#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dmh s SER 2 N 0.00 1.57 -0.30 1.61 0.01 -1.26 -5.15 113.70 110.17 2dmh s SER 2 Ca 0.00 -1.05 -0.10 0.00 1.31 0.00 0.00 55.95 56.11 2dmh s SER 2 Cb 0.00 0.03 0.13 0.00 0.21 0.00 0.00 66.02 66.39 2dmh s SER 2 CO 0.00 -0.41 0.66 -0.44 0.41 0.00 0.00 173.24 173.46 2dmh s SER 3 N -3.15 -1.14 0.00 2.44 0.01 -1.26 -4.85 113.70 105.75 2dmh s SER 3 Ca 0.17 1.57 0.00 0.00 1.31 0.00 0.00 55.95 59.00 2dmh s SER 3 Cb 0.04 2.28 0.00 0.00 0.21 0.00 0.00 66.02 68.55 2dmh s SER 3 CO 0.00 -0.22 0.00 0.61 0.41 0.00 0.00 173.24 174.05 2dmh n GLY 4 N 5.42 -0.15 0.42 3.44 0.00 -1.26 -5.01 105.19 108.05 2dmh n GLY 4 Ca -0.12 0.17 -0.17 0.00 0.00 0.00 0.00 46.02 45.91 2dmh n GLY 4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2dmh h SER 5 N 0.00 -1.08 -6.11 1.61 0.02 -1.97 -3.45 113.55 102.58 2dmh h SER 5 Ca 0.00 0.09 -0.46 0.00 -0.84 0.00 0.00 61.79 60.58 2dmh h SER 5 Cb 0.00 0.36 -0.28 0.00 0.14 0.00 0.00 62.40 62.61 2dmh h SER 5 CO 0.00 -0.56 -0.66 -1.20 -1.14 0.00 0.00 176.83 173.26 2dmh n SER 6 N -5.50 -1.36 -1.59 3.07 7.64 -1.26 -4.12 113.62 110.50 2dmh n SER 6 Ca -0.11 -0.90 0.00 0.00 1.01 0.00 0.00 58.87 58.87 2dmh n SER 6 Cb 0.40 -1.19 0.00 0.00 -1.01 0.00 0.00 64.21 62.41 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 -0.90 -4.57 3.62 0.23 0.00 -1.26 -1.41 105.19 100.89 2dmh n GLY 7 Ca 0.09 -0.72 -0.04 0.00 0.00 0.00 0.00 46.02 45.35 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 -3.99 0.58 -0.34 1.61 -2.45 -1.21 -2.98 119.30 110.51 2dmh s MET 8 Ca 0.00 1.14 -0.13 0.00 -1.25 0.00 0.00 55.69 55.46 2dmh s MET 8 Cb 0.00 0.36 -0.02 0.00 1.25 0.00 0.00 34.83 36.42 2dmh s MET 8 CO 0.00 -0.15 0.23 -1.17 1.05 0.00 0.00 175.02 174.99 2dmh s LEU 9 N 2.00 4.48 -0.09 4.11 2.96 -0.48 -3.73 118.68 127.93 2dmh s LEU 9 Ca -0.08 -0.43 -0.09 0.00 -0.22 0.00 0.00 54.13 53.31 2dmh s LEU 9 Cb -0.07 -2.13 -0.04 0.00 0.50 0.00 0.00 46.19 44.45 2dmh s LEU 9 CO -0.19 -0.23 0.20 -0.13 -1.32 0.00 0.00 176.35 174.69 2dmh s ARG 10 N 1.71 3.57 -0.28 1.98 0.52 -0.77 -0.89 118.95 124.80 2dmh s ARG 10 Ca 0.06 -0.00 -0.02 0.00 -0.52 0.00 0.00 55.73 55.25 2dmh s ARG 10 Cb -0.17 -3.20 0.09 0.00 0.52 0.00 0.00 34.95 32.18 2dmh s ARG 10 CO 0.10 0.74 0.08 0.08 0.02 0.00 0.00 175.30 176.33 2dmh s VAL 11 N -0.99 0.65 -0.16 3.52 1.01 -0.67 -0.53 120.40 123.22 2dmh s VAL 11 Ca 0.17 -1.09 -0.22 0.00 0.00 0.00 0.00 61.98 60.84 2dmh s VAL 11 Cb -0.13 -1.41 -0.03 0.00 0.00 0.00 0.00 36.38 34.82 2dmh s VAL 11 CO 0.06 -0.56 0.67 -0.63 0.00 0.00 0.00 175.10 174.64 2dmh s ILE 12 N 1.75 5.01 -0.72 2.22 1.01 -0.22 -1.41 121.20 128.84 2dmh s ILE 12 Ca 0.07 1.29 -0.14 0.00 0.00 0.00 0.00 60.65 61.88 2dmh s ILE 12 Cb -0.17 -3.99 0.19 0.00 0.01 0.00 0.00 42.46 38.50 2dmh s ILE 12 CO -0.23 0.14 0.66 -0.69 0.00 0.00 0.00 174.94 174.82 2dmh s VAL 13 N 1.65 5.33 0.00 2.92 1.01 0.76 -1.32 120.40 130.75 2dmh s VAL 13 Ca 0.32 -2.21 0.00 0.00 0.00 0.00 0.00 61.98 60.09 2dmh s VAL 13 Cb -0.16 -4.34 0.00 0.00 0.00 0.00 0.00 36.38 31.88 2dmh s VAL 13 CO 0.12 -0.97 0.72 -0.62 0.00 0.00 0.00 175.10 174.36 2dmh n GLU 14 N 4.33 0.00 -3.71 2.72 -0.58 -1.12 0.10 120.64 122.38 2dmh n GLU 14 Ca 0.05 0.25 0.01 0.00 -0.42 0.00 0.00 57.16 57.06 2dmh n GLU 14 Cb 0.44 -1.23 -0.00 0.00 -0.57 0.00 0.00 31.44 30.08 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 -2.00 -0.05 0.27 1.62 1.04 -1.25 -0.71 113.70 112.62 2dmh s SER 15 Ca 0.00 -0.19 0.04 0.00 0.48 0.00 0.00 55.95 56.28 2dmh s SER 15 Cb 0.00 0.19 -0.06 0.00 0.10 0.00 0.00 66.02 66.26 2dmh s SER 15 CO 0.00 -0.37 0.01 0.00 0.98 0.00 0.00 173.24 173.86 2dmh s ALA 16 N -2.38 2.07 0.24 5.32 0.00 -0.75 -1.08 121.76 125.18 2dmh s ALA 16 Ca 0.18 -1.89 -0.19 0.00 0.00 0.00 0.00 51.96 50.06 2dmh s ALA 16 Cb 0.03 0.52 0.03 0.00 0.00 0.00 0.00 23.12 23.69 2dmh s ALA 16 CO -0.02 -0.25 0.62 -1.12 0.00 0.00 0.00 175.76 174.99 2dmh s SER 17 N -3.39 -0.28 -0.96 0.00 0.01 0.56 -3.30 113.70 106.34 2dmh s SER 17 Ca 0.32 -0.53 -0.01 0.00 1.31 0.00 0.00 55.95 57.03 2dmh s SER 17 Cb 0.06 0.65 0.00 0.00 0.21 0.00 0.00 66.02 66.95 2dmh s SER 17 CO 0.12 -1.19 0.81 0.59 0.41 0.00 0.00 173.24 173.98 2dmh n ASN 18 N -0.41 -2.52 -4.83 2.44 3.02 -1.26 -1.19 115.26 110.50 2dmh n ASN 18 Ca -0.07 -0.48 -0.38 0.00 -0.03 0.00 0.00 54.58 53.62 2dmh n ASN 18 Cb 0.61 -4.14 -0.06 0.00 -0.61 0.00 0.00 39.78 35.58 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 -3.28 5.16 -0.46 2.41 1.01 -1.25 -3.25 121.20 121.54 2dmh s ILE 19 Ca 0.07 0.68 -0.28 0.00 0.00 0.00 0.00 60.65 61.12 2dmh s ILE 19 Cb -0.03 -3.64 -0.02 0.00 0.01 0.00 0.00 42.46 38.78 2dmh s ILE 19 CO 0.58 0.56 1.77 -2.16 0.00 0.00 0.00 174.94 175.69 2dmh s PRO 20 N -0.87 3.07 1.17 2.79 0.04 -1.26 -4.91 135.00 135.04 2dmh s PRO 20 Ca 0.21 1.02 -0.17 0.00 0.04 0.00 0.00 61.00 62.10 2dmh s PRO 20 Cb -0.15 -4.25 0.27 0.00 0.04 0.00 0.00 34.50 30.41 2dmh s PRO 20 CO 0.10 -2.18 0.61 0.36 0.04 0.00 0.00 177.00 175.94 2dmh n LYS 21 N 8.69 -3.02 -4.47 4.56 2.85 -1.26 -4.82 118.16 120.69 2dmh n LYS 21 Ca 0.21 -1.03 -0.22 0.00 -1.05 0.00 0.00 58.31 56.21 2dmh n LYS 21 Cb 0.49 -1.60 -0.11 0.00 -0.65 0.00 0.00 35.03 33.17 2dmh n LYS 21 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 177.40 177.27 2dmh s THR 22 N -2.01 1.37 0.45 0.58 -1.32 0.11 -4.89 115.64 109.92 2dmh s THR 22 Ca 0.47 -2.02 0.19 0.00 -1.21 0.00 0.00 61.69 59.13 2dmh s THR 22 Cb -0.08 -2.78 0.23 0.00 -1.51 0.00 0.00 72.50 68.36 2dmh s THR 22 CO 0.40 -0.04 2.03 0.50 -2.21 0.00 0.00 174.62 175.30 2dmh h LYS 23 N 2.09 0.00 -0.98 7.08 3.64 -2.00 -2.43 116.57 123.96 2dmh h LYS 23 Ca -0.41 0.00 -0.66 0.00 -1.27 0.00 0.00 60.65 58.30 2dmh h LYS 23 Cb 1.24 0.00 -0.30 0.00 -0.41 0.00 0.00 32.23 32.76 2dmh h LYS 23 CO 0.71 0.15 0.77 1.19 -2.27 0.00 0.00 179.45 180.00 2dmh n PHE 24 N -4.08 3.20 -0.41 1.91 3.01 -1.26 -5.03 117.46 114.80 2dmh n PHE 24 Ca -0.02 -2.94 0.00 0.00 1.01 0.00 0.00 57.45 55.49 2dmh n PHE 24 Cb 0.23 -1.37 0.00 0.00 -0.01 0.00 0.00 39.48 38.33 2dmh n PHE 24 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2dmh n GLY 25 N -0.92 0.84 3.53 1.37 0.00 -0.92 -4.87 105.19 104.23 2dmh n GLY 25 Ca 0.62 -1.30 -0.34 0.00 0.00 0.00 0.00 46.02 45.00 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 0.00 3.76 1.10 1.61 1.02 -1.26 0.05 119.74 126.02 2dmh s LYS 26 Ca 0.00 -0.46 -0.18 0.00 0.02 0.00 0.00 55.97 55.35 2dmh s LYS 26 Cb 0.00 -3.05 0.27 0.00 -0.52 0.00 0.00 37.83 34.53 2dmh s LYS 26 CO 0.00 0.20 0.97 -0.35 -0.92 0.00 0.00 175.35 175.26 2dmh n PRO 27 N 3.68 -2.92 -3.66 -1.68 -0.04 -1.26 -4.00 135.00 125.12 2dmh n PRO 27 Ca -0.17 -1.56 -0.38 0.00 -0.04 0.00 0.00 63.50 61.35 2dmh n PRO 27 Cb 0.52 -1.46 -0.09 0.00 -0.04 0.00 0.00 33.50 32.44 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 -4.13 5.49 0.39 3.54 1.11 -1.26 -3.25 116.67 118.56 2dmh s ASP 28 Ca 0.63 -2.68 -0.26 0.00 0.18 0.00 0.00 52.55 50.42 2dmh s ASP 28 Cb -0.06 -1.91 -0.09 0.00 1.07 0.00 0.00 42.92 41.93 2dmh s ASP 28 CO 0.49 -0.44 1.19 -2.16 1.18 0.00 0.00 175.17 175.43 2dmh s PRO 29 N 0.19 4.11 -0.18 8.23 0.04 -1.25 -1.80 135.00 144.34 2dmh s PRO 29 Ca 0.15 1.91 -0.08 0.00 0.04 0.00 0.00 61.00 63.02 2dmh s PRO 29 Cb -0.20 -2.75 0.07 0.00 0.04 0.00 0.00 34.50 31.66 2dmh s PRO 29 CO -0.04 -0.30 0.41 -1.50 0.04 0.00 0.00 177.00 175.61 2dmh s ILE 30 N -1.35 -0.29 0.23 0.56 2.07 -1.08 -2.96 121.20 118.39 2dmh s ILE 30 Ca 0.55 0.13 -0.30 0.00 -1.41 0.00 0.00 60.65 59.63 2dmh s ILE 30 Cb -0.33 -0.62 -0.09 0.00 0.13 0.00 0.00 42.46 41.55 2dmh s ILE 30 CO 0.41 0.06 0.96 -0.69 -1.91 0.00 0.00 174.94 173.77 2dmh s VAL 31 N 1.93 4.03 -0.22 4.00 1.01 -1.26 -3.31 120.40 126.57 2dmh s VAL 31 Ca -0.06 2.01 -0.04 0.00 0.00 0.00 0.00 61.98 63.89 2dmh s VAL 31 Cb -0.10 -4.28 0.07 0.00 0.00 0.00 0.00 36.38 32.08 2dmh s VAL 31 CO -0.13 0.46 0.08 -0.44 0.00 0.00 0.00 175.10 175.08 2dmh s SER 32 N -1.03 2.95 0.08 3.32 0.01 -0.19 -0.68 113.70 118.16 2dmh s SER 32 Ca 0.42 -0.93 -0.04 0.00 1.31 0.00 0.00 55.95 56.71 2dmh s SER 32 Cb -0.27 -0.44 -0.05 0.00 0.21 0.00 0.00 66.02 65.48 2dmh s SER 32 CO 0.33 -0.36 0.30 -0.69 0.41 0.00 0.00 173.24 173.23 2dmh s VAL 33 N 1.99 5.26 -0.03 3.43 1.01 0.11 -1.93 120.40 130.23 2dmh s VAL 33 Ca 0.03 -0.04 0.01 0.00 0.00 0.00 0.00 61.98 61.98 2dmh s VAL 33 Cb -0.16 -3.61 0.02 0.00 0.00 0.00 0.00 36.38 32.63 2dmh s VAL 33 CO -0.16 0.15 -0.03 -0.63 0.00 0.00 0.00 175.10 174.43 2dmh s ILE 34 N -1.52 0.36 -0.28 2.22 1.09 -1.11 -1.37 121.20 120.58 2dmh s ILE 34 Ca 0.36 -0.04 -0.17 0.00 -1.10 0.00 0.00 60.65 59.70 2dmh s ILE 34 Cb -0.13 -0.41 0.10 0.00 -1.06 0.00 0.00 42.46 40.96 2dmh s ILE 34 CO 0.23 0.18 0.78 0.12 -0.10 0.00 0.00 174.94 176.15 2dmh s PHE 35 N 0.86 -0.90 -1.11 3.97 5.36 -0.91 -3.46 117.98 121.79 2dmh s PHE 35 Ca -0.10 1.83 -0.04 0.00 -0.96 0.00 0.00 56.93 57.66 2dmh s PHE 35 Cb -0.13 0.53 0.00 0.00 -0.34 0.00 0.00 43.02 43.08 2dmh s PHE 35 CO -0.01 -0.44 0.94 1.63 -1.46 0.00 0.00 175.22 175.89 2dmh n LYS 36 N 3.97 -6.31 -3.43 10.12 4.76 -1.26 -2.38 118.16 123.64 2dmh n LYS 36 Ca -0.19 0.73 -0.25 0.00 -2.87 0.00 0.00 58.31 55.73 2dmh n LYS 36 Cb 0.58 -5.44 0.04 0.00 -1.84 0.00 0.00 35.03 28.37 2dmh n LYS 36 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 2dmh n ASP 37 N -2.67 -5.50 -3.87 4.39 -0.08 -1.26 -4.97 116.55 102.59 2dmh n ASP 37 Ca -0.14 -0.48 -0.28 0.00 -1.51 0.00 0.00 54.79 52.39 2dmh n ASP 37 Cb 0.61 -4.41 -0.16 0.00 2.34 0.00 0.00 41.12 39.49 2dmh n ASP 37 CO 0.00 0.00 0.00 -0.70 0.12 0.00 0.00 177.20 176.62 2dmh s GLU 38 N -6.12 1.34 -0.24 -0.67 2.12 -1.00 -5.12 118.70 109.01 2dmh s GLU 38 Ca 0.48 -0.48 -0.12 0.00 0.36 0.00 0.00 54.97 55.21 2dmh s GLU 38 Cb -0.23 -1.96 -0.05 0.00 0.26 0.00 0.00 34.13 32.15 2dmh s GLU 38 CO 0.59 -0.44 0.22 0.21 -0.54 0.00 0.00 175.26 175.30 2dmh s LYS 39 N 1.66 4.08 -0.01 4.30 2.47 -1.26 -2.15 119.74 128.83 2dmh s LYS 39 Ca 0.01 -0.17 -0.00 0.00 -1.56 0.00 0.00 55.97 54.24 2dmh s LYS 39 Cb -0.15 -3.56 0.01 0.00 -1.46 0.00 0.00 37.83 32.67 2dmh s LYS 39 CO -0.08 -0.00 0.02 0.15 0.16 0.00 0.00 175.35 175.60 2dmh s LYS 40 N 1.23 0.01 0.15 4.03 1.02 -0.47 -5.03 119.74 120.68 2dmh s LYS 40 Ca 0.10 0.06 0.07 0.00 0.02 0.00 0.00 55.97 56.22 2dmh s LYS 40 Cb -0.14 -0.04 -0.04 0.00 -0.52 0.00 0.00 37.83 37.09 2dmh s LYS 40 CO 0.06 -0.04 -0.15 -1.59 -0.92 0.00 0.00 175.35 172.72 2dmh s LYS 41 N 0.22 1.15 0.64 1.68 0.00 -1.26 0.06 119.74 122.23 2dmh s LYS 41 Ca -0.02 -1.38 -0.01 0.00 0.00 0.00 0.00 55.97 54.56 2dmh s LYS 41 Cb -0.03 -1.02 0.07 0.00 0.00 0.00 0.00 37.83 36.85 2dmh s LYS 41 CO -0.01 0.19 0.90 0.95 0.00 0.00 0.00 175.35 177.38 2dmh s THR 42 N -2.44 2.43 0.17 3.79 -4.23 0.15 -4.98 115.64 110.52 2dmh s THR 42 Ca 0.14 -0.54 -0.32 0.00 -1.18 0.00 0.00 61.69 59.80 2dmh s THR 42 Cb -0.03 -2.89 -0.11 0.00 1.34 0.00 0.00 72.50 70.81 2dmh s THR 42 CO 0.04 0.00 1.72 -1.59 -0.54 0.00 0.00 174.62 174.25 2dmh s LYS 43 N -4.99 4.15 0.19 3.99 -2.85 -1.26 -4.62 119.74 114.35 2dmh s LYS 43 Ca 0.60 2.54 -0.30 0.00 -1.00 0.00 0.00 55.97 57.81 2dmh s LYS 43 Cb -0.09 -3.27 -0.08 0.00 -2.06 0.00 0.00 37.83 32.32 2dmh s LYS 43 CO 0.42 -0.75 1.28 -1.59 0.10 0.00 0.00 175.35 174.80 2dmh s LYS 44 N 1.71 4.42 -0.15 1.78 -2.85 -1.26 -4.86 119.74 118.52 2dmh s LYS 44 Ca 0.76 1.99 -0.11 0.00 -1.00 0.00 0.00 55.97 57.61 2dmh s LYS 44 Cb -0.47 -3.21 -0.05 0.00 -2.06 0.00 0.00 37.83 32.04 2dmh s LYS 44 CO 0.33 -0.21 0.21 0.08 0.10 0.00 0.00 175.35 175.86 2dmh s VAL 45 N 0.12 5.36 1.21 1.79 1.01 -1.15 -5.03 120.40 123.70 2dmh s VAL 45 Ca 0.56 0.38 -0.18 0.00 0.00 0.00 0.00 61.98 62.74 2dmh s VAL 45 Cb -0.35 -3.53 0.24 0.00 0.00 0.00 0.00 36.38 32.73 2dmh s VAL 45 CO 0.37 0.47 0.52 0.47 0.00 0.00 0.00 175.10 176.93 2dmh n ASP 46 N 3.11 -2.86 -3.29 3.32 9.92 -1.26 -3.90 116.55 121.58 2dmh n ASP 46 Ca -0.15 -0.39 -0.30 0.00 -0.53 0.00 0.00 54.79 53.41 2dmh n ASP 46 Cb 0.53 -0.99 -0.11 0.00 -0.64 0.00 0.00 41.12 39.91 2dmh n ASP 46 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 2dmh n ASN 47 N -3.39 0.22 -3.64 -2.24 3.02 -1.26 -4.78 115.26 103.20 2dmh n ASN 47 Ca 0.05 0.13 -0.07 0.00 -0.03 0.00 0.00 54.58 54.66 2dmh n ASN 47 Cb 0.54 -0.67 -0.07 0.00 -0.61 0.00 0.00 39.78 38.97 2dmh n ASN 47 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 2dmh s GLU 48 N 6.57 0.65 -0.02 3.52 2.56 -1.20 -4.87 118.70 125.91 2dmh s GLU 48 Ca 0.99 1.05 -0.23 0.00 0.00 0.00 0.00 54.97 56.79 2dmh s GLU 48 Cb -0.92 0.17 -0.21 0.00 2.00 0.00 0.00 34.13 35.16 2dmh s GLU 48 CO 0.36 -0.12 1.12 -0.07 -0.56 0.00 0.00 175.26 175.98 2dmh h LEU 49 N 6.37 0.30 -7.43 2.70 4.07 -1.88 -3.39 115.31 116.06 2dmh h LEU 49 Ca -0.29 -0.70 -0.73 0.00 0.08 0.00 0.00 57.88 56.24 2dmh h LEU 49 Cb 1.21 -0.09 -0.33 0.00 1.08 0.00 0.00 40.66 42.53 2dmh h LEU 49 CO 0.15 0.96 -0.01 0.20 -1.08 0.00 0.00 178.44 178.66 2dmh s ASN 50 N -6.33 6.21 0.68 -0.43 0.01 -1.26 -3.95 114.94 109.87 2dmh s ASN 50 Ca -0.15 -3.53 -0.14 0.00 -0.71 0.00 0.00 52.86 48.33 2dmh s ASN 50 Cb 0.02 -1.98 0.01 0.00 0.41 0.00 0.00 41.25 39.71 2dmh s ASN 50 CO 0.76 -0.25 1.11 -2.16 -1.51 0.00 0.00 177.10 175.04 2dmh s PRO 51 N -1.08 2.72 -0.23 -0.60 0.04 -1.21 -4.82 135.00 129.81 2dmh s PRO 51 Ca 0.26 1.35 -0.03 0.00 0.04 0.00 0.00 61.00 62.63 2dmh s PRO 51 Cb -0.10 -1.94 0.08 0.00 0.04 0.00 0.00 34.50 32.58 2dmh s PRO 51 CO -0.10 -1.31 0.07 0.08 0.04 0.00 0.00 177.00 175.77 2dmh s VAL 52 N -2.43 0.46 -0.21 -0.36 1.01 -1.26 -1.81 120.40 115.81 2dmh s VAL 52 Ca 0.66 -0.75 -0.14 0.00 0.00 0.00 0.00 61.98 61.75 2dmh s VAL 52 Cb -0.20 -1.13 -0.19 0.00 0.00 0.00 0.00 36.38 34.86 2dmh s VAL 52 CO 0.44 -0.40 0.08 0.79 0.00 0.00 0.00 175.10 176.01 2dmh n TRP 53 N 5.05 0.75 -2.89 5.22 8.01 -1.06 -4.96 117.44 127.55 2dmh n TRP 53 Ca -0.07 0.26 -0.16 0.00 -1.31 0.00 0.00 57.50 56.22 2dmh n TRP 53 Cb 0.45 -1.08 -0.01 0.00 -2.01 0.00 0.00 31.31 28.66 2dmh n TRP 53 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.69 174.97 2dmh n ASN 54 N -4.04 -3.44 -4.97 -0.99 2.85 0.29 -4.93 115.26 100.02 2dmh n ASN 54 Ca -0.38 -0.05 -0.19 0.00 -0.11 0.00 0.00 54.58 53.85 2dmh n ASN 54 Cb 0.85 -2.90 0.00 0.00 1.24 0.00 0.00 39.78 38.97 2dmh n ASN 54 CO 0.00 0.00 0.00 -1.83 -2.11 0.00 0.00 177.26 173.32 2dmh s GLU 55 N -5.50 2.69 0.04 1.20 -1.05 -0.99 -4.88 118.70 110.20 2dmh s GLU 55 Ca 0.19 -1.38 0.06 0.00 -0.15 0.00 0.00 54.97 53.69 2dmh s GLU 55 Cb -0.10 -2.63 -0.02 0.00 -0.44 0.00 0.00 34.13 30.94 2dmh s GLU 55 CO 0.24 -0.31 -0.17 0.42 0.95 0.00 0.00 175.26 176.39 2dmh s ILE 56 N -2.42 1.34 0.25 1.83 1.01 -1.26 -0.17 121.20 121.77 2dmh s ILE 56 Ca 0.53 -1.07 0.09 0.00 0.00 0.00 0.00 60.65 60.21 2dmh s ILE 56 Cb -0.08 -1.19 -0.05 0.00 0.01 0.00 0.00 42.46 41.16 2dmh s ILE 56 CO 0.32 0.09 -0.16 -0.76 0.00 0.00 0.00 174.94 174.44 2dmh s LEU 57 N -1.13 2.57 -0.03 2.97 1.43 -0.50 -4.96 118.68 119.03 2dmh s LEU 57 Ca 0.04 -1.05 -0.02 0.00 -1.03 0.00 0.00 54.13 52.07 2dmh s LEU 57 Cb -0.08 -0.87 0.02 0.00 0.03 0.00 0.00 46.19 45.29 2dmh s LEU 57 CO 0.01 -0.10 0.08 -1.61 0.23 0.00 0.00 176.35 174.96 2dmh s GLU 58 N -3.59 0.05 -0.07 1.70 2.02 -1.26 -1.68 118.70 115.87 2dmh s GLU 58 Ca 0.27 0.18 0.04 0.00 0.02 0.00 0.00 54.97 55.48 2dmh s GLU 58 Cb -0.02 -0.09 0.00 0.00 0.10 0.00 0.00 34.13 34.12 2dmh s GLU 58 CO 0.11 -0.09 -0.19 -0.06 0.02 0.00 0.00 175.26 175.05 2dmh s PHE 59 N 0.59 1.97 -0.07 1.61 0.40 -0.06 -4.96 117.98 117.46 2dmh s PHE 59 Ca -0.05 -0.69 -0.30 0.00 -0.60 0.00 0.00 56.93 55.30 2dmh s PHE 59 Cb -0.06 -1.34 -0.02 0.00 0.51 0.00 0.00 43.02 42.10 2dmh s PHE 59 CO -0.02 -0.27 1.02 0.34 0.70 0.00 0.00 175.22 176.99 2dmh s ASP 60 N 0.27 7.25 0.03 1.36 -1.08 -1.26 -1.39 116.67 121.85 2dmh s ASP 60 Ca -0.11 1.60 0.18 0.00 -0.52 0.00 0.00 52.55 53.70 2dmh s ASP 60 Cb -0.15 -2.56 -0.16 0.00 -1.46 0.00 0.00 42.92 38.59 2dmh s ASP 60 CO 0.05 -0.41 0.72 0.18 0.52 0.00 0.00 175.17 176.22 2dmh n LEU 61 N 4.72 0.66 -2.54 -1.34 4.77 -1.16 -4.96 117.00 117.15 2dmh n LEU 61 Ca 0.08 0.28 -0.12 0.00 -0.03 0.00 0.00 56.01 56.22 2dmh n LEU 61 Cb 0.49 0.10 0.06 0.00 -2.33 0.00 0.00 43.42 41.74 2dmh n LEU 61 CO 0.52 0.14 0.10 0.54 -1.33 0.00 0.00 177.39 177.36 2dmh n ARG 62 N -2.78 -4.56 -0.98 3.23 1.74 -1.04 -2.40 116.66 109.87 2dmh n ARG 62 Ca -0.11 0.54 0.00 0.00 -0.77 0.00 0.00 57.85 57.51 2dmh n ARG 62 Cb 0.82 -4.67 0.00 0.00 -1.02 0.00 0.00 32.46 27.58 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 -1.21 0.21 3.52 -0.13 0.00 -0.50 -4.96 105.19 102.12 2dmh n GLY 63 Ca -0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 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 -1.45 5.17 1.10 -0.61 -1.09 -1.01 -4.85 121.20 118.46 2dmh s ILE 64 Ca 0.00 -0.12 -0.15 0.00 -2.23 0.00 0.00 60.65 58.15 2dmh s ILE 64 Cb 0.00 -3.87 0.24 0.00 -1.58 0.00 0.00 42.46 37.25 2dmh s ILE 64 CO 0.00 -0.17 1.10 -2.16 -1.23 0.00 0.00 174.94 172.48 2dmh s PRO 65 N 1.99 -0.38 0.78 2.79 0.04 -1.26 -4.80 135.00 134.16 2dmh s PRO 65 Ca 0.11 0.24 -0.04 0.00 0.04 0.00 0.00 61.00 61.34 2dmh s PRO 65 Cb -0.17 -1.67 0.15 0.00 0.04 0.00 0.00 34.50 32.85 2dmh s PRO 65 CO 0.12 -3.21 1.08 -0.51 0.04 0.00 0.00 177.00 174.51 2dmh s LEU 66 N -6.70 2.91 0.29 -3.56 1.43 -1.26 -5.12 118.68 106.66 2dmh s LEU 66 Ca 0.68 -0.23 -0.09 0.00 -1.03 0.00 0.00 54.13 53.46 2dmh s LEU 66 Cb -0.15 -2.03 0.00 0.00 0.03 0.00 0.00 46.19 44.05 2dmh s LEU 66 CO 0.57 -2.09 0.48 -1.81 0.23 0.00 0.00 176.35 173.73 2dmh s ASP 67 N -4.78 0.25 0.44 2.29 1.01 -1.26 -4.86 116.67 109.75 2dmh s ASP 67 Ca 0.68 -1.15 0.16 0.00 0.71 0.00 0.00 52.55 52.96 2dmh s ASP 67 Cb -0.05 0.62 0.99 0.00 1.01 0.00 0.00 42.92 45.49 2dmh s ASP 67 CO 0.47 -1.22 1.95 -0.26 0.21 0.00 0.00 175.17 176.32 2dmh h PHE 68 N 2.21 0.00 0.05 4.23 0.04 -1.90 -2.57 116.94 119.00 2dmh h PHE 68 Ca -0.28 0.00 -0.23 0.00 2.80 0.00 0.00 57.97 60.26 2dmh h PHE 68 Cb 1.25 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.39 2dmh h PHE 68 CO 0.82 0.23 -1.03 0.77 -0.60 0.00 0.00 178.31 178.50 2dmh h SER 69 N 0.00 0.34 -2.24 2.17 0.02 -1.96 -3.38 113.55 108.51 2dmh h SER 69 Ca -0.00 -0.32 -0.59 0.00 -0.84 0.00 0.00 61.79 60.04 2dmh h SER 69 Cb 0.44 -0.11 0.19 0.00 0.14 0.00 0.00 62.40 63.06 2dmh h SER 69 CO 0.03 1.17 -1.06 -0.24 -1.14 0.00 0.00 176.83 175.59 2dmh n SER 70 N -3.60 -3.35 -3.59 3.07 2.88 -0.97 -4.87 113.62 103.20 2dmh n SER 70 Ca -0.06 0.61 -0.09 0.00 -1.33 0.00 0.00 58.87 58.01 2dmh n SER 70 Cb 0.90 -0.92 -0.05 0.00 -0.75 0.00 0.00 64.21 63.40 2dmh n SER 70 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2dmh s SER 71 N -1.06 -0.30 -0.08 -3.46 1.04 -1.26 -2.65 113.70 105.92 2dmh s SER 71 Ca 0.57 0.30 -0.04 0.00 0.48 0.00 0.00 55.95 57.27 2dmh s SER 71 Cb -0.44 0.25 -0.04 0.00 0.10 0.00 0.00 66.02 65.89 2dmh s SER 71 CO 0.66 -0.30 0.10 -0.22 0.98 0.00 0.00 173.24 174.46 2dmh s LEU 72 N -1.20 4.11 -0.38 2.42 2.96 0.61 -4.89 118.68 122.30 2dmh s LEU 72 Ca 0.01 0.33 -0.09 0.00 -0.22 0.00 0.00 54.13 54.16 2dmh s LEU 72 Cb -0.01 -2.09 0.05 0.00 0.50 0.00 0.00 46.19 44.65 2dmh s LEU 72 CO -0.01 0.37 0.19 -0.83 -1.32 0.00 0.00 176.35 174.75 2dmh s GLY 73 N -1.18 1.92 -0.41 7.98 0.00 -1.22 -1.18 107.32 113.21 2dmh s GLY 73 Ca 0.17 -1.92 -0.14 0.00 0.00 0.00 0.00 44.72 42.83 2dmh s GLY 73 CO 0.06 0.87 0.30 -0.42 0.00 0.00 0.00 173.10 173.91 2dmh s ILE 74 N 1.44 5.05 -0.04 0.90 -1.09 0.49 -2.74 121.20 125.21 2dmh s ILE 74 Ca 0.01 -0.82 0.05 0.00 -2.23 0.00 0.00 60.65 57.66 2dmh s ILE 74 Cb -0.21 -3.87 -0.02 0.00 -1.58 0.00 0.00 42.46 36.78 2dmh s ILE 74 CO 0.03 -0.36 -0.18 -0.63 -1.23 0.00 0.00 174.94 172.58 2dmh s ILE 75 N 1.63 2.73 -0.14 2.92 1.01 -0.81 0.42 121.20 128.95 2dmh s ILE 75 Ca 0.04 -0.85 0.00 0.00 0.00 0.00 0.00 60.65 59.84 2dmh s ILE 75 Cb -0.20 -2.04 0.03 0.00 0.01 0.00 0.00 42.46 40.26 2dmh s ILE 75 CO 0.08 0.59 -0.11 -0.69 0.00 0.00 0.00 174.94 174.81 2dmh s VAL 76 N -0.67 1.33 0.40 2.92 1.01 -0.49 -1.02 120.40 123.89 2dmh s VAL 76 Ca 0.10 -0.51 0.03 0.00 0.00 0.00 0.00 61.98 61.61 2dmh s VAL 76 Cb -0.11 -1.30 -0.03 0.00 0.00 0.00 0.00 36.38 34.94 2dmh s VAL 76 CO 0.00 0.39 0.10 -0.54 0.00 0.00 0.00 175.10 175.05 2dmh s LYS 77 N 1.58 1.91 -0.45 2.72 1.02 -1.21 -1.69 119.74 123.61 2dmh s LYS 77 Ca 0.04 -2.15 -0.14 0.00 0.02 0.00 0.00 55.97 53.74 2dmh s LYS 77 Cb -0.13 -0.76 0.07 0.00 -0.52 0.00 0.00 37.83 36.48 2dmh s LYS 77 CO -0.09 -0.41 0.35 0.34 -0.92 0.00 0.00 175.35 174.62 2dmh s ASP 78 N -3.61 6.02 0.17 2.83 2.15 -1.26 -2.63 116.67 120.35 2dmh s ASP 78 Ca 0.24 -1.31 -0.22 0.00 0.43 0.00 0.00 52.55 51.70 2dmh s ASP 78 Cb 0.04 -2.14 0.07 0.00 -0.30 0.00 0.00 42.92 40.59 2dmh s ASP 78 CO 0.13 -0.60 1.36 0.33 -0.17 0.00 0.00 175.17 176.23 2dmh n PHE 79 N 5.13 -0.19 -0.31 -5.34 7.35 -0.75 -0.00 117.46 123.36 2dmh n PHE 79 Ca -0.12 1.09 -0.00 0.00 -0.76 0.00 0.00 57.45 57.66 2dmh n PHE 79 Cb 0.44 -0.70 0.04 0.00 0.35 0.00 0.00 39.48 39.62 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 -5.20 -0.17 -3.27 -4.13 1.02 -1.26 -3.86 120.64 103.77 2dmh n GLU 80 Ca 0.05 1.24 -0.40 0.00 -0.02 0.00 0.00 57.16 58.04 2dmh n GLU 80 Cb 0.29 -1.84 -0.08 0.00 -0.02 0.00 0.00 31.44 29.79 2dmh n GLU 80 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2dmh s THR 81 N -5.79 5.10 -0.16 2.62 -4.23 1.00 -5.05 115.64 109.12 2dmh s THR 81 Ca -0.11 0.83 0.01 0.00 -1.18 0.00 0.00 61.69 61.23 2dmh s THR 81 Cb 0.17 -3.80 0.02 0.00 1.34 0.00 0.00 72.50 70.23 2dmh s THR 81 CO 0.58 0.11 -0.16 -0.63 -0.54 0.00 0.00 174.62 173.99 2dmh s ILE 82 N 2.17 1.71 0.00 2.99 1.01 -1.25 -4.49 121.20 123.33 2dmh s ILE 82 Ca 0.20 -0.72 0.00 0.00 0.00 0.00 0.00 60.65 60.14 2dmh s ILE 82 Cb -0.16 -1.58 0.00 0.00 0.01 0.00 0.00 42.46 40.73 2dmh s ILE 82 CO 0.09 0.48 0.00 0.61 0.00 0.00 0.00 174.94 176.12 2dmh n GLY 83 N 4.73 3.08 3.53 6.18 0.00 -1.26 -5.06 105.19 116.39 2dmh n GLY 83 Ca -0.18 -0.92 -0.29 0.00 0.00 0.00 0.00 46.02 44.63 2dmh n GLY 83 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2dmh s GLN 84 N 0.00 -0.59 -0.43 1.61 1.11 -1.26 -4.90 119.66 115.20 2dmh s GLN 84 Ca 0.00 0.90 -0.01 0.00 0.01 0.00 0.00 55.36 56.27 2dmh s GLN 84 Cb 0.00 -1.59 0.34 0.00 -1.01 0.00 0.00 33.01 30.75 2dmh s GLN 84 CO 0.00 -3.52 1.95 0.09 0.01 0.00 0.00 175.29 173.82 2dmh n ASN 85 N -4.78 6.28 -1.56 5.90 3.02 -1.26 -4.56 115.26 118.30 2dmh n ASN 85 Ca 0.04 -3.31 -0.10 0.00 -0.03 0.00 0.00 54.58 51.19 2dmh n ASN 85 Cb 0.54 -0.97 0.05 0.00 -0.61 0.00 0.00 39.78 38.79 2dmh n ASN 85 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2dmh n LYS 86 N -0.26 1.50 -1.67 3.52 5.02 -1.26 -4.94 118.16 120.06 2dmh n LYS 86 Ca 0.43 -1.10 -0.47 0.00 -2.02 0.00 0.00 58.31 55.15 2dmh n LYS 86 Cb 0.75 -1.43 -0.04 0.00 -0.02 0.00 0.00 35.03 34.29 2dmh n LYS 86 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2dmh n LEU 87 N 0.17 3.19 0.12 -0.35 7.94 -1.26 -4.50 117.00 122.31 2dmh n LEU 87 Ca 0.22 1.04 -0.07 0.00 -1.11 0.00 0.00 56.01 56.08 2dmh n LEU 87 Cb 0.79 -1.40 -0.04 0.00 0.53 0.00 0.00 43.42 43.30 2dmh n LEU 87 CO 0.24 -0.22 0.21 0.40 -1.11 0.00 0.00 177.39 176.91 2dmh h ILE 88 N 4.34 0.15 -1.16 1.96 2.04 -1.68 -3.42 117.51 119.74 2dmh h ILE 88 Ca -0.46 -0.77 0.19 0.00 1.00 0.00 0.00 64.86 64.82 2dmh h ILE 88 Cb 1.26 0.26 -0.28 0.00 -0.74 0.00 0.00 36.82 37.32 2dmh h ILE 88 CO 0.91 0.04 0.85 -0.83 0.00 0.00 0.00 178.15 179.12 2dmh s GLY 89 N -3.10 0.10 0.31 5.37 0.00 -1.08 -4.28 107.32 104.65 2dmh s GLY 89 Ca -0.07 2.91 0.08 0.00 0.00 0.00 0.00 44.72 47.64 2dmh s GLY 89 CO 0.24 1.38 -0.09 -0.51 0.00 0.00 0.00 173.10 174.13 2dmh s THR 90 N -0.65 2.01 -0.28 0.90 -4.23 0.74 -1.39 115.64 112.73 2dmh s THR 90 Ca 0.07 -2.18 -0.15 0.00 -1.18 0.00 0.00 61.69 58.25 2dmh s THR 90 Cb -0.02 -2.55 0.09 0.00 1.34 0.00 0.00 72.50 71.36 2dmh s THR 90 CO -0.09 -0.25 0.68 0.00 -0.54 0.00 0.00 174.62 174.42 2dmh s ALA 91 N -2.77 -1.90 -0.21 3.99 0.00 0.17 -1.75 121.76 119.29 2dmh s ALA 91 Ca 0.31 2.40 -0.07 0.00 0.00 0.00 0.00 51.96 54.60 2dmh s ALA 91 Cb 0.03 -1.50 -0.03 0.00 0.00 0.00 0.00 23.12 21.61 2dmh s ALA 91 CO 0.14 -0.50 0.06 0.99 0.00 0.00 0.00 175.76 176.45 2dmh s THR 92 N 1.92 4.50 -0.29 0.00 2.01 -1.26 -0.38 115.64 122.14 2dmh s THR 92 Ca -0.09 -0.12 -0.08 0.00 0.31 0.00 0.00 61.69 61.71 2dmh s THR 92 Cb -0.07 -3.06 0.00 0.00 0.01 0.00 0.00 72.50 69.39 2dmh s THR 92 CO -0.20 0.41 0.10 -0.69 -0.69 0.00 0.00 174.62 173.55 2dmh s VAL 93 N 0.91 4.16 -0.18 3.82 1.01 -0.33 -4.93 120.40 124.86 2dmh s VAL 93 Ca 0.03 -0.57 -0.29 0.00 0.00 0.00 0.00 61.98 61.15 2dmh s VAL 93 Cb -0.14 -3.11 -0.03 0.00 0.00 0.00 0.00 36.38 33.10 2dmh s VAL 93 CO 0.03 0.11 1.50 0.00 0.00 0.00 0.00 175.10 176.73 2dmh s ALA 94 N 1.54 3.46 -2.00 5.51 0.00 -1.26 -0.29 121.76 128.72 2dmh s ALA 94 Ca 0.04 0.52 0.18 0.00 0.00 0.00 0.00 51.96 52.70 2dmh s ALA 94 Cb -0.17 -3.76 1.09 0.00 0.00 0.00 0.00 23.12 20.28 2dmh s ALA 94 CO 0.03 -1.61 1.64 1.28 0.00 0.00 0.00 175.76 177.11 2dmh n LEU 95 N 7.59 0.00 0.05 0.00 4.77 -1.08 -3.68 117.00 124.65 2dmh n LEU 95 Ca 0.17 0.00 0.03 0.00 -0.03 0.00 0.00 56.01 56.18 2dmh n LEU 95 Cb 0.45 0.00 0.18 0.00 -2.33 0.00 0.00 43.42 41.72 2dmh n LEU 95 CO 0.62 0.00 0.61 2.29 -1.33 0.00 0.00 177.39 179.58 2dmh n LYS 96 N -0.81 0.04 -0.04 3.23 2.85 -1.26 -0.71 118.16 121.46 2dmh n LYS 96 Ca 0.14 0.52 -0.11 0.00 -1.05 0.00 0.00 58.31 57.81 2dmh n LYS 96 Cb 0.06 -1.68 -0.14 0.00 -0.65 0.00 0.00 35.03 32.62 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 -1.72 0.92 0.12 -5.58 9.92 -1.24 -4.30 116.55 114.67 2dmh n ASP 97 Ca -0.00 0.26 -0.20 0.00 -0.53 0.00 0.00 54.79 54.32 2dmh n ASP 97 Cb 0.04 0.04 -0.15 0.00 -0.64 0.00 0.00 41.12 40.42 2dmh n ASP 97 CO 0.00 0.00 0.00 -0.07 0.13 0.00 0.00 177.20 177.26 2dmh h LEU 98 N 0.01 0.60 -9.13 0.64 3.38 -1.19 -3.47 115.31 106.15 2dmh h LEU 98 Ca -0.38 -0.65 -0.57 0.00 0.09 0.00 0.00 57.88 56.36 2dmh h LEU 98 Cb 2.06 -0.20 0.21 0.00 0.09 0.00 0.00 40.66 42.83 2dmh h LEU 98 CO 0.06 1.51 -1.30 0.35 0.09 0.00 0.00 178.44 179.15 2dmh n THR 99 N -3.60 0.27 -0.01 0.22 -2.24 -0.39 -4.62 114.28 103.91 2dmh n THR 99 Ca -0.12 -0.47 0.00 0.00 -2.27 0.00 0.00 64.05 61.18 2dmh n THR 99 Cb 1.06 -0.14 0.00 0.00 -2.10 0.00 0.00 70.33 69.15 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 2.74 0.07 1.59 3.38 0.00 -1.26 -4.94 105.19 106.77 2dmh n GLY 100 Ca 0.04 -1.15 -0.06 0.00 0.00 0.00 0.00 46.02 44.86 2dmh n GLY 100 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2dmh n ASP 101 N 0.00 2.67 -3.64 1.61 9.92 -1.26 -4.94 116.55 120.91 2dmh n ASP 101 Ca 0.00 -3.24 -0.07 0.00 -0.53 0.00 0.00 54.79 50.95 2dmh n ASP 101 Cb 0.00 -0.42 -0.07 0.00 -0.64 0.00 0.00 41.12 39.99 2dmh n ASP 101 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2dmh s GLN 102 N -2.93 0.35 0.07 -1.24 -2.07 -1.26 -4.99 119.66 107.59 2dmh s GLN 102 Ca 0.40 0.36 -0.37 0.00 -1.82 0.00 0.00 55.36 53.93 2dmh s GLN 102 Cb 0.38 0.17 -0.17 0.00 -1.09 0.00 0.00 33.01 32.30 2dmh s GLN 102 CO -0.04 -0.05 1.37 0.45 -1.32 0.00 0.00 175.29 175.69 2dmh n SER 103 N 1.80 1.75 -3.65 12.60 2.88 -1.26 -4.79 113.62 122.95 2dmh n SER 103 Ca -0.11 1.12 -0.21 0.00 -1.33 0.00 0.00 58.87 58.34 2dmh n SER 103 Cb 0.56 -1.20 -0.17 0.00 -0.75 0.00 0.00 64.21 62.66 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 0.65 -0.01 -0.32 -1.46 3.52 -0.84 -4.97 118.95 115.52 2dmh s ARG 104 Ca 0.85 0.30 -0.01 0.00 -0.13 0.00 0.00 55.73 56.75 2dmh s ARG 104 Cb -0.95 -0.80 0.07 0.00 -1.56 0.00 0.00 34.95 31.72 2dmh s ARG 104 CO 0.47 -0.42 0.04 -1.12 -0.81 0.00 0.00 175.30 173.46 2dmh s SER 105 N 2.20 4.89 -0.23 -2.12 0.01 -1.26 -1.55 113.70 115.64 2dmh s SER 105 Ca 0.04 -1.59 -0.08 0.00 1.31 0.00 0.00 55.95 55.63 2dmh s SER 105 Cb -0.13 -1.70 -0.03 0.00 0.21 0.00 0.00 66.02 64.36 2dmh s SER 105 CO -0.05 -0.33 0.07 -0.76 0.41 0.00 0.00 173.24 172.58 2dmh s LEU 106 N 1.15 3.60 -0.35 2.44 1.43 -1.10 -4.97 118.68 120.88 2dmh s LEU 106 Ca -0.00 -0.10 -0.28 0.00 -1.03 0.00 0.00 54.13 52.72 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 -0.03 0.04 1.70 -2.16 0.23 0.00 0.00 176.35 176.13 2dmh s PRO 107 N 1.20 3.39 -0.57 1.29 0.04 -1.26 -3.80 135.00 135.29 2dmh s PRO 107 Ca 0.05 1.30 -0.18 0.00 0.04 0.00 0.00 61.00 62.21 2dmh s PRO 107 Cb -0.14 -4.16 0.10 0.00 0.04 0.00 0.00 34.50 30.34 2dmh s PRO 107 CO 0.04 -1.79 0.64 0.71 0.04 0.00 0.00 177.00 176.64 2dmh s TYR 108 N 6.54 3.06 0.35 0.56 2.02 0.12 -5.00 117.35 124.99 2dmh s TYR 108 Ca 0.75 -0.98 0.07 0.00 -0.37 0.00 0.00 57.07 56.54 2dmh s TYR 108 Cb -0.20 -3.89 -0.07 0.00 -0.40 0.00 0.00 41.96 37.40 2dmh s TYR 108 CO 0.33 -1.20 -0.02 0.15 -1.57 0.00 0.00 175.55 173.25 2dmh s LYS 109 N 2.43 1.77 -1.17 -0.62 1.02 -1.26 -0.22 119.74 121.70 2dmh s LYS 109 Ca 0.10 -1.96 -0.07 0.00 0.02 0.00 0.00 55.97 54.06 2dmh s LYS 109 Cb -0.25 -1.38 0.01 0.00 -0.52 0.00 0.00 37.83 35.69 2dmh s LYS 109 CO 0.06 -0.01 1.02 1.28 -0.92 0.00 0.00 175.35 176.78 2dmh n LEU 110 N -0.78 -3.31 -4.66 3.17 4.77 -1.26 -4.96 117.00 109.97 2dmh n LEU 110 Ca -0.05 -0.48 -0.41 0.00 -0.03 0.00 0.00 56.01 55.04 2dmh n LEU 110 Cb 0.65 -2.73 -0.04 0.00 -2.33 0.00 0.00 43.42 38.97 2dmh n LEU 110 CO 0.44 0.54 0.57 -0.63 -1.33 0.00 0.00 177.39 176.99 2dmh s ILE 111 N -3.28 4.90 -0.44 -0.08 1.01 -1.24 -4.95 121.20 117.11 2dmh s ILE 111 Ca 0.45 1.53 -0.27 0.00 0.00 0.00 0.00 60.65 62.35 2dmh s ILE 111 Cb -0.20 -4.09 0.03 0.00 0.01 0.00 0.00 42.46 38.21 2dmh s ILE 111 CO 0.64 0.02 1.02 -0.44 0.00 0.00 0.00 174.94 176.18 2dmh s SER 112 N 1.21 6.61 0.36 3.58 0.01 -1.26 -3.43 113.70 120.78 2dmh s SER 112 Ca 0.36 0.40 -0.23 0.00 1.31 0.00 0.00 55.95 57.79 2dmh s SER 112 Cb -0.16 -2.50 -0.10 0.00 0.21 0.00 0.00 66.02 63.47 2dmh s SER 112 CO 0.11 -1.08 0.91 -0.76 0.41 0.00 0.00 173.24 172.83 2dmh s LEU 113 N 3.97 4.15 0.01 2.44 1.43 -0.70 -4.85 118.68 125.14 2dmh s LEU 113 Ca 0.42 1.70 0.04 0.00 -1.03 0.00 0.00 54.13 55.27 2dmh s LEU 113 Cb -0.09 -4.21 -0.02 0.00 0.03 0.00 0.00 46.19 41.90 2dmh s LEU 113 CO 0.26 -0.19 -0.14 -0.76 0.23 0.00 0.00 176.35 175.75 2dmh s LEU 114 N -2.59 2.10 0.00 1.79 1.43 -0.71 -1.60 118.68 119.09 2dmh s LEU 114 Ca 0.55 -0.35 -0.21 0.00 -1.03 0.00 0.00 54.13 53.10 2dmh s LEU 114 Cb -0.14 -0.64 0.32 0.00 0.03 0.00 0.00 46.19 45.76 2dmh s LEU 114 CO 0.18 0.10 0.96 -0.46 0.23 0.00 0.00 176.35 177.36 2dmh n ASN 115 N 2.34 -2.77 0.16 2.29 0.23 -0.91 -0.19 115.26 116.41 2dmh n ASN 115 Ca -0.16 -1.03 0.11 0.00 -0.53 0.00 0.00 54.58 52.97 2dmh n ASN 115 Cb 0.55 -0.95 0.58 0.00 -2.08 0.00 0.00 39.78 37.89 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 -5.01 0.14 0.00 -3.83 0.28 -1.26 -1.03 120.64 109.93 2dmh n GLU 116 Ca 0.14 0.63 -0.11 0.00 -0.16 0.00 0.00 57.16 57.66 2dmh n GLU 116 Cb 0.56 -1.96 -0.14 0.00 1.43 0.00 0.00 31.44 31.34 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 0.06 0.00 3.44 1.79 -1.98 -3.48 116.57 116.40 2dmh h LYS 117 Ca 0.00 -0.11 0.00 0.00 -2.18 0.00 0.00 60.65 58.36 2dmh h LYS 117 Cb 0.02 0.04 0.00 0.00 -1.58 0.00 0.00 32.23 30.71 2dmh h LYS 117 CO 0.00 0.73 0.00 0.41 -1.08 0.00 0.00 179.45 179.51 2dmh n GLY 118 N 1.59 1.29 3.82 3.86 0.00 -0.20 -5.11 105.19 110.44 2dmh n GLY 118 Ca -0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.43 4.16 -0.81 1.61 -1.52 -1.26 -4.79 119.66 116.62 2dmh s GLN 119 Ca 0.00 0.70 -0.26 0.00 -1.95 0.00 0.00 55.36 53.85 2dmh s GLN 119 Cb 0.00 -3.13 -0.13 0.00 -0.22 0.00 0.00 33.01 29.53 2dmh s GLN 119 CO 0.00 0.58 2.37 0.16 -0.25 0.00 0.00 175.29 178.15 2dmh s ASP 120 N -1.31 3.96 0.51 5.90 1.47 -1.26 -2.15 116.67 123.79 2dmh s ASP 120 Ca 0.33 -0.02 0.30 0.00 1.18 0.00 0.00 52.55 54.33 2dmh s ASP 120 Cb -0.18 -2.55 1.41 0.00 -0.34 0.00 0.00 42.92 41.26 2dmh s ASP 120 CO 0.19 -3.83 1.84 0.71 0.68 0.00 0.00 175.17 174.76 2dmh h THR 121 N 7.64 0.50 0.00 2.11 1.35 -1.63 -3.45 112.91 119.44 2dmh h THR 121 Ca 0.01 -0.03 0.00 0.00 -0.55 0.00 0.00 66.41 65.83 2dmh h THR 121 Cb 1.00 0.39 0.00 0.00 -1.73 0.00 0.00 68.15 67.82 2dmh h THR 121 CO 1.02 0.02 0.00 0.61 -0.25 0.00 0.00 175.52 176.92 2dmh n GLY 122 N -1.68 1.59 3.37 5.82 0.00 -1.25 -4.87 105.19 108.16 2dmh n GLY 122 Ca 0.22 -0.14 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 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 2.33 -0.02 4.61 0.00 -1.20 -4.62 121.76 120.87 2dmh s ALA 123 Ca 0.00 -1.14 0.07 0.00 0.00 0.00 0.00 51.96 50.89 2dmh s ALA 123 Cb 0.00 -0.63 -0.02 0.00 0.00 0.00 0.00 23.12 22.47 2dmh s ALA 123 CO 0.00 0.54 -0.22 0.95 0.00 0.00 0.00 175.76 177.03 2dmh s THR 124 N -0.72 1.76 -0.00 0.00 -4.23 -0.33 -1.72 115.64 110.39 2dmh s THR 124 Ca 0.11 -0.95 0.01 0.00 -1.18 0.00 0.00 61.69 59.69 2dmh s THR 124 Cb -0.10 -1.46 -0.00 0.00 1.34 0.00 0.00 72.50 72.27 2dmh s THR 124 CO 0.01 0.50 -0.04 -0.51 -0.54 0.00 0.00 174.62 174.03 2dmh s ILE 125 N -0.48 0.33 -0.21 2.99 2.07 -1.22 -0.32 121.20 124.36 2dmh s ILE 125 Ca 0.07 -0.23 -0.11 0.00 -1.41 0.00 0.00 60.65 58.97 2dmh s ILE 125 Cb -0.09 -0.29 -0.05 0.00 0.13 0.00 0.00 42.46 42.16 2dmh s ILE 125 CO -0.00 0.06 0.18 -1.81 -1.91 0.00 0.00 174.94 171.46 2dmh s ASP 126 N -0.19 6.22 0.01 4.50 1.11 -0.24 -3.69 116.67 124.38 2dmh s ASP 126 Ca 0.01 0.24 0.01 0.00 0.18 0.00 0.00 52.55 52.98 2dmh s ASP 126 Cb -0.02 -2.12 -0.01 0.00 1.07 0.00 0.00 42.92 41.84 2dmh s ASP 126 CO -0.00 0.11 -0.03 -0.76 1.18 0.00 0.00 175.17 175.67 2dmh s LEU 127 N 0.71 2.07 -0.32 1.23 1.43 0.70 -2.79 118.68 121.71 2dmh s LEU 127 Ca 0.10 -0.16 0.03 0.00 -1.03 0.00 0.00 54.13 53.06 2dmh s LEU 127 Cb -0.12 -0.07 0.10 0.00 0.03 0.00 0.00 46.19 46.12 2dmh s LEU 127 CO 0.02 -0.05 0.05 -0.69 0.23 0.00 0.00 176.35 175.91 2dmh s VAL 128 N -0.41 1.86 -0.11 -1.59 1.01 -0.43 0.13 120.40 120.86 2dmh s VAL 128 Ca -0.03 -2.01 -0.12 0.00 0.00 0.00 0.00 61.98 59.82 2dmh s VAL 128 Cb -0.03 -2.35 -0.05 0.00 0.00 0.00 0.00 36.38 33.95 2dmh s VAL 128 CO -0.00 -0.57 0.28 -0.63 0.00 0.00 0.00 175.10 174.18 2dmh s ILE 129 N 1.13 5.28 -0.11 2.22 1.01 -1.25 -1.05 121.20 128.42 2dmh s ILE 129 Ca 0.09 0.54 0.01 0.00 0.00 0.00 0.00 60.65 61.29 2dmh s ILE 129 Cb -0.19 -3.59 0.02 0.00 0.01 0.00 0.00 42.46 38.71 2dmh s ILE 129 CO -0.12 0.50 -0.14 -0.83 0.00 0.00 0.00 174.94 174.35 2dmh s GLY 130 N -0.32 1.01 0.23 6.18 0.00 0.31 -2.72 107.32 112.01 2dmh s GLY 130 Ca 0.18 -0.71 -0.02 0.00 0.00 0.00 0.00 44.72 44.16 2dmh s GLY 130 CO 0.06 0.37 0.45 -0.47 0.00 0.00 0.00 173.10 173.51 2dmh s TYR 131 N 1.18 3.48 -0.22 1.90 5.04 -0.59 -1.85 117.35 126.29 2dmh s TYR 131 Ca -0.03 0.44 -0.07 0.00 -2.44 0.00 0.00 57.07 54.96 2dmh s TYR 131 Cb -0.14 -1.93 0.10 0.00 0.35 0.00 0.00 41.96 40.33 2dmh s TYR 131 CO -0.04 0.31 0.46 0.34 -1.34 0.00 0.00 175.55 175.28 2dmh s ASP 132 N -3.19 -0.42 0.34 4.32 -1.08 -1.24 -1.98 116.67 113.41 2dmh s ASP 132 Ca 0.40 1.10 -0.28 0.00 -0.52 0.00 0.00 52.55 53.26 2dmh s ASP 132 Cb -0.11 1.53 -0.09 0.00 -1.46 0.00 0.00 42.92 42.79 2dmh s ASP 132 CO 0.29 -0.23 1.21 -2.16 0.52 0.00 0.00 175.17 174.81 2dmh s PRO 133 N 2.67 4.32 0.27 4.34 0.04 -1.26 -3.35 135.00 142.03 2dmh s PRO 133 Ca -0.02 2.00 -0.29 0.00 0.04 0.00 0.00 61.00 62.72 2dmh s PRO 133 Cb -0.12 -2.97 -0.10 0.00 0.04 0.00 0.00 34.50 31.36 2dmh s PRO 133 CO -0.14 -0.14 1.26 -1.25 0.04 0.00 0.00 177.00 176.77 2dmh s PRO 134 N -1.88 4.44 -0.02 0.56 0.04 -1.26 -4.45 135.00 132.43 2dmh s PRO 134 Ca 0.51 2.06 0.12 0.00 0.04 0.00 0.00 61.00 63.72 2dmh s PRO 134 Cb -0.35 -3.15 0.37 0.00 0.04 0.00 0.00 34.50 31.42 2dmh s PRO 134 CO 0.45 -0.12 1.28 -1.13 0.04 0.00 0.00 177.00 177.53 2dmh n SER 135 N 1.58 2.42 -4.54 6.66 3.41 -1.26 -4.85 113.62 117.04 2dmh n SER 135 Ca 0.02 -2.09 -0.31 0.00 -0.26 0.00 0.00 58.87 56.23 2dmh n SER 135 Cb 0.43 -0.33 0.18 0.00 -0.26 0.00 0.00 64.21 64.23 2dmh n SER 135 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dmh n GLY 136 N 1.01 -1.23 0.00 5.00 0.00 -1.26 -4.86 105.19 103.85 2dmh n GLY 136 Ca 0.14 -0.82 0.07 0.00 0.00 0.00 0.00 46.02 45.41 2dmh n GLY 136 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dmh n PRO 137 N -3.63 0.14 -4.30 1.61 -0.04 -1.26 -4.71 135.00 122.81 2dmh n PRO 137 Ca 0.08 0.18 -0.28 0.00 -0.04 0.00 0.00 63.50 63.44 2dmh n PRO 137 Cb 0.53 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.39 2dmh n PRO 137 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dmh s SER 138 N -2.71 4.02 -0.16 3.54 0.15 -1.26 -5.13 113.70 112.16 2dmh s SER 138 Ca 0.12 -0.57 -0.06 0.00 0.70 0.00 0.00 55.95 56.14 2dmh s SER 138 Cb 0.10 -0.61 0.07 0.00 -1.71 0.00 0.00 66.02 63.87 2dmh s SER 138 CO 0.24 0.15 0.33 -0.55 1.20 0.00 0.00 173.24 174.61 2dmh s SER 139 N -2.39 -0.02 0.00 5.45 0.15 -1.26 -4.96 113.70 110.66 2dmh s SER 139 Ca 0.21 0.76 0.00 0.00 0.70 0.00 0.00 55.95 57.62 2dmh s SER 139 Cb -0.10 0.90 0.00 0.00 -1.71 0.00 0.00 66.02 65.11 2dmh s SER 139 CO 0.12 -0.22 0.00 0.61 1.20 0.00 0.00 173.24 174.95