95 115.64 126.33 2h2s s THR 125 Ca 0.67 0.26 -0.17 0.00 0.31 0.00 0.00 61.69 62.76 2h2s s THR 125 Cb -0.66 -0.41 -0.01 0.00 0.01 0.00 0.00 72.50 71.43 2h2s s THR 125 CO 0.51 0.11 1.20 -0.81 -0.69 0.00 0.00 174.62 174.94 2h2s n PRO 126 N 5.09 0.92 -3.30 4.92 -0.04 -1.26 -0.95 135.00 140.38 2h2s n PRO 126 Ca -0.10 0.37 -0.34 0.00 -0.04 0.00 0.00 63.50 63.38 2h2s n PRO 126 Cb 0.50 -2.43 -0.06 0.00 -0.04 0.00 0.00 33.50 31.47 2h2s n PRO 126 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 2h2s s PRO 127 N -3.35 4.00 -0.37 0.54 0.05 -1.26 -4.21 135.00 130.40 2h2s s PRO 127 Ca 0.80 0.54 -0.14 0.00 0.05 0.00 0.00 61.00 62.25 2h2s s PRO 127 Cb -0.37 -2.81 -0.00 0.00 0.05 0.00 0.00 34.50 31.36 2h2s s PRO 127 CO 0.43 0.40 0.28 -1.12 0.05 0.00 0.00 177.00 177.04 2h2s s SER 128 N -1.89 6.09 -0.22 6.66 0.01 -0.29 -4.96 113.70 119.10 2h2s s SER 128 Ca 0.42 -0.58 -0.17 0.00 1.31 0.00 0.00 55.95 56.93 2h2s s SER 128 Cb -0.14 -2.15 -0.03 0.00 0.21 0.00 0.00 66.02 63.90 2h2s s SER 128 CO 0.20 -0.33 0.47 -0.69 0.41 0.00 0.00 173.24 173.30 2h2s s VAL 129 N 1.75 5.13 -0.03 3.43 1.01 -1.26 -1.98 120.40 128.45 2h2s s VAL 129 Ca 0.06 0.84 0.07 0.00 0.00 0.00 0.00 61.98 62.95 2h2s s VAL 129 Cb -0.18 -3.80 -0.02 0.00 0.00 0.00 0.00 36.38 32.39 2h2s s VAL 129 CO 0.11 0.18 -0.24 -0.31 0.00 0.00 0.00 175.10 174.83 2h2s s TYR 130 N 1.73 2.41 0.07 5.22 2.02 0.53 -4.94 117.35 124.39 2h2s s TYR 130 Ca 0.21 -0.41 -0.30 0.00 -0.37 0.00 0.00 57.07 56.20 2h2s s TYR 130 Cb -0.15 -1.53 -0.05 0.00 -0.40 0.00 0.00 41.96 39.83 2h2s s TYR 130 CO 0.09 -0.01 0.98 -1.25 -1.57 0.00 0.00 175.55 173.78 2h2s s PRO 131 N -0.59 4.64 -0.41 -1.71 0.04 -1.26 0.26 135.00 135.97 2h2s s PRO 131 Ca 0.09 1.45 -0.07 0.00 0.04 0.00 0.00 61.00 62.51 2h2s s PRO 131 Cb -0.10 -3.40 0.09 0.00 0.04 0.00 0.00 34.50 31.12 2h2s s PRO 131 CO -0.00 0.11 0.23 -0.51 0.04 0.00 0.00 177.00 176.87 2h2s s LEU 132 N 0.36 5.11 0.09 -3.56 1.43 0.13 -4.82 118.68 117.42 2h2s s LEU 132 Ca 0.49 -1.63 0.09 0.00 -1.03 0.00 0.00 54.13 52.04 2h2s s LEU 132 Cb -0.23 -1.93 -0.03 0.00 0.03 0.00 0.00 46.19 44.03 2h2s s LEU 132 CO 0.29 -0.53 -0.22 0.00 0.23 0.00 0.00 176.35 176.12 2h2s s ALA 133 N 1.34 1.93 0.42 4.21 0.00 -1.26 -3.57 121.76 124.84 2h2s s ALA 133 Ca 0.04 -1.25 -0.25 0.00 0.00 0.00 0.00 51.96 50.49 2h2s s ALA 133 Cb -0.23 -0.30 -0.10 0.00 0.00 0.00 0.00 23.12 22.49 2h2s s ALA 133 CO 0.00 0.41 1.20 -2.30 0.00 0.00 0.00 175.76 175.07 2h2s n PRO 134 N 1.24 1.76 -0.59 0.00 -0.02 -1.26 -4.81 135.00 131.31 2h2s n PRO 134 Ca -0.19 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 2h2s n PRO 134 Cb 0.53 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 2h2s n PRO 134 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2h2s n GLY 135 N 0.92 6.22 0.05 -1.23 0.00 -1.26 -3.77 105.19 106.11 2h2s n GLY 135 Ca 0.08 -1.91 0.04 0.00 0.00 0.00 0.00 46.02 44.23 2h2s n GLY 135 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2h2s n SER 136 N -0.47 0.04 -0.03 1.61 2.88 -1.26 -0.36 113.62 116.05 2h2s n SER 136 Ca 0.00 0.23 0.02 0.00 -1.33 0.00 0.00 58.87 57.80 2h2s n SER 136 Cb 0.00 -0.11 0.03 0.00 -0.75 0.00 0.00 64.21 63.38 2h2s n SER 136 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2h2s n ALA 137 N -2.95 1.99 -0.30 -1.46 0.00 -1.26 -5.08 120.51 111.45 2h2s n ALA 137 Ca 0.05 -1.31 -0.29 0.00 0.00 0.00 0.00 53.44 51.89 2h2s n ALA 137 Cb 0.18 -0.09 0.28 0.00 0.00 0.00 0.00 19.45 19.81 2h2s n ALA 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2h2s n ALA 138 N -0.66 -4.45 -2.94 0.00 0.00 0.52 -5.05 120.51 107.93 2h2s n ALA 138 Ca 0.03 -1.75 -0.12 0.00 0.00 0.00 0.00 53.44 51.60 2h2s n ALA 138 Cb 0.36 -1.60 -0.01 0.00 0.00 0.00 0.00 19.45 18.20 2h2s n ALA 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2h2s n ALA 139 N -5.58 -0.32 -0.91 0.00 0.00 -1.26 -5.05 120.51 107.39 2h2s n ALA 139 Ca 0.11 -1.81 -0.07 0.00 0.00 0.00 0.00 53.44 51.67 2h2s n ALA 139 Cb 0.57 -1.23 -0.07 0.00 0.00 0.00 0.00 19.45 18.72 2h2s n ALA 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2h2s n ALA 140 N 2.44 0.58 -2.01 0.00 0.00 -1.26 -4.89 120.51 115.37 2h2s n ALA 140 Ca 0.19 -0.70 -0.36 0.00 0.00 0.00 0.00 53.44 52.56 2h2s n ALA 140 Cb 0.56 -0.97 -0.06 0.00 0.00 0.00 0.00 19.45 18.98 2h2s n ALA 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2h2s s ALA 141 N 0.00 3.33 0.01 0.00 0.00 -1.26 -4.93 121.76 118.91 2h2s s ALA 141 Ca 0.41 0.26 -0.00 0.00 0.00 0.00 0.00 51.96 52.63 2h2s s ALA 141 Cb -0.26 -2.93 0.02 0.00 0.00 0.00 0.00 23.12 19.95 2h2s s ALA 141 CO 0.18 0.28 0.07 0.45 0.00 0.00 0.00 175.76 176.74 2h2s n SER 142 N 0.53 -0.01 -4.79 0.00 2.88 -1.26 -3.92 113.62 107.04 2h2s n SER 142 Ca -0.00 0.08 -0.37 0.00 -1.33 0.00 0.00 58.87 57.25 2h2s n SER 142 Cb 0.51 -0.02 -0.07 0.00 -0.75 0.00 0.00 64.21 63.88 2h2s n SER 142 CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 2h2s s MET 143 N -4.98 3.98 -0.06 -1.46 1.00 -1.26 0.15 119.30 116.67 2h2s s MET 143 Ca -0.01 0.04 0.06 0.00 0.00 0.00 0.00 55.69 55.78 2h2s s MET 143 Cb 0.01 -3.33 -0.01 0.00 0.00 0.00 0.00 34.83 31.51 2h2s s MET 143 CO 0.04 0.47 -0.24 0.54 0.00 0.00 0.00 175.02 175.83 2h2s s VAL 144 N -0.20 1.96 -0.19 -6.03 0.11 0.28 -4.72 120.40 111.61 2h2s s VAL 144 Ca 0.16 -1.01 -0.11 0.00 -2.93 0.00 0.00 61.98 58.09 2h2s s VAL 144 Cb -0.13 -1.67 -0.05 0.00 -1.53 0.00 0.00 36.38 33.00 2h2s s VAL 144 CO 0.05 0.55 0.17 -0.89 -3.33 0.00 0.00 175.10 171.64 2h2s s THR 145 N -0.06 5.39 0.00 5.04 2.01 -1.26 -1.08 115.64 125.67 2h2s s THR 145 Ca -0.06 0.28 0.00 0.00 0.31 0.00 0.00 61.69 62.22 2h2s s THR 145 Cb -0.14 -3.51 0.00 0.00 0.01 0.00 0.00 72.50 68.86 2h2s s THR 145 CO 0.04 0.44 0.00 0.18 -0.69 0.00 0.00 174.62 174.59 2h2s n LEU 146 N 3.45 0.00 0.00 4.42 4.77 -0.05 -4.63 117.00 124.95 2h2s n LEU 146 Ca -0.15 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.83 2h2s n LEU 146 Cb 0.52 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 2h2s n LEU 146 CO 0.37 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 2h2s n GLY 147 N 5.00 2.66 3.15 -0.72 0.00 -1.23 -4.15 105.19 109.90 2h2s n GLY 147 Ca 0.00 -1.91 -0.12 0.00 0.00 0.00 0.00 46.02 43.99 2h2s n GLY 147 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h2s s LEU 149 N -2.57 3.73 -0.51 0.00 2.96 0.74 -2.52 118.68 120.51 2h2s s LEU 149 Ca 0.05 0.11 0.04 0.00 -0.22 0.00 0.00 54.13 54.11 2h2s s LEU 149 Cb -0.00 -1.91 0.14 0.00 0.50 0.00 0.00 46.19 44.92 2h2s s LEU 149 CO -0.02 0.25 0.28 -0.69 -1.32 0.00 0.00 176.35 174.85 2h2s s VAL 150 N -0.12 2.25 0.20 1.68 1.01 0.29 0.20 120.40 125.91 2h2s s VAL 150 Ca 0.06 -3.20 0.10 0.00 0.00 0.00 0.00 61.98 58.94 2h2s s VAL 150 Cb -0.12 -2.56 -0.04 0.00 0.00 0.00 0.00 36.38 33.66 2h2s s VAL 150 CO 0.01 -0.85 -0.12 -1.59 0.00 0.00 0.00 175.10 172.55 2h2s s LYS 151 N -0.23 1.97 0.00 2.72 -2.85 -0.84 0.02 119.74 120.53 2h2s s LYS 151 Ca 0.18 -1.36 0.00 0.00 -1.00 0.00 0.00 55.97 53.79 2h2s s LYS 151 Cb -0.23 -2.08 0.00 0.00 -2.06 0.00 0.00 37.83 33.46 2h2s s LYS 151 CO -0.02 0.41 0.00 0.41 0.10 0.00 0.00 175.35 176.25 2h2s n GLY 152 N -0.06 0.66 3.91 0.59 0.00 -0.29 -1.14 105.19 108.87 2h2s n GLY 152 Ca -0.10 -0.28 -0.21 0.00 0.00 0.00 0.00 46.02 45.43 2h2s n GLY 152 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2h2s s TYR 153 N -2.00 3.13 -0.28 1.61 -0.85 -0.92 -4.54 117.35 113.49 2h2s s TYR 153 Ca 0.00 -0.18 -0.22 0.00 -0.52 0.00 0.00 57.07 56.16 2h2s s TYR 153 Cb 0.00 -1.73 0.11 0.00 0.38 0.00 0.00 41.96 40.73 2h2s s TYR 153 CO 0.00 0.25 0.92 0.12 -1.52 0.00 0.00 175.55 175.32 2h2s s PHE 154 N -2.16 -0.63 0.00 -3.49 5.36 -0.12 -0.56 117.98 116.37 2h2s s PHE 154 Ca 0.39 1.42 0.00 0.00 -0.96 0.00 0.00 56.93 57.78 2h2s s PHE 154 Cb -0.08 0.38 0.00 0.00 -0.34 0.00 0.00 43.02 42.98 2h2s s PHE 154 CO 0.28 -0.31 0.00 -0.35 -1.46 0.00 0.00 175.22 173.38 2h2s n PRO 155 N 2.90 1.35 -4.02 10.12 -0.04 -1.26 -0.09 135.00 143.96 2h2s n PRO 155 Ca -0.15 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.00 2h2s n PRO 155 Cb 0.56 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.97 2h2s n PRO 155 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2h2s s GLU 156 N 3.95 3.09 0.34 0.54 0.41 -1.26 -4.66 118.70 121.12 2h2s s GLU 156 Ca 0.00 -0.56 0.05 0.00 -0.41 0.00 0.00 54.97 54.05 2h2s s GLU 156 Cb 0.00 -2.86 -0.02 0.00 -1.78 0.00 0.00 34.13 29.48 2h2s s GLU 156 CO 0.00 0.60 0.17 -0.35 -0.49 0.00 0.00 175.26 175.19 2h2s n PRO 157 N 0.61 0.53 -3.67 0.39 -0.04 -1.26 -4.96 135.00 126.59 2h2s n PRO 157 Ca -0.09 -3.01 -0.23 0.00 -0.04 0.00 0.00 63.50 60.14 2h2s n PRO 157 Cb 0.52 1.90 -0.02 0.00 -0.04 0.00 0.00 33.50 35.86 2h2s n PRO 157 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2h2s s VAL 158 N -3.00 2.32 -0.18 0.52 -7.23 -1.25 -4.18 120.40 107.39 2h2s s VAL 158 Ca 0.24 -1.40 -0.04 0.00 -1.81 0.00 0.00 61.98 58.97 2h2s s VAL 158 Cb 0.01 -2.71 0.09 0.00 0.56 0.00 0.00 36.38 34.33 2h2s s VAL 158 CO 0.17 0.00 0.29 0.42 -0.31 0.00 0.00 175.10 175.66 2h2s s THR 159 N -2.58 -0.44 -0.10 5.32 -4.23 0.16 -4.91 115.64 108.86 2h2s s THR 159 Ca 0.44 0.06 -0.05 0.00 -1.18 0.00 0.00 61.69 60.97 2h2s s THR 159 Cb -0.02 -0.62 -0.04 0.00 1.34 0.00 0.00 72.50 73.16 2h2s s THR 159 CO 0.26 -0.05 0.09 -0.69 -0.54 0.00 0.00 174.62 173.69 2h2s s VAL 160 N 2.43 5.04 0.03 2.29 1.01 -1.26 -1.75 120.40 128.20 2h2s s VAL 160 Ca 0.06 0.02 -0.09 0.00 0.00 0.00 0.00 61.98 61.97 2h2s s VAL 160 Cb -0.14 -3.18 0.00 0.00 0.00 0.00 0.00 36.38 33.06 2h2s s VAL 160 CO -0.12 0.60 0.17 0.42 0.00 0.00 0.00 175.10 176.18 2h2s s THR 161 N -0.98 0.10 -0.08 3.92 -4.23 -1.02 -4.94 115.64 108.40 2h2s s THR 161 Ca 0.15 -0.86 -0.02 0.00 -1.18 0.00 0.00 61.69 59.78 2h2s s THR 161 Cb -0.12 -0.79 -0.03 0.00 1.34 0.00 0.00 72.50 72.90 2h2s s THR 161 CO 0.04 -0.47 -0.00 0.26 -0.54 0.00 0.00 174.62 173.90 2h2s s TRP 162 N -2.26 3.15 -1.39 3.99 0.52 -1.26 0.21 118.94 121.90 2h2s s TRP 162 Ca -0.08 0.18 -0.15 0.00 0.02 0.00 0.00 56.10 56.08 2h2s s TRP 162 Cb -0.03 -1.78 0.02 0.00 -1.15 0.00 0.00 33.47 30.53 2h2s s TRP 162 CO -0.02 0.46 0.33 0.09 0.02 0.00 0.00 176.95 177.82 2h2s n ASN 163 N 2.15 -1.37 -1.97 2.95 3.02 0.41 0.20 115.26 120.66 2h2s n ASN 163 Ca -0.19 -1.27 -0.10 0.00 -0.03 0.00 0.00 54.58 52.99 2h2s n ASN 163 Cb 0.54 -1.74 -0.02 0.00 -0.61 0.00 0.00 39.78 37.94 2h2s n ASN 163 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2h2s n SER 164 N -2.58 -3.09 0.00 6.41 7.64 -1.26 -1.46 113.62 119.28 2h2s n SER 164 Ca -0.23 0.25 0.00 0.00 1.01 0.00 0.00 58.87 59.90 2h2s n SER 164 Cb 0.64 -2.78 0.00 0.00 -1.01 0.00 0.00 64.21 61.06 2h2s n SER 164 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2h2s n GLY 165 N -0.52 3.32 3.57 0.23 0.00 0.13 -5.00 105.19 106.92 2h2s n GLY 165 Ca -0.11 -0.94 -0.18 0.00 0.00 0.00 0.00 46.02 44.79 2h2s n GLY 165 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2h2s s SER 166 N 0.00 4.14 0.00 1.61 1.04 -0.53 -1.52 113.70 118.44 2h2s s SER 166 Ca 0.00 -0.58 0.00 0.00 0.48 0.00 0.00 55.95 55.85 2h2s s SER 166 Cb 0.00 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.55 2h2s s SER 166 CO 0.00 -3.81 0.00 -0.11 0.98 0.00 0.00 173.24 170.30 2h2s n LEU 167 N 17.54 0.00 -3.68 2.42 0.00 -1.26 -4.44 117.00 127.59 2h2s n LEU 167 Ca 0.44 0.00 -0.41 0.00 0.00 0.00 0.00 56.01 56.04 2h2s n LEU 167 Cb 0.45 0.00 0.01 0.00 0.00 0.00 0.00 43.42 43.88 2h2s n LEU 167 CO 0.58 0.00 1.71 0.00 0.00 0.00 0.00 177.39 179.68 2h2s n ALA 168 N 0.00 6.07 -3.31 1.96 0.00 -0.57 -4.67 120.51 119.98 2h2s n ALA 168 Ca 0.00 -4.47 0.02 0.00 0.00 0.00 0.00 53.44 49.00 2h2s n ALA 168 Cb 0.00 -2.46 -0.04 0.00 0.00 0.00 0.00 19.45 16.95 2h2s n ALA 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2h2s s ALA 169 N -2.72 -2.95 0.00 0.00 0.00 -1.26 -4.91 121.76 109.93 2h2s s ALA 169 Ca 0.42 1.92 0.00 0.00 0.00 0.00 0.00 51.96 54.30 2h2s s ALA 169 Cb 0.16 -2.16 0.00 0.00 0.00 0.00 0.00 23.12 21.11 2h2s s ALA 169 CO -0.07 -1.00 0.00 0.41 0.00 0.00 0.00 175.76 175.11 2h2s n GLY 170 N 4.88 0.76 3.71 0.00 0.00 -1.26 -4.82 105.19 108.45 2h2s n GLY 170 Ca -0.08 -0.15 -0.36 0.00 0.00 0.00 0.00 46.02 45.42 2h2s n GLY 170 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2h2s s VAL 171 N -2.00 5.34 -0.33 1.61 1.01 -1.26 -1.18 120.40 123.58 2h2s s VAL 171 Ca 0.00 0.37 0.04 0.00 0.00 0.00 0.00 61.98 62.38 2h2s s VAL 171 Cb 0.00 -3.56 0.10 0.00 0.00 0.00 0.00 36.38 32.92 2h2s s VAL 171 CO 0.00 0.38 0.04 -1.00 0.00 0.00 0.00 175.10 174.52 2h2s s HIS 172 N 0.67 3.68 -0.20 5.22 3.76 0.22 -4.99 115.29 123.66 2h2s s HIS 172 Ca 0.12 -2.93 -0.11 0.00 -0.15 0.00 0.00 55.06 52.00 2h2s s HIS 172 Cb -0.13 -2.82 -0.05 0.00 1.11 0.00 0.00 32.58 30.69 2h2s s HIS 172 CO 0.03 -0.94 0.15 0.99 -0.85 0.00 0.00 174.74 174.12 2h2s s THR 173 N 0.93 5.39 -0.09 1.30 2.01 -1.26 -0.74 115.64 123.18 2h2s s THR 173 Ca 0.09 0.24 -0.10 0.00 0.31 0.00 0.00 61.69 62.23 2h2s s THR 173 Cb -0.19 -3.49 -0.05 0.00 0.01 0.00 0.00 72.50 68.78 2h2s s THR 173 CO -0.08 0.42 0.24 -0.36 -0.69 0.00 0.00 174.62 174.15 2h2s s PHE 174 N 0.45 3.62 0.39 4.92 0.08 -0.51 -5.00 117.98 121.93 2h2s s PHE 174 Ca 0.09 0.68 -0.27 0.00 0.12 0.00 0.00 56.93 57.54 2h2s s PHE 174 Cb -0.11 -2.10 -0.10 0.00 -0.57 0.00 0.00 43.02 40.13 2h2s s PHE 174 CO -0.01 0.64 1.46 -2.14 -0.10 0.00 0.00 175.22 175.07 2h2s s PRO 175 N -0.82 4.01 0.55 0.24 0.02 -1.26 -4.40 135.00 133.34 2h2s s PRO 175 Ca 0.18 2.51 -0.19 0.00 0.02 0.00 0.00 61.00 63.52 2h2s s PRO 175 Cb -0.14 -2.89 -0.06 0.00 0.02 0.00 0.00 34.50 31.44 2h2s s PRO 175 CO 0.07 -0.59 1.10 0.00 -0.33 0.00 0.00 177.00 177.25 2h2s s ALA 176 N -1.15 2.71 -0.05 -1.55 0.00 -1.26 -4.88 121.76 115.58 2h2s s ALA 176 Ca 0.55 0.71 0.06 0.00 0.00 0.00 0.00 51.96 53.28 2h2s s ALA 176 Cb -0.45 -3.32 -0.02 0.00 0.00 0.00 0.00 23.12 19.33 2h2s s ALA 176 CO 0.61 -0.73 -0.22 0.14 0.00 0.00 0.00 175.76 175.55 2h2s s VAL 177 N -1.94 2.33 -0.56 0.00 -7.23 -0.69 -4.92 120.40 107.40 2h2s s VAL 177 Ca 0.70 -0.98 -0.16 0.00 -1.81 0.00 0.00 61.98 59.73 2h2s s VAL 177 Cb -0.21 -1.86 0.13 0.00 0.56 0.00 0.00 36.38 35.00 2h2s s VAL 177 CO 0.28 0.57 0.52 -0.22 -0.31 0.00 0.00 175.10 175.94 2h2s s LEU 178 N -0.39 6.22 -0.17 1.32 2.96 -1.26 -1.69 118.68 125.66 2h2s s LEU 178 Ca 0.03 -1.84 -0.05 0.00 -0.22 0.00 0.00 54.13 52.05 2h2s s LEU 178 Cb -0.12 -2.21 -0.03 0.00 0.50 0.00 0.00 46.19 44.33 2h2s s LEU 178 CO 0.02 -0.85 0.01 -1.58 -1.32 0.00 0.00 176.35 172.63 2h2s s GLN 179 N 1.53 3.78 -0.87 1.98 0.74 -0.10 -4.67 119.66 122.05 2h2s s GLN 179 Ca 0.04 -0.45 -0.05 0.00 0.05 0.00 0.00 55.36 54.95 2h2s s GLN 179 Cb -0.29 -3.05 -0.00 0.00 1.10 0.00 0.00 33.01 30.76 2h2s s GLN 179 CO 0.02 0.22 0.69 0.00 -0.55 0.00 0.00 175.29 175.68 2h2s n ALA 180 N 3.64 -2.62 -3.98 1.58 0.00 -1.26 -2.65 120.51 115.23 2h2s n ALA 180 Ca -0.17 -0.14 -0.28 0.00 0.00 0.00 0.00 53.44 52.84 2h2s n ALA 180 Cb 0.52 -1.94 -0.08 0.00 0.00 0.00 0.00 19.45 17.96 2h2s n ALA 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2h2s n ALA 181 N -2.63 -1.53 -3.64 0.00 0.00 -1.26 -4.91 120.51 106.53 2h2s n ALA 181 Ca -0.13 -0.28 -0.09 0.00 0.00 0.00 0.00 53.44 52.94 2h2s n ALA 181 Cb 0.59 -1.12 -0.07 0.00 0.00 0.00 0.00 19.45 18.85 2h2s n ALA 181 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2h2s s LEU 182 N -6.39 -0.86 0.32 0.00 1.43 -1.09 -4.95 118.68 107.14 2h2s s LEU 182 Ca 0.23 1.46 -0.10 0.00 -1.03 0.00 0.00 54.13 54.69 2h2s s LEU 182 Cb -0.14 2.38 -0.07 0.00 0.03 0.00 0.00 46.19 48.39 2h2s s LEU 182 CO 0.82 -0.24 0.67 -0.31 0.23 0.00 0.00 176.35 177.52 2h2s s TYR 183 N 1.22 3.44 -0.13 0.29 4.12 0.27 -0.93 117.35 125.63 2h2s s TYR 183 Ca -0.07 0.96 -0.10 0.00 0.02 0.00 0.00 57.07 57.89 2h2s s TYR 183 Cb -0.05 -2.35 0.04 0.00 -1.52 0.00 0.00 41.96 38.08 2h2s s TYR 183 CO -0.13 0.09 0.34 -0.08 0.02 0.00 0.00 175.55 175.78 2h2s s THR 184 N -2.09 -0.01 0.09 -0.71 -1.32 -0.68 -1.13 115.64 109.77 2h2s s THR 184 Ca 0.49 0.05 -0.09 0.00 -1.21 0.00 0.00 61.69 60.94 2h2s s THR 184 Cb -0.11 -0.49 -0.00 0.00 -1.51 0.00 0.00 72.50 70.39 2h2s s THR 184 CO 0.25 0.02 0.20 -1.48 -2.21 0.00 0.00 174.62 171.40 2h2s s LEU 185 N 0.71 1.39 0.07 9.08 0.05 0.10 -1.71 118.68 128.37 2h2s s LEU 185 Ca -0.04 -0.62 0.01 0.00 0.05 0.00 0.00 54.13 53.53 2h2s s LEU 185 Cb -0.06 1.05 -0.04 0.00 -2.05 0.00 0.00 46.19 45.10 2h2s s LEU 185 CO -0.05 -0.72 -0.06 -0.94 -0.55 0.00 0.00 176.35 174.04 2h2s s SER 186 N -2.80 0.84 -0.16 1.48 1.04 -1.26 0.10 113.70 112.95 2h2s s SER 186 Ca 0.04 -0.85 -0.05 0.00 0.48 0.00 0.00 55.95 55.57 2h2s s SER 186 Cb 0.04 0.11 0.08 0.00 0.10 0.00 0.00 66.02 66.34 2h2s s SER 186 CO -0.10 -0.42 0.32 -0.55 0.98 0.00 0.00 173.24 173.46 2h2s s SER 187 N -2.52 0.17 0.08 7.02 0.15 -1.05 -1.42 113.70 116.14 2h2s s SER 187 Ca 0.03 0.70 0.04 0.00 0.70 0.00 0.00 55.95 57.42 2h2s s SER 187 Cb 0.01 0.92 -0.04 0.00 -1.71 0.00 0.00 66.02 65.20 2h2s s SER 187 CO -0.04 -0.24 0.04 -0.94 1.20 0.00 0.00 173.24 173.26 2h2s s SER 188 N 2.49 5.30 -0.01 5.45 1.04 0.08 -1.93 113.70 126.11 2h2s s SER 188 Ca 0.01 -0.09 0.01 0.00 0.48 0.00 0.00 55.95 56.36 2h2s s SER 188 Cb -0.12 -1.35 0.00 0.00 0.10 0.00 0.00 66.02 64.65 2h2s s SER 188 CO -0.10 0.17 -0.04 0.54 0.98 0.00 0.00 173.24 174.79 2h2s s VAL 189 N -1.35 0.38 -0.10 5.02 0.11 -1.26 0.71 120.40 123.91 2h2s s VAL 189 Ca 0.28 -0.16 -0.01 0.00 -2.93 0.00 0.00 61.98 59.16 2h2s s VAL 189 Cb -0.12 -0.35 -0.03 0.00 -1.53 0.00 0.00 36.38 34.35 2h2s s VAL 189 CO 0.20 0.13 -0.03 -0.89 -3.33 0.00 0.00 175.10 171.18 2h2s s THR 190 N 0.18 4.00 0.07 5.04 2.01 -0.33 -0.87 115.64 125.74 2h2s s THR 190 Ca -0.02 -0.35 -0.11 0.00 0.31 0.00 0.00 61.69 61.52 2h2s s THR 190 Cb -0.05 -2.69 0.01 0.00 0.01 0.00 0.00 72.50 69.78 2h2s s THR 190 CO -0.00 0.57 0.25 0.68 -0.69 0.00 0.00 174.62 175.43 2h2s s VAL 191 N -0.52 0.11 -0.20 3.82 -7.23 -0.24 -4.73 120.40 111.40 2h2s s VAL 191 Ca 0.08 -0.89 -0.37 0.00 -1.81 0.00 0.00 61.98 59.00 2h2s s VAL 191 Cb -0.12 -1.11 -0.13 0.00 0.56 0.00 0.00 36.38 35.58 2h2s s VAL 191 CO 0.02 -0.49 1.87 -0.81 -0.31 0.00 0.00 175.10 175.38 2h2s n PRO 192 N 0.25 1.65 -0.89 4.82 -0.04 -1.26 -0.55 135.00 138.98 2h2s n PRO 192 Ca -0.17 0.59 -0.37 0.00 -0.04 0.00 0.00 63.50 63.51 2h2s n PRO 192 Cb 0.61 -2.42 -0.06 0.00 -0.04 0.00 0.00 33.50 31.59 2h2s n PRO 192 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2h2s n SER 193 N 6.61 2.54 0.00 3.54 2.88 0.39 -0.61 113.62 128.97 2h2s n SER 193 Ca 0.26 -2.54 0.00 0.00 -1.33 0.00 0.00 58.87 55.27 2h2s n SER 193 Cb 0.22 -0.97 0.00 0.00 -0.75 0.00 0.00 64.21 62.72 2h2s n SER 193 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2h2s n SER 194 N 6.95 0.00 -0.51 -3.46 3.41 -1.26 -4.82 113.62 113.93 2h2s n SER 194 Ca 0.45 0.00 0.14 0.00 -0.26 0.00 0.00 58.87 59.20 2h2s n SER 194 Cb 0.33 0.00 0.48 0.00 -0.26 0.00 0.00 64.21 64.76 2h2s n SER 194 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2h2s n SER 195 N -1.07 1.60 -3.64 4.04 3.41 0.22 -4.30 113.62 113.87 2h2s n SER 195 Ca 0.00 -1.51 -0.10 0.00 -0.26 0.00 0.00 58.87 57.00 2h2s n SER 195 Cb 0.00 0.01 -0.07 0.00 -0.26 0.00 0.00 64.21 63.89 2h2s n SER 195 CO 0.00 0.00 0.00 0.86 -0.16 0.00 0.00 175.04 175.74 2h2s s TRP 196 N -2.02 -0.93 -2.00 7.33 -0.00 -1.24 0.21 118.94 120.28 2h2s s TRP 196 Ca 0.36 2.01 0.11 0.00 -0.00 0.00 0.00 56.10 58.58 2h2s s TRP 196 Cb 0.21 0.47 0.67 0.00 -0.00 0.00 0.00 33.47 34.82 2h2s s TRP 196 CO 0.34 -0.46 1.18 -2.30 -0.00 0.00 0.00 176.95 175.72 2h2s n PRO 197 N 3.63 0.66 0.00 5.86 -0.02 -1.26 -4.66 135.00 139.21 2h2s n PRO 197 Ca -0.18 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.30 2h2s n PRO 197 Cb 0.57 -1.27 0.00 0.00 -0.02 0.00 0.00 33.50 32.79 2h2s n PRO 197 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2h2s n SER 198 N -0.77 0.00 -4.24 2.55 2.88 -1.22 -4.57 113.62 108.26 2h2s n SER 198 Ca 0.08 0.22 -0.28 0.00 -1.33 0.00 0.00 58.87 57.56 2h2s n SER 198 Cb 0.04 0.00 0.17 0.00 -0.75 0.00 0.00 64.21 63.67 2h2s n SER 198 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 2h2s s GLU 199 N -0.59 0.84 -0.31 -1.46 0.41 0.55 -5.04 118.70 113.11 2h2s s GLU 199 Ca 0.00 -0.57 -0.12 0.00 -0.41 0.00 0.00 54.97 53.86 2h2s s GLU 199 Cb 0.00 -1.95 -0.03 0.00 -1.78 0.00 0.00 34.13 30.37 2h2s s GLU 199 CO 0.00 -2.22 0.24 0.99 -0.49 0.00 0.00 175.26 173.78 2h2s s THR 200 N -3.74 5.27 -0.78 3.63 2.01 -1.26 -4.49 115.64 116.28 2h2s s THR 200 Ca 0.73 0.07 -0.16 0.00 0.31 0.00 0.00 61.69 62.64 2h2s s THR 200 Cb -0.04 -3.64 0.18 0.00 0.01 0.00 0.00 72.50 69.01 2h2s s THR 200 CO 0.51 0.12 0.79 -0.69 -0.69 0.00 0.00 174.62 174.66 2h2s s VAL 201 N 1.80 5.32 -0.07 3.82 1.01 -1.26 -4.91 120.40 126.12 2h2s s VAL 201 Ca 0.08 -2.03 -0.13 0.00 0.00 0.00 0.00 61.98 59.90 2h2s s VAL 201 Cb -0.16 -4.51 -0.05 0.00 0.00 0.00 0.00 36.38 31.66 2h2s s VAL 201 CO 0.11 -1.10 0.32 -0.89 0.00 0.00 0.00 175.10 173.54 2h2s s THR 202 N 1.06 5.21 -0.24 3.92 2.01 -1.26 -2.03 115.64 124.31 2h2s s THR 202 Ca 0.18 0.63 -0.06 0.00 0.31 0.00 0.00 61.69 62.75 2h2s s THR 202 Cb -0.13 -3.63 -0.02 0.00 0.01 0.00 0.00 72.50 68.73 2h2s s THR 202 CO -0.06 0.54 0.04 0.00 -0.69 0.00 0.00 174.62 174.45 2h2s s ASN 204 N 1.54 6.65 0.44 0.00 -0.87 0.57 0.26 114.94 123.53 2h2s s ASN 204 Ca 0.06 -2.83 -0.17 0.00 -1.57 0.00 0.00 52.86 48.35 2h2s s ASN 204 Cb -0.15 -2.17 -0.09 0.00 -0.02 0.00 0.00 41.25 38.82 2h2s s ASN 204 CO 0.02 -0.51 0.91 -0.69 -2.57 0.00 0.00 177.10 174.25 2h2s s VAL 205 N -0.05 4.53 -0.11 1.60 1.01 0.10 -2.44 120.40 125.04 2h2s s VAL 205 Ca 0.19 1.21 -0.16 0.00 0.00 0.00 0.00 61.98 63.22 2h2s s VAL 205 Cb -0.11 -3.66 0.04 0.00 0.00 0.00 0.00 36.38 32.65 2h2s s VAL 205 CO -0.08 -0.45 0.42 0.00 0.00 0.00 0.00 175.10 174.99 2h2s s ALA 206 N -2.32 -1.04 -0.29 5.51 0.00 -0.71 -2.23 121.76 120.68 2h2s s ALA 206 Ca 0.58 0.98 -0.04 0.00 0.00 0.00 0.00 51.96 53.49 2h2s s ALA 206 Cb -0.10 -0.44 0.10 0.00 0.00 0.00 0.00 23.12 22.68 2h2s s ALA 206 CO 0.22 -0.23 0.14 -1.58 0.00 0.00 0.00 175.76 174.31 2h2s s HIS 207 N -0.30 0.27 0.20 0.00 2.46 -0.68 -0.66 115.29 116.58 2h2s s HIS 207 Ca -0.04 -0.82 -0.11 0.00 0.47 0.00 0.00 55.06 54.56 2h2s s HIS 207 Cb -0.03 -0.87 0.19 0.00 -0.13 0.00 0.00 32.58 31.74 2h2s s HIS 207 CO 0.02 -0.82 1.82 -1.35 -2.47 0.00 0.00 174.74 171.94 2h2s h PRO 208 N 8.40 0.71 -0.24 2.88 0.11 -1.85 -2.16 132.00 139.86 2h2s h PRO 208 Ca -0.19 -0.04 0.02 0.00 0.11 0.00 0.00 66.00 65.89 2h2s h PRO 208 Cb 1.02 -0.16 -0.03 0.00 0.11 0.00 0.00 31.00 31.94 2h2s h PRO 208 CO 0.43 0.47 -0.14 0.00 -0.21 0.00 0.00 178.00 178.55 2h2s n ALA 209 N -2.32 -0.15 1.03 -0.75 0.00 -1.26 -0.18 120.51 116.88 2h2s n ALA 209 Ca 0.07 0.20 0.04 0.00 0.00 0.00 0.00 53.44 53.75 2h2s n ALA 209 Cb 0.12 0.24 0.12 0.00 0.00 0.00 0.00 19.45 19.93 2h2s n ALA 209 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2h2s n SER 210 N -3.45 1.60 -3.80 0.00 3.41 -1.19 -4.89 113.62 105.30 2h2s n SER 210 Ca 0.00 -2.06 -0.23 0.00 -0.26 0.00 0.00 58.87 56.32 2h2s n SER 210 Cb 0.06 -0.24 0.01 0.00 -0.26 0.00 0.00 64.21 63.78 2h2s n SER 210 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2h2s n SER 211 N 0.24 -0.97 -4.14 4.04 7.64 0.75 -4.90 113.62 116.28 2h2s n SER 211 Ca 0.09 -0.88 -0.34 0.00 1.01 0.00 0.00 58.87 58.74 2h2s n SER 211 Cb 0.28 -3.69 -0.14 0.00 -1.01 0.00 0.00 64.21 59.64 2h2s n SER 211 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2h2s s THR 212 N -3.76 2.63 -0.18 0.44 2.01 -0.84 -5.04 115.64 110.90 2h2s s THR 212 Ca 0.03 -1.38 -0.02 0.00 0.31 0.00 0.00 61.69 60.63 2h2s s THR 212 Cb -0.01 -2.47 -0.00 0.00 0.01 0.00 0.00 72.50 70.02 2h2s s THR 212 CO 0.84 0.01 -0.10 -0.54 -0.69 0.00 0.00 174.62 174.14 2h2s s LYS 213 N 1.21 3.29 -0.10 4.92 1.02 -1.26 -1.69 119.74 127.14 2h2s s LYS 213 Ca -0.05 -0.69 -0.04 0.00 0.02 0.00 0.00 55.97 55.21 2h2s s LYS 213 Cb -0.19 -2.80 0.05 0.00 -0.52 0.00 0.00 37.83 34.38 2h2s s LYS 213 CO -0.04 -0.08 0.21 0.08 -0.92 0.00 0.00 175.35 174.61 2h2s s VAL 214 N 1.09 -0.23 -0.86 3.17 1.01 -0.95 -5.05 120.40 118.59 2h2s s VAL 214 Ca 0.00 0.26 -0.04 0.00 0.00 0.00 0.00 61.98 62.20 2h2s s VAL 214 Cb -0.15 -0.35 0.22 0.00 0.00 0.00 0.00 36.38 36.10 2h2s s VAL 214 CO -0.03 0.11 0.75 -1.81 0.00 0.00 0.00 175.10 174.13 2h2s s ASP 215 N 1.93 6.09 0.08 3.32 1.01 -1.26 0.03 116.67 127.87 2h2s s ASP 215 Ca -0.02 -3.44 -0.31 0.00 0.71 0.00 0.00 52.55 49.49 2h2s s ASP 215 Cb -0.12 -1.96 -0.07 0.00 1.01 0.00 0.00 42.92 41.78 2h2s s ASP 215 CO -0.07 -0.27 1.35 -0.75 0.21 0.00 0.00 175.17 175.64 2h2s s LYS 216 N -0.94 4.34 -0.43 8.23 2.47 0.14 -4.69 119.74 128.85 2h2s s LYS 216 Ca 0.25 1.99 -0.14 0.00 -1.56 0.00 0.00 55.97 56.52 2h2s s LYS 216 Cb -0.11 -3.32 0.05 0.00 -1.46 0.00 0.00 37.83 32.99 2h2s s LYS 216 CO -0.10 -0.42 0.31 0.21 0.16 0.00 0.00 175.35 175.51 2h2s s LYS 217 N 1.32 2.90 0.24 4.03 2.20 -1.26 0.10 119.74 129.27 2h2s s LYS 217 Ca 0.63 -1.20 -0.31 0.00 -0.36 0.00 0.00 55.97 54.73 2h2s s LYS 217 Cb -0.34 -3.96 -0.12 0.00 -1.51 0.00 0.00 37.83 31.89 2h2s s LYS 217 CO 0.29 -0.86 1.61 -0.89 -0.36 0.00 0.00 175.35 175.14 2h2s n ILE 218 N 5.11 0.58 -3.89 5.43 2.08 -0.86 -4.97 119.36 122.84 2h2s n ILE 218 Ca -0.12 -0.15 -0.11 0.00 0.56 0.00 0.00 62.75 62.94 2h2s n ILE 218 Cb 0.45 -1.85 -0.12 0.00 -0.75 0.00 0.00 39.64 37.38 2h2s n ILE 218 CO 0.00 0.00 0.00 0.68 0.56 0.00 0.00 176.55 177.79 2h2s s VAL 219 N 0.45 0.05 -0.06 1.39 -7.23 -1.26 -4.52 120.40 109.23 2h2s s VAL 219 Ca 0.70 -0.45 -0.39 0.00 -1.81 0.00 0.00 61.98 60.03 2h2s s VAL 219 Cb -0.54 -0.24 -0.17 0.00 0.56 0.00 0.00 36.38 35.98 2h2s s VAL 219 CO 0.42 -0.25 1.39 -0.81 -0.31 0.00 0.00 175.10 175.55 2h2s n PRO 220 N 2.20 0.80 -1.87 4.82 -0.04 -1.26 -4.82 135.00 134.83 2h2s n PRO 220 Ca -0.18 0.29 -0.38 0.00 -0.04 0.00 0.00 63.50 63.19 2h2s n PRO 220 Cb 0.57 -1.90 0.03 0.00 -0.04 0.00 0.00 33.50 32.16 2h2s n PRO 220 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2h2s s ARG 221 N 1.26 3.25 0.00 0.54 0.52 -1.25 -5.09 118.95 118.18 2h2s s ARG 221 Ca 0.91 2.15 0.14 0.00 -0.52 0.00 0.00 55.73 58.40 2h2s s ARG 221 Cb -1.09 -2.28 0.82 0.00 0.52 0.00 0.00 34.95 32.91 2h2s s ARG 221 CO 0.56 -1.07 1.24 0.00 0.02 0.00 0.00 175.30 176.05