#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dmh n SER 2 N 0.00 -2.55 -3.70 1.61 3.41 -1.26 -4.99 113.62 106.14 2dmh n SER 2 Ca 0.00 -0.08 -0.30 0.00 -0.26 0.00 0.00 58.87 58.23 2dmh n SER 2 Cb 0.00 -0.86 -0.14 0.00 -0.26 0.00 0.00 64.21 62.95 2dmh n SER 2 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2dmh s SER 3 N -1.65 3.73 -1.04 4.04 1.04 -1.26 -5.05 113.70 113.51 2dmh s SER 3 Ca 0.51 -2.24 -0.10 0.00 0.48 0.00 0.00 55.95 54.61 2dmh s SER 3 Cb -0.07 -0.93 0.26 0.00 0.10 0.00 0.00 66.02 65.38 2dmh s SER 3 CO 0.66 -0.32 1.02 -0.83 0.98 0.00 0.00 173.24 174.75 2dmh s GLY 4 N 0.86 3.11 -0.07 7.32 0.00 -1.26 -4.79 107.32 112.49 2dmh s GLY 4 Ca 0.15 -3.74 0.03 0.00 0.00 0.00 0.00 44.72 41.16 2dmh s GLY 4 CO -0.08 1.30 -0.17 -0.56 0.00 0.00 0.00 173.10 173.59 2dmh s SER 5 N 1.39 2.29 -0.47 1.64 0.01 -1.26 -5.03 113.70 112.25 2dmh s SER 5 Ca 0.28 -0.39 0.04 0.00 1.31 0.00 0.00 55.95 57.18 2dmh s SER 5 Cb -0.10 -0.93 0.43 0.00 0.21 0.00 0.00 66.02 65.63 2dmh s SER 5 CO -0.08 0.11 1.42 -1.20 0.41 0.00 0.00 173.24 173.89 2dmh n SER 6 N 3.53 5.66 -1.52 2.44 7.64 -1.26 -0.79 113.62 129.32 2dmh n SER 6 Ca -0.20 -3.76 0.00 0.00 1.01 0.00 0.00 58.87 55.92 2dmh n SER 6 Cb 0.52 -0.58 0.00 0.00 -1.01 0.00 0.00 64.21 63.15 2dmh n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dmh n GLY 7 N -0.65 -4.73 3.31 0.23 0.00 -1.26 -0.38 105.19 101.71 2dmh n GLY 7 Ca 0.47 -0.54 -0.10 0.00 0.00 0.00 0.00 46.02 45.84 2dmh n GLY 7 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2dmh s MET 8 N -2.57 0.43 -0.31 1.61 -2.45 -1.20 -1.97 119.30 112.83 2dmh s MET 8 Ca 0.00 0.82 -0.06 0.00 -1.25 0.00 0.00 55.69 55.20 2dmh s MET 8 Cb 0.00 0.00 0.02 0.00 1.25 0.00 0.00 34.83 36.11 2dmh s MET 8 CO 0.00 -0.15 0.08 -1.17 1.05 0.00 0.00 175.02 174.83 2dmh s LEU 9 N 1.36 4.03 -0.12 4.11 2.96 -0.47 -3.51 118.68 127.04 2dmh s LEU 9 Ca -0.09 -0.92 -0.15 0.00 -0.22 0.00 0.00 54.13 52.75 2dmh s LEU 9 Cb -0.08 -1.86 -0.05 0.00 0.50 0.00 0.00 46.19 44.70 2dmh s LEU 9 CO -0.13 -0.25 0.35 -0.13 -1.32 0.00 0.00 176.35 174.87 2dmh s ARG 10 N 1.44 4.18 -0.34 1.98 0.52 -1.01 -0.83 118.95 124.89 2dmh s ARG 10 Ca 0.00 0.23 0.02 0.00 -0.52 0.00 0.00 55.73 55.47 2dmh s ARG 10 Cb -0.18 -3.38 0.10 0.00 0.52 0.00 0.00 34.95 32.01 2dmh s ARG 10 CO 0.02 0.33 0.08 0.08 0.02 0.00 0.00 175.30 175.83 2dmh s VAL 11 N 0.15 1.84 -0.02 3.52 1.01 -0.68 -0.65 120.40 125.58 2dmh s VAL 11 Ca 0.20 -2.10 -0.21 0.00 0.00 0.00 0.00 61.98 59.87 2dmh s VAL 11 Cb -0.14 -2.36 -0.05 0.00 0.00 0.00 0.00 36.38 33.82 2dmh s VAL 11 CO 0.07 -0.64 0.60 -0.63 0.00 0.00 0.00 175.10 174.51 2dmh s ILE 12 N 1.06 4.93 -0.32 2.22 1.01 -0.60 -1.93 121.20 127.57 2dmh s ILE 12 Ca 0.11 1.26 0.01 0.00 0.00 0.00 0.00 60.65 62.03 2dmh s ILE 12 Cb -0.19 -3.94 0.08 0.00 0.01 0.00 0.00 42.46 38.42 2dmh s ILE 12 CO -0.13 0.39 0.02 -0.69 0.00 0.00 0.00 174.94 174.54 2dmh s VAL 13 N -0.04 2.63 0.00 2.92 1.01 -0.94 -0.76 120.40 125.22 2dmh s VAL 13 Ca 0.32 -1.84 0.00 0.00 0.00 0.00 0.00 61.98 60.46 2dmh s VAL 13 Cb -0.18 -2.69 0.00 0.00 0.00 0.00 0.00 36.38 33.51 2dmh s VAL 13 CO 0.17 -0.33 0.55 -0.62 0.00 0.00 0.00 175.10 174.88 2dmh n GLU 14 N 4.46 0.00 -3.65 2.72 -0.58 -1.21 -0.95 120.64 121.43 2dmh n GLU 14 Ca -0.07 0.28 -0.01 0.00 -0.42 0.00 0.00 57.16 56.95 2dmh n GLU 14 Cb 0.42 -1.14 -0.01 0.00 -0.57 0.00 0.00 31.44 30.15 2dmh n GLU 14 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2dmh s SER 15 N -2.04 -0.11 0.36 1.62 1.04 -1.26 -0.70 113.70 112.61 2dmh s SER 15 Ca 0.00 -0.20 0.09 0.00 0.48 0.00 0.00 55.95 56.32 2dmh s SER 15 Cb 0.00 0.26 -0.07 0.00 0.10 0.00 0.00 66.02 66.32 2dmh s SER 15 CO 0.00 -0.48 -0.07 0.00 0.98 0.00 0.00 173.24 173.66 2dmh s ALA 16 N -2.70 3.00 0.17 5.32 0.00 -1.08 -2.20 121.76 124.26 2dmh s ALA 16 Ca 0.13 -2.14 -0.21 0.00 0.00 0.00 0.00 51.96 49.75 2dmh s ALA 16 Cb 0.02 -0.00 0.05 0.00 0.00 0.00 0.00 23.12 23.19 2dmh s ALA 16 CO -0.02 0.04 0.56 -1.12 0.00 0.00 0.00 175.76 175.22 2dmh s SER 17 N -3.63 -0.42 -0.93 0.00 0.01 -0.16 -3.58 113.70 104.99 2dmh s SER 17 Ca 0.33 -0.21 -0.06 0.00 1.31 0.00 0.00 55.95 57.33 2dmh s SER 17 Cb 0.04 0.59 0.01 0.00 0.21 0.00 0.00 66.02 66.86 2dmh s SER 17 CO 0.17 -1.01 0.81 0.59 0.41 0.00 0.00 173.24 174.22 2dmh n ASN 18 N -0.35 -4.79 -4.72 2.44 3.02 -1.26 -1.28 115.26 108.31 2dmh n ASN 18 Ca -0.14 -0.38 -0.41 0.00 -0.03 0.00 0.00 54.58 53.62 2dmh n ASN 18 Cb 0.64 -3.66 -0.04 0.00 -0.61 0.00 0.00 39.78 36.11 2dmh n ASN 18 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2dmh s ILE 19 N -3.22 4.65 -0.58 2.41 1.01 -1.26 -2.94 121.20 121.27 2dmh s ILE 19 Ca 0.37 2.01 -0.27 0.00 0.00 0.00 0.00 60.65 62.76 2dmh s ILE 19 Cb -0.16 -4.29 -0.02 0.00 0.01 0.00 0.00 42.46 37.99 2dmh s ILE 19 CO 0.51 0.27 1.85 -2.16 0.00 0.00 0.00 174.94 175.41 2dmh s PRO 20 N 0.32 2.71 1.21 2.79 0.04 -1.26 -4.93 135.00 135.87 2dmh s PRO 20 Ca 0.47 0.70 -0.19 0.00 0.04 0.00 0.00 61.00 62.02 2dmh s PRO 20 Cb -0.22 -4.36 0.29 0.00 0.04 0.00 0.00 34.50 30.25 2dmh s PRO 20 CO 0.28 -2.63 0.66 0.36 0.04 0.00 0.00 177.00 175.72 2dmh n LYS 21 N 9.09 -3.57 -3.97 4.56 2.85 -1.26 -4.96 118.16 120.89 2dmh n LYS 21 Ca 0.21 -1.12 -0.23 0.00 -1.05 0.00 0.00 58.31 56.12 2dmh n LYS 21 Cb 0.51 -1.61 -0.05 0.00 -0.65 0.00 0.00 35.03 33.23 2dmh n LYS 21 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 177.40 174.98 2dmh n THR 22 N -5.17 0.00 -0.34 0.58 5.66 -1.25 -5.01 114.28 108.75 2dmh n THR 22 Ca 0.11 -1.84 -0.01 0.00 -3.05 0.00 0.00 64.05 59.25 2dmh n THR 22 Cb 0.46 0.49 0.15 0.00 -1.55 0.00 0.00 70.33 69.88 2dmh n THR 22 CO 0.00 0.00 0.00 0.07 -3.05 0.00 0.00 175.07 172.09 2dmh h LYS 23 N 0.00 1.23 0.00 1.09 2.10 -2.03 -3.23 116.57 115.72 2dmh h LYS 23 Ca -0.29 -0.07 0.00 0.00 -2.00 0.00 0.00 60.65 58.28 2dmh h LYS 23 Cb 0.96 -0.28 0.00 0.00 -0.90 0.00 0.00 32.23 32.02 2dmh h LYS 23 CO 0.48 0.81 0.00 1.19 -2.00 0.00 0.00 179.45 179.93 2dmh n PHE 24 N -4.40 0.00 0.00 0.07 3.72 -1.26 -5.02 117.46 110.58 2dmh n PHE 24 Ca 0.11 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.51 2dmh n PHE 24 Cb 0.03 -0.46 0.00 0.00 -0.94 0.00 0.00 39.48 38.11 2dmh n PHE 24 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2dmh n GLY 25 N -0.85 -2.32 2.61 1.37 0.00 -1.22 -5.11 105.19 99.67 2dmh n GLY 25 Ca 0.00 0.76 -0.26 0.00 0.00 0.00 0.00 46.02 46.52 2dmh n GLY 25 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dmh s LYS 26 N -0.37 0.11 0.79 1.61 1.02 -1.26 -3.88 119.74 117.75 2dmh s LYS 26 Ca 0.00 -0.14 -0.13 0.00 0.02 0.00 0.00 55.97 55.72 2dmh s LYS 26 Cb 0.00 -1.80 0.20 0.00 -0.52 0.00 0.00 37.83 35.70 2dmh s LYS 26 CO 0.00 -0.69 0.70 -0.35 -0.92 0.00 0.00 175.35 174.08 2dmh n PRO 27 N 5.26 -2.39 -3.74 -1.68 -0.04 -1.26 -4.16 135.00 126.99 2dmh n PRO 27 Ca -0.07 -1.12 -0.37 0.00 -0.04 0.00 0.00 63.50 61.91 2dmh n PRO 27 Cb 0.48 -1.05 -0.11 0.00 -0.04 0.00 0.00 33.50 32.79 2dmh n PRO 27 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2dmh s ASP 28 N -3.38 5.28 0.41 3.54 1.11 -1.26 -2.20 116.67 120.16 2dmh s ASP 28 Ca 0.45 -2.37 -0.25 0.00 0.18 0.00 0.00 52.55 50.57 2dmh s ASP 28 Cb -0.04 -1.85 -0.08 0.00 1.07 0.00 0.00 42.92 42.01 2dmh s ASP 28 CO 0.35 -0.48 1.18 -2.16 1.18 0.00 0.00 175.17 175.24 2dmh s PRO 29 N 0.65 4.01 -0.18 8.23 0.04 -1.26 -2.57 135.00 143.94 2dmh s PRO 29 Ca 0.12 1.87 -0.14 0.00 0.04 0.00 0.00 61.00 62.89 2dmh s PRO 29 Cb -0.22 -2.66 0.05 0.00 0.04 0.00 0.00 34.50 31.72 2dmh s PRO 29 CO -0.04 -0.36 0.46 -1.50 0.04 0.00 0.00 177.00 175.60 2dmh s ILE 30 N -1.41 -0.01 0.06 0.56 2.07 -1.08 -2.99 121.20 118.40 2dmh s ILE 30 Ca 0.58 0.03 -0.22 0.00 -1.41 0.00 0.00 60.65 59.63 2dmh s ILE 30 Cb -0.31 -0.66 -0.06 0.00 0.13 0.00 0.00 42.46 41.55 2dmh s ILE 30 CO 0.39 0.01 0.65 -0.69 -1.91 0.00 0.00 174.94 173.40 2dmh s VAL 31 N 0.76 4.72 -0.28 4.00 1.01 -1.26 -3.25 120.40 126.10 2dmh s VAL 31 Ca -0.04 1.39 -0.02 0.00 0.00 0.00 0.00 61.98 63.31 2dmh s VAL 31 Cb -0.05 -3.99 0.09 0.00 0.00 0.00 0.00 36.38 32.43 2dmh s VAL 31 CO -0.06 0.47 0.09 -0.44 0.00 0.00 0.00 175.10 175.17 2dmh s SER 32 N -0.63 3.66 0.06 3.32 0.01 -1.11 -1.10 113.70 117.91 2dmh s SER 32 Ca 0.33 -1.37 -0.12 0.00 1.31 0.00 0.00 55.95 56.10 2dmh s SER 32 Cb -0.20 -0.67 -0.06 0.00 0.21 0.00 0.00 66.02 65.30 2dmh s SER 32 CO 0.20 -0.40 0.41 -0.69 0.41 0.00 0.00 173.24 173.18 2dmh s VAL 33 N 1.80 5.05 -0.11 3.43 1.01 0.15 -2.64 120.40 129.10 2dmh s VAL 33 Ca 0.07 0.62 -0.02 0.00 0.00 0.00 0.00 61.98 62.66 2dmh s VAL 33 Cb -0.17 -3.67 0.04 0.00 0.00 0.00 0.00 36.38 32.57 2dmh s VAL 33 CO -0.25 0.39 0.01 -0.63 0.00 0.00 0.00 175.10 174.62 2dmh s ILE 34 N -1.29 0.45 -0.21 2.22 1.09 -1.15 -0.48 121.20 121.83 2dmh s ILE 34 Ca 0.30 -0.07 -0.16 0.00 -1.10 0.00 0.00 60.65 59.62 2dmh s ILE 34 Cb -0.15 -0.69 0.06 0.00 -1.06 0.00 0.00 42.46 40.62 2dmh s ILE 34 CO 0.16 0.15 0.53 0.12 -0.10 0.00 0.00 174.94 175.80 2dmh s PHE 35 N 1.93 -0.69 -1.09 3.97 5.36 -0.57 -3.62 117.98 123.27 2dmh s PHE 35 Ca 0.04 1.54 -0.01 0.00 -0.96 0.00 0.00 56.93 57.53 2dmh s PHE 35 Cb -0.13 0.31 0.00 0.00 -0.34 0.00 0.00 43.02 42.85 2dmh s PHE 35 CO -0.06 -0.35 0.91 1.63 -1.46 0.00 0.00 175.22 175.89 2dmh n LYS 36 N 3.50 -6.07 -3.14 10.12 4.76 -1.26 -2.27 118.16 123.80 2dmh n LYS 36 Ca -0.18 0.75 -0.22 0.00 -2.87 0.00 0.00 58.31 55.80 2dmh n LYS 36 Cb 0.56 -5.49 0.01 0.00 -1.84 0.00 0.00 35.03 28.27 2dmh n LYS 36 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2dmh n ASP 37 N -2.83 -4.47 -3.95 4.39 8.00 -1.26 -4.95 116.55 111.48 2dmh n ASP 37 Ca -0.21 -0.28 -0.23 0.00 0.71 0.00 0.00 54.79 54.77 2dmh n ASP 37 Cb 0.64 -3.67 -0.17 0.00 -0.02 0.00 0.00 41.12 37.90 2dmh n ASP 37 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2dmh s GLU 38 N -5.79 1.34 -0.31 -1.24 8.01 -0.96 -5.12 118.70 114.63 2dmh s GLU 38 Ca 0.32 -0.26 -0.08 0.00 0.01 0.00 0.00 54.97 54.96 2dmh s GLU 38 Cb -0.16 -1.24 0.01 0.00 -4.31 0.00 0.00 34.13 28.44 2dmh s GLU 38 CO 0.39 -0.08 0.12 0.21 0.01 0.00 0.00 175.26 175.91 2dmh s LYS 39 N 0.99 3.05 -0.10 1.61 2.20 -1.26 -1.52 119.74 124.72 2dmh s LYS 39 Ca -0.09 -0.90 0.01 0.00 -0.36 0.00 0.00 55.97 54.64 2dmh s LYS 39 Cb -0.15 -3.48 0.02 0.00 -1.51 0.00 0.00 37.83 32.71 2dmh s LYS 39 CO 0.00 -0.50 -0.12 0.15 -0.36 0.00 0.00 175.35 174.52 2dmh s LYS 40 N 1.52 1.87 0.33 4.03 1.02 0.37 -4.99 119.74 123.89 2dmh s LYS 40 Ca 0.02 -0.43 0.09 0.00 0.02 0.00 0.00 55.97 55.67 2dmh s LYS 40 Cb -0.18 -1.65 -0.06 0.00 -0.52 0.00 0.00 37.83 35.42 2dmh s LYS 40 CO 0.04 -0.09 -0.08 -1.59 -0.92 0.00 0.00 175.35 172.71 2dmh s LYS 41 N 1.06 1.76 0.58 1.68 -2.85 -1.26 0.30 119.74 121.02 2dmh s LYS 41 Ca -0.06 -1.91 0.05 0.00 -1.00 0.00 0.00 55.97 53.04 2dmh s LYS 41 Cb -0.15 -1.56 0.07 0.00 -2.06 0.00 0.00 37.83 34.14 2dmh s LYS 41 CO -0.02 0.10 0.81 0.95 0.10 0.00 0.00 175.35 177.29 2dmh s THR 42 N -2.72 2.40 -0.01 3.79 -4.23 -0.26 -4.99 115.64 109.62 2dmh s THR 42 Ca 0.32 -0.82 -0.30 0.00 -1.18 0.00 0.00 61.69 59.71 2dmh s THR 42 Cb 0.03 -2.58 -0.06 0.00 1.34 0.00 0.00 72.50 71.24 2dmh s THR 42 CO 0.15 0.00 1.56 -1.59 -0.54 0.00 0.00 174.62 174.20 2dmh s LYS 43 N -4.76 4.22 0.10 3.99 -2.85 -1.26 -4.64 119.74 114.53 2dmh s LYS 43 Ca 0.61 2.13 -0.31 0.00 -1.00 0.00 0.00 55.97 57.40 2dmh s LYS 43 Cb -0.07 -3.75 -0.09 0.00 -2.06 0.00 0.00 37.83 31.85 2dmh s LYS 43 CO 0.39 -0.73 1.74 -1.59 0.10 0.00 0.00 175.35 175.26 2dmh s LYS 44 N 3.17 4.17 -0.13 1.78 -2.85 -1.26 -4.90 119.74 119.72 2dmh s LYS 44 Ca 0.70 2.46 -0.21 0.00 -1.00 0.00 0.00 55.97 57.91 2dmh s LYS 44 Cb -0.34 -3.58 -0.03 0.00 -2.06 0.00 0.00 37.83 31.82 2dmh s LYS 44 CO 0.28 -0.78 0.62 0.08 0.10 0.00 0.00 175.35 175.65 2dmh s VAL 45 N 2.63 5.07 1.03 1.79 1.01 -1.16 -5.03 120.40 125.73 2dmh s VAL 45 Ca 0.77 1.24 -0.21 0.00 0.00 0.00 0.00 61.98 63.77 2dmh s VAL 45 Cb -0.43 -3.95 -0.08 0.00 0.00 0.00 0.00 36.38 31.92 2dmh s VAL 45 CO 0.34 0.22 -0.74 -0.90 0.00 0.00 0.00 175.10 174.02 2dmh n ASP 46 N 4.22 -3.32 -3.21 3.32 5.68 -1.26 -3.98 116.55 117.99 2dmh n ASP 46 Ca -0.03 0.04 -0.35 0.00 -0.50 0.00 0.00 54.79 53.96 2dmh n ASP 46 Cb 0.51 -0.77 -0.10 0.00 -1.14 0.00 0.00 41.12 39.62 2dmh n ASP 46 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.20 175.41 2dmh n ASN 47 N 1.46 0.33 -3.63 -1.12 0.23 -1.26 -4.77 115.26 106.50 2dmh n ASN 47 Ca -0.00 0.26 -0.11 0.00 -0.53 0.00 0.00 54.58 54.20 2dmh n ASN 47 Cb 0.65 -0.66 -0.07 0.00 -2.08 0.00 0.00 39.78 37.62 2dmh n ASN 47 CO 0.00 0.00 0.00 -0.70 -0.93 0.00 0.00 177.26 175.63 2dmh s GLU 48 N 5.78 0.64 -0.05 -3.83 2.56 -0.94 -4.94 118.70 117.93 2dmh s GLU 48 Ca 0.95 0.78 -0.22 0.00 0.00 0.00 0.00 54.97 56.47 2dmh s GLU 48 Cb -0.98 0.31 -0.28 0.00 2.00 0.00 0.00 34.13 35.18 2dmh s GLU 48 CO 0.40 -0.08 0.94 -0.07 -0.56 0.00 0.00 175.26 175.89 2dmh h LEU 49 N 4.62 0.41 -7.42 2.70 4.07 -1.88 -3.40 115.31 114.41 2dmh h LEU 49 Ca -0.29 -0.90 -0.73 0.00 0.08 0.00 0.00 57.88 56.04 2dmh h LEU 49 Cb 1.17 -0.13 -0.33 0.00 1.08 0.00 0.00 40.66 42.45 2dmh h LEU 49 CO 0.09 1.27 0.05 0.20 -1.08 0.00 0.00 178.44 178.97 2dmh s ASN 50 N -6.78 6.36 0.78 -0.43 0.01 -1.26 -4.02 114.94 109.60 2dmh s ASN 50 Ca -0.14 -3.60 -0.11 0.00 -0.71 0.00 0.00 52.86 48.30 2dmh s ASN 50 Cb 0.01 -2.00 0.06 0.00 0.41 0.00 0.00 41.25 39.73 2dmh s ASN 50 CO 0.81 -0.24 1.09 -2.16 -1.51 0.00 0.00 177.10 175.09 2dmh s PRO 51 N -1.20 2.21 -0.19 -0.60 0.04 -1.23 -4.87 135.00 129.16 2dmh s PRO 51 Ca 0.27 1.15 -0.04 0.00 0.04 0.00 0.00 61.00 62.43 2dmh s PRO 51 Cb -0.09 -1.89 0.06 0.00 0.04 0.00 0.00 34.50 32.62 2dmh s PRO 51 CO -0.11 -1.68 0.07 0.08 0.04 0.00 0.00 177.00 175.41 2dmh s VAL 52 N -2.91 0.15 -0.26 -0.36 1.01 -1.26 -2.64 120.40 114.13 2dmh s VAL 52 Ca 0.61 -0.35 -0.15 0.00 0.00 0.00 0.00 61.98 62.10 2dmh s VAL 52 Cb -0.17 -0.77 -0.11 0.00 0.00 0.00 0.00 36.38 35.33 2dmh s VAL 52 CO 0.56 -0.28 -0.34 0.79 0.00 0.00 0.00 175.10 175.83 2dmh n TRP 53 N 5.19 0.03 -3.93 5.22 8.01 -1.06 -5.01 117.44 125.89 2dmh n TRP 53 Ca -0.08 0.01 -0.26 0.00 -1.31 0.00 0.00 57.50 55.86 2dmh n TRP 53 Cb 0.48 -0.90 -0.01 0.00 -2.01 0.00 0.00 31.31 28.87 2dmh n TRP 53 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.69 176.77 2dmh n ASN 54 N -4.30 -1.32 -4.83 -0.99 3.02 0.12 -4.97 115.26 102.00 2dmh n ASN 54 Ca -0.46 -0.94 -0.29 0.00 -0.03 0.00 0.00 54.58 52.86 2dmh n ASN 54 Cb 0.81 -3.31 -0.04 0.00 -0.61 0.00 0.00 39.78 36.62 2dmh n ASN 54 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 2dmh s GLU 55 N -6.49 2.23 -0.03 3.52 1.03 -1.09 -4.97 118.70 112.90 2dmh s GLU 55 Ca 0.16 -2.14 0.03 0.00 0.03 0.00 0.00 54.97 53.06 2dmh s GLU 55 Cb -0.09 -1.87 -0.00 0.00 -0.80 0.00 0.00 34.13 31.37 2dmh s GLU 55 CO 0.87 -0.45 -0.13 0.42 -1.33 0.00 0.00 175.26 174.64 2dmh s ILE 56 N -2.79 1.08 0.29 1.83 1.01 -1.26 -2.21 121.20 119.15 2dmh s ILE 56 Ca 0.24 -0.53 0.10 0.00 0.00 0.00 0.00 60.65 60.46 2dmh s ILE 56 Cb 0.00 -0.93 -0.05 0.00 0.01 0.00 0.00 42.46 41.49 2dmh s ILE 56 CO 0.14 0.32 -0.03 -0.76 0.00 0.00 0.00 174.94 174.61 2dmh s LEU 57 N 0.03 3.01 -0.09 2.97 1.43 -0.81 -4.96 118.68 120.25 2dmh s LEU 57 Ca -0.01 -0.83 -0.07 0.00 -1.03 0.00 0.00 54.13 52.19 2dmh s LEU 57 Cb -0.09 -1.49 0.03 0.00 0.03 0.00 0.00 46.19 44.68 2dmh s LEU 57 CO 0.01 -0.07 0.24 -1.61 0.23 0.00 0.00 176.35 175.15 2dmh s GLU 58 N -3.66 0.24 -0.07 1.70 2.02 -1.26 -1.69 118.70 115.98 2dmh s GLU 58 Ca 0.32 0.41 0.04 0.00 0.02 0.00 0.00 54.97 55.76 2dmh s GLU 58 Cb -0.04 0.02 0.00 0.00 0.10 0.00 0.00 34.13 34.21 2dmh s GLU 58 CO 0.19 -0.09 -0.18 -0.06 0.02 0.00 0.00 175.26 175.14 2dmh s PHE 59 N 0.63 1.95 -0.05 1.61 0.08 -0.01 -4.95 117.98 117.24 2dmh s PHE 59 Ca -0.04 -0.71 -0.27 0.00 0.12 0.00 0.00 56.93 56.03 2dmh s PHE 59 Cb -0.06 -1.34 -0.03 0.00 -0.57 0.00 0.00 43.02 41.03 2dmh s PHE 59 CO -0.04 -0.30 0.86 0.34 -0.10 0.00 0.00 175.22 175.98 2dmh s ASP 60 N 0.37 7.17 -0.14 1.36 -1.08 -1.26 -1.37 116.67 121.72 2dmh s ASP 60 Ca -0.13 1.42 0.17 0.00 -0.52 0.00 0.00 52.55 53.49 2dmh s ASP 60 Cb -0.15 -2.50 -0.24 0.00 -1.46 0.00 0.00 42.92 38.57 2dmh s ASP 60 CO 0.05 -0.23 0.28 0.18 0.52 0.00 0.00 175.17 175.98 2dmh n LEU 61 N 4.03 0.28 -1.91 -1.34 4.77 -0.83 -4.96 117.00 117.04 2dmh n LEU 61 Ca 0.03 0.13 -0.12 0.00 -0.03 0.00 0.00 56.01 56.03 2dmh n LEU 61 Cb 0.51 0.37 0.03 0.00 -2.33 0.00 0.00 43.42 42.00 2dmh n LEU 61 CO 0.50 0.44 0.08 0.54 -1.33 0.00 0.00 177.39 177.62 2dmh n ARG 62 N -2.82 -3.51 -0.46 3.23 1.74 -0.27 -2.62 116.66 111.95 2dmh n ARG 62 Ca -0.26 0.43 0.00 0.00 -0.77 0.00 0.00 57.85 57.24 2dmh n ARG 62 Cb 1.10 -4.25 0.00 0.00 -1.02 0.00 0.00 32.46 28.29 2dmh n ARG 62 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2dmh n GLY 63 N -1.22 1.34 3.58 -0.13 0.00 0.49 -4.98 105.19 104.27 2dmh n GLY 63 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 2dmh n GLY 63 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dmh s ILE 64 N -3.19 4.42 1.24 -0.61 -1.09 -1.08 -4.71 121.20 116.19 2dmh s ILE 64 Ca 0.00 1.00 -0.21 0.00 -2.23 0.00 0.00 60.65 59.21 2dmh s ILE 64 Cb 0.00 -4.46 0.31 0.00 -1.58 0.00 0.00 42.46 36.73 2dmh s ILE 64 CO 0.00 -0.81 1.10 -0.81 -1.23 0.00 0.00 174.94 173.19 2dmh n PRO 65 N 7.27 -3.16 -3.97 2.79 -0.04 -1.26 -4.80 135.00 131.82 2dmh n PRO 65 Ca 0.08 -1.76 -0.21 0.00 -0.04 0.00 0.00 63.50 61.57 2dmh n PRO 65 Cb 0.48 -1.65 -0.02 0.00 -0.04 0.00 0.00 33.50 32.28 2dmh n PRO 65 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2dmh s LEU 66 N 0.00 4.32 0.21 1.53 1.43 -1.26 -5.09 118.68 119.82 2dmh s LEU 66 Ca 0.71 0.07 -0.00 0.00 -1.03 0.00 0.00 54.13 53.89 2dmh s LEU 66 Cb -0.07 -2.86 -0.04 0.00 0.03 0.00 0.00 46.19 43.25 2dmh s LEU 66 CO 0.55 -0.06 0.11 -0.62 0.23 0.00 0.00 176.35 176.56 2dmh s ASP 67 N -3.94 0.50 0.45 2.29 2.15 -1.26 -4.71 116.67 112.15 2dmh s ASP 67 Ca 0.34 -1.37 0.29 0.00 0.43 0.00 0.00 52.55 52.24 2dmh s ASP 67 Cb -0.09 0.30 1.60 0.00 -0.30 0.00 0.00 42.92 44.43 2dmh s ASP 67 CO 0.29 -0.79 1.90 -0.26 -0.17 0.00 0.00 175.17 176.13 2dmh h PHE 68 N 2.57 0.00 0.01 -5.34 0.04 -1.89 -0.14 116.94 112.19 2dmh h PHE 68 Ca -0.37 0.00 -0.28 0.00 2.80 0.00 0.00 57.97 60.13 2dmh h PHE 68 Cb 1.24 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 39.35 2dmh h PHE 68 CO 0.39 0.00 -1.55 1.03 -0.60 0.00 0.00 178.31 177.58 2dmh h SER 69 N 0.00 0.04 -2.89 2.17 0.87 -1.95 -3.39 113.55 108.40 2dmh h SER 69 Ca 0.00 -0.07 -0.58 0.00 -1.23 0.00 0.00 61.79 59.91 2dmh h SER 69 Cb 0.04 -0.01 0.17 0.00 -0.44 0.00 0.00 62.40 62.16 2dmh h SER 69 CO 0.00 1.06 -0.41 -1.54 -0.53 0.00 0.00 176.83 175.41 2dmh n SER 70 N -3.15 -1.08 -3.59 6.23 3.41 -0.06 -4.89 113.62 110.48 2dmh n SER 70 Ca -0.14 0.75 -0.07 0.00 -0.26 0.00 0.00 58.87 59.16 2dmh n SER 70 Cb 1.03 -1.16 -0.04 0.00 -0.26 0.00 0.00 64.21 63.78 2dmh n SER 70 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2dmh s SER 71 N -1.15 -0.22 -0.10 4.04 1.04 -1.26 -2.36 113.70 113.68 2dmh s SER 71 Ca 0.68 0.15 -0.03 0.00 0.48 0.00 0.00 55.95 57.23 2dmh s SER 71 Cb -0.46 0.20 -0.03 0.00 0.10 0.00 0.00 66.02 65.83 2dmh s SER 71 CO 0.55 -0.27 0.03 -0.22 0.98 0.00 0.00 173.24 174.31 2dmh s LEU 72 N -1.55 3.73 -0.33 2.42 2.96 0.59 -4.89 118.68 121.61 2dmh s LEU 72 Ca 0.05 0.19 -0.09 0.00 -0.22 0.00 0.00 54.13 54.05 2dmh s LEU 72 Cb -0.01 -1.87 0.01 0.00 0.50 0.00 0.00 46.19 44.82 2dmh s LEU 72 CO -0.04 0.36 0.15 -0.83 -1.32 0.00 0.00 176.35 174.67 2dmh s GLY 73 N -0.76 1.87 -0.38 7.98 0.00 -1.24 -0.66 107.32 114.12 2dmh s GLY 73 Ca 0.12 -1.51 -0.10 0.00 0.00 0.00 0.00 44.72 43.23 2dmh s GLY 73 CO 0.02 0.73 0.21 -0.42 0.00 0.00 0.00 173.10 173.64 2dmh s ILE 74 N 1.56 4.47 -0.27 0.90 -1.09 0.13 -2.95 121.20 123.96 2dmh s ILE 74 Ca 0.03 -0.97 -0.01 0.00 -2.23 0.00 0.00 60.65 57.48 2dmh s ILE 74 Cb -0.18 -3.54 0.04 0.00 -1.58 0.00 0.00 42.46 37.21 2dmh s ILE 74 CO 0.05 -0.28 -0.06 -0.63 -1.23 0.00 0.00 174.94 172.80 2dmh s ILE 75 N 1.52 2.74 -0.45 2.92 1.01 -1.08 0.57 121.20 128.43 2dmh s ILE 75 Ca 0.02 -1.28 -0.14 0.00 0.00 0.00 0.00 60.65 59.24 2dmh s ILE 75 Cb -0.20 -2.49 0.06 0.00 0.01 0.00 0.00 42.46 39.84 2dmh s ILE 75 CO 0.06 0.06 0.35 -0.69 0.00 0.00 0.00 174.94 174.72 2dmh s VAL 76 N 1.25 5.10 0.40 2.92 1.01 -0.43 -2.74 120.40 127.91 2dmh s VAL 76 Ca -0.03 -1.01 0.05 0.00 0.00 0.00 0.00 61.98 60.98 2dmh s VAL 76 Cb -0.18 -4.00 -0.06 0.00 0.00 0.00 0.00 36.38 32.14 2dmh s VAL 76 CO -0.04 -0.50 0.04 -0.54 0.00 0.00 0.00 175.10 174.06 2dmh s LYS 77 N 1.62 1.90 -0.42 2.72 1.02 -1.20 -2.39 119.74 122.99 2dmh s LYS 77 Ca 0.04 -2.10 -0.18 0.00 0.02 0.00 0.00 55.97 53.75 2dmh s LYS 77 Cb -0.23 -1.26 0.02 0.00 -0.52 0.00 0.00 37.83 35.84 2dmh s LYS 77 CO 0.07 -0.19 0.47 0.16 -0.92 0.00 0.00 175.35 174.94 2dmh s ASP 78 N -3.66 6.22 0.37 2.83 1.47 -1.26 -2.63 116.67 120.01 2dmh s ASP 78 Ca 0.29 -0.59 0.21 0.00 1.18 0.00 0.00 52.55 53.65 2dmh s ASP 78 Cb 0.07 -2.24 1.34 0.00 -0.34 0.00 0.00 42.92 41.76 2dmh s ASP 78 CO 0.14 -0.61 1.57 0.33 0.68 0.00 0.00 175.17 177.29 2dmh n PHE 79 N 5.71 1.16 -0.14 2.11 7.35 -1.06 -1.41 117.46 131.17 2dmh n PHE 79 Ca -0.06 1.17 -0.04 0.00 -0.76 0.00 0.00 57.45 57.76 2dmh n PHE 79 Cb 0.48 -1.57 -0.03 0.00 0.35 0.00 0.00 39.48 38.70 2dmh n PHE 79 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 2dmh n GLU 80 N -5.24 -0.15 -3.89 -4.13 1.02 -1.26 -4.05 120.64 102.94 2dmh n GLU 80 Ca 0.38 0.98 -0.30 0.00 -0.02 0.00 0.00 57.16 58.20 2dmh n GLU 80 Cb 1.29 -1.45 -0.16 0.00 -0.02 0.00 0.00 31.44 31.10 2dmh n GLU 80 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 2dmh s THR 81 N -4.02 1.30 0.06 2.62 -1.32 -0.50 -5.03 115.64 108.74 2dmh s THR 81 Ca -0.04 -1.06 -0.29 0.00 -1.21 0.00 0.00 61.69 59.09 2dmh s THR 81 Cb 0.04 -1.62 -0.15 0.00 -1.51 0.00 0.00 72.50 69.26 2dmh s THR 81 CO 0.21 -0.12 1.44 0.40 -2.21 0.00 0.00 174.62 174.34 2dmh h ILE 82 N 6.63 0.00 0.00 5.08 1.08 -1.71 -3.42 117.51 125.17 2dmh h ILE 82 Ca -0.18 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.29 2dmh h ILE 82 Cb 1.08 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.83 2dmh h ILE 82 CO 0.39 0.00 0.00 0.61 -0.69 0.00 0.00 178.15 178.46 2dmh n GLY 83 N -1.48 0.55 2.63 5.37 0.00 -1.26 -4.48 105.19 106.51 2dmh n GLY 83 Ca -0.11 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.75 2dmh n GLY 83 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2dmh n GLN 84 N 0.00 -2.56 -3.58 1.61 3.00 -1.26 -0.97 117.38 113.61 2dmh n GLN 84 Ca 0.00 0.65 -0.22 0.00 -0.01 0.00 0.00 57.00 57.42 2dmh n GLN 84 Cb 0.00 -5.30 0.07 0.00 0.00 0.00 0.00 30.24 25.02 2dmh n GLN 84 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35 2dmh n ASN 85 N -1.96 -4.01 -4.15 1.08 5.15 -1.26 -4.98 115.26 105.12 2dmh n ASN 85 Ca -0.14 -0.63 -0.35 0.00 -0.60 0.00 0.00 54.58 52.87 2dmh n ASN 85 Cb 0.61 -4.85 -0.14 0.00 -0.53 0.00 0.00 39.78 34.87 2dmh n ASN 85 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 2dmh s LYS 86 N -5.95 2.36 -0.12 1.20 -0.14 -0.15 -5.07 119.74 111.87 2dmh s LYS 86 Ca 0.31 -1.32 -0.06 0.00 -1.36 0.00 0.00 55.97 53.54 2dmh s LYS 86 Cb -0.14 -3.16 0.05 0.00 -1.68 0.00 0.00 37.83 32.90 2dmh s LYS 86 CO 0.75 -0.64 0.28 -1.17 -0.76 0.00 0.00 175.35 173.81 2dmh s LEU 87 N 1.22 0.15 -0.15 3.17 2.96 -1.26 -4.69 118.68 120.08 2dmh s LEU 87 Ca -0.05 0.62 -0.16 0.00 -0.22 0.00 0.00 54.13 54.32 2dmh s LEU 87 Cb -0.20 0.85 -0.14 0.00 0.50 0.00 0.00 46.19 47.21 2dmh s LEU 87 CO -0.02 -0.19 0.27 0.40 -1.32 0.00 0.00 176.35 175.49 2dmh h ILE 88 N 5.91 0.81 0.00 6.68 2.04 -1.87 -3.46 117.51 127.61 2dmh h ILE 88 Ca -0.34 -1.73 0.00 0.00 1.00 0.00 0.00 64.86 63.79 2dmh h ILE 88 Cb 1.15 1.65 0.00 0.00 -0.74 0.00 0.00 36.82 38.88 2dmh h ILE 88 CO 0.31 0.27 0.00 0.61 0.00 0.00 0.00 178.15 179.34 2dmh n GLY 89 N 1.61 1.62 3.79 5.37 0.00 -1.01 -4.60 105.19 111.99 2dmh n GLY 89 Ca -0.12 -0.08 -0.30 0.00 0.00 0.00 0.00 46.02 45.52 2dmh n GLY 89 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2dmh s THR 90 N -1.31 1.49 -0.29 2.61 -4.23 0.69 -1.31 115.64 113.30 2dmh s THR 90 Ca 0.00 -1.81 -0.17 0.00 -1.18 0.00 0.00 61.69 58.53 2dmh s THR 90 Cb 0.00 -2.30 0.14 0.00 1.34 0.00 0.00 72.50 71.67 2dmh s THR 90 CO 0.00 0.00 0.95 0.00 -0.54 0.00 0.00 174.62 175.03 2dmh s ALA 91 N -2.80 -2.21 -0.23 3.99 0.00 0.19 -1.72 121.76 118.98 2dmh s ALA 91 Ca 0.20 2.20 -0.06 0.00 0.00 0.00 0.00 51.96 54.30 2dmh s ALA 91 Cb 0.01 -1.66 -0.02 0.00 0.00 0.00 0.00 23.12 21.45 2dmh s ALA 91 CO 0.12 -0.34 0.02 0.99 0.00 0.00 0.00 175.76 176.55 2dmh s THR 92 N 1.28 3.93 -0.38 0.00 2.01 -1.26 0.22 115.64 121.43 2dmh s THR 92 Ca -0.08 -0.30 -0.15 0.00 0.31 0.00 0.00 61.69 61.47 2dmh s THR 92 Cb -0.04 -2.81 0.00 0.00 0.01 0.00 0.00 72.50 69.66 2dmh s THR 92 CO -0.15 0.38 0.32 -0.69 -0.69 0.00 0.00 174.62 173.79 2dmh s VAL 93 N 1.47 5.22 -0.36 3.82 1.01 0.16 -4.94 120.40 126.78 2dmh s VAL 93 Ca 0.05 -0.37 -0.29 0.00 0.00 0.00 0.00 61.98 61.38 2dmh s VAL 93 Cb -0.15 -3.87 -0.00 0.00 0.00 0.00 0.00 36.38 32.36 2dmh s VAL 93 CO 0.01 -0.21 1.56 0.00 0.00 0.00 0.00 175.10 176.45 2dmh s ALA 94 N 1.83 3.02 -2.03 5.51 0.00 -1.26 -0.30 121.76 128.53 2dmh s ALA 94 Ca 0.08 0.05 0.14 0.00 0.00 0.00 0.00 51.96 52.23 2dmh s ALA 94 Cb -0.18 -3.95 0.79 0.00 0.00 0.00 0.00 23.12 19.78 2dmh s ALA 94 CO 0.11 -2.41 1.52 1.28 0.00 0.00 0.00 175.76 176.26 2dmh n LEU 95 N 9.24 0.22 0.08 0.00 4.77 -1.00 -3.79 117.00 126.53 2dmh n LEU 95 Ca 0.19 -0.10 0.06 0.00 -0.03 0.00 0.00 56.01 56.13 2dmh n LEU 95 Cb 0.47 -0.02 0.30 0.00 -2.33 0.00 0.00 43.42 41.85 2dmh n LEU 95 CO 0.69 0.05 0.67 2.29 -1.33 0.00 0.00 177.39 179.76 2dmh n LYS 96 N -0.57 0.07 -0.01 3.23 2.85 -1.24 -1.51 118.16 120.98 2dmh n LYS 96 Ca 0.11 0.56 -0.21 0.00 -1.05 0.00 0.00 58.31 57.72 2dmh n LYS 96 Cb 0.08 -1.73 -0.14 0.00 -0.65 0.00 0.00 35.03 32.59 2dmh n LYS 96 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2dmh n ASP 97 N -1.88 2.08 0.22 -5.58 8.00 -1.25 -4.12 116.55 114.02 2dmh n ASP 97 Ca -0.01 0.18 0.08 0.00 0.71 0.00 0.00 54.79 55.75 2dmh n ASP 97 Cb 0.02 -0.80 0.51 0.00 -0.02 0.00 0.00 41.12 40.84 2dmh n ASP 97 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 2dmh h LEU 98 N 0.06 0.00 -9.16 0.64 3.38 -1.54 -3.45 115.31 105.24 2dmh h LEU 98 Ca -0.44 0.00 -0.60 0.00 0.09 0.00 0.00 57.88 56.93 2dmh h LEU 98 Cb 2.02 0.00 0.17 0.00 0.09 0.00 0.00 40.66 42.94 2dmh h LEU 98 CO 0.07 0.25 -0.87 0.35 0.09 0.00 0.00 178.44 178.34 2dmh n THR 99 N -3.76 0.82 -0.85 0.22 -2.24 -0.92 -4.72 114.28 102.83 2dmh n THR 99 Ca -0.01 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.27 2dmh n THR 99 Cb 0.36 -0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.36 2dmh n THR 99 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dmh n GLY 100 N 2.23 -0.03 2.12 3.38 0.00 -1.26 -4.94 105.19 106.69 2dmh n GLY 100 Ca 0.10 -1.70 -0.28 0.00 0.00 0.00 0.00 46.02 44.14 2dmh n GLY 100 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2dmh n ASP 101 N 3.00 6.02 -3.57 1.61 2.03 -1.26 -4.81 116.55 119.57 2dmh n ASP 101 Ca 0.00 -3.77 -0.14 0.00 0.52 0.00 0.00 54.79 51.40 2dmh n ASP 101 Cb 0.00 -0.63 -0.06 0.00 -0.72 0.00 0.00 41.12 39.71 2dmh n ASP 101 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2dmh s GLN 102 N -3.68 0.83 0.06 -0.67 -2.07 -1.26 -4.96 119.66 107.90 2dmh s GLN 102 Ca 0.57 0.45 -0.31 0.00 -1.82 0.00 0.00 55.36 54.25 2dmh s GLN 102 Cb 0.45 0.39 -0.10 0.00 -1.09 0.00 0.00 33.01 32.67 2dmh s GLN 102 CO 0.02 -0.21 1.91 0.45 -1.32 0.00 0.00 175.29 176.14 2dmh n SER 103 N 1.46 4.02 -3.76 12.60 2.88 -1.26 -4.70 113.62 124.86 2dmh n SER 103 Ca -0.15 0.94 -0.23 0.00 -1.33 0.00 0.00 58.87 58.11 2dmh n SER 103 Cb 0.57 -1.51 -0.18 0.00 -0.75 0.00 0.00 64.21 62.34 2dmh n SER 103 CO 0.00 0.00 0.00 -0.60 -1.23 0.00 0.00 175.04 173.21 2dmh s ARG 104 N 3.71 0.56 -0.30 -1.46 3.52 -0.78 -4.97 118.95 119.23 2dmh s ARG 104 Ca 0.87 0.11 0.02 0.00 -0.13 0.00 0.00 55.73 56.59 2dmh s ARG 104 Cb -0.49 -0.99 0.08 0.00 -1.56 0.00 0.00 34.95 31.99 2dmh s ARG 104 CO 0.41 -0.32 -0.02 -1.54 -0.81 0.00 0.00 175.30 173.02 2dmh s SER 105 N 1.98 4.67 -0.25 -2.12 1.04 -1.26 -0.79 113.70 116.97 2dmh s SER 105 Ca 0.05 -1.67 -0.08 0.00 0.48 0.00 0.00 55.95 54.73 2dmh s SER 105 Cb -0.12 -1.62 -0.03 0.00 0.10 0.00 0.00 66.02 64.35 2dmh s SER 105 CO -0.05 -0.29 0.08 -0.76 0.98 0.00 0.00 173.24 173.21 2dmh s LEU 106 N 1.06 3.52 -0.39 2.42 1.43 -1.06 -4.97 118.68 120.68 2dmh s LEU 106 Ca -0.01 -0.19 -0.28 0.00 -1.03 0.00 0.00 54.13 52.62 2dmh s LEU 106 Cb -0.20 -1.95 -0.01 0.00 0.03 0.00 0.00 46.19 44.06 2dmh s LEU 106 CO -0.05 -0.04 1.72 -2.16 0.23 0.00 0.00 176.35 176.05 2dmh s PRO 107 N 1.63 3.29 -0.56 1.29 0.04 -1.26 -3.73 135.00 135.70 2dmh s PRO 107 Ca 0.06 1.20 -0.19 0.00 0.04 0.00 0.00 61.00 62.12 2dmh s PRO 107 Cb -0.15 -4.19 0.08 0.00 0.04 0.00 0.00 34.50 30.28 2dmh s PRO 107 CO 0.04 -1.92 0.68 0.71 0.04 0.00 0.00 177.00 176.56 2dmh s TYR 108 N 6.88 3.01 0.33 0.56 1.51 0.29 -4.97 117.35 124.95 2dmh s TYR 108 Ca 0.74 -0.78 0.06 0.00 -1.01 0.00 0.00 57.07 56.09 2dmh s TYR 108 Cb -0.19 -3.83 -0.06 0.00 -0.11 0.00 0.00 41.96 37.76 2dmh s TYR 108 CO 0.32 -1.20 -0.02 0.15 -1.11 0.00 0.00 175.55 173.68 2dmh s LYS 109 N 2.71 1.70 -1.22 -0.62 1.02 -1.26 0.36 119.74 122.42 2dmh s LYS 109 Ca 0.13 -1.90 -0.01 0.00 0.02 0.00 0.00 55.97 54.20 2dmh s LYS 109 Cb -0.22 -1.27 0.00 0.00 -0.52 0.00 0.00 37.83 35.82 2dmh s LYS 109 CO 0.09 -0.02 0.18 1.28 -0.92 0.00 0.00 175.35 175.96 2dmh n LEU 110 N -0.72 -1.97 -4.69 3.17 4.77 -1.26 -4.95 117.00 111.35 2dmh n LEU 110 Ca -0.05 -0.09 -0.42 0.00 -0.03 0.00 0.00 56.01 55.42 2dmh n LEU 110 Cb 0.65 -2.28 -0.03 0.00 -2.33 0.00 0.00 43.42 39.44 2dmh n LEU 110 CO 0.43 -0.02 0.99 -0.63 -1.33 0.00 0.00 177.39 176.82 2dmh s ILE 111 N -2.86 4.10 -0.47 -0.08 1.01 -1.25 -4.93 121.20 116.73 2dmh s ILE 111 Ca 0.09 1.45 -0.26 0.00 0.00 0.00 0.00 60.65 61.93 2dmh s ILE 111 Cb -0.04 -3.93 0.03 0.00 0.01 0.00 0.00 42.46 38.53 2dmh s ILE 111 CO 0.11 0.01 0.98 -0.44 0.00 0.00 0.00 174.94 175.60 2dmh s SER 112 N 1.54 6.53 0.28 3.58 0.01 -1.26 -3.44 113.70 120.94 2dmh s SER 112 Ca 0.58 0.20 -0.29 0.00 1.31 0.00 0.00 55.95 57.75 2dmh s SER 112 Cb -0.27 -2.48 -0.09 0.00 0.21 0.00 0.00 66.02 63.39 2dmh s SER 112 CO 0.24 -1.11 0.99 -0.76 0.41 0.00 0.00 173.24 173.01 2dmh s LEU 113 N 3.94 4.53 0.12 2.44 1.43 -0.69 -4.86 118.68 125.59 2dmh s LEU 113 Ca 0.40 2.03 0.09 0.00 -1.03 0.00 0.00 54.13 55.61 2dmh s LEU 113 Cb -0.09 -3.73 -0.04 0.00 0.03 0.00 0.00 46.19 42.36 2dmh s LEU 113 CO 0.28 -0.02 -0.22 -0.76 0.23 0.00 0.00 176.35 175.86 2dmh s LEU 114 N -1.53 2.33 0.00 1.79 1.43 -0.70 -2.01 118.68 119.98 2dmh s LEU 114 Ca 0.45 -0.73 -0.10 0.00 -1.03 0.00 0.00 54.13 52.72 2dmh s LEU 114 Cb -0.26 -0.95 0.14 0.00 0.03 0.00 0.00 46.19 45.15 2dmh s LEU 114 CO 0.33 0.07 0.83 -0.46 0.23 0.00 0.00 176.35 177.35 2dmh n ASN 115 N 0.91 0.02 0.16 2.29 0.23 -1.10 -0.22 115.26 117.55 2dmh n ASN 115 Ca -0.18 -1.29 0.12 0.00 -0.53 0.00 0.00 54.58 52.70 2dmh n ASN 115 Cb 0.54 -0.64 0.58 0.00 -2.08 0.00 0.00 39.78 38.18 2dmh n ASN 115 CO 0.00 0.00 0.00 -1.84 -0.93 0.00 0.00 177.26 174.49 2dmh n GLU 116 N -2.78 0.17 0.02 -3.83 0.28 -1.26 -1.55 120.64 111.68 2dmh n GLU 116 Ca 0.10 0.57 -0.12 0.00 -0.16 0.00 0.00 57.16 57.56 2dmh n GLU 116 Cb 0.36 -1.95 -0.14 0.00 1.43 0.00 0.00 31.44 31.14 2dmh n GLU 116 CO 0.00 0.00 0.00 0.87 -0.16 0.00 0.00 177.13 177.84 2dmh h LYS 117 N 0.00 0.10 0.00 3.44 6.56 -2.01 -3.48 116.57 121.18 2dmh h LYS 117 Ca 0.00 -0.18 0.00 0.00 -1.06 0.00 0.00 60.65 59.41 2dmh h LYS 117 Cb 0.12 0.07 0.00 0.00 -0.57 0.00 0.00 32.23 31.85 2dmh h LYS 117 CO 0.00 0.84 0.00 0.41 -2.06 0.00 0.00 179.45 178.64 2dmh n GLY 118 N 1.61 1.33 3.97 3.86 0.00 -0.59 -5.12 105.19 110.25 2dmh n GLY 118 Ca -0.16 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.65 2dmh n GLY 118 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2dmh s GLN 119 N -0.21 2.88 -0.72 1.61 -1.52 -1.26 -4.84 119.66 115.60 2dmh s GLN 119 Ca 0.00 -0.77 -0.27 0.00 -1.95 0.00 0.00 55.36 52.37 2dmh s GLN 119 Cb 0.00 -2.61 0.03 0.00 -0.22 0.00 0.00 33.01 30.21 2dmh s GLN 119 CO 0.00 -0.36 1.28 0.16 -0.25 0.00 0.00 175.29 176.13 2dmh s ASP 120 N -4.29 6.18 0.24 5.90 1.47 -1.26 -2.71 116.67 122.19 2dmh s ASP 120 Ca 0.51 -0.37 -0.06 0.00 1.18 0.00 0.00 52.55 53.81 2dmh s ASP 120 Cb -0.10 -2.56 0.23 0.00 -0.34 0.00 0.00 42.92 40.15 2dmh s ASP 120 CO 0.36 -1.81 1.84 0.71 0.68 0.00 0.00 175.17 176.95 2dmh h THR 121 N 6.06 1.25 0.00 2.11 1.35 -1.75 -3.47 112.91 118.47 2dmh h THR 121 Ca -0.28 -0.69 0.00 0.00 -0.55 0.00 0.00 66.41 64.89 2dmh h THR 121 Cb 1.05 0.16 0.00 0.00 -1.73 0.00 0.00 68.15 67.63 2dmh h THR 121 CO 1.27 0.30 0.00 0.61 -0.25 0.00 0.00 175.52 177.45 2dmh n GLY 122 N -1.06 1.24 3.48 5.82 0.00 -1.26 -4.83 105.19 108.58 2dmh n GLY 122 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 2dmh n GLY 122 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dmh s ALA 123 N -2.00 2.88 -0.05 4.61 0.00 -1.15 -4.59 121.76 121.45 2dmh s ALA 123 Ca 0.00 -0.85 0.06 0.00 0.00 0.00 0.00 51.96 51.16 2dmh s ALA 123 Cb 0.00 -1.38 -0.02 0.00 0.00 0.00 0.00 23.12 21.72 2dmh s ALA 123 CO 0.00 0.30 -0.22 0.95 0.00 0.00 0.00 175.76 176.79 2dmh s THR 124 N 0.11 2.39 -0.03 0.00 -4.23 -0.40 -1.70 115.64 111.78 2dmh s THR 124 Ca -0.03 -0.96 0.02 0.00 -1.18 0.00 0.00 61.69 59.54 2dmh s THR 124 Cb -0.14 -1.89 0.01 0.00 1.34 0.00 0.00 72.50 71.82 2dmh s THR 124 CO 0.03 0.58 -0.06 -0.51 -0.54 0.00 0.00 174.62 174.12 2dmh s ILE 125 N -0.42 0.54 0.14 2.99 2.07 -1.22 -0.98 121.20 124.32 2dmh s ILE 125 Ca 0.04 -0.20 -0.17 0.00 -1.41 0.00 0.00 60.65 58.91 2dmh s ILE 125 Cb -0.12 -0.52 -0.07 0.00 0.13 0.00 0.00 42.46 41.88 2dmh s ILE 125 CO 0.01 0.19 0.60 -1.81 -1.91 0.00 0.00 174.94 172.03 2dmh s ASP 126 N 0.44 6.96 -0.09 4.50 1.11 -0.94 -3.78 116.67 124.87 2dmh s ASP 126 Ca -0.06 1.22 -0.15 0.00 0.18 0.00 0.00 52.55 53.74 2dmh s ASP 126 Cb -0.09 -2.34 0.04 0.00 1.07 0.00 0.00 42.92 41.59 2dmh s ASP 126 CO 0.00 0.14 0.39 -0.76 1.18 0.00 0.00 175.17 176.12 2dmh s LEU 127 N -1.69 0.53 -0.35 1.23 1.43 0.16 -3.32 118.68 116.66 2dmh s LEU 127 Ca 0.36 0.54 0.02 0.00 -1.03 0.00 0.00 54.13 54.02 2dmh s LEU 127 Cb -0.17 1.42 0.11 0.00 0.03 0.00 0.00 46.19 47.58 2dmh s LEU 127 CO 0.20 -0.28 0.11 -0.69 0.23 0.00 0.00 176.35 175.91 2dmh s VAL 128 N -0.44 1.53 -0.01 -1.59 1.01 0.06 0.11 120.40 121.07 2dmh s VAL 128 Ca -0.06 -2.00 -0.15 0.00 0.00 0.00 0.00 61.98 59.77 2dmh s VAL 128 Cb -0.03 -2.13 -0.06 0.00 0.00 0.00 0.00 36.38 34.16 2dmh s VAL 128 CO 0.03 -0.69 0.42 -0.63 0.00 0.00 0.00 175.10 174.22 2dmh s ILE 129 N 1.09 5.04 -0.11 2.22 1.01 -1.24 -1.56 121.20 127.65 2dmh s ILE 129 Ca 0.12 0.85 0.01 0.00 0.00 0.00 0.00 60.65 61.63 2dmh s ILE 129 Cb -0.19 -3.72 0.02 0.00 0.01 0.00 0.00 42.46 38.57 2dmh s ILE 129 CO -0.14 0.55 -0.14 -0.83 0.00 0.00 0.00 174.94 174.37 2dmh s GLY 130 N -0.86 1.01 0.06 6.18 0.00 0.18 -2.57 107.32 111.32 2dmh s GLY 130 Ca 0.24 -0.70 -0.09 0.00 0.00 0.00 0.00 44.72 44.16 2dmh s GLY 130 CO 0.13 0.29 0.37 -0.47 0.00 0.00 0.00 173.10 173.42 2dmh s TYR 131 N 1.05 3.58 -0.17 1.90 5.04 0.03 -2.40 117.35 126.38 2dmh s TYR 131 Ca -0.06 0.74 -0.04 0.00 -2.44 0.00 0.00 57.07 55.28 2dmh s TYR 131 Cb -0.15 -2.12 0.08 0.00 0.35 0.00 0.00 41.96 40.12 2dmh s TYR 131 CO -0.02 0.54 0.24 0.34 -1.34 0.00 0.00 175.55 175.31 2dmh s ASP 132 N -1.75 0.89 0.35 4.32 -1.08 -1.23 -1.86 116.67 116.31 2dmh s ASP 132 Ca 0.32 0.14 -0.28 0.00 -0.52 0.00 0.00 52.55 52.21 2dmh s ASP 132 Cb -0.14 0.53 -0.09 0.00 -1.46 0.00 0.00 42.92 41.76 2dmh s ASP 132 CO 0.18 -0.29 1.21 -2.16 0.52 0.00 0.00 175.17 174.63 2dmh s PRO 133 N 2.37 4.30 0.53 4.34 0.04 -1.26 -3.26 135.00 142.05 2dmh s PRO 133 Ca 0.05 1.99 -0.20 0.00 0.04 0.00 0.00 61.00 62.88 2dmh s PRO 133 Cb -0.14 -2.95 -0.06 0.00 0.04 0.00 0.00 34.50 31.39 2dmh s PRO 133 CO -0.11 -0.16 1.14 -1.25 0.04 0.00 0.00 177.00 176.66 2dmh s PRO 134 N -1.91 3.44 -0.53 0.56 0.04 -1.26 -4.54 135.00 130.80 2dmh s PRO 134 Ca 0.51 1.64 0.02 0.00 0.04 0.00 0.00 61.00 63.21 2dmh s PRO 134 Cb -0.35 -2.09 0.55 0.00 0.04 0.00 0.00 34.50 32.66 2dmh s PRO 134 CO 0.45 -0.78 1.92 0.45 0.04 0.00 0.00 177.00 179.07 2dmh n SER 135 N -1.13 5.51 -4.10 6.66 2.88 0.03 -4.89 113.62 118.58 2dmh n SER 135 Ca 0.11 -3.71 -0.07 0.00 -1.33 0.00 0.00 58.87 53.86 2dmh n SER 135 Cb 0.50 -0.87 -0.10 0.00 -0.75 0.00 0.00 64.21 62.99 2dmh n SER 135 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2dmh s GLY 136 N -1.71 0.54 -0.45 0.46 0.00 -1.26 -4.81 107.32 100.10 2dmh s GLY 136 Ca 0.60 -1.25 -0.28 0.00 0.00 0.00 0.00 44.72 43.79 2dmh s GLY 136 CO 0.05 -1.33 1.76 2.56 0.00 0.00 0.00 173.10 176.14 2dmh s PRO 137 N -3.93 3.11 -0.25 2.90 0.04 -1.26 -4.97 135.00 130.63 2dmh s PRO 137 Ca 0.09 1.05 -0.04 0.00 0.04 0.00 0.00 61.00 62.14 2dmh s PRO 137 Cb 0.08 -4.24 0.01 0.00 0.04 0.00 0.00 34.50 30.38 2dmh s PRO 137 CO -0.08 -2.14 -0.02 0.45 0.04 0.00 0.00 177.00 175.25 2dmh s SER 138 N 6.52 4.53 0.05 6.66 0.15 -1.26 -5.07 113.70 125.28 2dmh s SER 138 Ca 0.72 -0.66 -0.33 0.00 0.70 0.00 0.00 55.95 56.38 2dmh s SER 138 Cb -0.17 -1.75 -0.12 0.00 -1.71 0.00 0.00 66.02 62.27 2dmh s SER 138 CO 0.29 -0.11 1.81 -1.54 1.20 0.00 0.00 173.24 174.89 2dmh n SER 139 N 4.77 3.65 -0.73 5.45 3.41 -1.26 -5.07 113.62 123.83 2dmh n SER 139 Ca -0.17 0.99 0.09 0.00 -0.26 0.00 0.00 58.87 59.53 2dmh n SER 139 Cb 0.49 -1.46 0.08 0.00 -0.26 0.00 0.00 64.21 63.05 2dmh n SER 139 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49