#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hfm s VAL 2 N 0.00 1.59 -0.05 5.18 1.01 -1.26 -3.74 120.40 123.13 3hfm s VAL 2 Ca 0.00 -0.70 -0.02 0.00 0.00 0.00 0.00 61.98 61.25 3hfm s VAL 2 Cb 0.00 -1.44 0.03 0.00 0.00 0.00 0.00 36.38 34.97 3hfm s VAL 2 CO 0.00 0.46 0.10 -1.58 0.00 0.00 0.00 175.10 174.08 3hfm s GLN 3 N 0.90 0.06 -0.16 2.72 0.74 -1.20 -4.98 119.66 117.74 3hfm s GLN 3 Ca -0.08 0.27 0.02 0.00 0.05 0.00 0.00 55.36 55.61 3hfm s GLN 3 Cb -0.15 -0.14 0.02 0.00 1.10 0.00 0.00 33.01 33.84 3hfm s GLN 3 CO -0.01 -0.13 -0.21 -0.51 -0.55 0.00 0.00 175.29 173.89 3hfm s LEU 4 N 0.86 2.13 -0.56 3.68 1.02 -1.26 -1.48 118.68 123.07 3hfm s LEU 4 Ca -0.07 -0.63 0.04 0.00 0.02 0.00 0.00 54.13 53.50 3hfm s LEU 4 Cb -0.09 -1.47 0.16 0.00 0.02 0.00 0.00 46.19 44.81 3hfm s LEU 4 CO -0.04 0.04 0.39 0.00 0.02 0.00 0.00 176.35 176.75 3hfm s GLN 5 N 1.07 1.76 0.19 1.70 -2.07 -0.88 -4.15 119.66 117.28 3hfm s GLN 5 Ca -0.01 -2.68 -0.31 0.00 -1.82 0.00 0.00 55.36 50.54 3hfm s GLN 5 Cb -0.14 -2.63 -0.16 0.00 -1.09 0.00 0.00 33.01 28.99 3hfm s GLN 5 CO -0.08 -1.28 0.99 -0.85 -1.32 0.00 0.00 175.29 172.75 3hfm n GLU 6 N 2.60 0.90 -4.10 9.60 0.28 -1.26 -3.88 120.64 124.78 3hfm n GLU 6 Ca 0.19 0.32 -0.08 0.00 -0.16 0.00 0.00 57.16 57.43 3hfm n GLU 6 Cb 0.38 -1.69 -0.10 0.00 1.43 0.00 0.00 31.44 31.47 3hfm n GLU 6 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 3hfm s SER 7 N -0.34 0.42 0.00 -1.84 0.15 0.36 -4.87 113.70 107.58 3hfm s SER 7 Ca 0.69 -1.06 0.00 0.00 0.70 0.00 0.00 55.95 56.28 3hfm s SER 7 Cb -0.86 0.23 0.00 0.00 -1.71 0.00 0.00 66.02 63.68 3hfm s SER 7 CO 0.55 -0.65 0.00 0.61 1.20 0.00 0.00 173.24 174.96 3hfm n GLY 8 N 0.04 -0.34 3.71 9.45 0.00 -1.26 0.25 105.19 117.03 3hfm n GLY 8 Ca -0.11 -1.47 -0.29 0.00 0.00 0.00 0.00 46.02 44.14 3hfm n GLY 8 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3hfm s PRO 9 N -2.00 0.04 -0.19 1.61 0.04 -1.26 -5.02 135.00 128.22 3hfm s PRO 9 Ca 0.00 0.12 0.07 0.00 0.04 0.00 0.00 61.00 61.23 3hfm s PRO 9 Cb 0.00 -1.73 -0.17 0.00 0.04 0.00 0.00 34.50 32.65 3hfm s PRO 9 CO 0.00 -2.91 -0.08 0.43 0.04 0.00 0.00 177.00 174.48 3hfm n SER 10 N -4.23 1.75 -3.62 6.66 7.64 -1.26 -4.76 113.62 115.80 3hfm n SER 10 Ca 0.10 -0.06 -0.15 0.00 1.01 0.00 0.00 58.87 59.77 3hfm n SER 10 Cb 0.59 0.22 -0.07 0.00 -1.01 0.00 0.00 64.21 63.94 3hfm n SER 10 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 3hfm s LEU 11 N -5.77 -0.60 0.08 -3.43 2.96 -1.26 -0.09 118.68 110.58 3hfm s LEU 11 Ca -0.19 1.23 0.02 0.00 -0.22 0.00 0.00 54.13 54.97 3hfm s LEU 11 Cb 0.06 2.36 -0.04 0.00 0.50 0.00 0.00 46.19 49.08 3hfm s LEU 11 CO 0.57 -0.31 -0.08 0.68 -1.32 0.00 0.00 176.35 175.89 3hfm s VAL 12 N 0.04 0.69 0.41 1.68 -7.23 -0.99 -5.01 120.40 110.00 3hfm s VAL 12 Ca -0.02 -1.60 -0.23 0.00 -1.81 0.00 0.00 61.98 58.32 3hfm s VAL 12 Cb -0.04 -1.27 -0.10 0.00 0.56 0.00 0.00 36.38 35.53 3hfm s VAL 12 CO 0.03 -0.66 1.00 -0.54 -0.31 0.00 0.00 175.10 174.62 3hfm s LYS 13 N -2.91 4.18 0.57 4.82 1.02 -1.26 -3.64 119.74 122.53 3hfm s LYS 13 Ca 0.04 1.32 -0.19 0.00 0.02 0.00 0.00 55.97 57.15 3hfm s LYS 13 Cb -0.01 -2.37 -0.06 0.00 -0.52 0.00 0.00 37.83 34.86 3hfm s LYS 13 CO -0.02 -0.09 0.84 -0.35 -0.92 0.00 0.00 175.35 174.81 3hfm n PRO 14 N -0.33 0.82 -2.14 -1.68 -0.04 -1.26 -1.53 135.00 128.84 3hfm n PRO 14 Ca 0.06 0.32 -0.17 0.00 -0.04 0.00 0.00 63.50 63.67 3hfm n PRO 14 Cb 0.52 -2.02 -0.03 0.00 -0.04 0.00 0.00 33.50 31.93 3hfm n PRO 14 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 3hfm n SER 15 N -0.28 -4.89 0.00 3.54 7.64 0.47 -4.90 113.62 115.20 3hfm n SER 15 Ca 0.13 0.18 0.00 0.00 1.01 0.00 0.00 58.87 60.19 3hfm n SER 15 Cb 0.46 -4.19 0.00 0.00 -1.01 0.00 0.00 64.21 59.48 3hfm n SER 15 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 3hfm n GLN 16 N -2.69 3.84 -3.78 1.43 -0.06 -0.58 -4.68 117.38 110.87 3hfm n GLN 16 Ca -0.19 0.00 -0.13 0.00 -2.00 0.00 0.00 57.00 54.68 3hfm n GLN 16 Cb 0.63 0.00 -0.13 0.00 -4.06 0.00 0.00 30.24 26.68 3hfm n GLN 16 CO 0.00 0.00 0.00 -0.08 -0.20 0.00 0.00 177.06 176.78 3hfm s THR 17 N 2.97 -0.02 -0.08 1.69 -1.32 -1.26 -2.06 115.64 115.56 3hfm s THR 17 Ca 0.00 0.08 0.01 0.00 -1.21 0.00 0.00 61.69 60.57 3hfm s THR 17 Cb 0.00 -0.25 -0.03 0.00 -1.51 0.00 0.00 72.50 70.72 3hfm s THR 17 CO 0.00 0.03 -0.11 -1.48 -2.21 0.00 0.00 174.62 170.86 3hfm s LEU 18 N 0.59 2.93 -0.08 9.08 2.34 0.12 -4.99 118.68 128.66 3hfm s LEU 18 Ca -0.04 -0.15 0.02 0.00 0.06 0.00 0.00 54.13 54.02 3hfm s LEU 18 Cb -0.06 -1.63 0.02 0.00 -0.56 0.00 0.00 46.19 43.96 3hfm s LEU 18 CO -0.03 0.31 -0.12 -0.44 -1.06 0.00 0.00 176.35 175.01 3hfm s SER 19 N -0.50 1.96 0.42 1.48 0.01 -1.26 -0.78 113.70 115.04 3hfm s SER 19 Ca 0.07 -0.32 0.04 0.00 1.31 0.00 0.00 55.95 57.05 3hfm s SER 19 Cb -0.12 -0.87 -0.04 0.00 0.21 0.00 0.00 66.02 65.20 3hfm s SER 19 CO 0.02 -0.00 0.05 -0.76 0.41 0.00 0.00 173.24 172.95 3hfm s LEU 20 N 0.94 2.32 0.12 2.44 1.02 -0.75 -4.28 118.68 120.49 3hfm s LEU 20 Ca -0.09 -1.54 -0.12 0.00 0.02 0.00 0.00 54.13 52.40 3hfm s LEU 20 Cb -0.15 -0.53 0.01 0.00 0.02 0.00 0.00 46.19 45.54 3hfm s LEU 20 CO 0.00 -0.73 0.29 0.28 0.02 0.00 0.00 176.35 176.21 3hfm s THR 21 N -3.02 0.10 -0.38 5.49 -1.32 0.14 -2.55 115.64 114.10 3hfm s THR 21 Ca 0.23 -0.99 0.02 0.00 -1.21 0.00 0.00 61.69 59.75 3hfm s THR 21 Cb 0.05 -1.37 0.16 0.00 -1.51 0.00 0.00 72.50 69.83 3hfm s THR 21 CO 0.12 -0.46 0.30 0.00 -2.21 0.00 0.00 174.62 172.37 3hfm s SER 23 N 0.71 6.53 -0.15 0.00 0.15 -1.25 -3.82 113.70 115.86 3hfm s SER 23 Ca 0.24 2.59 -0.04 0.00 0.70 0.00 0.00 55.95 59.44 3hfm s SER 23 Cb -0.10 -2.56 -0.03 0.00 -1.71 0.00 0.00 66.02 61.61 3hfm s SER 23 CO -0.08 -0.95 0.00 0.68 1.20 0.00 0.00 173.24 174.10 3hfm s VAL 24 N 2.88 4.25 0.38 4.45 -7.23 -1.26 -2.08 120.40 121.80 3hfm s VAL 24 Ca 0.78 -0.24 0.04 0.00 -1.81 0.00 0.00 61.98 60.75 3hfm s VAL 24 Cb -0.42 -2.86 -0.05 0.00 0.56 0.00 0.00 36.38 33.61 3hfm s VAL 24 CO 0.34 0.50 0.07 0.42 -0.31 0.00 0.00 175.10 176.13 3hfm s THR 25 N 0.13 1.05 0.00 5.32 -4.23 -0.55 -4.67 115.64 112.69 3hfm s THR 25 Ca 0.01 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.52 3hfm s THR 25 Cb -0.13 -2.59 0.00 0.00 1.34 0.00 0.00 72.50 71.12 3hfm s THR 25 CO 0.02 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.71 3hfm n GLY 26 N -0.85 1.39 3.74 3.99 0.00 -1.26 -3.22 105.19 108.98 3hfm n GLY 26 Ca -0.06 0.24 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 3hfm n GLY 26 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hfm s ASP 27 N -4.00 4.06 0.84 1.61 3.68 -1.25 -5.01 116.67 116.60 3hfm s ASP 27 Ca 0.00 2.00 -0.11 0.00 2.13 0.00 0.00 52.55 56.57 3hfm s ASP 27 Cb 0.00 -2.54 0.10 0.00 -1.45 0.00 0.00 42.92 39.02 3hfm s ASP 27 CO 0.00 -2.34 1.09 -0.94 0.13 0.00 0.00 175.17 173.11 3hfm s SER 28 N -2.96 3.94 0.00 -0.34 1.04 -1.26 -4.99 113.70 109.12 3hfm s SER 28 Ca 0.65 1.56 0.00 0.00 0.48 0.00 0.00 55.95 58.63 3hfm s SER 28 Cb -0.20 -2.26 0.00 0.00 0.10 0.00 0.00 66.02 63.66 3hfm s SER 28 CO 0.54 -2.35 0.00 2.30 0.98 0.00 0.00 173.24 174.71 3hfm n ILE 29 N -3.70 0.00 0.00 -1.02 -5.35 -1.26 -4.84 119.36 103.18 3hfm n ILE 29 Ca 0.08 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.56 3hfm n ILE 29 Cb 0.55 0.10 0.00 0.00 -1.74 0.00 0.00 39.64 38.55 3hfm n ILE 29 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 3hfm n THR 30 N -1.10 0.00 0.00 7.28 -2.24 -1.26 -2.52 114.28 114.44 3hfm n THR 30 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 3hfm n THR 30 Cb 0.08 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.31 3hfm n THR 30 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3hfm n SER 31 N -1.41 0.00 -4.41 3.42 7.64 -1.26 -4.89 113.62 112.71 3hfm n SER 31 Ca 0.00 0.00 -0.49 0.00 1.01 0.00 0.00 58.87 59.39 3hfm n SER 31 Cb 0.00 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 3hfm n SER 31 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 3hfm n ASP 32 N -0.19 -1.14 -4.67 6.43 2.03 -1.05 -3.07 116.55 114.88 3hfm n ASP 32 Ca 0.00 1.13 -0.43 0.00 0.52 0.00 0.00 54.79 56.02 3hfm n ASP 32 Cb 0.00 -0.95 -0.02 0.00 -0.72 0.00 0.00 41.12 39.42 3hfm n ASP 32 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 3hfm s TYR 33 N -0.94 3.20 0.40 -0.67 1.51 -1.26 -4.67 117.35 114.92 3hfm s TYR 33 Ca 0.66 1.30 0.08 0.00 -1.01 0.00 0.00 57.07 58.09 3hfm s TYR 33 Cb -0.95 -3.36 -0.03 0.00 -0.11 0.00 0.00 41.96 37.51 3hfm s TYR 33 CO 0.56 -0.99 0.32 -1.58 -1.11 0.00 0.00 175.55 172.75 3hfm s TRP 34 N 2.77 2.71 0.35 2.71 0.52 0.37 0.71 118.94 129.08 3hfm s TRP 34 Ca 0.51 -0.48 -0.06 0.00 0.02 0.00 0.00 56.10 56.09 3hfm s TRP 34 Cb -0.20 -2.05 0.01 0.00 -1.15 0.00 0.00 33.47 30.08 3hfm s TRP 34 CO 0.15 0.00 0.55 -1.12 0.02 0.00 0.00 176.95 176.55 3hfm s SER 35 N -4.05 0.65 -0.05 2.95 0.01 -0.96 -0.60 113.70 111.65 3hfm s SER 35 Ca 0.45 -1.37 0.00 0.00 1.31 0.00 0.00 55.95 56.34 3hfm s SER 35 Cb -0.02 0.70 0.02 0.00 0.21 0.00 0.00 66.02 66.93 3hfm s SER 35 CO 0.26 -1.38 -0.02 0.26 0.41 0.00 0.00 173.24 172.77 3hfm s TRP 36 N -2.95 0.63 -0.02 2.43 0.52 -1.18 -1.26 118.94 117.11 3hfm s TRP 36 Ca 0.27 -0.15 0.02 0.00 0.02 0.00 0.00 56.10 56.26 3hfm s TRP 36 Cb -0.02 -0.63 0.00 0.00 -1.15 0.00 0.00 33.47 31.68 3hfm s TRP 36 CO 0.18 -0.20 -0.08 0.42 0.02 0.00 0.00 176.95 177.28 3hfm s ILE 37 N 1.15 0.67 -0.01 2.03 1.01 0.49 0.61 121.20 127.15 3hfm s ILE 37 Ca -0.08 -0.31 0.05 0.00 0.00 0.00 0.00 60.65 60.32 3hfm s ILE 37 Cb -0.14 -0.60 -0.03 0.00 0.01 0.00 0.00 42.46 41.71 3hfm s ILE 37 CO -0.01 0.21 -0.16 -0.13 0.00 0.00 0.00 174.94 174.85 3hfm s ARG 38 N 0.16 2.31 -0.20 2.79 0.52 0.16 0.79 118.95 125.48 3hfm s ARG 38 Ca -0.02 -0.82 -0.02 0.00 -0.52 0.00 0.00 55.73 54.35 3hfm s ARG 38 Cb -0.07 -2.29 0.01 0.00 0.52 0.00 0.00 34.95 33.12 3hfm s ARG 38 CO 0.00 0.59 -0.11 0.21 0.02 0.00 0.00 175.30 176.00 3hfm s LYS 39 N -1.03 3.18 0.49 3.54 2.20 0.77 0.23 119.74 129.13 3hfm s LYS 39 Ca 0.13 -0.73 -0.02 0.00 -0.36 0.00 0.00 55.97 54.99 3hfm s LYS 39 Cb -0.11 -2.82 -0.00 0.00 -1.51 0.00 0.00 37.83 33.39 3hfm s LYS 39 CO 0.03 -0.21 0.75 -0.06 -0.36 0.00 0.00 175.35 175.49 3hfm s PHE 40 N 1.39 3.27 0.40 4.03 0.08 -0.89 -0.74 117.98 125.52 3hfm s PHE 40 Ca 0.05 0.42 0.20 0.00 0.12 0.00 0.00 56.93 57.72 3hfm s PHE 40 Cb -0.14 -2.42 1.16 0.00 -0.57 0.00 0.00 43.02 41.05 3hfm s PHE 40 CO -0.08 -0.47 1.72 -1.00 -0.10 0.00 0.00 175.22 175.30 3hfm h PRO 41 N 0.22 0.32 -0.85 0.24 0.13 -1.88 0.11 132.00 130.28 3hfm h PRO 41 Ca -0.46 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 3hfm h PRO 41 Cb 1.25 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.31 3hfm h PRO 41 CO 0.59 0.21 0.00 0.41 -0.23 0.00 0.00 178.00 178.98 3hfm n GLY 42 N -1.46 1.17 2.40 1.56 0.00 -1.26 -4.82 105.19 102.78 3hfm n GLY 42 Ca 0.29 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.13 3hfm n GLY 42 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3hfm n ASN 43 N -0.03 -4.98 -4.48 1.61 6.94 0.36 -4.96 115.26 109.72 3hfm n ASN 43 Ca 0.00 0.28 -0.34 0.00 -0.02 0.00 0.00 54.58 54.50 3hfm n ASN 43 Cb 0.21 -4.33 -0.12 0.00 -2.36 0.00 0.00 39.78 33.18 3hfm n ASN 43 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3hfm s ARG 44 N -4.17 3.64 0.41 -3.83 1.70 -1.21 -4.89 118.95 110.59 3hfm s ARG 44 Ca 0.00 -0.53 -0.22 0.00 -0.47 0.00 0.00 55.73 54.50 3hfm s ARG 44 Cb 0.00 -2.93 -0.10 0.00 -0.57 0.00 0.00 34.95 31.35 3hfm s ARG 44 CO 0.00 0.19 0.97 -0.51 -1.08 0.00 0.00 175.30 174.87 3hfm s LEU 45 N 0.50 4.05 -0.06 -1.89 1.43 -1.26 -2.09 118.68 119.35 3hfm s LEU 45 Ca -0.03 1.78 -0.02 0.00 -1.03 0.00 0.00 54.13 54.82 3hfm s LEU 45 Cb -0.14 -4.38 0.04 0.00 0.03 0.00 0.00 46.19 41.73 3hfm s LEU 45 CO 0.03 -0.34 0.13 -0.70 0.23 0.00 0.00 176.35 175.70 3hfm s GLU 46 N -2.84 0.08 0.18 1.70 2.12 0.14 -4.98 118.70 115.09 3hfm s GLU 46 Ca 0.59 0.35 -0.28 0.00 0.36 0.00 0.00 54.97 55.99 3hfm s GLU 46 Cb -0.13 -0.19 -0.08 0.00 0.26 0.00 0.00 34.13 33.99 3hfm s GLU 46 CO 0.18 -0.16 0.87 -0.47 -0.54 0.00 0.00 175.26 175.14 3hfm s TYR 47 N 1.15 3.91 0.00 5.30 5.04 -1.26 0.39 117.35 131.87 3hfm s TYR 47 Ca -0.09 1.77 0.00 0.00 -2.44 0.00 0.00 57.07 56.31 3hfm s TYR 47 Cb -0.12 -2.91 0.00 0.00 0.35 0.00 0.00 41.96 39.28 3hfm s TYR 47 CO -0.06 0.42 0.00 -1.33 -1.34 0.00 0.00 175.55 173.24 3hfm n MET 48 N 1.87 0.00 0.00 4.97 2.81 0.20 -4.69 117.12 122.28 3hfm n MET 48 Ca -0.02 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.87 3hfm n MET 48 Cb 0.48 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.99 3hfm n MET 48 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3hfm n GLY 49 N 3.46 4.52 3.83 3.03 0.00 -1.23 -1.84 105.19 116.95 3hfm n GLY 49 Ca 0.00 -0.89 -0.08 0.00 0.00 0.00 0.00 46.02 45.06 3hfm n GLY 49 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3hfm s TYR 50 N -0.11 0.02 -0.23 1.61 -0.85 -0.65 -3.09 117.35 114.05 3hfm s TYR 50 Ca 0.00 -0.60 -0.01 0.00 -0.52 0.00 0.00 57.07 55.94 3hfm s TYR 50 Cb 0.00 0.79 0.07 0.00 0.38 0.00 0.00 41.96 43.19 3hfm s TYR 50 CO 0.00 -1.40 0.02 0.08 -1.52 0.00 0.00 175.55 172.73 3hfm s VAL 51 N -2.77 0.96 0.13 -3.49 1.01 0.23 -3.09 120.40 113.38 3hfm s VAL 51 Ca 0.15 -0.96 -0.01 0.00 0.00 0.00 0.00 61.98 61.16 3hfm s VAL 51 Cb -0.05 -1.43 -0.04 0.00 0.00 0.00 0.00 36.38 34.86 3hfm s VAL 51 CO 0.09 -0.26 0.31 -0.94 0.00 0.00 0.00 175.10 174.30 3hfm s SER 52 N 1.64 6.39 0.18 3.32 1.04 -0.90 -0.48 113.70 124.89 3hfm s SER 52 Ca -0.01 0.35 -0.31 0.00 0.48 0.00 0.00 55.95 56.47 3hfm s SER 52 Cb -0.18 -1.99 -0.17 0.00 0.10 0.00 0.00 66.02 63.79 3hfm s SER 52 CO -0.10 0.06 0.80 0.00 0.98 0.00 0.00 173.24 174.99 3hfm n TYR 53 N -0.18 0.31 0.00 5.02 4.11 -1.18 -2.26 117.16 122.99 3hfm n TYR 53 Ca -0.05 0.88 0.00 0.00 -0.00 0.00 0.00 57.90 58.74 3hfm n TYR 53 Cb 0.52 -2.09 0.00 0.00 -0.00 0.00 0.00 39.34 37.78 3hfm n TYR 53 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.86 177.31 3hfm n SER 54 N 1.78 0.00 0.00 9.48 2.88 -1.26 -4.33 113.62 122.17 3hfm n SER 54 Ca 0.16 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.70 3hfm n SER 54 Cb 0.24 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.70 3hfm n SER 54 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3hfm n GLY 55 N 0.00 0.37 3.71 0.46 0.00 -0.96 -5.12 105.19 103.66 3hfm n GLY 55 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 3hfm n GLY 55 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3hfm s SER 56 N -0.41 7.18 0.08 1.61 0.15 -1.19 -4.97 113.70 116.16 3hfm s SER 56 Ca 0.00 1.43 0.06 0.00 0.70 0.00 0.00 55.95 58.14 3hfm s SER 56 Cb 0.00 -2.50 -0.03 0.00 -1.71 0.00 0.00 66.02 61.78 3hfm s SER 56 CO 0.00 -0.22 -0.15 0.42 1.20 0.00 0.00 173.24 174.49 3hfm s THR 57 N 1.05 1.23 0.03 6.45 -4.23 -1.26 -2.11 115.64 116.79 3hfm s THR 57 Ca 0.45 -1.37 0.02 0.00 -1.18 0.00 0.00 61.69 59.61 3hfm s THR 57 Cb -0.19 -1.19 -0.02 0.00 1.34 0.00 0.00 72.50 72.45 3hfm s THR 57 CO 0.23 -0.21 -0.07 -0.31 -0.54 0.00 0.00 174.62 173.72 3hfm s TYR 58 N -1.31 0.61 -0.15 3.99 1.51 -1.18 -5.00 117.35 115.82 3hfm s TYR 58 Ca 0.00 -0.35 -0.08 0.00 -1.01 0.00 0.00 57.07 55.63 3hfm s TYR 58 Cb -0.10 -0.37 0.06 0.00 -0.11 0.00 0.00 41.96 41.44 3hfm s TYR 58 CO 0.03 -0.05 0.37 0.71 -1.11 0.00 0.00 175.55 175.49 3hfm s TYR 59 N -0.92 -0.54 -0.34 2.71 2.02 -1.26 -1.63 117.35 117.39 3hfm s TYR 59 Ca -0.05 1.17 -0.39 0.00 -0.37 0.00 0.00 57.07 57.42 3hfm s TYR 59 Cb -0.07 0.21 -0.15 0.00 -0.40 0.00 0.00 41.96 41.56 3hfm s TYR 59 CO 0.00 -0.32 1.96 -1.71 -1.57 0.00 0.00 175.55 173.91 3hfm n ASN 60 N 4.26 2.05 -0.33 2.29 2.85 -0.77 -4.82 115.26 120.79 3hfm n ASN 60 Ca -0.24 0.79 0.15 0.00 -0.11 0.00 0.00 54.58 55.17 3hfm n ASN 60 Cb 0.55 -1.14 0.36 0.00 1.24 0.00 0.00 39.78 40.79 3hfm n ASN 60 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3hfm h PRO 61 N 9.22 0.67 -1.00 1.20 0.11 -1.90 0.14 132.00 140.44 3hfm h PRO 61 Ca -0.34 -0.04 0.15 0.00 0.11 0.00 0.00 66.00 65.87 3hfm h PRO 61 Cb 1.33 -0.15 -0.16 0.00 0.11 0.00 0.00 31.00 32.14 3hfm h PRO 61 CO 1.00 0.44 -0.41 0.77 -0.21 0.00 0.00 178.00 179.60 3hfm h SER 62 N 0.69 -1.50 -0.81 -2.05 0.02 -1.97 -2.40 113.55 105.52 3hfm h SER 62 Ca 0.56 0.31 -0.48 0.00 -0.84 0.00 0.00 61.79 61.35 3hfm h SER 62 Cb 0.98 0.78 -0.07 0.00 0.14 0.00 0.00 62.40 64.22 3hfm h SER 62 CO -0.34 -0.28 1.36 -0.76 -1.14 0.00 0.00 176.83 175.66 3hfm s LEU 63 N -10.91 3.39 0.00 5.07 1.43 0.48 -4.96 118.68 113.19 3hfm s LEU 63 Ca -0.14 -1.50 0.00 0.00 -1.03 0.00 0.00 54.13 51.46 3hfm s LEU 63 Cb 0.20 -2.57 0.00 0.00 0.03 0.00 0.00 46.19 43.84 3hfm s LEU 63 CO 0.71 -2.10 0.00 0.29 0.23 0.00 0.00 176.35 175.47 3hfm n LYS 64 N 8.65 0.00 -0.88 1.70 4.01 -0.91 -4.41 118.16 126.32 3hfm n LYS 64 Ca 0.41 0.00 0.01 0.00 -0.51 0.00 0.00 58.31 58.22 3hfm n LYS 64 Cb 0.48 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.00 3hfm n LYS 64 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 3hfm n SER 65 N 0.00 0.30 0.24 4.39 2.88 -1.26 -4.78 113.62 115.39 3hfm n SER 65 Ca 0.00 -1.93 0.15 0.00 -1.33 0.00 0.00 58.87 55.76 3hfm n SER 65 Cb 0.00 -0.20 0.49 0.00 -0.75 0.00 0.00 64.21 63.75 3hfm n SER 65 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 3hfm h ARG 66 N 0.35 0.00 -7.36 -1.46 3.08 -1.87 -3.45 114.38 103.66 3hfm h ARG 66 Ca -0.11 0.00 -0.46 0.00 0.07 0.00 0.00 59.98 59.48 3hfm h ARG 66 Cb 1.55 0.00 0.11 0.00 0.08 0.00 0.00 29.97 31.70 3hfm h ARG 66 CO 0.02 0.00 0.23 -1.50 -1.07 0.00 0.00 179.97 177.65 3hfm s ILE 67 N -3.46 2.14 0.00 2.04 2.07 -1.26 0.71 121.20 123.43 3hfm s ILE 67 Ca 0.04 -0.35 0.00 0.00 -1.41 0.00 0.00 60.65 58.93 3hfm s ILE 67 Cb 0.08 -2.79 0.00 0.00 0.13 0.00 0.00 42.46 39.88 3hfm s ILE 67 CO 0.58 0.00 0.00 -0.24 -1.91 0.00 0.00 174.94 173.37 3hfm n SER 68 N -3.13 0.00 -4.82 4.50 2.88 -1.24 -4.90 113.62 106.90 3hfm n SER 68 Ca 0.13 0.00 -0.33 0.00 -1.33 0.00 0.00 58.87 57.35 3hfm n SER 68 Cb 0.60 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 64.04 3hfm n SER 68 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 3hfm s ILE 69 N 0.00 4.25 0.09 2.46 1.01 -1.26 -3.43 121.20 124.32 3hfm s ILE 69 Ca 0.00 1.13 -0.26 0.00 0.00 0.00 0.00 60.65 61.52 3hfm s ILE 69 Cb 0.00 -3.59 0.08 0.00 0.01 0.00 0.00 42.46 38.96 3hfm s ILE 69 CO 0.00 -0.56 0.84 0.28 0.00 0.00 0.00 174.94 175.49 3hfm s THR 70 N -2.48 0.00 0.16 2.92 -1.32 -1.09 -5.01 115.64 108.82 3hfm s THR 70 Ca 0.61 -0.25 0.01 0.00 -1.21 0.00 0.00 61.69 60.85 3hfm s THR 70 Cb -0.12 -1.33 -0.04 0.00 -1.51 0.00 0.00 72.50 69.49 3hfm s THR 70 CO 0.30 0.00 0.02 0.00 -2.21 0.00 0.00 174.62 172.73 3hfm s ARG 71 N -3.35 1.04 -0.31 7.08 1.70 -1.26 -0.62 118.95 123.23 3hfm s ARG 71 Ca 0.07 -1.50 -0.02 0.00 -0.47 0.00 0.00 55.73 53.81 3hfm s ARG 71 Cb -0.01 -0.08 0.11 0.00 -0.57 0.00 0.00 34.95 34.39 3hfm s ARG 71 CO -0.06 -0.18 0.13 0.34 -1.08 0.00 0.00 175.30 174.45 3hfm s ASP 72 N -3.13 3.72 0.25 -2.89 -1.08 0.20 -4.96 116.67 108.78 3hfm s ASP 72 Ca 0.24 -1.60 0.00 0.00 -0.52 0.00 0.00 52.55 50.67 3hfm s ASP 72 Cb 0.07 -0.62 0.32 0.00 -1.46 0.00 0.00 42.92 41.22 3hfm s ASP 72 CO 0.03 -0.41 1.67 0.74 0.52 0.00 0.00 175.17 177.72 3hfm h THR 73 N 6.26 1.28 -0.15 1.71 2.02 -1.90 -0.05 112.91 122.09 3hfm h THR 73 Ca -0.14 -1.36 -0.04 0.00 0.77 0.00 0.00 66.41 65.64 3hfm h THR 73 Cb 1.00 1.38 -0.00 0.00 -1.74 0.00 0.00 68.15 68.79 3hfm h THR 73 CO 0.44 0.44 -0.08 0.28 0.37 0.00 0.00 175.52 176.97 3hfm h SER 74 N 0.48 0.32 -0.27 4.18 0.02 -1.96 -2.49 113.55 113.84 3hfm h SER 74 Ca 0.06 -0.42 -0.06 0.00 -0.84 0.00 0.00 61.79 60.53 3hfm h SER 74 Cb 0.74 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 63.16 3hfm h SER 74 CO 0.06 0.67 0.07 0.29 -1.14 0.00 0.00 176.83 176.78 3hfm n LYS 75 N -4.64 2.24 0.00 3.45 4.76 -1.17 -4.90 118.16 117.90 3hfm n LYS 75 Ca -0.06 -1.23 0.00 0.00 -2.87 0.00 0.00 58.31 54.16 3hfm n LYS 75 Cb 0.30 -1.71 0.00 0.00 -1.84 0.00 0.00 35.03 31.78 3hfm n LYS 75 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 3hfm n ASN 76 N 0.13 0.00 -4.83 4.39 3.02 -0.26 -4.84 115.26 112.88 3hfm n ASN 76 Ca 0.15 0.00 -0.22 0.00 -0.03 0.00 0.00 54.58 54.48 3hfm n ASN 76 Cb 0.72 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.85 3hfm n ASN 76 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hfm s GLN 77 N 0.00 2.52 0.06 3.52 -2.07 -0.19 -4.08 119.66 119.42 3hfm s GLN 77 Ca 0.00 -1.52 0.03 0.00 -1.82 0.00 0.00 55.36 52.06 3hfm s GLN 77 Cb 0.00 -2.32 -0.03 0.00 -1.09 0.00 0.00 33.01 29.57 3hfm s GLN 77 CO 0.00 -0.07 -0.10 1.52 -1.32 0.00 0.00 175.29 175.32 3hfm s TYR 78 N -2.44 0.90 0.49 9.60 -0.85 -1.25 0.62 117.35 124.42 3hfm s TYR 78 Ca 0.44 -0.53 0.03 0.00 -0.52 0.00 0.00 57.07 56.49 3hfm s TYR 78 Cb -0.03 -0.52 -0.02 0.00 0.38 0.00 0.00 41.96 41.78 3hfm s TYR 78 CO 0.26 -0.03 0.06 0.71 -1.52 0.00 0.00 175.55 175.03 3hfm s TYR 79 N -1.58 1.98 -0.00 -3.49 2.02 0.21 -1.41 117.35 115.08 3hfm s TYR 79 Ca -0.05 -0.88 0.01 0.00 -0.37 0.00 0.00 57.07 55.78 3hfm s TYR 79 Cb -0.08 -1.69 -0.00 0.00 -0.40 0.00 0.00 41.96 39.78 3hfm s TYR 79 CO 0.01 0.18 -0.02 -1.17 -1.57 0.00 0.00 175.55 172.98 3hfm s LEU 80 N -3.90 1.97 -0.41 -1.29 2.96 -1.06 -2.69 118.68 114.26 3hfm s LEU 80 Ca 0.16 -0.04 0.04 0.00 -0.22 0.00 0.00 54.13 54.06 3hfm s LEU 80 Cb 0.03 -0.12 0.17 0.00 0.50 0.00 0.00 46.19 46.76 3hfm s LEU 80 CO 0.09 0.02 0.37 -0.62 -1.32 0.00 0.00 176.35 174.88 3hfm s ASP 81 N -0.01 1.31 -0.41 3.68 2.15 -1.22 -1.80 116.67 120.37 3hfm s ASP 81 Ca 0.00 -2.64 -0.28 0.00 0.43 0.00 0.00 52.55 50.07 3hfm s ASP 81 Cb -0.01 -0.07 0.02 0.00 -0.30 0.00 0.00 42.92 42.56 3hfm s ASP 81 CO -0.00 -0.19 1.04 -0.22 -0.17 0.00 0.00 175.17 175.63 3hfm s LEU 82 N 0.45 3.85 0.74 -1.34 2.96 0.04 -3.69 118.68 121.69 3hfm s LEU 82 Ca 0.29 0.59 -0.09 0.00 -0.22 0.00 0.00 54.13 54.69 3hfm s LEU 82 Cb -0.03 -3.42 0.06 0.00 0.50 0.00 0.00 46.19 43.30 3hfm s LEU 82 CO -0.13 -1.03 1.08 0.20 -1.32 0.00 0.00 176.35 175.15 3hfm s ASN 83 N 2.09 4.78 -0.40 3.68 0.01 0.22 0.13 114.94 125.45 3hfm s ASN 83 Ca 0.43 0.64 -0.08 0.00 -0.71 0.00 0.00 52.86 53.14 3hfm s ASN 83 Cb -0.10 -1.26 0.01 0.00 0.41 0.00 0.00 41.25 40.31 3hfm s ASN 83 CO 0.24 -1.67 0.36 -0.24 -1.51 0.00 0.00 177.10 174.28 3hfm n SER 84 N -3.06 -2.89 -4.75 -1.22 2.88 -0.99 -4.81 113.62 98.78 3hfm n SER 84 Ca 0.08 -0.39 -0.29 0.00 -1.33 0.00 0.00 58.87 56.93 3hfm n SER 84 Cb 0.60 -0.91 0.14 0.00 -0.75 0.00 0.00 64.21 63.29 3hfm n SER 84 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 3hfm s VAL 85 N -1.93 2.22 0.23 2.46 -7.23 -0.87 -4.78 120.40 110.50 3hfm s VAL 85 Ca 0.08 0.07 -0.22 0.00 -1.81 0.00 0.00 61.98 60.10 3hfm s VAL 85 Cb -0.01 -2.71 0.05 0.00 0.56 0.00 0.00 36.38 34.27 3hfm s VAL 85 CO 0.51 -0.09 0.89 0.28 -0.31 0.00 0.00 175.10 176.38 3hfm s THR 86 N -3.13 0.00 0.05 5.32 -1.32 -1.26 -0.40 115.64 114.90 3hfm s THR 86 Ca 0.64 -0.79 -0.16 0.00 -1.21 0.00 0.00 61.69 60.18 3hfm s THR 86 Cb -0.16 -2.33 -0.06 0.00 -1.51 0.00 0.00 72.50 68.44 3hfm s THR 86 CO 0.55 0.00 1.26 0.74 -2.21 0.00 0.00 174.62 174.96 3hfm h THR 87 N 2.00 0.00 -1.43 5.08 2.02 -1.99 -2.07 112.91 116.53 3hfm h THR 87 Ca -0.25 0.00 0.46 0.00 0.77 0.00 0.00 66.41 67.39 3hfm h THR 87 Cb 1.24 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 67.53 3hfm h THR 87 CO 0.30 0.00 0.95 -0.33 0.37 0.00 0.00 175.52 176.80 3hfm h GLU 88 N -0.27 0.06 0.00 6.66 4.39 -1.98 0.79 114.58 124.22 3hfm h GLU 88 Ca 0.01 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.71 3hfm h GLU 88 Cb 0.32 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.96 3hfm h GLU 88 CO -0.20 0.04 0.00 -0.25 -1.16 0.00 0.00 179.01 177.44 3hfm n ASP 89 N -4.56 0.00 -4.60 1.42 10.43 -0.78 -4.53 116.55 113.95 3hfm n ASP 89 Ca 0.38 -0.09 -0.43 0.00 2.57 0.00 0.00 54.79 57.22 3hfm n ASP 89 Cb 1.53 0.00 -0.03 0.00 1.84 0.00 0.00 41.12 44.46 3hfm n ASP 89 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 3hfm s THR 90 N -2.00 4.33 0.00 -3.53 -4.23 0.27 -4.86 115.64 105.63 3hfm s THR 90 Ca 0.04 1.15 0.00 0.00 -1.18 0.00 0.00 61.69 61.70 3hfm s THR 90 Cb 0.02 -4.52 0.00 0.00 1.34 0.00 0.00 72.50 69.34 3hfm s THR 90 CO 0.03 -0.88 0.00 0.00 -0.54 0.00 0.00 174.62 173.23 3hfm n ALA 91 N 7.49 0.00 -3.94 3.99 0.00 -1.12 -4.50 120.51 122.44 3hfm n ALA 91 Ca 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.21 3hfm n ALA 91 Cb 0.49 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.78 3hfm n ALA 91 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3hfm s THR 92 N -2.49 2.43 -0.05 0.00 -1.32 0.08 -1.86 115.64 112.44 3hfm s THR 92 Ca 0.00 -0.96 -0.20 0.00 -1.21 0.00 0.00 61.69 59.32 3hfm s THR 92 Cb 0.00 -2.13 -0.05 0.00 -1.51 0.00 0.00 72.50 68.82 3hfm s THR 92 CO 0.00 0.39 0.57 -0.31 -2.21 0.00 0.00 174.62 173.06 3hfm s TYR 93 N 1.31 3.62 0.22 9.09 1.51 -1.12 -0.16 117.35 131.81 3hfm s TYR 93 Ca 0.03 1.11 0.06 0.00 -1.01 0.00 0.00 57.07 57.25 3hfm s TYR 93 Cb -0.15 -2.60 -0.05 0.00 -0.11 0.00 0.00 41.96 39.05 3hfm s TYR 93 CO -0.09 0.28 -0.08 0.71 -1.11 0.00 0.00 175.55 175.26 3hfm s TYR 94 N 0.13 1.63 -0.03 2.71 1.51 0.24 -2.65 117.35 120.88 3hfm s TYR 94 Ca 0.30 -0.73 0.06 0.00 -1.01 0.00 0.00 57.07 55.69 3hfm s TYR 94 Cb -0.17 -0.86 -0.01 0.00 -0.11 0.00 0.00 41.96 40.81 3hfm s TYR 94 CO 0.15 0.18 -0.22 0.00 -1.11 0.00 0.00 175.55 174.55 3hfm n ALA 96 N 2.75 0.00 -3.68 0.00 0.00 -0.39 -3.84 120.51 115.34 3hfm n ALA 96 Ca -0.16 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.11 3hfm n ALA 96 Cb 0.52 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.82 3hfm n ALA 96 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3hfm s ASN 97 N 1.00 0.62 0.00 0.00 4.22 -1.26 -2.28 114.94 117.24 3hfm s ASN 97 Ca 0.00 0.32 0.00 0.00 -2.14 0.00 0.00 52.86 51.04 3hfm s ASN 97 Cb 0.00 0.24 0.00 0.00 1.28 0.00 0.00 41.25 42.77 3hfm s ASN 97 CO 0.00 -0.23 0.00 1.87 -2.04 0.00 0.00 177.10 176.70 3hfm n TRP 98 N 5.13 0.00 0.00 1.54 -0.00 0.22 -1.87 117.44 122.46 3hfm n TRP 98 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.42 3hfm n TRP 98 Cb 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.81 3hfm n TRP 98 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 177.69 177.44 3hfm n ASP 99 N 0.69 0.00 0.00 5.87 10.43 -1.26 -4.95 116.55 127.33 3hfm n ASP 99 Ca 0.00 0.21 0.00 0.00 2.57 0.00 0.00 54.79 57.57 3hfm n ASP 99 Cb 0.00 0.00 0.00 0.00 1.84 0.00 0.00 41.12 42.96 3hfm n ASP 99 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3hfm n GLY 100 N 1.20 0.00 0.31 0.44 0.00 -0.78 -5.00 105.19 101.36 3hfm n GLY 100 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 3hfm n GLY 100 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 3hfm h ASP 101 N 0.00 0.76 -3.99 1.61 1.82 -1.93 -3.43 116.42 111.26 3hfm h ASP 101 Ca 0.00 0.03 -0.48 0.00 -0.39 0.00 0.00 57.03 56.19 3hfm h ASP 101 Cb 0.00 -0.12 -0.19 0.00 0.68 0.00 0.00 39.33 39.69 3hfm h ASP 101 CO 0.00 0.46 -0.78 -0.31 -1.61 0.00 0.00 179.24 177.00 3hfm s TYR 102 N -6.05 1.58 0.00 0.28 4.12 -1.26 -5.11 117.35 110.91 3hfm s TYR 102 Ca -0.13 -0.49 0.00 0.00 0.02 0.00 0.00 57.07 56.48 3hfm s TYR 102 Cb 0.19 -0.83 0.00 0.00 -1.52 0.00 0.00 41.96 39.79 3hfm s TYR 102 CO 0.78 0.20 0.00 0.91 0.02 0.00 0.00 175.55 177.46 3hfm n TRP 103 N 0.68 -0.10 -3.96 2.71 7.02 -1.26 -4.06 117.44 118.46 3hfm n TRP 103 Ca -0.16 0.00 -0.08 0.00 -1.02 0.00 0.00 57.50 56.23 3hfm n TRP 103 Cb 0.56 0.00 -0.08 0.00 -2.42 0.00 0.00 31.31 29.37 3hfm n TRP 103 CO 0.00 0.00 0.00 0.20 -2.02 0.00 0.00 177.69 175.87 3hfm s GLY 104 N -0.38 0.30 0.30 6.99 0.00 -1.25 -4.25 107.32 109.03 3hfm s GLY 104 Ca 0.00 -0.89 0.05 0.00 0.00 0.00 0.00 44.72 43.88 3hfm s GLY 104 CO 0.00 -1.02 1.64 1.46 0.00 0.00 0.00 173.10 175.18 3hfm h GLN 105 N 2.89 0.21 0.00 2.90 4.20 -1.95 -3.46 115.11 119.89 3hfm h GLN 105 Ca -0.34 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.36 3hfm h GLN 105 Cb 1.18 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.91 3hfm h GLN 105 CO 0.59 0.14 0.00 0.41 -0.67 0.00 0.00 178.83 179.30 3hfm n GLY 106 N -1.36 2.49 3.06 3.46 0.00 -1.26 -5.06 105.19 106.51 3hfm n GLY 106 Ca 0.24 -1.92 -0.13 0.00 0.00 0.00 0.00 46.02 44.21 3hfm n GLY 106 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3hfm s THR 107 N -2.99 -0.24 0.25 2.61 -1.32 -1.08 -4.96 115.64 107.90 3hfm s THR 107 Ca 0.00 0.21 -0.30 0.00 -1.21 0.00 0.00 61.69 60.39 3hfm s THR 107 Cb 0.00 -0.44 -0.09 0.00 -1.51 0.00 0.00 72.50 70.46 3hfm s THR 107 CO 0.00 0.09 1.15 -0.22 -2.21 0.00 0.00 174.62 173.43 3hfm s LEU 108 N 1.87 4.51 -0.05 9.08 2.96 -1.26 -2.79 118.68 133.00 3hfm s LEU 108 Ca -0.04 2.30 -0.02 0.00 -0.22 0.00 0.00 54.13 56.15 3hfm s LEU 108 Cb -0.11 -3.62 0.03 0.00 0.50 0.00 0.00 46.19 42.99 3hfm s LEU 108 CO -0.09 -0.25 0.05 -0.69 -1.32 0.00 0.00 176.35 174.04 3hfm s VAL 109 N -0.80 -0.02 -0.07 1.68 1.01 -0.78 -4.55 120.40 116.88 3hfm s VAL 109 Ca 0.48 0.37 -0.01 0.00 0.00 0.00 0.00 61.98 62.81 3hfm s VAL 109 Cb -0.33 -0.22 -0.03 0.00 0.00 0.00 0.00 36.38 35.80 3hfm s VAL 109 CO 0.41 0.19 0.01 0.42 0.00 0.00 0.00 175.10 176.13 3hfm s THR 110 N 2.11 4.31 -0.50 3.92 -4.23 0.88 -2.78 115.64 119.34 3hfm s THR 110 Ca 0.05 -0.31 0.03 0.00 -1.18 0.00 0.00 61.69 60.28 3hfm s THR 110 Cb -0.12 -2.83 0.14 0.00 1.34 0.00 0.00 72.50 71.02 3hfm s THR 110 CO -0.03 0.56 0.28 -0.69 -0.54 0.00 0.00 174.62 174.19 3hfm s VAL 111 N -0.93 2.10 -0.02 2.29 1.01 -1.26 -2.33 120.40 121.26 3hfm s VAL 111 Ca 0.15 -3.10 -0.04 0.00 0.00 0.00 0.00 61.98 58.99 3hfm s VAL 111 Cb -0.11 -2.46 0.00 0.00 0.00 0.00 0.00 36.38 33.81 3hfm s VAL 111 CO 0.04 -0.87 0.09 -0.55 0.00 0.00 0.00 175.10 173.81 3hfm s SER 112 N -0.15 -0.03 0.00 3.32 0.15 -1.24 -4.13 113.70 111.63 3hfm s SER 112 Ca 0.18 0.01 0.29 0.00 0.70 0.00 0.00 55.95 57.13 3hfm s SER 112 Cb -0.23 0.19 1.17 0.00 -1.71 0.00 0.00 66.02 65.44 3hfm s SER 112 CO -0.02 -0.14 1.87 0.00 1.20 0.00 0.00 173.24 176.15 3hfm n ALA 113 N 2.50 2.49 -1.56 5.45 0.00 -1.26 -4.56 120.51 123.56 3hfm n ALA 113 Ca -0.16 -0.13 -0.30 0.00 0.00 0.00 0.00 53.44 52.84 3hfm n ALA 113 Cb 0.58 -1.43 0.22 0.00 0.00 0.00 0.00 19.45 18.82 3hfm n ALA 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hfm s ALA 114 N -2.97 1.49 0.04 0.00 0.00 -1.26 -5.06 121.76 114.00 3hfm s ALA 114 Ca 0.15 -1.15 -0.00 0.00 0.00 0.00 0.00 51.96 50.96 3hfm s ALA 114 Cb 0.19 -2.80 -0.03 0.00 0.00 0.00 0.00 23.12 20.48 3hfm s ALA 114 CO 0.55 -3.01 -0.04 0.21 0.00 0.00 0.00 175.76 173.47 3hfm s LYS 115 N -5.72 0.48 -0.04 0.00 2.20 -1.26 -5.07 119.74 110.34 3hfm s LYS 115 Ca 0.74 -0.91 -0.39 0.00 -0.36 0.00 0.00 55.97 55.05 3hfm s LYS 115 Cb -0.06 0.09 -0.18 0.00 -1.51 0.00 0.00 37.83 36.18 3hfm s LYS 115 CO 0.54 -0.06 1.32 -2.37 -0.36 0.00 0.00 175.35 174.43 3hfm n THR 116 N 0.90 0.04 -3.84 3.43 5.66 -1.25 -4.79 114.28 114.42 3hfm n THR 116 Ca -0.19 -0.01 -0.14 0.00 -3.05 0.00 0.00 64.05 60.66 3hfm n THR 116 Cb 0.58 -0.58 -0.15 0.00 -1.55 0.00 0.00 70.33 68.63 3hfm n THR 116 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 3hfm s THR 117 N 0.91 0.01 0.96 1.09 -4.23 -0.11 -4.90 115.64 109.38 3hfm s THR 117 Ca 0.90 0.11 -0.12 0.00 -1.18 0.00 0.00 61.69 61.41 3hfm s THR 117 Cb -1.12 -0.09 0.17 0.00 1.34 0.00 0.00 72.50 72.80 3hfm s THR 117 CO 0.55 0.07 1.09 -2.16 -0.54 0.00 0.00 174.62 173.63 3hfm s PRO 118 N 0.65 0.70 0.80 3.99 0.04 -1.26 0.20 135.00 140.12 3hfm s PRO 118 Ca -0.06 0.93 -0.09 0.00 0.04 0.00 0.00 61.00 61.82 3hfm s PRO 118 Cb -0.08 -1.74 0.12 0.00 0.04 0.00 0.00 34.50 32.84 3hfm s PRO 118 CO -0.02 -2.65 1.13 -1.25 0.04 0.00 0.00 177.00 174.25 3hfm s PRO 119 N -4.79 1.58 -0.24 0.56 0.04 -1.25 -4.00 135.00 126.91 3hfm s PRO 119 Ca 0.65 -0.42 -0.01 0.00 0.04 0.00 0.00 61.00 61.27 3hfm s PRO 119 Cb -0.20 -2.07 0.07 0.00 0.04 0.00 0.00 34.50 32.34 3hfm s PRO 119 CO 0.59 -1.69 0.01 0.45 0.04 0.00 0.00 177.00 176.40 3hfm s SER 120 N -4.68 3.63 -0.40 6.66 0.15 -0.09 -4.95 113.70 114.01 3hfm s SER 120 Ca 0.66 -1.21 -0.16 0.00 0.70 0.00 0.00 55.95 55.94 3hfm s SER 120 Cb -0.08 -0.95 0.01 0.00 -1.71 0.00 0.00 66.02 63.30 3hfm s SER 120 CO 0.48 -0.30 0.37 -0.69 1.20 0.00 0.00 173.24 174.29 3hfm s VAL 121 N 1.57 5.17 -0.10 4.45 1.01 -1.26 -0.40 120.40 130.84 3hfm s VAL 121 Ca -0.00 -0.39 -0.03 0.00 0.00 0.00 0.00 61.98 61.57 3hfm s VAL 121 Cb -0.18 -3.95 -0.03 0.00 0.00 0.00 0.00 36.38 32.22 3hfm s VAL 121 CO -0.11 -0.31 0.01 -0.31 0.00 0.00 0.00 175.10 174.39 3hfm s TYR 122 N 1.94 3.19 0.03 5.22 2.02 0.73 -4.93 117.35 125.54 3hfm s TYR 122 Ca 0.09 0.17 -0.23 0.00 -0.37 0.00 0.00 57.07 56.74 3hfm s TYR 122 Cb -0.18 -1.83 -0.06 0.00 -0.40 0.00 0.00 41.96 39.50 3hfm s TYR 122 CO 0.12 0.43 0.68 -1.25 -1.57 0.00 0.00 175.55 173.96 3hfm s PRO 123 N -0.71 4.41 -0.43 -1.71 0.04 -1.26 0.33 135.00 135.66 3hfm s PRO 123 Ca 0.11 0.91 -0.11 0.00 0.04 0.00 0.00 61.00 61.95 3hfm s PRO 123 Cb -0.12 -3.34 0.07 0.00 0.04 0.00 0.00 34.50 31.15 3hfm s PRO 123 CO 0.02 0.35 0.30 -0.51 0.04 0.00 0.00 177.00 177.20 3hfm s LEU 124 N -0.21 5.25 -0.12 -3.56 1.43 0.90 -4.85 118.68 117.51 3hfm s LEU 124 Ca 0.35 -1.39 -0.11 0.00 -1.03 0.00 0.00 54.13 51.95 3hfm s LEU 124 Cb -0.20 -2.05 -0.05 0.00 0.03 0.00 0.00 46.19 43.93 3hfm s LEU 124 CO 0.20 -0.55 0.23 0.00 0.23 0.00 0.00 176.35 176.46 3hfm s ALA 125 N 1.51 3.74 0.69 4.21 0.00 -1.26 -2.76 121.76 127.88 3hfm s ALA 125 Ca 0.03 -0.52 -0.17 0.00 0.00 0.00 0.00 51.96 51.30 3hfm s ALA 125 Cb -0.23 -2.19 0.01 0.00 0.00 0.00 0.00 23.12 20.71 3hfm s ALA 125 CO 0.04 0.37 1.26 -1.25 0.00 0.00 0.00 175.76 176.18 3hfm s PRO 126 N -0.39 2.34 0.00 0.00 0.04 -1.26 -5.03 135.00 130.70 3hfm s PRO 126 Ca 0.16 1.94 0.00 0.00 0.04 0.00 0.00 61.00 63.13 3hfm s PRO 126 Cb -0.13 -1.84 0.00 0.00 0.04 0.00 0.00 34.50 32.58 3hfm s PRO 126 CO 0.05 -1.73 0.00 0.41 0.04 0.00 0.00 177.00 175.77 3hfm n GLY 127 N 0.70 0.73 0.00 0.56 0.00 -1.26 -4.79 105.19 101.13 3hfm n GLY 127 Ca 0.15 -1.61 0.04 0.00 0.00 0.00 0.00 46.02 44.61 3hfm n GLY 127 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3hfm n SER 128 N 0.00 1.49 -4.67 1.61 7.64 -1.26 -5.00 113.62 113.43 3hfm n SER 128 Ca 0.00 -0.40 -0.44 0.00 1.01 0.00 0.00 58.87 59.03 3hfm n SER 128 Cb 0.00 1.18 -0.02 0.00 -1.01 0.00 0.00 64.21 64.36 3hfm n SER 128 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3hfm n ALA 129 N -1.47 0.97 -1.00 -0.43 0.00 -1.26 -5.00 120.51 112.32 3hfm n ALA 129 Ca 0.00 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.84 3hfm n ALA 129 Cb 0.18 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.39 3hfm n ALA 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hfm n ALA 130 N 1.33 0.00 -3.04 0.00 0.00 -1.26 -5.14 120.51 112.40 3hfm n ALA 130 Ca 0.10 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.41 3hfm n ALA 130 Cb 0.32 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.74 3hfm n ALA 130 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 3hfm s GLN 131 N -1.84 1.89 -0.87 0.00 -2.07 -1.26 -5.06 119.66 110.45 3hfm s GLN 131 Ca 0.00 -1.64 -0.02 0.00 -1.82 0.00 0.00 55.36 51.87 3hfm s GLN 131 Cb 0.00 0.47 0.27 0.00 -1.09 0.00 0.00 33.01 32.66 3hfm s GLN 131 CO 0.00 -0.80 2.14 -2.37 -1.32 0.00 0.00 175.29 172.95 3hfm n THR 132 N -0.53 4.36 0.00 3.63 5.66 -1.26 -4.65 114.28 121.49 3hfm n THR 132 Ca -0.01 -4.51 0.00 0.00 -3.05 0.00 0.00 64.05 56.49 3hfm n THR 132 Cb 0.61 -1.46 0.00 0.00 -1.55 0.00 0.00 70.33 67.93 3hfm n THR 132 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 3hfm n ASN 133 N 0.04 0.00 -4.57 1.09 2.85 -1.26 -5.01 115.26 108.40 3hfm n ASN 133 Ca 0.52 0.00 -0.23 0.00 -0.11 0.00 0.00 54.58 54.76 3hfm n ASN 133 Cb 0.30 0.00 -0.07 0.00 1.24 0.00 0.00 39.78 41.25 3hfm n ASN 133 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 3hfm s SER 134 N 0.00 4.64 -0.30 1.20 1.04 -1.26 -4.79 113.70 114.22 3hfm s SER 134 Ca 0.00 -0.83 -0.02 0.00 0.48 0.00 0.00 55.95 55.58 3hfm s SER 134 Cb 0.00 -2.57 0.12 0.00 0.10 0.00 0.00 66.02 63.67 3hfm s SER 134 CO 0.00 -3.33 0.22 -0.32 0.98 0.00 0.00 173.24 170.79 3hfm s MET 135 N 7.43 0.32 -0.13 4.02 0.00 -1.26 -3.42 119.30 126.26 3hfm s MET 135 Ca 0.76 -0.51 -0.29 0.00 0.00 0.00 0.00 55.69 55.64 3hfm s MET 135 Cb -0.06 -0.95 -0.04 0.00 0.00 0.00 0.00 34.83 33.78 3hfm s MET 135 CO 0.07 -1.06 1.58 0.54 0.00 0.00 0.00 175.02 176.15 3hfm s VAL 136 N 2.02 3.73 -0.26 10.11 0.11 -0.06 -4.78 120.40 131.27 3hfm s VAL 136 Ca 0.11 0.87 -0.05 0.00 -2.93 0.00 0.00 61.98 59.98 3hfm s VAL 136 Cb -0.16 -3.63 0.00 0.00 -1.53 0.00 0.00 36.38 31.06 3hfm s VAL 136 CO -0.28 -0.16 0.01 0.28 -3.33 0.00 0.00 175.10 171.63 3hfm s THR 137 N 4.39 3.59 0.31 5.04 -1.32 -1.26 0.24 115.64 126.64 3hfm s THR 137 Ca 0.70 -0.64 0.08 0.00 -1.21 0.00 0.00 61.69 60.62 3hfm s THR 137 Cb -0.28 -2.76 -0.04 0.00 -1.51 0.00 0.00 72.50 67.91 3hfm s THR 137 CO 0.27 0.24 0.15 -0.76 -2.21 0.00 0.00 174.62 172.31 3hfm s LEU 138 N 1.47 3.37 0.22 9.08 1.02 0.38 -4.71 118.68 129.51 3hfm s LEU 138 Ca 0.03 -0.64 -0.16 0.00 0.02 0.00 0.00 54.13 53.39 3hfm s LEU 138 Cb -0.16 -1.89 0.02 0.00 0.02 0.00 0.00 46.19 44.18 3hfm s LEU 138 CO -0.01 -0.22 0.52 -0.83 0.02 0.00 0.00 176.35 175.84 3hfm s GLY 139 N -3.84 0.12 0.03 -3.19 0.00 -1.11 0.52 107.32 99.84 3hfm s GLY 139 Ca 0.36 -0.46 -0.00 0.00 0.00 0.00 0.00 44.72 44.62 3hfm s GLY 139 CO 0.23 -0.37 -0.03 0.00 0.00 0.00 0.00 173.10 172.93 3hfm s LEU 141 N -1.90 1.82 -0.35 0.00 2.96 0.99 -2.14 118.68 120.06 3hfm s LEU 141 Ca -0.09 -0.36 0.03 0.00 -0.22 0.00 0.00 54.13 53.49 3hfm s LEU 141 Cb -0.05 -0.97 0.10 0.00 0.50 0.00 0.00 46.19 45.78 3hfm s LEU 141 CO -0.04 0.10 0.08 0.68 -1.32 0.00 0.00 176.35 175.85 3hfm s VAL 142 N 0.36 2.48 -0.03 1.68 -7.23 -0.99 0.26 120.40 116.92 3hfm s VAL 142 Ca -0.11 -2.28 0.07 0.00 -1.81 0.00 0.00 61.98 57.86 3hfm s VAL 142 Cb -0.14 -2.80 -0.02 0.00 0.56 0.00 0.00 36.38 33.98 3hfm s VAL 142 CO 0.04 -0.61 -0.25 -0.75 -0.31 0.00 0.00 175.10 173.22 3hfm s LYS 143 N 0.95 2.23 -0.41 4.82 2.20 0.46 -2.10 119.74 127.90 3hfm s LYS 143 Ca 0.10 -0.91 -0.05 0.00 -0.36 0.00 0.00 55.97 54.75 3hfm s LYS 143 Cb -0.20 -2.08 0.01 0.00 -1.51 0.00 0.00 37.83 34.04 3hfm s LYS 143 CO -0.07 0.52 0.44 0.41 -0.36 0.00 0.00 175.35 176.29 3hfm n GLY 144 N 2.56 -1.01 3.26 5.54 0.00 -0.81 -0.92 105.19 113.82 3hfm n GLY 144 Ca -0.16 0.50 -0.14 0.00 0.00 0.00 0.00 46.02 46.21 3hfm n GLY 144 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3hfm s TYR 145 N -2.60 1.31 -0.29 1.61 -0.85 -1.12 -3.87 117.35 111.54 3hfm s TYR 145 Ca 0.07 -1.09 -0.16 0.00 -0.52 0.00 0.00 57.07 55.38 3hfm s TYR 145 Cb -0.02 -0.75 0.15 0.00 0.38 0.00 0.00 41.96 41.72 3hfm s TYR 145 CO 0.51 -0.27 0.98 0.12 -1.52 0.00 0.00 175.55 175.37 3hfm s PHE 146 N -3.72 -0.59 0.00 -3.49 5.99 0.13 -3.51 117.98 112.79 3hfm s PHE 146 Ca 0.29 1.14 0.00 0.00 0.00 0.00 0.00 56.93 58.36 3hfm s PHE 146 Cb 0.07 0.35 0.00 0.00 0.00 0.00 0.00 43.02 43.44 3hfm s PHE 146 CO 0.07 -0.29 0.00 -0.35 -0.00 0.00 0.00 175.22 174.65 3hfm n PRO 147 N 4.01 1.83 -2.31 10.12 -0.04 -1.26 -0.93 135.00 146.43 3hfm n PRO 147 Ca -0.16 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.04 3hfm n PRO 147 Cb 0.56 0.00 0.10 0.00 -0.04 0.00 0.00 33.50 34.13 3hfm n PRO 147 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3hfm s GLU 148 N 0.67 1.73 0.08 0.54 2.02 -1.26 -4.85 118.70 117.63 3hfm s GLU 148 Ca 0.00 -0.62 0.01 0.00 0.02 0.00 0.00 54.97 54.39 3hfm s GLU 148 Cb 0.00 -2.18 0.01 0.00 0.10 0.00 0.00 34.13 32.06 3hfm s GLU 148 CO 0.00 -1.51 0.11 -0.35 0.02 0.00 0.00 175.26 173.53 3hfm n PRO 149 N -3.02 0.96 -4.15 0.39 -0.04 -1.26 -4.93 135.00 122.94 3hfm n PRO 149 Ca 0.12 -0.42 -0.10 0.00 -0.04 0.00 0.00 63.50 63.06 3hfm n PRO 149 Cb 0.60 -0.03 -0.10 0.00 -0.04 0.00 0.00 33.50 33.93 3hfm n PRO 149 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 3hfm s VAL 150 N 0.49 0.26 -0.34 0.52 -7.23 -1.26 -4.32 120.40 108.52 3hfm s VAL 150 Ca 0.08 -1.90 0.03 0.00 -1.81 0.00 0.00 61.98 58.39 3hfm s VAL 150 Cb -0.01 -1.90 0.10 0.00 0.56 0.00 0.00 36.38 35.14 3hfm s VAL 150 CO 0.05 -0.63 0.07 -0.89 -0.31 0.00 0.00 175.10 173.39 3hfm s THR 151 N -3.93 2.00 -0.28 5.32 2.01 0.20 -4.93 115.64 116.04 3hfm s THR 151 Ca 0.19 -2.20 -0.10 0.00 0.31 0.00 0.00 61.69 59.89 3hfm s THR 151 Cb 0.07 -2.48 -0.04 0.00 0.01 0.00 0.00 72.50 70.06 3hfm s THR 151 CO -0.01 -0.63 0.16 -0.69 -0.69 0.00 0.00 174.62 172.76 3hfm s VAL 152 N 1.00 5.05 -0.02 3.82 1.01 -1.26 -0.83 120.40 129.16 3hfm s VAL 152 Ca 0.11 0.04 0.01 0.00 0.00 0.00 0.00 61.98 62.14 3hfm s VAL 152 Cb -0.19 -3.42 0.01 0.00 0.00 0.00 0.00 36.38 32.78 3hfm s VAL 152 CO -0.11 0.24 -0.04 0.42 0.00 0.00 0.00 175.10 175.61 3hfm s THR 153 N 1.72 0.42 0.05 3.92 -4.23 0.37 -4.95 115.64 112.94 3hfm s THR 153 Ca 0.07 -0.13 -0.27 0.00 -1.18 0.00 0.00 61.69 60.18 3hfm s THR 153 Cb -0.16 -0.42 -0.05 0.00 1.34 0.00 0.00 72.50 73.21 3hfm s THR 153 CO 0.09 0.17 0.84 0.26 -0.54 0.00 0.00 174.62 175.44 3hfm s TRP 154 N 0.48 3.73 -0.19 3.99 0.52 -1.26 0.24 118.94 126.46 3hfm s TRP 154 Ca -0.06 1.57 -0.10 0.00 0.02 0.00 0.00 56.10 57.53 3hfm s TRP 154 Cb -0.09 -2.92 0.02 0.00 -1.15 0.00 0.00 33.47 29.32 3hfm s TRP 154 CO -0.00 0.20 0.22 0.09 0.02 0.00 0.00 176.95 177.48 3hfm n ASN 155 N 3.04 -1.80 0.00 2.95 4.13 0.23 -2.84 115.26 120.96 3hfm n ASN 155 Ca 0.00 -0.13 0.00 0.00 1.68 0.00 0.00 54.58 56.13 3hfm n ASN 155 Cb 0.50 -0.54 0.00 0.00 -1.54 0.00 0.00 39.78 38.20 3hfm n ASN 155 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 3hfm n SER 156 N 0.30 0.00 0.00 6.41 7.64 -1.26 0.73 113.62 127.44 3hfm n SER 156 Ca -0.05 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.83 3hfm n SER 156 Cb 0.24 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.44 3hfm n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3hfm n GLY 157 N 0.94 0.00 0.18 0.23 0.00 -1.13 -4.51 105.19 100.91 3hfm n GLY 157 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 3hfm n GLY 157 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3hfm h SER 158 N 0.00 -0.38 -2.34 1.61 0.87 0.29 -3.36 113.55 110.24 3hfm h SER 158 Ca 0.00 0.01 -0.53 0.00 -1.23 0.00 0.00 61.79 60.04 3hfm h SER 158 Cb 0.00 0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 62.03 3hfm h SER 158 CO 0.00 -0.23 1.31 -0.76 -0.53 0.00 0.00 176.83 176.62 3hfm s LEU 159 N -6.31 3.40 -0.00 2.23 1.43 -1.17 -4.47 118.68 113.80 3hfm s LEU 159 Ca -0.07 0.78 -0.00 0.00 -1.03 0.00 0.00 54.13 53.82 3hfm s LEU 159 Cb 0.01 -2.99 -0.00 0.00 0.03 0.00 0.00 46.19 43.23 3hfm s LEU 159 CO 0.20 -2.06 -0.00 -0.24 0.23 0.00 0.00 176.35 174.48 3hfm n SER 160 N 11.58 1.56 -4.54 2.29 2.88 -1.26 -4.33 113.62 121.80 3hfm n SER 160 Ca 0.22 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.44 3hfm n SER 160 Cb 0.50 -0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.89 3hfm n SER 160 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 3hfm n SER 161 N -2.81 1.82 -2.62 -3.46 7.64 -1.26 -3.89 113.62 109.03 3hfm n SER 161 Ca -0.00 -0.62 -0.04 0.00 1.01 0.00 0.00 58.87 59.22 3hfm n SER 161 Cb 0.50 -1.48 0.02 0.00 -1.01 0.00 0.00 64.21 62.24 3hfm n SER 161 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3hfm n GLY 162 N 6.21 -0.79 3.82 0.23 0.00 -1.26 -4.79 105.19 108.60 3hfm n GLY 162 Ca 0.44 0.28 -0.31 0.00 0.00 0.00 0.00 46.02 46.43 3hfm n GLY 162 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3hfm s VAL 163 N -3.10 1.27 -0.20 1.61 -7.23 -1.25 -2.34 120.40 109.16 3hfm s VAL 163 Ca 0.12 -1.83 -0.06 0.00 -1.81 0.00 0.00 61.98 58.39 3hfm s VAL 163 Cb -0.02 -2.11 0.10 0.00 0.56 0.00 0.00 36.38 34.91 3hfm s VAL 163 CO 0.51 0.00 0.40 -1.00 -0.31 0.00 0.00 175.10 174.71 3hfm s HIS 164 N -2.85 -0.78 -0.44 2.82 3.76 0.03 -4.97 115.29 112.85 3hfm s HIS 164 Ca 0.13 1.37 0.02 0.00 -0.15 0.00 0.00 55.06 56.43 3hfm s HIS 164 Cb -0.00 0.23 0.12 0.00 1.11 0.00 0.00 32.58 34.04 3hfm s HIS 164 CO 0.08 -0.52 0.19 0.99 -0.85 0.00 0.00 174.74 174.64 3hfm s THR 165 N 2.59 2.78 0.29 1.30 2.01 -1.26 -1.37 115.64 121.98 3hfm s THR 165 Ca 0.01 -2.61 -0.29 0.00 0.31 0.00 0.00 61.69 59.11 3hfm s THR 165 Cb -0.13 -2.95 -0.10 0.00 0.01 0.00 0.00 72.50 69.34 3hfm s THR 165 CO -0.13 -0.71 1.28 -0.36 -0.69 0.00 0.00 174.62 174.01 3hfm s PHE 166 N 0.52 3.17 0.77 4.92 0.08 -1.09 -4.98 117.98 121.37 3hfm s PHE 166 Ca 0.13 1.40 -0.15 0.00 0.12 0.00 0.00 56.93 58.43 3hfm s PHE 166 Cb -0.22 -3.61 0.04 0.00 -0.57 0.00 0.00 43.02 38.66 3hfm s PHE 166 CO -0.05 -1.70 1.03 -0.35 -0.10 0.00 0.00 175.22 174.06 3hfm n PRO 167 N 1.31 0.35 -2.01 0.24 -0.04 -1.26 -4.32 135.00 129.27 3hfm n PRO 167 Ca 0.01 0.18 -0.28 0.00 -0.04 0.00 0.00 63.50 63.38 3hfm n PRO 167 Cb 0.42 -2.29 0.10 0.00 -0.04 0.00 0.00 33.50 31.69 3hfm n PRO 167 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3hfm s ALA 168 N -1.96 2.78 -0.13 0.55 0.00 -1.26 -4.80 121.76 116.94 3hfm s ALA 168 Ca 0.73 -0.83 -0.04 0.00 0.00 0.00 0.00 51.96 51.82 3hfm s ALA 168 Cb -0.32 -2.81 0.05 0.00 0.00 0.00 0.00 23.12 20.05 3hfm s ALA 168 CO 0.51 -1.65 0.07 0.08 0.00 0.00 0.00 175.76 174.78 3hfm s VAL 169 N -3.50 -0.03 0.33 0.00 1.01 -0.98 -4.98 120.40 112.24 3hfm s VAL 169 Ca 0.63 -0.03 -0.29 0.00 0.00 0.00 0.00 61.98 62.29 3hfm s VAL 169 Cb -0.10 -0.50 -0.12 0.00 0.00 0.00 0.00 36.38 35.67 3hfm s VAL 169 CO 0.48 -0.13 1.45 0.00 0.00 0.00 0.00 175.10 176.90 3hfm n LEU 170 N 5.26 4.12 -4.00 3.92 -0.00 -1.26 -3.30 117.00 121.74 3hfm n LEU 170 Ca -0.06 1.19 -0.32 0.00 -0.00 0.00 0.00 56.01 56.82 3hfm n LEU 170 Cb 0.49 -1.55 -0.12 0.00 -0.00 0.00 0.00 43.42 42.24 3hfm n LEU 170 CO 0.09 -0.10 -0.06 0.00 -0.00 0.00 0.00 177.39 177.32 3hfm s GLN 171 N -1.42 2.31 -0.07 1.47 1.03 0.13 -4.86 119.66 118.25 3hfm s GLN 171 Ca 0.58 -2.74 -0.00 0.00 0.04 0.00 0.00 55.36 53.24 3hfm s GLN 171 Cb -0.53 -3.50 0.00 0.00 0.03 0.00 0.00 33.01 29.01 3hfm s GLN 171 CO 0.58 -1.16 0.05 0.45 -2.54 0.00 0.00 175.29 172.67 3hfm n SER 172 N 3.01 -0.41 0.00 12.60 2.88 -1.26 -1.12 113.62 129.32 3hfm n SER 172 Ca 0.09 -0.09 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 3hfm n SER 172 Cb 0.34 -0.14 0.00 0.00 -0.75 0.00 0.00 64.21 63.67 3hfm n SER 172 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 3hfm n ASP 173 N 0.23 -0.09 -3.30 -3.46 4.64 -1.26 -5.07 116.55 108.24 3hfm n ASP 173 Ca -0.03 0.00 0.03 0.00 -1.38 0.00 0.00 54.79 53.41 3hfm n ASP 173 Cb 0.06 -0.02 -0.04 0.00 -1.04 0.00 0.00 41.12 40.08 3hfm n ASP 173 CO 0.00 0.00 0.00 -0.22 -0.82 0.00 0.00 177.20 176.16 3hfm s LEU 174 N 0.00 -0.21 0.38 -2.67 0.20 -0.27 -4.93 118.68 111.18 3hfm s LEU 174 Ca 0.00 0.29 -0.26 0.00 0.69 0.00 0.00 54.13 54.85 3hfm s LEU 174 Cb 0.00 1.24 -0.09 0.00 -0.43 0.00 0.00 46.19 46.92 3hfm s LEU 174 CO 0.00 -0.04 1.16 -0.31 -0.29 0.00 0.00 176.35 176.87 3hfm s TYR 175 N 2.01 3.13 -0.24 5.38 2.02 -1.23 0.19 117.35 128.61 3hfm s TYR 175 Ca -0.01 1.56 -0.10 0.00 -0.37 0.00 0.00 57.07 58.14 3hfm s TYR 175 Cb -0.02 -3.39 0.09 0.00 -0.40 0.00 0.00 41.96 38.24 3hfm s TYR 175 CO -0.16 -1.24 0.54 -0.08 -1.57 0.00 0.00 175.55 173.05 3hfm s THR 176 N -1.39 -0.44 0.11 -0.71 -1.32 -1.21 -1.92 115.64 108.76 3hfm s THR 176 Ca 0.55 0.07 0.01 0.00 -1.21 0.00 0.00 61.69 61.11 3hfm s THR 176 Cb -0.31 -0.82 -0.04 0.00 -1.51 0.00 0.00 72.50 69.82 3hfm s THR 176 CO 0.39 0.03 -0.04 -1.48 -2.21 0.00 0.00 174.62 171.31 3hfm s LEU 177 N 2.18 2.38 0.34 9.08 0.05 -0.89 -2.33 118.68 129.49 3hfm s LEU 177 Ca -0.07 -1.05 0.04 0.00 0.05 0.00 0.00 54.13 53.10 3hfm s LEU 177 Cb -0.09 0.00 -0.06 0.00 -2.05 0.00 0.00 46.19 43.99 3hfm s LEU 177 CO -0.16 -0.53 0.07 -0.94 -0.55 0.00 0.00 176.35 174.24 3hfm s SER 178 N -3.05 2.42 -0.15 1.48 1.04 -1.26 -2.34 113.70 111.84 3hfm s SER 178 Ca 0.14 -1.42 -0.13 0.00 0.48 0.00 0.00 55.95 55.01 3hfm s SER 178 Cb 0.06 0.01 0.04 0.00 0.10 0.00 0.00 66.02 66.24 3hfm s SER 178 CO -0.04 -0.66 0.40 -0.55 0.98 0.00 0.00 173.24 173.37 3hfm s SER 179 N -3.51 -0.42 0.15 7.02 0.15 -0.91 -2.68 113.70 113.50 3hfm s SER 179 Ca 0.34 0.81 0.07 0.00 0.70 0.00 0.00 55.95 57.86 3hfm s SER 179 Cb 0.08 0.80 -0.04 0.00 -1.71 0.00 0.00 66.02 65.15 3hfm s SER 179 CO 0.15 -0.14 -0.14 -0.44 1.20 0.00 0.00 173.24 173.87 3hfm s SER 180 N 0.34 2.21 -0.01 5.45 0.01 -0.47 0.13 113.70 121.37 3hfm s SER 180 Ca -0.01 -0.91 0.00 0.00 1.31 0.00 0.00 55.95 56.34 3hfm s SER 180 Cb -0.03 -0.09 0.01 0.00 0.21 0.00 0.00 66.02 66.12 3hfm s SER 180 CO -0.01 -0.17 0.01 0.54 0.41 0.00 0.00 173.24 174.02 3hfm s VAL 181 N -2.54 -0.00 -0.25 3.43 0.11 0.18 -0.79 120.40 120.53 3hfm s VAL 181 Ca 0.15 0.07 -0.02 0.00 -2.93 0.00 0.00 61.98 59.25 3hfm s VAL 181 Cb -0.03 -0.05 0.03 0.00 -1.53 0.00 0.00 36.38 34.80 3hfm s VAL 181 CO 0.04 0.04 -0.05 0.28 -3.33 0.00 0.00 175.10 172.08 3hfm s THR 182 N 0.41 2.93 0.44 5.04 -1.32 -0.99 0.14 115.64 122.29 3hfm s THR 182 Ca -0.03 -1.04 0.04 0.00 -1.21 0.00 0.00 61.69 59.44 3hfm s THR 182 Cb -0.05 -2.50 -0.04 0.00 -1.51 0.00 0.00 72.50 68.39 3hfm s THR 182 CO -0.01 0.17 0.03 0.68 -2.21 0.00 0.00 174.62 173.28 3hfm s VAL 183 N 1.33 1.31 0.02 5.08 -7.23 0.66 -4.75 120.40 116.81 3hfm s VAL 183 Ca -0.00 -2.00 -0.32 0.00 -1.81 0.00 0.00 61.98 57.85 3hfm s VAL 183 Cb -0.17 -2.53 -0.10 0.00 0.56 0.00 0.00 36.38 34.13 3hfm s VAL 183 CO -0.04 0.00 1.91 -0.81 -0.31 0.00 0.00 175.10 175.85 3hfm n PRO 184 N -1.03 2.62 -1.55 4.82 -0.04 -1.26 -0.89 135.00 137.67 3hfm n PRO 184 Ca -0.10 0.96 -0.37 0.00 -0.04 0.00 0.00 63.50 63.95 3hfm n PRO 184 Cb 0.67 -2.86 -0.03 0.00 -0.04 0.00 0.00 33.50 31.23 3hfm n PRO 184 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 3hfm n SER 185 N 6.76 2.38 -3.32 3.54 7.64 -1.22 -3.60 113.62 125.80 3hfm n SER 185 Ca 0.20 -0.41 -0.26 0.00 1.01 0.00 0.00 58.87 59.40 3hfm n SER 185 Cb 0.36 -1.57 0.02 0.00 -1.01 0.00 0.00 64.21 62.02 3hfm n SER 185 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 3hfm n SER 186 N 15.35 -6.27 -0.90 6.43 2.88 -1.26 -4.74 113.62 125.11 3hfm n SER 186 Ca 0.37 -0.04 0.00 0.00 -1.33 0.00 0.00 58.87 57.87 3hfm n SER 186 Cb 0.52 -2.95 0.00 0.00 -0.75 0.00 0.00 64.21 61.04 3hfm n SER 186 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 3hfm n PRO 187 N -0.58 -0.49 0.00 -1.46 -0.02 -1.24 -5.02 135.00 126.20 3hfm n PRO 187 Ca -0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.43 3hfm n PRO 187 Cb 0.61 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.09 3hfm n PRO 187 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 3hfm n ARG 188 N -0.33 0.00 0.22 -0.52 0.63 -1.25 -4.41 116.66 110.99 3hfm n ARG 188 Ca 0.00 0.00 0.09 0.00 -0.92 0.00 0.00 57.85 57.02 3hfm n ARG 188 Cb 0.00 -0.02 0.45 0.00 0.45 0.00 0.00 32.46 33.34 3hfm n ARG 188 CO 0.00 0.00 0.00 -1.35 -2.51 0.00 0.00 177.63 173.77 3hfm h PRO 189 N 0.00 0.00 -1.00 -0.14 0.11 -1.96 -3.33 132.00 125.69 3hfm h PRO 189 Ca 0.00 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.01 3hfm h PRO 189 Cb 0.00 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.05 3hfm h PRO 189 CO 0.00 0.24 0.13 0.45 -0.21 0.00 0.00 178.00 178.61 3hfm n SER 190 N -3.41 3.11 0.00 -2.05 2.88 -1.26 -4.01 113.62 108.88 3hfm n SER 190 Ca 0.00 -2.32 0.00 0.00 -1.33 0.00 0.00 58.87 55.23 3hfm n SER 190 Cb 0.44 -0.57 0.00 0.00 -0.75 0.00 0.00 64.21 63.33 3hfm n SER 190 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 3hfm n GLU 191 N 0.17 0.00 -1.75 -1.46 2.13 -1.25 -4.91 120.64 113.56 3hfm n GLU 191 Ca 0.12 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.94 3hfm n GLU 191 Cb 0.72 -0.11 0.00 0.00 0.27 0.00 0.00 31.44 32.32 3hfm n GLU 191 CO 0.00 0.00 0.00 -2.37 -0.41 0.00 0.00 177.13 174.35 3hfm n THR 192 N -0.64 -5.63 -4.26 6.31 5.66 -1.25 -5.05 114.28 109.42 3hfm n THR 192 Ca 0.00 1.43 -0.24 0.00 -3.05 0.00 0.00 64.05 62.19 3hfm n THR 192 Cb 0.00 -2.57 -0.08 0.00 -1.55 0.00 0.00 70.33 66.13 3hfm n THR 192 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 175.07 172.70 3hfm s VAL 193 N -0.22 2.80 -0.27 1.08 -7.23 -1.25 -5.08 120.40 110.23 3hfm s VAL 193 Ca 0.00 -1.88 -0.17 0.00 -1.81 0.00 0.00 61.98 58.12 3hfm s VAL 193 Cb 0.00 -2.86 0.08 0.00 0.56 0.00 0.00 36.38 34.16 3hfm s VAL 193 CO 0.00 -0.20 0.68 0.28 -0.31 0.00 0.00 175.10 175.54 3hfm s THR 194 N -2.48 -0.00 -0.15 5.32 -1.32 -1.26 -3.26 115.64 112.49 3hfm s THR 194 Ca 0.35 0.01 -0.29 0.00 -1.21 0.00 0.00 61.69 60.55 3hfm s THR 194 Cb -0.01 -0.97 -0.02 0.00 -1.51 0.00 0.00 72.50 69.99 3hfm s THR 194 CO 0.20 0.00 1.23 0.00 -2.21 0.00 0.00 174.62 173.85 3hfm s ASN 196 N 1.82 5.34 0.87 0.00 2.47 0.67 -2.67 114.94 123.44 3hfm s ASN 196 Ca 0.54 -1.89 -0.09 0.00 0.42 0.00 0.00 52.86 51.84 3hfm s ASN 196 Cb -0.22 -1.86 0.18 0.00 -1.45 0.00 0.00 41.25 37.90 3hfm s ASN 196 CO 0.15 -0.54 1.19 0.54 -3.72 0.00 0.00 177.10 174.72 3hfm s VAL 197 N 1.22 2.02 -0.30 -5.21 0.11 -1.19 0.14 120.40 117.18 3hfm s VAL 197 Ca 0.06 -0.31 -0.19 0.00 -2.93 0.00 0.00 61.98 58.62 3hfm s VAL 197 Cb -0.23 -2.71 0.19 0.00 -1.53 0.00 0.00 36.38 32.10 3hfm s VAL 197 CO -0.03 0.00 1.25 0.00 -3.33 0.00 0.00 175.10 172.99 3hfm s ALA 198 N -3.57 -3.37 -0.65 1.54 0.00 -0.01 -4.21 121.76 111.50 3hfm s ALA 198 Ca 0.72 1.69 -0.13 0.00 0.00 0.00 0.00 51.96 54.25 3hfm s ALA 198 Cb -0.03 -2.35 0.17 0.00 0.00 0.00 0.00 23.12 20.90 3hfm s ALA 198 CO 0.49 -1.09 0.57 -1.58 0.00 0.00 0.00 175.76 174.15 3hfm s HIS 199 N 2.29 3.49 0.26 0.00 2.46 -1.08 0.61 115.29 123.33 3hfm s HIS 199 Ca -0.02 -1.80 -0.02 0.00 0.47 0.00 0.00 55.06 53.69 3hfm s HIS 199 Cb -0.03 -3.70 0.53 0.00 -0.13 0.00 0.00 32.58 29.26 3hfm s HIS 199 CO -0.14 -0.99 1.70 -1.00 -2.47 0.00 0.00 174.74 171.84 3hfm h PRO 200 N 8.21 0.34 -0.01 2.88 0.13 -1.86 -1.95 132.00 139.74 3hfm h PRO 200 Ca -0.10 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.01 3hfm h PRO 200 Cb 1.06 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.11 3hfm h PRO 200 CO 0.87 0.22 -0.58 0.00 -0.23 0.00 0.00 178.00 178.28 3hfm n ALA 201 N -2.59 3.80 0.03 -0.56 0.00 -1.26 -4.00 120.51 115.93 3hfm n ALA 201 Ca 0.16 -0.54 -0.13 0.00 0.00 0.00 0.00 53.44 52.93 3hfm n ALA 201 Cb 0.50 -0.90 -0.14 0.00 0.00 0.00 0.00 19.45 18.91 3hfm n ALA 201 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3hfm h SER 202 N 1.17 0.20 -3.79 0.00 0.87 -1.80 -3.49 113.55 106.72 3hfm h SER 202 Ca 0.00 -0.33 -0.07 0.00 -1.23 0.00 0.00 61.79 60.16 3hfm h SER 202 Cb 0.60 -0.07 0.06 0.00 -0.44 0.00 0.00 62.40 62.55 3hfm h SER 202 CO 0.00 1.28 -0.25 -1.20 -0.53 0.00 0.00 176.83 176.13 3hfm n SER 203 N -3.30 -3.54 -3.51 6.23 7.64 -0.76 -4.98 113.62 111.40 3hfm n SER 203 Ca -0.16 -0.21 -0.12 0.00 1.01 0.00 0.00 58.87 59.39 3hfm n SER 203 Cb 1.03 -2.06 -0.11 0.00 -1.01 0.00 0.00 64.21 62.07 3hfm n SER 203 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3hfm s THR 204 N -3.11 -0.50 -0.58 0.44 -4.23 -1.20 -5.09 115.64 101.38 3hfm s THR 204 Ca 0.13 0.05 -0.10 0.00 -1.18 0.00 0.00 61.69 60.59 3hfm s THR 204 Cb -0.02 -0.66 0.15 0.00 1.34 0.00 0.00 72.50 73.31 3hfm s THR 204 CO 0.24 -0.05 0.47 -0.54 -0.54 0.00 0.00 174.62 174.19 3hfm s LYS 205 N 2.47 2.78 -0.00 3.99 -0.14 -1.26 -2.63 119.74 124.95 3hfm s LYS 205 Ca 0.06 -2.02 -0.18 0.00 -1.36 0.00 0.00 55.97 52.47 3hfm s LYS 205 Cb -0.14 -4.05 -0.06 0.00 -1.68 0.00 0.00 37.83 31.91 3hfm s LYS 205 CO -0.13 -1.23 0.51 0.08 -0.76 0.00 0.00 175.35 173.83 3hfm s VAL 206 N 0.92 4.95 -0.21 3.17 1.01 -1.26 -5.06 120.40 123.92 3hfm s VAL 206 Ca 0.10 1.07 -0.07 0.00 0.00 0.00 0.00 61.98 63.08 3hfm s VAL 206 Cb -0.23 -3.84 -0.03 0.00 0.00 0.00 0.00 36.38 32.28 3hfm s VAL 206 CO -0.02 0.48 0.05 -1.81 0.00 0.00 0.00 175.10 173.80 3hfm s ASP 207 N -0.52 5.20 -0.10 3.32 -0.00 -1.26 -3.19 116.67 120.13 3hfm s ASP 207 Ca 0.27 -0.11 -0.06 0.00 -0.00 0.00 0.00 52.55 52.65 3hfm s ASP 207 Cb -0.18 -1.91 0.04 0.00 -0.00 0.00 0.00 42.92 40.87 3hfm s ASP 207 CO 0.15 0.06 0.23 -0.75 -0.00 0.00 0.00 175.17 174.87 3hfm s LYS 208 N 1.04 0.22 0.18 8.23 2.47 -1.09 -5.06 119.74 125.73 3hfm s LYS 208 Ca 0.03 0.44 -0.30 0.00 -1.56 0.00 0.00 55.97 54.58 3hfm s LYS 208 Cb -0.14 -0.03 -0.09 0.00 -1.46 0.00 0.00 37.83 36.11 3hfm s LYS 208 CO 0.03 -0.11 1.36 0.21 0.16 0.00 0.00 175.35 176.99 3hfm s LYS 209 N 0.83 4.34 -0.49 4.03 2.20 -1.26 -1.23 119.74 128.17 3hfm s LYS 209 Ca -0.06 2.11 0.05 0.00 -0.36 0.00 0.00 55.97 57.71 3hfm s LYS 209 Cb -0.07 -3.20 0.22 0.00 -1.51 0.00 0.00 37.83 33.27 3hfm s LYS 209 CO -0.05 -0.34 0.85 1.51 -0.36 0.00 0.00 175.35 176.95 3hfm n ILE 210 N 3.02 0.00 -3.43 5.43 0.13 -1.20 -4.64 119.36 118.66 3hfm n ILE 210 Ca 0.08 -1.20 -0.43 0.00 -1.10 0.00 0.00 62.75 60.10 3hfm n ILE 210 Cb 0.42 1.24 -0.10 0.00 -0.84 0.00 0.00 39.64 40.36 3hfm n ILE 210 CO 0.00 0.00 0.00 -0.69 2.80 0.00 0.00 176.55 178.66 3hfm s VAL 211 N 0.75 5.23 -0.76 9.51 1.01 -1.26 -3.84 120.40 131.04 3hfm s VAL 211 Ca 0.31 -0.63 -0.14 0.00 0.00 0.00 0.00 61.98 61.51 3hfm s VAL 211 Cb 0.13 -3.96 -0.21 0.00 0.00 0.00 0.00 36.38 32.34 3hfm s VAL 211 CO -0.15 -0.35 1.99 -2.65 0.00 0.00 0.00 175.10 173.94 3hfm n PRO 212 N 5.24 0.16 -4.18 2.72 -0.02 -1.26 -4.77 135.00 132.89 3hfm n PRO 212 Ca -0.10 -0.43 -0.29 0.00 -2.02 0.00 0.00 63.50 60.66 3hfm n PRO 212 Cb 0.47 -2.07 -0.03 0.00 -0.02 0.00 0.00 33.50 31.85 3hfm n PRO 212 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 3hfm s ARG 213 N 7.30 2.24 -0.29 -0.52 3.52 -1.26 -4.66 118.95 125.28 3hfm s ARG 213 Ca 0.90 -2.15 -0.15 0.00 -0.13 0.00 0.00 55.73 54.19 3hfm s ARG 213 Cb -0.40 -1.91 0.14 0.00 -1.56 0.00 0.00 34.95 31.23 3hfm s ARG 213 CO 0.28 -0.53 0.93 0.16 -0.81 0.00 0.00 175.30 175.33 3hfm s ASP 214 N -4.15 -0.61 0.00 -2.12 1.47 -1.26 -4.60 116.67 105.40 3hfm s ASP 214 Ca 0.24 0.92 0.00 0.00 1.18 0.00 0.00 52.55 54.90 3hfm s ASP 214 Cb -0.01 1.41 0.00 0.00 -0.34 0.00 0.00 42.92 43.98 3hfm s ASP 214 CO 0.15 -0.14 0.28 0.00 0.68 0.00 0.00 175.17 176.14