#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ehw s LEU 26 N 0.00 4.28 0.12 2.61 2.96 -1.26 -3.76 118.68 123.62 3ehw s LEU 26 Ca 0.00 -0.74 -0.13 0.00 -0.22 0.00 0.00 54.13 53.04 3ehw s LEU 26 Cb 0.00 -2.57 -0.06 0.00 0.50 0.00 0.00 46.19 44.05 3ehw s LEU 26 CO 0.00 -1.34 0.50 -0.13 -1.32 0.00 0.00 176.35 174.05 3ehw s ARG 27 N 3.98 3.91 0.03 1.98 0.52 -0.97 -4.95 118.95 123.45 3ehw s ARG 27 Ca 0.25 0.39 -0.10 0.00 -0.52 0.00 0.00 55.73 55.75 3ehw s ARG 27 Cb -0.15 -2.97 0.01 0.00 0.52 0.00 0.00 34.95 32.35 3ehw s ARG 27 CO 0.14 0.52 0.20 -0.59 0.02 0.00 0.00 175.30 175.59 3ehw s PHE 28 N -1.42 0.03 0.06 -0.53 -0.12 -1.26 -0.47 117.98 114.27 3ehw s PHE 28 Ca 0.35 -0.20 0.07 0.00 -0.05 0.00 0.00 56.93 57.11 3ehw s PHE 28 Cb -0.15 -0.02 -0.03 0.00 -0.63 0.00 0.00 43.02 42.20 3ehw s PHE 28 CO 0.18 -0.41 -0.21 0.00 -0.05 0.00 0.00 175.22 174.74 3ehw s ALA 29 N -2.28 1.76 -0.04 1.99 0.00 -0.45 -4.99 121.76 117.75 3ehw s ALA 29 Ca -0.07 -1.09 -0.27 0.00 0.00 0.00 0.00 51.96 50.52 3ehw s ALA 29 Cb -0.02 -0.32 -0.03 0.00 0.00 0.00 0.00 23.12 22.74 3ehw s ALA 29 CO -0.02 0.39 0.86 1.03 0.00 0.00 0.00 175.76 178.01 3ehw s ARG 30 N -1.33 4.49 0.04 0.00 0.52 -1.26 -2.02 118.95 119.39 3ehw s ARG 30 Ca 0.07 1.17 0.23 0.00 -0.52 0.00 0.00 55.73 56.69 3ehw s ARG 30 Cb -0.09 -3.47 0.15 0.00 0.52 0.00 0.00 34.95 32.07 3ehw s ARG 30 CO 0.02 -0.04 1.13 1.28 0.02 0.00 0.00 175.30 177.72 3ehw n LEU 31 N 4.00 0.63 -3.87 2.53 4.77 0.66 -4.96 117.00 120.76 3ehw n LEU 31 Ca 0.03 -0.03 -0.09 0.00 -0.03 0.00 0.00 56.01 55.89 3ehw n LEU 31 Cb 0.51 -0.13 -0.01 0.00 -2.33 0.00 0.00 43.42 41.46 3ehw n LEU 31 CO 0.50 0.07 0.44 -0.94 -1.33 0.00 0.00 177.39 176.12 3ehw s SER 32 N -3.67 -0.03 0.18 -1.43 1.04 -1.25 -5.01 113.70 103.53 3ehw s SER 32 Ca 0.06 -0.95 0.19 0.00 0.48 0.00 0.00 55.95 55.73 3ehw s SER 32 Cb 0.15 0.76 0.83 0.00 0.10 0.00 0.00 66.02 67.86 3ehw s SER 32 CO 0.78 -1.47 1.58 -1.84 0.98 0.00 0.00 173.24 173.27 3ehw n GLU 33 N -0.49 0.12 0.00 4.02 0.00 -1.26 -2.98 120.64 120.05 3ehw n GLU 33 Ca -0.05 0.41 0.13 0.00 0.00 0.00 0.00 57.16 57.64 3ehw n GLU 33 Cb 0.60 -1.75 0.34 0.00 0.00 0.00 0.00 31.44 30.62 3ehw n GLU 33 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 3ehw n HIS 34 N -1.98 0.00 -1.61 -1.84 8.25 -1.26 -4.91 115.22 111.87 3ehw n HIS 34 Ca 0.02 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.16 3ehw n HIS 34 Cb 0.17 -0.28 0.05 0.00 1.12 0.00 0.00 29.99 31.06 3ehw n HIS 34 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3ehw s ALA 35 N -2.93 2.55 -0.04 -1.41 0.00 -1.16 -4.41 121.76 114.37 3ehw s ALA 35 Ca 0.13 0.26 0.02 0.00 0.00 0.00 0.00 51.96 52.37 3ehw s ALA 35 Cb 0.18 -3.23 0.01 0.00 0.00 0.00 0.00 23.12 20.08 3ehw s ALA 35 CO 0.65 -1.29 -0.09 0.99 0.00 0.00 0.00 175.76 176.02 3ehw s THR 36 N -2.79 0.83 -0.00 0.00 2.01 -1.26 -5.05 115.64 109.37 3ehw s THR 36 Ca 0.61 -0.35 -0.34 0.00 0.31 0.00 0.00 61.69 61.92 3ehw s THR 36 Cb -0.16 -0.76 -0.13 0.00 0.01 0.00 0.00 72.50 71.47 3ehw s THR 36 CO 0.50 0.27 1.75 0.00 -0.69 0.00 0.00 174.62 176.45 3ehw n ALA 37 N 3.52 0.96 -1.67 7.40 0.00 -1.26 -4.70 120.51 124.76 3ehw n ALA 37 Ca -0.21 0.35 -0.37 0.00 0.00 0.00 0.00 53.44 53.21 3ehw n ALA 37 Cb 0.53 -2.43 0.06 0.00 0.00 0.00 0.00 19.45 17.61 3ehw n ALA 37 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3ehw n PRO 38 N 5.35 1.03 -4.10 0.00 -0.02 -1.26 -4.97 135.00 131.03 3ehw n PRO 38 Ca 0.21 0.40 -0.14 0.00 -2.02 0.00 0.00 63.50 61.95 3ehw n PRO 38 Cb 0.28 -2.35 -0.11 0.00 -0.02 0.00 0.00 33.50 31.30 3ehw n PRO 38 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3ehw s THR 39 N -1.44 0.70 -0.04 3.45 -4.23 -1.15 -4.88 115.64 108.04 3ehw s THR 39 Ca 0.79 -1.25 -0.16 0.00 -1.18 0.00 0.00 61.69 59.89 3ehw s THR 39 Cb -0.40 -0.86 -0.05 0.00 1.34 0.00 0.00 72.50 72.53 3ehw s THR 39 CO 0.44 -0.41 0.43 -0.13 -0.54 0.00 0.00 174.62 174.41 3ehw s ARG 40 N -1.91 4.07 0.43 3.99 0.52 -1.26 0.43 118.95 125.22 3ehw s ARG 40 Ca -0.05 0.42 0.24 0.00 -0.52 0.00 0.00 55.73 55.82 3ehw s ARG 40 Cb -0.08 -3.29 0.42 0.00 0.52 0.00 0.00 34.95 32.51 3ehw s ARG 40 CO 0.00 0.52 1.64 0.78 0.02 0.00 0.00 175.30 178.25 3ehw h GLY 41 N 5.36 0.00 -2.45 -3.53 0.00 -1.94 -3.46 103.07 97.06 3ehw h GLY 41 Ca -0.48 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 46.77 3ehw h GLY 41 CO 0.66 0.00 -0.20 -1.35 0.00 0.00 0.00 176.54 175.66 3ehw s SER 42 N -6.09 -0.06 0.24 0.19 1.04 -1.26 -5.02 113.70 102.74 3ehw s SER 42 Ca 0.07 -0.90 -0.05 0.00 0.48 0.00 0.00 55.95 55.55 3ehw s SER 42 Cb 0.06 0.53 0.39 0.00 0.10 0.00 0.00 66.02 67.09 3ehw s SER 42 CO 0.66 -1.04 1.80 0.00 0.98 0.00 0.00 173.24 175.64 3ehw h ALA 43 N 2.36 1.12 -0.19 5.32 0.00 -2.02 -2.46 119.26 123.38 3ehw h ALA 43 Ca -0.29 0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.55 3ehw h ALA 43 Cb 1.25 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.86 3ehw h ALA 43 CO 0.40 0.03 -0.44 0.54 0.00 0.00 0.00 179.25 179.79 3ehw n ARG 44 N -4.79 1.92 -1.76 0.00 5.12 -1.26 -5.03 116.66 110.87 3ehw n ARG 44 Ca 0.13 -3.40 -0.41 0.00 -1.93 0.00 0.00 57.85 52.23 3ehw n ARG 44 Cb 0.29 -1.76 -0.01 0.00 -1.16 0.00 0.00 32.46 29.82 3ehw n ARG 44 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3ehw n ALA 45 N -1.07 2.41 0.18 7.54 0.00 -0.93 -4.90 120.51 123.74 3ehw n ALA 45 Ca 0.26 0.36 0.02 0.00 0.00 0.00 0.00 53.44 54.08 3ehw n ALA 45 Cb 0.80 -2.43 0.33 0.00 0.00 0.00 0.00 19.45 18.15 3ehw n ALA 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ehw h ALA 46 N 3.86 1.23 -3.72 0.00 0.00 -1.96 -3.46 119.26 115.22 3ehw h ALA 46 Ca -0.49 -0.38 -0.68 0.00 0.00 0.00 0.00 54.91 53.37 3ehw h ALA 46 Cb 1.24 -0.07 -0.18 0.00 0.00 0.00 0.00 17.79 18.77 3ehw h ALA 46 CO 0.72 0.53 -0.78 0.20 0.00 0.00 0.00 179.25 179.91 3ehw s GLY 47 N -4.35 1.70 -0.29 0.00 0.00 -1.26 -4.39 107.32 98.73 3ehw s GLY 47 Ca -0.02 -1.28 -0.18 0.00 0.00 0.00 0.00 44.72 43.24 3ehw s GLY 47 CO 0.72 -1.24 0.51 -0.19 0.00 0.00 0.00 173.10 172.90 3ehw s TYR 48 N -1.12 3.24 0.25 1.90 1.51 -0.20 -4.37 117.35 118.56 3ehw s TYR 48 Ca 0.18 0.50 -0.30 0.00 -1.01 0.00 0.00 57.07 56.44 3ehw s TYR 48 Cb -0.11 -2.78 -0.10 0.00 -0.11 0.00 0.00 41.96 38.86 3ehw s TYR 48 CO 0.10 -0.36 1.43 -0.51 -1.11 0.00 0.00 175.55 175.10 3ehw s ASP 49 N 1.62 6.66 -0.17 2.29 1.01 0.17 0.50 116.67 128.75 3ehw s ASP 49 Ca 0.20 2.66 -0.07 0.00 0.71 0.00 0.00 52.55 56.05 3ehw s ASP 49 Cb -0.16 -2.62 -0.04 0.00 1.01 0.00 0.00 42.92 41.11 3ehw s ASP 49 CO 0.10 -0.69 0.07 -0.76 0.21 0.00 0.00 175.17 174.10 3ehw s LEU 50 N -0.45 3.85 -0.13 1.23 1.43 0.16 -2.95 118.68 121.83 3ehw s LEU 50 Ca 0.59 0.12 -0.06 0.00 -1.03 0.00 0.00 54.13 53.74 3ehw s LEU 50 Cb -0.42 -1.97 -0.04 0.00 0.03 0.00 0.00 46.19 43.80 3ehw s LEU 50 CO 0.44 0.21 0.11 -0.31 0.23 0.00 0.00 176.35 177.02 3ehw s TYR 51 N 0.18 3.47 0.27 0.29 2.02 -1.26 -1.42 117.35 120.91 3ehw s TYR 51 Ca 0.05 0.41 -0.29 0.00 -0.37 0.00 0.00 57.07 56.86 3ehw s TYR 51 Cb -0.12 -1.95 -0.10 0.00 -0.40 0.00 0.00 41.96 39.39 3ehw s TYR 51 CO 0.00 0.59 1.27 0.45 -1.57 0.00 0.00 175.55 176.29 3ehw s SER 52 N -0.72 6.91 0.00 2.29 0.15 -0.34 -4.52 113.70 117.46 3ehw s SER 52 Ca 0.13 2.51 0.26 0.00 0.70 0.00 0.00 55.95 59.55 3ehw s SER 52 Cb -0.12 -2.63 0.72 0.00 -1.71 0.00 0.00 66.02 62.29 3ehw s SER 52 CO 0.03 -0.45 1.55 0.00 1.20 0.00 0.00 173.24 175.57 3ehw n ALA 53 N 1.53 3.22 -2.41 5.45 0.00 -0.54 -0.17 120.51 127.58 3ehw n ALA 53 Ca 0.02 -0.34 -0.10 0.00 0.00 0.00 0.00 53.44 53.02 3ehw n ALA 53 Cb 0.43 -1.18 -0.09 0.00 0.00 0.00 0.00 19.45 18.61 3ehw n ALA 53 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3ehw s TYR 54 N -2.78 0.73 0.08 0.00 2.02 -1.26 -4.82 117.35 111.32 3ehw s TYR 54 Ca 0.17 -1.07 -0.28 0.00 -0.37 0.00 0.00 57.07 55.52 3ehw s TYR 54 Cb 0.18 -0.31 -0.06 0.00 -0.40 0.00 0.00 41.96 41.38 3ehw s TYR 54 CO 0.60 -0.64 0.89 -0.51 -1.57 0.00 0.00 175.55 174.32 3ehw s ASP 55 N -3.04 7.39 0.06 2.29 -0.00 -1.26 -2.78 116.67 119.32 3ehw s ASP 55 Ca 0.24 1.66 0.04 0.00 -0.00 0.00 0.00 52.55 54.49 3ehw s ASP 55 Cb 0.05 -2.54 -0.03 0.00 -0.00 0.00 0.00 42.92 40.41 3ehw s ASP 55 CO 0.04 -0.04 -0.11 -0.31 -0.00 0.00 0.00 175.17 174.74 3ehw s TYR 56 N 0.01 0.96 -0.21 4.23 1.51 0.01 -4.95 117.35 118.90 3ehw s TYR 56 Ca 0.44 -0.47 0.02 0.00 -1.01 0.00 0.00 57.07 56.04 3ehw s TYR 56 Cb -0.22 -0.55 0.04 0.00 -0.11 0.00 0.00 41.96 41.12 3ehw s TYR 56 CO 0.27 -0.01 -0.13 0.99 -1.11 0.00 0.00 175.55 175.56 3ehw s THR 57 N -1.31 1.91 -0.33 -0.71 2.01 -1.26 -0.57 115.64 115.37 3ehw s THR 57 Ca -0.06 -1.17 -0.11 0.00 0.31 0.00 0.00 61.69 60.67 3ehw s THR 57 Cb -0.10 -1.92 0.00 0.00 0.01 0.00 0.00 72.50 70.50 3ehw s THR 57 CO 0.01 0.21 0.18 -0.63 -0.69 0.00 0.00 174.62 173.71 3ehw s ILE 58 N 1.28 4.73 0.91 1.82 1.01 0.00 -4.94 121.20 126.01 3ehw s ILE 58 Ca -0.02 -0.50 -0.11 0.00 0.00 0.00 0.00 60.65 60.02 3ehw s ILE 58 Cb -0.16 -3.48 0.14 0.00 0.01 0.00 0.00 42.46 38.97 3ehw s ILE 58 CO -0.09 -0.03 1.10 -2.84 0.00 0.00 0.00 174.94 173.08 3ehw s PRO 59 N 1.62 1.15 0.32 2.79 0.02 -1.26 0.16 135.00 139.79 3ehw s PRO 59 Ca 0.04 1.14 -0.29 0.00 0.02 0.00 0.00 61.00 61.91 3ehw s PRO 59 Cb -0.18 -1.77 -0.11 0.00 0.02 0.00 0.00 34.50 32.46 3ehw s PRO 59 CO 0.07 -2.41 1.53 -1.25 -0.33 0.00 0.00 177.00 174.62 3ehw s PRO 60 N -4.78 4.14 -1.61 5.54 0.04 -1.25 -2.16 135.00 134.92 3ehw s PRO 60 Ca 0.65 2.54 0.00 0.00 0.04 0.00 0.00 61.00 64.22 3ehw s PRO 60 Cb -0.20 -3.02 0.00 0.00 0.04 0.00 0.00 34.50 31.32 3ehw s PRO 60 CO 0.58 -0.56 0.00 -1.33 0.04 0.00 0.00 177.00 175.73 3ehw n MET 61 N 1.59 -1.45 -4.61 4.56 2.81 0.90 -4.99 117.12 115.93 3ehw n MET 61 Ca 0.05 0.92 -0.28 0.00 -1.81 0.00 0.00 57.70 56.58 3ehw n MET 61 Cb 0.38 -5.41 -0.10 0.00 -0.71 0.00 0.00 33.22 27.38 3ehw n MET 61 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 3ehw s GLU 62 N -4.79 1.94 0.22 0.03 0.41 -0.92 -4.96 118.70 110.63 3ehw s GLU 62 Ca 0.00 -2.12 0.08 0.00 -0.41 0.00 0.00 54.97 52.52 3ehw s GLU 62 Cb 0.00 -1.47 -0.05 0.00 -1.78 0.00 0.00 34.13 30.83 3ehw s GLU 62 CO 0.00 -0.12 -0.14 -1.59 -0.49 0.00 0.00 175.26 172.91 3ehw s LYS 63 N -3.76 1.37 -0.03 1.61 -2.85 -1.26 -0.84 119.74 113.98 3ehw s LYS 63 Ca 0.31 -1.62 -0.14 0.00 -1.00 0.00 0.00 55.97 53.52 3ehw s LYS 63 Cb 0.08 -1.17 0.02 0.00 -2.06 0.00 0.00 37.83 34.71 3ehw s LYS 63 CO 0.15 0.18 0.31 0.00 0.10 0.00 0.00 175.35 176.10 3ehw s ALA 64 N -2.94 -0.79 -0.47 0.59 0.00 -0.14 -4.93 121.76 113.09 3ehw s ALA 64 Ca 0.24 0.41 -0.16 0.00 0.00 0.00 0.00 51.96 52.45 3ehw s ALA 64 Cb -0.01 -0.01 0.06 0.00 0.00 0.00 0.00 23.12 23.17 3ehw s ALA 64 CO 0.08 -0.25 0.40 0.08 0.00 0.00 0.00 175.76 176.07 3ehw s VAL 65 N -1.12 5.21 -0.24 0.00 1.01 -1.26 -0.53 120.40 123.47 3ehw s VAL 65 Ca -0.12 -0.96 -0.24 0.00 0.00 0.00 0.00 61.98 60.66 3ehw s VAL 65 Cb -0.05 -4.11 -0.01 0.00 0.00 0.00 0.00 36.38 32.21 3ehw s VAL 65 CO 0.04 -0.56 0.82 -0.69 0.00 0.00 0.00 175.10 174.70 3ehw s VAL 66 N 1.73 4.85 0.17 2.92 1.01 0.20 -4.82 120.40 126.45 3ehw s VAL 66 Ca 0.05 1.54 -0.30 0.00 0.00 0.00 0.00 61.98 63.28 3ehw s VAL 66 Cb -0.23 -4.11 -0.07 0.00 0.00 0.00 0.00 36.38 31.97 3ehw s VAL 66 CO 0.08 -0.06 1.08 -0.54 0.00 0.00 0.00 175.10 175.66 3ehw s LYS 67 N 2.74 4.61 0.08 2.72 1.02 -1.26 -0.16 119.74 129.49 3ehw s LYS 67 Ca 0.35 1.69 0.23 0.00 0.02 0.00 0.00 55.97 58.25 3ehw s LYS 67 Cb -0.15 -3.29 -0.07 0.00 -0.52 0.00 0.00 37.83 33.80 3ehw s LYS 67 CO 0.08 0.10 0.89 0.25 -0.92 0.00 0.00 175.35 175.75 3ehw n THR 68 N 2.39 0.26 -2.79 2.17 -2.24 -0.90 -1.47 114.28 111.70 3ehw n THR 68 Ca 0.03 -0.40 -0.19 0.00 -2.27 0.00 0.00 64.05 61.21 3ehw n THR 68 Cb 0.46 -0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.70 3ehw n THR 68 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3ehw n ASP 69 N -2.25 -4.99 -4.31 3.42 9.92 -1.26 -4.40 116.55 112.67 3ehw n ASP 69 Ca -0.00 -0.11 -0.25 0.00 -0.53 0.00 0.00 54.79 53.89 3ehw n ASP 69 Cb 0.50 -4.13 -0.13 0.00 -0.64 0.00 0.00 41.12 36.73 3ehw n ASP 69 CO 0.00 0.00 0.00 0.27 0.13 0.00 0.00 177.20 177.60 3ehw s ILE 70 N -2.94 1.84 0.02 0.53 -4.36 -1.26 -0.25 121.20 114.78 3ehw s ILE 70 Ca 0.17 -1.56 0.03 0.00 -0.26 0.00 0.00 60.65 59.03 3ehw s ILE 70 Cb -0.08 -1.66 -0.04 0.00 1.25 0.00 0.00 42.46 41.94 3ehw s ILE 70 CO 0.21 0.00 -0.02 0.00 0.24 0.00 0.00 174.94 175.37 3ehw s GLN 71 N -1.87 2.66 0.13 0.37 -2.07 -0.86 -0.79 119.66 117.23 3ehw s GLN 71 Ca 0.08 -0.69 0.08 0.00 -1.82 0.00 0.00 55.36 53.01 3ehw s GLN 71 Cb -0.10 -2.59 -0.04 0.00 -1.09 0.00 0.00 33.01 29.20 3ehw s GLN 71 CO 0.04 0.60 -0.18 0.96 -1.32 0.00 0.00 175.29 175.39 3ehw s ILE 72 N -1.09 1.68 -0.30 3.63 -4.36 -1.26 -1.34 121.20 118.16 3ehw s ILE 72 Ca 0.20 -1.73 0.02 0.00 -0.26 0.00 0.00 60.65 58.88 3ehw s ILE 72 Cb -0.11 -1.67 0.09 0.00 1.25 0.00 0.00 42.46 42.02 3ehw s ILE 72 CO 0.11 -0.24 0.02 0.00 0.24 0.00 0.00 174.94 175.06 3ehw s ALA 73 N -1.72 2.38 0.39 2.27 0.00 0.38 -4.62 121.76 120.83 3ehw s ALA 73 Ca 0.11 -2.01 -0.25 0.00 0.00 0.00 0.00 51.96 49.81 3ehw s ALA 73 Cb -0.07 -1.73 -0.09 0.00 0.00 0.00 0.00 23.12 21.23 3ehw s ALA 73 CO 0.05 -1.51 1.09 -0.51 0.00 0.00 0.00 175.76 174.88 3ehw s LEU 74 N 1.18 4.21 0.99 0.00 1.43 -1.26 -2.29 118.68 122.93 3ehw s LEU 74 Ca 0.04 2.17 -0.11 0.00 -1.03 0.00 0.00 54.13 55.21 3ehw s LEU 74 Cb -0.19 -4.06 0.19 0.00 0.03 0.00 0.00 46.19 42.16 3ehw s LEU 74 CO -0.11 -0.52 1.11 -2.16 0.23 0.00 0.00 176.35 174.91 3ehw s PRO 75 N -2.30 0.45 0.41 1.29 0.04 -1.25 -4.94 135.00 128.71 3ehw s PRO 75 Ca 0.56 1.35 -0.25 0.00 0.04 0.00 0.00 61.00 62.70 3ehw s PRO 75 Cb -0.26 -1.68 -0.08 0.00 0.04 0.00 0.00 34.50 32.52 3ehw s PRO 75 CO 0.33 -2.96 1.21 0.45 0.04 0.00 0.00 177.00 176.07 3ehw s SER 76 N -2.62 6.38 -0.28 6.66 0.15 -1.26 -3.26 113.70 119.47 3ehw s SER 76 Ca 0.67 2.44 0.00 0.00 0.70 0.00 0.00 55.95 59.76 3ehw s SER 76 Cb -0.23 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.46 3ehw s SER 76 CO 0.60 -0.78 0.00 0.61 1.20 0.00 0.00 173.24 174.87 3ehw n GLY 77 N 0.63 0.52 3.32 9.45 0.00 -1.26 -5.03 105.19 112.82 3ehw n GLY 77 Ca 0.05 -0.92 -0.10 0.00 0.00 0.00 0.00 46.02 45.04 3ehw n GLY 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ehw s TYR 79 N -4.06 1.89 -0.44 0.00 1.13 -0.59 -4.34 117.35 110.94 3ehw s TYR 79 Ca 0.27 -0.91 -0.14 0.00 -1.41 0.00 0.00 57.07 54.88 3ehw s TYR 79 Cb 0.04 -1.19 0.05 0.00 -1.10 0.00 0.00 41.96 39.76 3ehw s TYR 79 CO 0.07 0.04 0.33 0.20 -2.51 0.00 0.00 175.55 173.68 3ehw s GLY 80 N -3.45 2.01 -0.23 5.49 0.00 -0.09 -1.00 107.32 110.05 3ehw s GLY 80 Ca 0.34 -1.94 -0.21 0.00 0.00 0.00 0.00 44.72 42.90 3ehw s GLY 80 CO 0.14 0.98 0.67 -1.60 0.00 0.00 0.00 173.10 173.29 3ehw s ARG 81 N 1.62 4.16 -0.23 2.90 3.52 0.53 -0.03 118.95 131.42 3ehw s ARG 81 Ca 0.04 0.66 -0.29 0.00 -0.13 0.00 0.00 55.73 56.00 3ehw s ARG 81 Cb -0.22 -3.62 -0.00 0.00 -1.56 0.00 0.00 34.95 29.54 3ehw s ARG 81 CO 0.07 -0.38 1.23 0.08 -0.81 0.00 0.00 175.30 175.50 3ehw s VAL 82 N 2.37 4.30 0.15 7.11 1.01 0.12 -0.78 120.40 134.67 3ehw s VAL 82 Ca 0.29 1.53 0.11 0.00 0.00 0.00 0.00 61.98 63.91 3ehw s VAL 82 Cb -0.16 -4.12 -0.04 0.00 0.00 0.00 0.00 36.38 32.06 3ehw s VAL 82 CO 0.09 -0.28 -0.25 0.00 0.00 0.00 0.00 175.10 174.66 3ehw s ALA 83 N 3.78 2.32 0.42 5.51 0.00 0.62 -4.67 121.76 129.74 3ehw s ALA 83 Ca 0.53 -1.49 -0.23 0.00 0.00 0.00 0.00 51.96 50.78 3ehw s ALA 83 Cb -0.18 -0.34 -0.09 0.00 0.00 0.00 0.00 23.12 22.51 3ehw s ALA 83 CO 0.16 0.47 1.02 -1.25 0.00 0.00 0.00 175.76 176.16 3ehw s PRO 84 N -2.25 4.11 0.35 0.00 0.04 -1.26 -1.25 135.00 134.74 3ehw s PRO 84 Ca 0.15 1.38 -0.20 0.00 0.04 0.00 0.00 61.00 62.37 3ehw s PRO 84 Cb -0.09 -2.37 -0.10 0.00 0.04 0.00 0.00 34.50 31.98 3ehw s PRO 84 CO 0.07 -0.17 0.86 1.03 0.04 0.00 0.00 177.00 178.83 3ehw s ARG 85 N -2.79 4.24 0.18 4.56 0.52 -1.26 -4.83 118.95 119.57 3ehw s ARG 85 Ca 0.61 1.00 0.08 0.00 -0.52 0.00 0.00 55.73 56.90 3ehw s ARG 85 Cb -0.18 -2.46 0.02 0.00 0.52 0.00 0.00 34.95 32.85 3ehw s ARG 85 CO 0.22 0.14 1.41 0.66 0.02 0.00 0.00 175.30 177.75 3ehw h SER 86 N 2.44 0.03 -0.03 0.23 4.64 -1.96 -2.73 113.55 116.17 3ehw h SER 86 Ca -0.48 -0.02 -0.00 0.00 -0.47 0.00 0.00 61.79 60.81 3ehw h SER 86 Cb 1.18 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 63.26 3ehw h SER 86 CO 0.63 0.86 0.01 1.23 -0.87 0.00 0.00 176.83 178.70 3ehw h GLY 87 N 2.45 0.06 1.41 -0.77 0.00 -1.98 0.37 103.07 104.61 3ehw h GLY 87 Ca -0.01 -0.03 -0.09 0.00 0.00 0.00 0.00 47.33 47.19 3ehw h GLY 87 CO 0.11 0.03 -0.12 1.41 0.00 0.00 0.00 176.54 177.97 3ehw h LEU 88 N -0.15 0.68 0.24 3.11 3.38 -1.91 0.16 115.31 120.82 3ehw h LEU 88 Ca 0.01 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 3ehw h LEU 88 Cb 0.22 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.79 3ehw h LEU 88 CO -0.00 0.83 -0.12 0.00 0.09 0.00 0.00 178.44 179.25 3ehw h ALA 89 N 1.23 -0.32 -0.01 1.53 0.00 -1.37 -1.07 119.26 119.24 3ehw h ALA 89 Ca 0.11 -0.17 -0.19 0.00 0.00 0.00 0.00 54.91 54.65 3ehw h ALA 89 Cb 0.58 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3ehw h ALA 89 CO 0.04 -0.53 -0.83 0.00 0.00 0.00 0.00 179.25 177.93 3ehw h ALA 90 N 0.02 0.57 0.15 0.00 0.00 -0.81 -0.45 119.26 118.73 3ehw h ALA 90 Ca -0.03 -0.69 -0.35 0.00 0.00 0.00 0.00 54.91 53.84 3ehw h ALA 90 Cb 0.45 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 3ehw h ALA 90 CO 0.05 0.87 -1.83 0.87 0.00 0.00 0.00 179.25 179.21 3ehw h LYS 91 N 0.14 0.32 0.00 0.00 1.57 -0.79 -3.42 116.57 114.39 3ehw h LYS 91 Ca -0.04 -0.54 0.00 0.00 -1.87 0.00 0.00 60.65 58.20 3ehw h LYS 91 Cb 1.44 0.20 0.00 0.00 0.08 0.00 0.00 32.23 33.95 3ehw h LYS 91 CO 0.13 1.23 0.00 0.72 -0.57 0.00 0.00 179.45 180.96 3ehw n HIS 92 N -3.51 0.00 -3.00 -1.35 8.25 -0.46 -5.01 115.22 110.14 3ehw n HIS 92 Ca -0.27 -0.25 -0.22 0.00 -0.26 0.00 0.00 57.72 56.72 3ehw n HIS 92 Cb 1.06 -0.02 0.03 0.00 1.12 0.00 0.00 29.99 32.18 3ehw n HIS 92 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3ehw n PHE 93 N -0.25 -1.88 -3.25 4.41 -0.00 -0.18 -4.18 117.46 112.13 3ehw n PHE 93 Ca 0.00 0.48 -0.38 0.00 -0.00 0.00 0.00 57.45 57.54 3ehw n PHE 93 Cb 0.18 -4.32 -0.06 0.00 -0.00 0.00 0.00 39.48 35.29 3ehw n PHE 93 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.76 177.18 3ehw s ILE 94 N -3.14 5.06 0.20 -2.13 -1.09 -0.86 -1.41 121.20 117.82 3ehw s ILE 94 Ca 0.29 1.11 0.04 0.00 -2.23 0.00 0.00 60.65 59.86 3ehw s ILE 94 Cb -0.13 -3.88 -0.05 0.00 -1.58 0.00 0.00 42.46 36.82 3ehw s ILE 94 CO 0.35 0.37 -0.05 -0.62 -1.23 0.00 0.00 174.94 173.76 3ehw s ASP 95 N 0.24 1.89 -0.18 3.58 3.68 -0.15 -3.59 116.67 122.14 3ehw s ASP 95 Ca 0.29 -1.12 -0.03 0.00 2.13 0.00 0.00 52.55 53.82 3ehw s ASP 95 Cb -0.17 -0.01 -0.01 0.00 -1.45 0.00 0.00 42.92 41.28 3ehw s ASP 95 CO 0.14 -0.41 -0.07 -0.69 0.13 0.00 0.00 175.17 174.27 3ehw s VAL 96 N -3.34 3.37 0.66 1.11 1.01 -1.26 -0.42 120.40 121.52 3ehw s VAL 96 Ca 0.23 -0.52 0.02 0.00 0.00 0.00 0.00 61.98 61.71 3ehw s VAL 96 Cb 0.04 -2.49 0.10 0.00 0.00 0.00 0.00 36.38 34.03 3ehw s VAL 96 CO 0.05 0.47 0.91 -0.83 0.00 0.00 0.00 175.10 175.70 3ehw s GLY 97 N 0.94 1.77 0.00 4.51 0.00 0.94 -4.88 107.32 110.61 3ehw s GLY 97 Ca -0.01 -1.72 0.00 0.00 0.00 0.00 0.00 44.72 42.99 3ehw s GLY 97 CO 0.00 -1.23 0.00 0.00 0.00 0.00 0.00 173.10 171.87 3ehw n ALA 98 N -2.62 0.00 0.00 3.20 0.00 -1.26 -4.39 120.51 115.44 3ehw n ALA 98 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.58 3ehw n ALA 98 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.06 3ehw n ALA 98 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ehw n GLY 99 N 0.00 0.71 3.37 0.00 0.00 -1.26 -4.93 105.19 103.07 3ehw n GLY 99 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.56 3ehw n GLY 99 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ehw s VAL 100 N -2.00 5.26 -0.32 1.61 1.01 -1.26 0.15 120.40 124.84 3ehw s VAL 100 Ca 0.00 -2.00 -0.24 0.00 0.00 0.00 0.00 61.98 59.74 3ehw s VAL 100 Cb 0.00 -4.55 0.00 0.00 0.00 0.00 0.00 36.38 31.83 3ehw s VAL 100 CO 0.00 -1.16 0.82 -0.63 0.00 0.00 0.00 175.10 174.12 3ehw s ILE 101 N 1.23 4.75 0.48 2.22 -1.09 0.96 -4.96 121.20 124.78 3ehw s ILE 101 Ca 0.20 1.18 -0.19 0.00 -2.23 0.00 0.00 60.65 59.61 3ehw s ILE 101 Cb -0.11 -4.19 -0.09 0.00 -1.58 0.00 0.00 42.46 36.48 3ehw s ILE 101 CO -0.07 -0.32 0.99 -1.81 -1.23 0.00 0.00 174.94 172.50 3ehw s ASP 102 N 1.68 6.65 0.41 3.58 1.11 -1.26 -0.92 116.67 127.91 3ehw s ASP 102 Ca 0.34 1.72 0.18 0.00 0.18 0.00 0.00 52.55 54.96 3ehw s ASP 102 Cb -0.14 -2.54 1.08 0.00 1.07 0.00 0.00 42.92 42.40 3ehw s ASP 102 CO 0.14 -0.57 1.82 -0.08 1.18 0.00 0.00 175.17 177.66 3ehw h GLU 103 N 1.47 0.40 -0.55 8.23 4.81 -1.93 -1.11 114.58 125.90 3ehw h GLU 103 Ca -0.48 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.72 3ehw h GLU 103 Cb 1.19 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.48 3ehw h GLU 103 CO 0.60 0.27 0.00 -0.40 -0.73 0.00 0.00 179.01 178.75 3ehw n ASP 104 N -4.55 3.00 -4.72 1.04 5.68 -1.26 -4.43 116.55 111.31 3ehw n ASP 104 Ca 0.22 -2.07 -0.41 0.00 -0.50 0.00 0.00 54.79 52.03 3ehw n ASP 104 Cb 0.77 -0.39 -0.04 0.00 -1.14 0.00 0.00 41.12 40.33 3ehw n ASP 104 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 3ehw s TYR 105 N -1.40 3.62 -0.01 2.11 5.04 -0.42 -4.91 117.35 121.39 3ehw s TYR 105 Ca 0.36 1.45 0.01 0.00 -2.44 0.00 0.00 57.07 56.44 3ehw s TYR 105 Cb 0.20 -2.93 0.01 0.00 0.35 0.00 0.00 41.96 39.59 3ehw s TYR 105 CO 0.23 0.07 0.95 0.54 -1.34 0.00 0.00 175.55 175.99 3ehw n ARG 106 N 3.74 2.54 -1.09 4.97 5.12 -1.26 -4.54 116.66 126.14 3ehw n ARG 106 Ca 0.01 -1.42 -0.15 0.00 -1.93 0.00 0.00 57.85 54.37 3ehw n ARG 106 Cb 0.51 -0.96 0.10 0.00 -1.16 0.00 0.00 32.46 30.95 3ehw n ARG 106 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3ehw n GLY 107 N -0.48 -1.01 3.71 -0.13 0.00 -1.26 -4.84 105.19 101.19 3ehw n GLY 107 Ca 0.01 -1.74 -0.42 0.00 0.00 0.00 0.00 46.02 43.87 3ehw n GLY 107 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3ehw s ASN 108 N -3.46 6.86 -0.41 1.61 3.84 -1.26 -4.20 114.94 117.92 3ehw s ASN 108 Ca 0.38 2.25 -0.29 0.00 0.21 0.00 0.00 52.86 55.41 3ehw s ASN 108 Cb -0.01 -2.58 0.01 0.00 -0.55 0.00 0.00 41.25 38.12 3ehw s ASN 108 CO 0.27 -0.64 1.34 -0.69 -2.79 0.00 0.00 177.10 174.59 3ehw s VAL 109 N 1.36 4.00 -0.09 -5.21 1.01 0.03 -4.95 120.40 116.54 3ehw s VAL 109 Ca 0.64 1.03 -0.09 0.00 0.00 0.00 0.00 61.98 63.56 3ehw s VAL 109 Cb -0.35 -4.27 -0.05 0.00 0.00 0.00 0.00 36.38 31.71 3ehw s VAL 109 CO 0.29 -0.76 0.22 -0.83 0.00 0.00 0.00 175.10 174.02 3ehw s GLY 110 N 3.49 2.24 -0.29 4.51 0.00 -1.26 -2.12 107.32 113.89 3ehw s GLY 110 Ca 0.58 -0.52 -0.09 0.00 0.00 0.00 0.00 44.72 44.69 3ehw s GLY 110 CO 0.31 -0.19 0.14 0.14 0.00 0.00 0.00 173.10 173.50 3ehw s VAL 111 N -0.94 4.62 -0.64 1.40 1.01 0.77 -4.89 120.40 121.74 3ehw s VAL 111 Ca 0.17 -0.30 -0.24 0.00 0.00 0.00 0.00 61.98 61.61 3ehw s VAL 111 Cb -0.13 -3.30 0.05 0.00 0.00 0.00 0.00 36.38 33.00 3ehw s VAL 111 CO 0.06 0.15 1.02 -0.69 0.00 0.00 0.00 175.10 175.64 3ehw s VAL 112 N 1.63 4.22 -0.15 2.92 1.01 -1.26 0.58 120.40 129.35 3ehw s VAL 112 Ca 0.05 -0.02 -0.13 0.00 0.00 0.00 0.00 61.98 61.88 3ehw s VAL 112 Cb -0.16 -4.69 -0.05 0.00 0.00 0.00 0.00 36.38 31.48 3ehw s VAL 112 CO 0.06 -1.44 0.28 -0.76 0.00 0.00 0.00 175.10 173.24 3ehw s LEU 113 N 4.37 4.26 -0.18 3.92 1.43 0.31 -0.04 118.68 132.75 3ehw s LEU 113 Ca 0.27 0.51 -0.05 0.00 -1.03 0.00 0.00 54.13 53.84 3ehw s LEU 113 Cb -0.14 -2.35 -0.03 0.00 0.03 0.00 0.00 46.19 43.70 3ehw s LEU 113 CO 0.14 0.13 -0.01 -0.36 0.23 0.00 0.00 176.35 176.48 3ehw s PHE 114 N 0.31 3.06 -0.49 0.29 2.99 0.45 -0.96 117.98 123.62 3ehw s PHE 114 Ca 0.16 -0.33 -0.15 0.00 0.00 0.00 0.00 56.93 56.62 3ehw s PHE 114 Cb -0.13 -2.03 0.09 0.00 0.00 0.00 0.00 43.02 40.95 3ehw s PHE 114 CO 0.04 -0.11 0.42 1.21 -0.00 0.00 0.00 175.22 176.78 3ehw s ASN 115 N 0.67 6.12 0.00 1.36 3.04 -0.02 -0.98 114.94 125.13 3ehw s ASN 115 Ca -0.01 -1.52 0.19 0.00 0.04 0.00 0.00 52.86 51.57 3ehw s ASN 115 Cb -0.14 -2.18 0.52 0.00 -1.54 0.00 0.00 41.25 37.91 3ehw s ASN 115 CO 0.02 -0.72 1.43 0.49 -3.04 0.00 0.00 177.10 175.28 3ehw n PHE 116 N 5.19 0.56 -1.36 0.43 3.72 -0.50 -0.07 117.46 125.44 3ehw n PHE 116 Ca -0.13 -0.28 -0.29 0.00 -0.05 0.00 0.00 57.45 56.71 3ehw n PHE 116 Cb 0.42 0.00 0.16 0.00 -0.94 0.00 0.00 39.48 39.12 3ehw n PHE 116 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3ehw s GLY 117 N -1.23 1.57 0.00 1.37 0.00 -1.25 -4.74 107.32 103.04 3ehw s GLY 117 Ca 0.36 -0.45 0.27 0.00 0.00 0.00 0.00 44.72 44.90 3ehw s GLY 117 CO 0.26 0.13 1.65 0.28 0.00 0.00 0.00 173.10 175.43 3ehw n LYS 118 N -3.97 0.53 -4.29 2.90 4.01 -1.26 -3.46 118.16 112.61 3ehw n LYS 118 Ca 0.06 -0.26 -0.16 0.00 -0.51 0.00 0.00 58.31 57.44 3ehw n LYS 118 Cb 0.58 -1.49 -0.10 0.00 -0.51 0.00 0.00 35.03 33.51 3ehw n LYS 118 CO 0.00 0.00 0.00 -2.00 -1.11 0.00 0.00 177.40 174.29 3ehw s GLU 119 N -2.65 1.37 0.76 1.97 2.56 -1.26 -4.78 118.70 116.67 3ehw s GLU 119 Ca 0.22 -1.74 -0.15 0.00 0.00 0.00 0.00 54.97 53.30 3ehw s GLU 119 Cb 0.19 -0.15 0.05 0.00 2.00 0.00 0.00 34.13 36.22 3ehw s GLU 119 CO 0.55 -0.32 1.19 0.36 -0.56 0.00 0.00 175.26 176.48 3ehw n LYS 120 N -0.43 0.44 -5.13 4.30 2.85 -1.26 -3.90 118.16 115.03 3ehw n LYS 120 Ca 0.00 0.22 -0.32 0.00 -1.05 0.00 0.00 58.31 57.16 3ehw n LYS 120 Cb 0.66 -2.43 -0.17 0.00 -0.65 0.00 0.00 35.03 32.45 3ehw n LYS 120 CO 0.00 0.00 0.00 0.12 -0.05 0.00 0.00 177.40 177.47 3ehw s PHE 121 N -1.91 2.60 -0.37 5.58 2.19 0.12 -4.92 117.98 121.28 3ehw s PHE 121 Ca 0.75 -1.02 -0.18 0.00 0.33 0.00 0.00 56.93 56.82 3ehw s PHE 121 Cb -0.32 -1.73 0.00 0.00 -1.31 0.00 0.00 43.02 39.66 3ehw s PHE 121 CO 0.48 -0.41 0.50 -1.21 1.83 0.00 0.00 175.22 176.42 3ehw s GLU 122 N 0.37 3.49 -0.14 10.12 0.41 -1.26 -0.82 118.70 130.88 3ehw s GLU 122 Ca -0.17 -0.31 -0.21 0.00 -0.41 0.00 0.00 54.97 53.88 3ehw s GLU 122 Cb -0.18 -3.85 -0.03 0.00 -1.78 0.00 0.00 34.13 28.29 3ehw s GLU 122 CO 0.08 -0.71 0.60 0.08 -0.49 0.00 0.00 175.26 174.82 3ehw s VAL 123 N 2.37 5.08 0.00 2.63 1.01 0.27 -4.99 120.40 126.77 3ehw s VAL 123 Ca 0.17 1.18 0.00 0.00 0.00 0.00 0.00 61.98 63.33 3ehw s VAL 123 Cb -0.16 -3.93 -0.04 0.00 0.00 0.00 0.00 36.38 32.26 3ehw s VAL 123 CO 0.14 0.21 0.06 -0.75 0.00 0.00 0.00 175.10 174.76 3ehw s LYS 124 N 1.22 2.98 0.08 2.72 2.47 -1.26 -0.81 119.74 127.14 3ehw s LYS 124 Ca 0.30 -0.53 -0.37 0.00 -1.56 0.00 0.00 55.97 53.81 3ehw s LYS 124 Cb -0.16 -2.80 -0.17 0.00 -1.46 0.00 0.00 37.83 33.24 3ehw s LYS 124 CO 0.12 0.63 1.36 1.17 0.16 0.00 0.00 175.35 178.80 3ehw n LYS 125 N 1.17 1.21 -0.33 4.03 0.00 -1.12 -0.98 118.16 122.14 3ehw n LYS 125 Ca -0.13 0.44 0.00 0.00 0.00 0.00 0.00 58.31 58.61 3ehw n LYS 125 Cb 0.53 -2.09 0.00 0.00 0.00 0.00 0.00 35.03 33.47 3ehw n LYS 125 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3ehw n GLY 126 N 2.60 0.98 3.73 3.14 0.00 0.77 -4.97 105.19 111.45 3ehw n GLY 126 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 3ehw n GLY 126 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3ehw s ASP 127 N -2.99 7.38 -0.56 1.61 1.01 -0.15 -4.77 116.67 118.20 3ehw s ASP 127 Ca 0.00 1.95 -0.27 0.00 0.71 0.00 0.00 52.55 54.94 3ehw s ASP 127 Cb 0.00 -2.60 0.03 0.00 1.01 0.00 0.00 42.92 41.37 3ehw s ASP 127 CO 0.00 -0.14 1.10 -0.13 0.21 0.00 0.00 175.17 176.21 3ehw s ARG 128 N -0.22 3.47 0.00 8.23 0.52 -1.26 -1.20 118.95 128.48 3ehw s ARG 128 Ca 0.48 0.11 0.05 0.00 -0.52 0.00 0.00 55.73 55.85 3ehw s ARG 128 Cb -0.27 -4.02 0.09 0.00 0.52 0.00 0.00 34.95 31.27 3ehw s ARG 128 CO 0.32 -1.59 0.87 0.44 0.02 0.00 0.00 175.30 175.36 3ehw n ILE 129 N 6.53 0.45 -3.86 1.52 -6.64 -0.51 -4.96 119.36 111.89 3ehw n ILE 129 Ca 0.07 -0.72 -0.01 0.00 -1.77 0.00 0.00 62.75 60.31 3ehw n ILE 129 Cb 0.49 0.84 0.01 0.00 -1.44 0.00 0.00 39.64 39.54 3ehw n ILE 129 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 3ehw n ALA 130 N 0.15 -2.40 -2.91 -1.28 0.00 -1.23 -4.69 120.51 108.14 3ehw n ALA 130 Ca 0.04 -0.77 -0.10 0.00 0.00 0.00 0.00 53.44 52.61 3ehw n ALA 130 Cb 0.22 0.35 -0.10 0.00 0.00 0.00 0.00 19.45 19.92 3ehw n ALA 130 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 3ehw s GLN 131 N -2.03 0.48 -0.24 0.00 -2.07 -0.38 -0.66 119.66 114.76 3ehw s GLN 131 Ca 0.20 -0.60 -0.04 0.00 -1.82 0.00 0.00 55.36 53.10 3ehw s GLN 131 Cb -0.02 0.19 -0.00 0.00 -1.09 0.00 0.00 33.01 32.09 3ehw s GLN 131 CO 0.03 -0.11 -0.02 -1.17 -1.32 0.00 0.00 175.29 172.70 3ehw s LEU 132 N -1.70 3.11 -0.12 2.60 2.96 0.18 -0.27 118.68 125.44 3ehw s LEU 132 Ca -0.11 -0.49 -0.03 0.00 -0.22 0.00 0.00 54.13 53.27 3ehw s LEU 132 Cb -0.06 -1.76 -0.03 0.00 0.50 0.00 0.00 46.19 44.84 3ehw s LEU 132 CO -0.01 -0.06 0.00 -0.63 -1.32 0.00 0.00 176.35 174.33 3ehw s ILE 133 N 1.47 4.29 -1.08 6.68 1.01 0.04 -1.03 121.20 132.57 3ehw s ILE 133 Ca 0.05 -0.24 -0.17 0.00 0.00 0.00 0.00 60.65 60.29 3ehw s ILE 133 Cb -0.15 -2.84 0.14 0.00 0.01 0.00 0.00 42.46 39.62 3ehw s ILE 133 CO -0.02 0.56 1.32 0.00 0.00 0.00 0.00 174.94 176.80 3ehw s GLU 135 N 2.48 4.33 0.17 0.00 0.41 -0.17 -4.88 118.70 121.03 3ehw s GLU 135 Ca 0.39 1.17 -0.30 0.00 -0.41 0.00 0.00 54.97 55.83 3ehw s GLU 135 Cb -0.03 -3.57 -0.07 0.00 -1.78 0.00 0.00 34.13 28.67 3ehw s GLU 135 CO -0.04 -0.37 1.00 1.03 -0.49 0.00 0.00 175.26 176.39 3ehw s ARG 136 N 2.26 4.71 0.07 1.61 0.52 -1.26 -1.55 118.95 125.31 3ehw s ARG 136 Ca 0.42 1.55 0.00 0.00 -0.52 0.00 0.00 55.73 57.18 3ehw s ARG 136 Cb -0.17 -3.32 -0.04 0.00 0.52 0.00 0.00 34.95 31.94 3ehw s ARG 136 CO 0.13 0.25 -0.04 0.96 0.02 0.00 0.00 175.30 176.62 3ehw s ILE 137 N -0.39 0.41 0.22 1.52 -4.36 -0.62 -4.96 121.20 113.03 3ehw s ILE 137 Ca 0.46 -1.85 -0.07 0.00 -0.26 0.00 0.00 60.65 58.93 3ehw s ILE 137 Cb -0.26 -1.57 -0.06 0.00 1.25 0.00 0.00 42.46 41.82 3ehw s ILE 137 CO 0.32 -0.94 0.50 -0.36 0.24 0.00 0.00 174.94 174.70 3ehw s PHE 138 N -3.78 3.45 -0.77 1.37 2.99 -1.26 -4.63 117.98 115.35 3ehw s PHE 138 Ca 0.09 0.72 0.03 0.00 0.00 0.00 0.00 56.93 57.77 3ehw s PHE 138 Cb 0.07 -2.15 0.24 0.00 0.00 0.00 0.00 43.02 41.18 3ehw s PHE 138 CO -0.08 0.29 0.81 0.66 -0.00 0.00 0.00 175.22 176.90 3ehw n TYR 139 N -0.30 3.51 -1.86 0.36 4.01 -1.26 -5.10 117.16 116.53 3ehw n TYR 139 Ca -0.01 -3.96 -0.31 0.00 -0.16 0.00 0.00 57.90 53.45 3ehw n TYR 139 Cb 0.53 -0.80 0.02 0.00 -0.31 0.00 0.00 39.34 38.78 3ehw n TYR 139 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 3ehw s PRO 140 N -2.09 3.33 0.02 -0.72 0.04 -1.26 -5.01 135.00 129.30 3ehw s PRO 140 Ca 0.33 0.95 -0.27 0.00 0.04 0.00 0.00 61.00 62.06 3ehw s PRO 140 Cb 0.05 -2.04 -0.04 0.00 0.04 0.00 0.00 34.50 32.50 3ehw s PRO 140 CO -0.05 -0.79 0.84 -1.83 0.04 0.00 0.00 177.00 175.21 3ehw s GLU 141 N -4.74 4.53 0.09 4.56 1.03 -1.26 -5.03 118.70 117.88 3ehw s GLU 141 Ca 0.58 1.19 -0.30 0.00 0.03 0.00 0.00 54.97 56.47 3ehw s GLU 141 Cb -0.13 -3.41 -0.06 0.00 -0.80 0.00 0.00 34.13 29.73 3ehw s GLU 141 CO 0.48 0.12 1.09 -1.50 -1.33 0.00 0.00 175.26 174.12 3ehw s ILE 142 N 0.46 4.24 -0.07 1.83 1.10 -1.26 -5.04 121.20 122.47 3ehw s ILE 142 Ca 0.44 1.72 -0.01 0.00 -0.51 0.00 0.00 60.65 62.28 3ehw s ILE 142 Cb -0.20 -4.10 0.03 0.00 0.15 0.00 0.00 42.46 38.33 3ehw s ILE 142 CO 0.24 0.20 0.01 -0.70 -2.11 0.00 0.00 174.94 172.58 3ehw s GLU 143 N 0.52 0.54 0.19 3.50 2.12 -1.26 -5.13 118.70 119.17 3ehw s GLU 143 Ca 0.53 0.13 -0.30 0.00 0.36 0.00 0.00 54.97 55.69 3ehw s GLU 143 Cb -0.27 -0.91 -0.08 0.00 0.26 0.00 0.00 34.13 33.14 3ehw s GLU 143 CO 0.31 -0.29 1.11 -2.00 -0.54 0.00 0.00 175.26 173.85 3ehw s GLU 144 N 1.93 4.58 0.15 4.30 2.12 -1.26 -5.06 118.70 125.46 3ehw s GLU 144 Ca 0.04 1.75 0.06 0.00 0.36 0.00 0.00 54.97 57.18 3ehw s GLU 144 Cb -0.12 -3.26 -0.04 0.00 0.26 0.00 0.00 34.13 30.96 3ehw s GLU 144 CO -0.05 0.07 -0.13 0.14 -0.54 0.00 0.00 175.26 174.75 3ehw s VAL 145 N -0.32 1.39 0.25 3.70 -7.23 -1.26 -5.05 120.40 111.89 3ehw s VAL 145 Ca 0.49 -1.96 -0.06 0.00 -1.81 0.00 0.00 61.98 58.64 3ehw s VAL 145 Cb -0.30 -1.77 0.24 0.00 0.56 0.00 0.00 36.38 35.10 3ehw s VAL 145 CO 0.36 -0.57 1.90 0.06 -0.31 0.00 0.00 175.10 176.54 3ehw h GLN 146 N 3.02 1.28 -2.47 4.82 -0.00 -2.09 -3.45 115.11 116.22 3ehw h GLN 146 Ca -0.38 -0.11 -0.09 0.00 -0.00 0.00 0.00 58.65 58.07 3ehw h GLN 146 Cb 1.20 -0.27 -0.24 0.00 -0.00 0.00 0.00 27.48 28.17 3ehw h GLN 146 CO 0.58 0.89 -0.14 0.00 -0.00 0.00 0.00 178.83 180.16 3ehw s ALA 147 N -5.98 -1.29 0.46 0.06 0.00 -1.26 -5.17 121.76 108.57 3ehw s ALA 147 Ca -0.13 1.57 -0.05 0.00 0.00 0.00 0.00 51.96 53.36 3ehw s ALA 147 Cb 0.18 -0.93 -0.04 0.00 0.00 0.00 0.00 23.12 22.33 3ehw s ALA 147 CO 0.82 -0.26 0.75 -0.51 0.00 0.00 0.00 175.76 176.56 3ehw s LEU 148 N 0.66 3.70 0.69 0.00 1.02 -1.26 -5.08 118.68 118.40 3ehw s LEU 148 Ca -0.03 0.89 -0.15 0.00 0.02 0.00 0.00 54.13 54.86 3ehw s LEU 148 Cb -0.05 -3.83 0.02 0.00 0.02 0.00 0.00 46.19 42.35 3ehw s LEU 148 CO -0.04 -0.52 1.16 1.51 0.02 0.00 0.00 176.35 178.47 3ehw s ASP 149 N -3.99 4.68 0.31 2.29 3.84 -1.26 -5.03 116.67 117.52 3ehw s ASP 149 Ca 0.47 2.19 -0.13 0.00 -0.00 0.00 0.00 52.55 55.08 3ehw s ASP 149 Cb -0.10 -2.57 -0.08 0.00 -1.38 0.00 0.00 42.92 38.78 3ehw s ASP 149 CO 0.42 -1.93 0.70 -0.62 -0.00 0.00 0.00 175.17 173.74 3ehw s ASP 150 N -2.26 6.71 0.17 2.11 -1.08 -1.26 -5.10 116.67 115.96 3ehw s ASP 150 Ca 0.71 1.18 0.02 0.00 -0.52 0.00 0.00 52.55 53.93 3ehw s ASP 150 Cb -0.25 -2.33 -0.05 0.00 -1.46 0.00 0.00 42.92 38.83 3ehw s ASP 150 CO 0.42 -0.20 0.00 0.42 0.52 0.00 0.00 175.17 176.34 3ehw s THR 151 N -1.99 0.65 0.17 1.71 -4.23 -1.26 -5.02 115.64 105.66 3ehw s THR 151 Ca 0.52 -1.97 -0.11 0.00 -1.18 0.00 0.00 61.69 58.95 3ehw s THR 151 Cb -0.10 -2.10 0.05 0.00 1.34 0.00 0.00 72.50 71.69 3ehw s THR 151 CO 0.20 -0.49 1.65 -0.33 -0.54 0.00 0.00 174.62 175.11 3ehw h GLU 152 N 2.71 0.95 -0.95 3.99 5.08 -2.05 -1.44 114.58 122.87 3ehw h GLU 152 Ca -0.37 -0.26 0.11 0.00 -1.00 0.00 0.00 59.36 57.84 3ehw h GLU 152 Cb 1.20 -0.11 -0.08 0.00 0.50 0.00 0.00 28.75 30.27 3ehw h GLU 152 CO 0.63 0.91 0.59 -0.09 -1.00 0.00 0.00 179.01 180.05 3ehw h ARG 153 N 0.84 0.92 0.00 2.33 2.43 -1.97 -3.47 114.38 115.46 3ehw h ARG 153 Ca 0.17 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.28 3ehw h ARG 153 Cb 0.44 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.78 3ehw h ARG 153 CO 0.01 0.61 0.00 0.41 -1.51 0.00 0.00 179.97 179.49 3ehw n GLY 154 N -1.34 3.57 1.06 2.80 0.00 -0.54 -0.72 105.19 110.02 3ehw n GLY 154 Ca 0.17 0.01 0.07 0.00 0.00 0.00 0.00 46.02 46.27 3ehw n GLY 154 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3ehw n SER 155 N 5.23 3.09 -4.70 1.61 7.64 -1.26 -4.92 113.62 120.30 3ehw n SER 155 Ca 0.00 -2.15 -0.42 0.00 1.01 0.00 0.00 58.87 57.31 3ehw n SER 155 Cb 0.00 -0.41 -0.03 0.00 -1.01 0.00 0.00 64.21 62.76 3ehw n SER 155 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 3ehw s GLY 156 N -0.89 1.45 0.32 0.23 0.00 0.10 -4.97 107.32 103.55 3ehw s GLY 156 Ca 0.35 1.38 -0.18 0.00 0.00 0.00 0.00 44.72 46.27 3ehw s GLY 156 CO 0.21 2.86 0.87 -0.32 0.00 0.00 0.00 173.10 176.71 3ehw s GLY 157 N 1.86 0.26 -1.37 0.20 0.00 -1.26 -4.95 107.32 102.05 3ehw s GLY 157 Ca 0.74 -0.59 -0.02 0.00 0.00 0.00 0.00 44.72 44.85 3ehw s GLY 157 CO 0.33 0.53 0.64 0.69 0.00 0.00 0.00 173.10 175.29 3ehw n PHE 158 N -0.58 -1.86 -0.25 1.90 3.01 -1.26 -2.23 117.46 116.19 3ehw n PHE 158 Ca -0.07 0.82 0.00 0.00 1.01 0.00 0.00 57.45 59.21 3ehw n PHE 158 Cb 0.60 -4.10 0.00 0.00 -0.01 0.00 0.00 39.48 35.97 3ehw n PHE 158 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3ehw n GLY 159 N -1.71 0.85 0.33 1.37 0.00 -1.26 -4.97 105.19 99.80 3ehw n GLY 159 Ca -0.26 0.00 0.17 0.00 0.00 0.00 0.00 46.02 45.93 3ehw n GLY 159 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3ehw h SER 160 N 0.00 0.00 0.20 1.61 4.64 -1.82 -0.11 113.55 118.07 3ehw h SER 160 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3ehw h SER 160 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3ehw h SER 160 CO 0.00 0.00 -0.10 0.35 -0.87 0.00 0.00 176.83 176.21 3ehw n THR 161 N -3.87 0.00 0.00 2.95 -2.24 -1.26 -5.00 114.28 104.86 3ehw n THR 161 Ca 0.02 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 3ehw n THR 161 Cb 0.32 0.11 0.00 0.00 -2.10 0.00 0.00 70.33 68.66 3ehw n THR 161 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ehw n GLY 162 N 1.23 -2.64 0.04 3.38 0.00 -0.06 -4.84 105.19 102.31 3ehw n GLY 162 Ca 0.16 -2.13 0.02 0.00 0.00 0.00 0.00 46.02 44.07 3ehw n GLY 162 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3ehw n LYS 163 N -0.09 0.79 0.00 1.61 4.76 -1.26 -4.93 118.16 119.04 3ehw n LYS 163 Ca 0.00 -0.11 0.00 0.00 -2.87 0.00 0.00 58.31 55.33 3ehw n LYS 163 Cb 0.00 -1.46 0.00 0.00 -1.84 0.00 0.00 35.03 31.73 3ehw n LYS 163 CO 0.00 0.00 0.00 0.27 -1.37 0.00 0.00 177.40 176.30