#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 5.99 -4.67 1.61 7.64 -1.26 -4.93 113.62 118.00 2dmh n SER 2 Ca 0.00 -2.82 -0.42 0.00 1.01 0.00 0.00 58.87 56.63 2dmh n SER 2 Cb 0.00 -1.16 -0.03 0.00 -1.01 0.00 0.00 64.21 62.01 2dmh n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dmh s SER 3 N 0.97 6.68 0.00 6.43 0.15 -1.26 -4.99 113.70 121.68 2dmh s SER 3 Ca 0.32 2.26 0.00 0.00 0.70 0.00 0.00 55.95 59.23 2dmh s SER 3 Cb 0.21 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.98 2dmh s SER 3 CO -0.04 -0.89 0.00 0.61 1.20 0.00 0.00 173.24 174.12 2dmh n GLY 4 N 4.05 1.93 3.67 9.45 0.00 -1.26 -5.06 105.19 117.96 2dmh n GLY 4 Ca 0.16 -1.89 -0.40 0.00 0.00 0.00 0.00 46.02 43.90 2dmh n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dmh s SER 5 N -0.99 6.66 -0.36 1.61 0.15 -1.17 -4.95 113.70 114.66 2dmh s SER 5 Ca 0.00 0.80 0.07 0.00 0.70 0.00 0.00 55.95 57.52 2dmh s SER 5 Cb 0.00 -2.33 0.68 0.00 -1.71 0.00 0.00 66.02 62.66 2dmh s SER 5 CO 0.00 -0.22 1.81 -1.20 1.20 0.00 0.00 173.24 174.83 2dmh n SER 6 N 4.82 4.28 -1.78 5.45 7.64 -1.26 -0.64 113.62 132.13 2dmh n SER 6 Ca -0.03 -3.32 0.00 0.00 1.01 0.00 0.00 58.87 56.54 2dmh n SER 6 Cb 0.50 -0.78 0.00 0.00 -1.01 0.00 0.00 64.21 62.93 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 -0.53 -4.96 3.38 0.23 0.00 -1.26 -0.71 105.19 101.34 2dmh n GLY 7 Ca 0.47 -0.48 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.41 0.53 -0.15 1.61 1.75 -1.25 -1.76 119.30 117.61 2dmh s MET 8 Ca 0.00 0.79 -0.08 0.00 -1.25 0.00 0.00 55.69 55.15 2dmh s MET 8 Cb 0.00 0.16 -0.04 0.00 2.84 0.00 0.00 34.83 37.78 2dmh s MET 8 CO 0.00 -0.11 0.11 -1.17 -0.65 0.00 0.00 175.02 173.20 2dmh s LEU 9 N 0.82 4.17 -0.21 4.11 2.96 -0.23 -3.85 118.68 126.46 2dmh s LEU 9 Ca -0.05 0.30 -0.02 0.00 -0.22 0.00 0.00 54.13 54.15 2dmh s LEU 9 Cb -0.05 -2.04 0.01 0.00 0.50 0.00 0.00 46.19 44.61 2dmh s LEU 9 CO -0.07 0.30 -0.11 -0.13 -1.32 0.00 0.00 176.35 175.02 2dmh s ARG 10 N -0.35 3.14 -0.41 1.98 0.52 -0.96 0.14 118.95 123.01 2dmh s ARG 10 Ca 0.11 -0.76 -0.05 0.00 -0.52 0.00 0.00 55.73 54.51 2dmh s ARG 10 Cb -0.12 -2.83 0.10 0.00 0.52 0.00 0.00 34.95 32.62 2dmh s ARG 10 CO 0.01 -0.23 0.21 0.08 0.02 0.00 0.00 175.30 175.39 2dmh s VAL 11 N 1.38 3.54 -0.22 3.52 1.01 -0.88 -1.34 120.40 127.41 2dmh s VAL 11 Ca 0.05 -1.84 -0.23 0.00 0.00 0.00 0.00 61.98 59.95 2dmh s VAL 11 Cb -0.14 -3.33 -0.01 0.00 0.00 0.00 0.00 36.38 32.90 2dmh s VAL 11 CO -0.07 -0.61 0.76 -0.63 0.00 0.00 0.00 175.10 174.55 2dmh s ILE 12 N 1.23 4.90 -0.85 2.22 1.01 -0.42 -1.59 121.20 127.69 2dmh s ILE 12 Ca 0.06 1.44 -0.15 0.00 0.00 0.00 0.00 60.65 62.00 2dmh s ILE 12 Cb -0.23 -4.06 0.20 0.00 0.01 0.00 0.00 42.46 38.39 2dmh s ILE 12 CO -0.02 -0.00 0.84 -0.69 0.00 0.00 0.00 174.94 175.06 2dmh s VAL 13 N 2.48 5.46 0.00 2.92 1.01 -0.47 -1.25 120.40 130.56 2dmh s VAL 13 Ca 0.33 -2.33 0.00 0.00 0.00 0.00 0.00 61.98 59.98 2dmh s VAL 13 Cb -0.16 -4.53 0.00 0.00 0.00 0.00 0.00 36.38 31.69 2dmh s VAL 13 CO 0.09 -1.12 0.77 -0.62 0.00 0.00 0.00 175.10 174.22 2dmh n GLU 14 N 4.41 0.00 -3.80 2.72 1.02 -1.03 0.23 120.64 124.19 2dmh n GLU 14 Ca 0.16 0.32 0.01 0.00 -0.02 0.00 0.00 57.16 57.64 2dmh n GLU 14 Cb 0.47 -1.27 0.00 0.00 -0.02 0.00 0.00 31.44 30.63 2dmh n GLU 14 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2dmh s SER 15 N -2.11 -0.03 0.26 1.62 1.04 -1.21 0.21 113.70 113.48 2dmh s SER 15 Ca 0.00 -0.22 0.04 0.00 0.48 0.00 0.00 55.95 56.25 2dmh s SER 15 Cb 0.00 0.20 -0.06 0.00 0.10 0.00 0.00 66.02 66.26 2dmh s SER 15 CO 0.00 -0.38 -0.01 0.00 0.98 0.00 0.00 173.24 173.83 2dmh s ALA 16 N -2.25 2.04 0.19 5.32 0.00 -0.52 -0.44 121.76 126.10 2dmh s ALA 16 Ca 0.21 -1.85 -0.21 0.00 0.00 0.00 0.00 51.96 50.11 2dmh s ALA 16 Cb 0.02 0.44 0.05 0.00 0.00 0.00 0.00 23.12 23.62 2dmh s ALA 16 CO -0.01 -0.21 0.59 -1.12 0.00 0.00 0.00 175.76 175.01 2dmh s SER 17 N -3.37 -0.43 -0.93 0.00 0.01 0.13 -3.51 113.70 105.61 2dmh s SER 17 Ca 0.30 -0.23 -0.01 0.00 1.31 0.00 0.00 55.95 57.32 2dmh s SER 17 Cb 0.06 0.61 0.00 0.00 0.21 0.00 0.00 66.02 66.90 2dmh s SER 17 CO 0.11 -1.05 0.78 0.59 0.41 0.00 0.00 173.24 174.08 2dmh n ASN 18 N -0.38 -2.45 -4.78 2.44 3.02 -1.26 -1.26 115.26 110.59 2dmh n ASN 18 Ca -0.13 -0.46 -0.38 0.00 -0.03 0.00 0.00 54.58 53.58 2dmh n ASN 18 Cb 0.63 -4.00 -0.06 0.00 -0.61 0.00 0.00 39.78 35.74 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 -3.27 5.07 -0.59 2.41 1.01 -1.26 -3.14 121.20 121.44 2dmh s ILE 19 Ca 0.06 0.90 -0.27 0.00 0.00 0.00 0.00 60.65 61.35 2dmh s ILE 19 Cb -0.03 -3.77 -0.02 0.00 0.01 0.00 0.00 42.46 38.66 2dmh s ILE 19 CO 0.55 0.47 1.85 -2.16 0.00 0.00 0.00 174.94 175.65 2dmh s PRO 20 N -0.35 2.69 0.78 2.79 0.04 -1.26 -4.92 135.00 134.78 2dmh s PRO 20 Ca 0.25 0.66 -0.11 0.00 0.04 0.00 0.00 61.00 61.84 2dmh s PRO 20 Cb -0.16 -4.37 0.06 0.00 0.04 0.00 0.00 34.50 30.07 2dmh s PRO 20 CO 0.12 -2.66 1.08 -1.59 0.04 0.00 0.00 177.00 174.00 2dmh s LYS 21 N 6.92 2.18 0.06 4.56 -2.85 -1.26 -4.94 119.74 124.41 2dmh s LYS 21 Ca 0.68 0.94 0.00 0.00 -1.00 0.00 0.00 55.97 56.59 2dmh s LYS 21 Cb -0.13 -1.90 -0.04 0.00 -2.06 0.00 0.00 37.83 33.69 2dmh s LYS 21 CO 0.22 -1.63 0.20 -0.08 0.10 0.00 0.00 175.35 174.15 2dmh s THR 22 N -2.99 5.32 0.46 3.79 -1.32 -1.26 -4.95 115.64 114.69 2dmh s THR 22 Ca 0.61 -0.42 0.42 0.00 -1.21 0.00 0.00 61.69 61.09 2dmh s THR 22 Cb -0.16 -3.59 0.62 0.00 -1.51 0.00 0.00 72.50 67.86 2dmh s THR 22 CO 0.56 0.14 1.30 2.29 -2.21 0.00 0.00 174.62 176.70 2dmh n LYS 23 N 0.31 -0.00 0.00 7.08 0.00 -1.26 -0.82 118.16 123.47 2dmh n LYS 23 Ca -0.05 0.91 0.00 0.00 -0.00 0.00 0.00 58.31 59.16 2dmh n LYS 23 Cb 0.51 -2.09 0.00 0.00 -0.00 0.00 0.00 35.03 33.45 2dmh n LYS 23 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 2dmh n PHE 24 N -3.61 0.00 0.00 5.58 7.35 -1.26 -5.02 117.46 120.50 2dmh n PHE 24 Ca 0.37 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 57.06 2dmh n PHE 24 Cb 1.69 -0.44 0.00 0.00 0.35 0.00 0.00 39.48 41.08 2dmh n PHE 24 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2dmh n GLY 25 N -0.94 -2.11 2.63 7.13 0.00 -0.00 -5.12 105.19 106.77 2dmh n GLY 25 Ca 0.00 0.74 -0.24 0.00 0.00 0.00 0.00 46.02 46.51 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 0.02 1.19 1.61 1.02 -1.26 -4.15 119.74 118.17 2dmh s LYS 26 Ca 0.00 0.05 -0.19 0.00 0.02 0.00 0.00 55.97 55.85 2dmh s LYS 26 Cb 0.00 -1.46 0.28 0.00 -0.52 0.00 0.00 37.83 36.13 2dmh s LYS 26 CO 0.00 -0.58 1.11 -1.25 -0.92 0.00 0.00 175.35 173.71 2dmh s PRO 27 N 2.15 -1.10 -0.63 -1.68 0.04 -1.26 -4.06 135.00 128.46 2dmh s PRO 27 Ca 0.03 -0.03 -0.05 0.00 0.04 0.00 0.00 61.00 60.99 2dmh s PRO 27 Cb -0.15 -1.61 0.16 0.00 0.04 0.00 0.00 34.50 32.95 2dmh s PRO 27 CO -0.07 -3.64 0.46 -0.51 0.04 0.00 0.00 177.00 173.28 2dmh s ASP 28 N -3.86 5.48 0.62 6.66 1.11 -1.26 -1.50 116.67 123.92 2dmh s ASP 28 Ca 0.70 -2.70 -0.17 0.00 0.18 0.00 0.00 52.55 50.56 2dmh s ASP 28 Cb -0.10 -1.91 -0.02 0.00 1.07 0.00 0.00 42.92 41.95 2dmh s ASP 28 CO 0.56 -0.43 1.12 -2.16 1.18 0.00 0.00 175.17 175.43 2dmh s PRO 29 N 0.16 3.00 -0.23 8.23 0.04 -1.25 -0.84 135.00 144.11 2dmh s PRO 29 Ca 0.16 1.47 -0.13 0.00 0.04 0.00 0.00 61.00 62.54 2dmh s PRO 29 Cb -0.19 -1.97 0.07 0.00 0.04 0.00 0.00 34.50 32.45 2dmh s PRO 29 CO -0.04 -1.10 0.56 -1.50 0.04 0.00 0.00 177.00 174.96 2dmh s ILE 30 N -2.14 -0.05 0.17 0.56 2.07 -0.70 -2.45 121.20 118.66 2dmh s ILE 30 Ca 0.69 0.04 -0.30 0.00 -1.41 0.00 0.00 60.65 59.67 2dmh s ILE 30 Cb -0.22 -0.82 -0.07 0.00 0.13 0.00 0.00 42.46 41.48 2dmh s ILE 30 CO 0.36 0.02 0.97 -0.69 -1.91 0.00 0.00 174.94 173.69 2dmh s VAL 31 N 1.59 4.28 -0.26 4.00 1.01 -1.26 -3.00 120.40 126.75 2dmh s VAL 31 Ca -0.10 2.04 -0.02 0.00 0.00 0.00 0.00 61.98 63.90 2dmh s VAL 31 Cb -0.07 -4.30 0.09 0.00 0.00 0.00 0.00 36.38 32.10 2dmh s VAL 31 CO -0.17 0.38 0.08 -0.44 0.00 0.00 0.00 175.10 174.95 2dmh s SER 32 N -0.45 3.57 0.12 3.32 0.01 -0.81 -1.29 113.70 118.17 2dmh s SER 32 Ca 0.45 -1.29 -0.08 0.00 1.31 0.00 0.00 55.95 56.34 2dmh s SER 32 Cb -0.25 -0.70 -0.06 0.00 0.21 0.00 0.00 66.02 65.22 2dmh s SER 32 CO 0.31 -0.38 0.42 -0.69 0.41 0.00 0.00 173.24 173.31 2dmh s VAL 33 N 1.77 5.09 -0.04 3.43 1.01 0.17 -2.16 120.40 129.67 2dmh s VAL 33 Ca 0.06 0.31 -0.01 0.00 0.00 0.00 0.00 61.98 62.33 2dmh s VAL 33 Cb -0.17 -3.63 0.03 0.00 0.00 0.00 0.00 36.38 32.61 2dmh s VAL 33 CO -0.21 0.15 0.07 -0.63 0.00 0.00 0.00 175.10 174.48 2dmh s ILE 34 N -1.55 -0.07 -0.28 2.22 1.09 -1.19 -0.75 121.20 120.68 2dmh s ILE 34 Ca 0.38 0.22 -0.18 0.00 -1.10 0.00 0.00 60.65 59.97 2dmh s ILE 34 Cb -0.13 -0.14 0.09 0.00 -1.06 0.00 0.00 42.46 41.22 2dmh s ILE 34 CO 0.21 0.09 0.75 0.12 -0.10 0.00 0.00 174.94 176.01 2dmh s PHE 35 N 1.22 -0.93 -1.34 3.97 5.36 -0.91 -3.54 117.98 121.80 2dmh s PHE 35 Ca -0.08 1.93 -0.01 0.00 -0.96 0.00 0.00 56.93 57.82 2dmh s PHE 35 Cb -0.12 0.52 0.01 0.00 -0.34 0.00 0.00 43.02 43.08 2dmh s PHE 35 CO -0.04 -0.46 0.64 1.63 -1.46 0.00 0.00 175.22 175.53 2dmh n LYS 36 N 3.86 -4.54 -2.78 10.12 4.76 -1.26 -0.77 118.16 127.56 2dmh n LYS 36 Ca -0.18 0.57 -0.21 0.00 -2.87 0.00 0.00 58.31 55.61 2dmh n LYS 36 Cb 0.58 -5.04 0.01 0.00 -1.84 0.00 0.00 35.03 28.75 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 -3.03 -5.67 -4.02 4.39 2.03 -1.26 -4.96 116.55 104.04 2dmh n ASP 37 Ca -0.29 -0.16 -0.31 0.00 0.52 0.00 0.00 54.79 54.56 2dmh n ASP 37 Cb 0.67 -4.65 -0.15 0.00 -0.72 0.00 0.00 41.12 36.27 2dmh n ASP 37 CO 0.00 0.00 0.00 -0.70 -1.92 0.00 0.00 177.20 174.58 2dmh s GLU 38 N -5.44 1.56 -0.47 -0.67 2.56 0.05 -5.08 118.70 111.22 2dmh s GLU 38 Ca 0.18 -1.79 -0.21 0.00 0.00 0.00 0.00 54.97 53.15 2dmh s GLU 38 Cb -0.08 -3.14 0.04 0.00 2.00 0.00 0.00 34.13 32.94 2dmh s GLU 38 CO 0.22 -0.89 0.69 0.21 -0.56 0.00 0.00 175.26 174.93 2dmh s LYS 39 N 0.94 3.25 -0.07 4.30 2.20 -1.26 -2.13 119.74 126.98 2dmh s LYS 39 Ca 0.08 -0.47 0.02 0.00 -0.36 0.00 0.00 55.97 55.24 2dmh s LYS 39 Cb -0.19 -4.00 0.02 0.00 -1.51 0.00 0.00 37.83 32.14 2dmh s LYS 39 CO -0.08 -1.14 -0.11 0.15 -0.36 0.00 0.00 175.35 173.81 2dmh s LYS 40 N 2.97 1.59 0.23 4.03 1.02 0.07 -5.00 119.74 124.65 2dmh s LYS 40 Ca 0.22 -0.36 0.09 0.00 0.02 0.00 0.00 55.97 55.94 2dmh s LYS 40 Cb -0.15 -1.37 -0.05 0.00 -0.52 0.00 0.00 37.83 35.74 2dmh s LYS 40 CO 0.17 -0.02 -0.16 -1.59 -0.92 0.00 0.00 175.35 172.83 2dmh s LYS 41 N 0.82 1.45 0.47 1.68 0.00 -1.26 0.46 119.74 123.36 2dmh s LYS 41 Ca -0.12 -1.65 -0.02 0.00 0.00 0.00 0.00 55.97 54.18 2dmh s LYS 41 Cb -0.15 -1.33 -0.01 0.00 0.00 0.00 0.00 37.83 36.34 2dmh s LYS 41 CO 0.02 0.23 0.72 0.95 0.00 0.00 0.00 175.35 177.27 2dmh s THR 42 N -2.83 4.23 -0.06 3.79 -4.23 -0.41 -4.99 115.64 111.13 2dmh s THR 42 Ca 0.25 -0.27 -0.31 0.00 -1.18 0.00 0.00 61.69 60.18 2dmh s THR 42 Cb -0.02 -3.59 -0.09 0.00 1.34 0.00 0.00 72.50 70.14 2dmh s THR 42 CO 0.10 -0.48 2.02 2.29 -0.54 0.00 0.00 174.62 178.01 2dmh n LYS 43 N -2.18 2.46 -1.28 3.99 2.85 -1.26 -4.57 118.16 118.18 2dmh n LYS 43 Ca 0.01 0.86 -0.38 0.00 -1.05 0.00 0.00 58.31 57.75 2dmh n LYS 43 Cb 0.57 -2.96 0.03 0.00 -0.65 0.00 0.00 35.03 32.02 2dmh n LYS 43 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 177.40 177.71 2dmh n LYS 44 N 7.65 0.18 -4.34 -1.58 2.85 -1.26 -4.93 118.16 116.72 2dmh n LYS 44 Ca 0.24 0.08 -0.34 0.00 -1.05 0.00 0.00 58.31 57.23 2dmh n LYS 44 Cb 0.39 -1.33 -0.15 0.00 -0.65 0.00 0.00 35.03 33.29 2dmh n LYS 44 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 2dmh s VAL 45 N -1.92 2.96 0.98 0.58 1.01 -1.02 -5.06 120.40 117.94 2dmh s VAL 45 Ca 0.60 -0.66 -0.16 0.00 0.00 0.00 0.00 61.98 61.76 2dmh s VAL 45 Cb -0.42 -2.28 -0.08 0.00 0.00 0.00 0.00 36.38 33.59 2dmh s VAL 45 CO 0.63 0.49 -0.40 -0.67 0.00 0.00 0.00 175.10 175.15 2dmh n ASP 46 N 4.21 -4.57 -3.14 3.32 2.03 -1.26 -3.84 116.55 113.30 2dmh n ASP 46 Ca -0.19 0.22 -0.35 0.00 0.52 0.00 0.00 54.79 55.00 2dmh n ASP 46 Cb 0.52 -0.91 -0.10 0.00 -0.72 0.00 0.00 41.12 39.91 2dmh n ASP 46 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 2dmh n ASN 47 N 1.77 0.34 -3.62 1.67 6.94 -1.25 -4.75 115.26 116.36 2dmh n ASN 47 Ca 0.01 0.27 -0.12 0.00 -0.02 0.00 0.00 54.58 54.72 2dmh n ASN 47 Cb 0.56 -0.65 -0.07 0.00 -2.36 0.00 0.00 39.78 37.26 2dmh n ASN 47 CO 0.00 0.00 0.00 -0.70 -1.03 0.00 0.00 177.26 175.53 2dmh s GLU 48 N 5.57 0.67 -0.05 -3.83 2.56 -0.56 -4.89 118.70 118.17 2dmh s GLU 48 Ca 0.93 0.67 -0.23 0.00 0.00 0.00 0.00 54.97 56.33 2dmh s GLU 48 Cb -0.97 0.33 -0.26 0.00 2.00 0.00 0.00 34.13 35.23 2dmh s GLU 48 CO 0.40 -0.11 0.96 -0.07 -0.56 0.00 0.00 175.26 175.89 2dmh h LEU 49 N 4.24 0.33 -7.43 2.70 4.07 -1.88 -3.40 115.31 113.93 2dmh h LEU 49 Ca -0.28 -0.86 -0.73 0.00 0.08 0.00 0.00 57.88 56.09 2dmh h LEU 49 Cb 1.17 -0.10 -0.33 0.00 1.08 0.00 0.00 40.66 42.48 2dmh h LEU 49 CO 0.13 1.15 0.04 0.20 -1.08 0.00 0.00 178.44 178.88 2dmh s ASN 50 N -6.58 6.34 0.41 -0.43 0.01 -1.26 -4.03 114.94 109.40 2dmh s ASN 50 Ca -0.15 -3.57 -0.25 0.00 -0.71 0.00 0.00 52.86 48.18 2dmh s ASN 50 Cb 0.01 -2.00 -0.08 0.00 0.41 0.00 0.00 41.25 39.58 2dmh s ASN 50 CO 0.78 -0.25 1.18 -2.16 -1.51 0.00 0.00 177.10 175.14 2dmh s PRO 51 N -1.15 3.98 -0.29 -0.60 0.04 -1.23 -4.79 135.00 130.96 2dmh s PRO 51 Ca 0.27 1.86 0.03 0.00 0.04 0.00 0.00 61.00 63.20 2dmh s PRO 51 Cb -0.09 -2.63 0.08 0.00 0.04 0.00 0.00 34.50 31.90 2dmh s PRO 51 CO -0.10 -0.39 -0.03 0.08 0.04 0.00 0.00 177.00 176.60 2dmh s VAL 52 N -1.42 2.09 -0.18 -0.36 1.01 -1.26 -1.43 120.40 118.85 2dmh s VAL 52 Ca 0.58 -1.89 -0.07 0.00 0.00 0.00 0.00 61.98 60.61 2dmh s VAL 52 Cb -0.31 -2.38 -0.22 0.00 0.00 0.00 0.00 36.38 33.47 2dmh s VAL 52 CO 0.39 -0.31 0.16 0.79 0.00 0.00 0.00 175.10 176.13 2dmh n TRP 53 N 4.40 0.85 -4.16 5.22 8.01 -1.03 -4.95 117.44 125.77 2dmh n TRP 53 Ca -0.06 0.21 -0.36 0.00 -1.31 0.00 0.00 57.50 55.99 2dmh n TRP 53 Cb 0.42 -1.11 -0.07 0.00 -2.01 0.00 0.00 31.31 28.55 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 -3.60 -1.65 -4.90 -0.99 3.02 0.14 -4.89 115.26 102.38 2dmh n ASN 54 Ca -0.37 -0.97 -0.21 0.00 -0.03 0.00 0.00 54.58 53.00 2dmh n ASN 54 Cb 0.98 -1.46 -0.02 0.00 -0.61 0.00 0.00 39.78 38.67 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 -6.72 2.51 -0.02 3.52 -1.05 -1.05 -4.94 118.70 110.96 2dmh s GLU 55 Ca 0.70 -1.58 0.08 0.00 -0.15 0.00 0.00 54.97 54.02 2dmh s GLU 55 Cb -0.41 -2.39 -0.02 0.00 -0.44 0.00 0.00 34.13 30.87 2dmh s GLU 55 CO 0.85 -0.29 -0.26 0.42 0.95 0.00 0.00 175.26 176.94 2dmh s ILE 56 N -2.51 2.01 0.29 1.83 1.01 -1.26 -1.36 121.20 121.21 2dmh s ILE 56 Ca 0.48 -1.10 0.11 0.00 0.00 0.00 0.00 60.65 60.15 2dmh s ILE 56 Cb -0.04 -1.67 -0.05 0.00 0.01 0.00 0.00 42.46 40.71 2dmh s ILE 56 CO 0.28 0.57 -0.15 -0.76 0.00 0.00 0.00 174.94 174.87 2dmh s LEU 57 N -0.61 2.71 0.01 2.97 1.43 -0.62 -4.97 118.68 119.59 2dmh s LEU 57 Ca 0.10 -0.99 -0.03 0.00 -1.03 0.00 0.00 54.13 52.18 2dmh s LEU 57 Cb -0.10 -1.19 -0.01 0.00 0.03 0.00 0.00 46.19 44.92 2dmh s LEU 57 CO -0.01 -0.00 0.04 -1.61 0.23 0.00 0.00 176.35 175.00 2dmh s GLU 58 N -3.55 0.36 -0.03 1.70 2.02 -1.26 -2.08 118.70 115.86 2dmh s GLU 58 Ca 0.31 -0.48 -0.03 0.00 0.02 0.00 0.00 54.97 54.78 2dmh s GLU 58 Cb -0.04 0.14 0.01 0.00 0.10 0.00 0.00 34.13 34.33 2dmh s GLU 58 CO 0.16 -0.07 0.09 -0.06 0.02 0.00 0.00 175.26 175.40 2dmh s PHE 59 N -1.34 -0.07 -0.07 1.61 0.40 0.12 -4.95 117.98 113.70 2dmh s PHE 59 Ca -0.14 0.17 -0.20 0.00 -0.60 0.00 0.00 56.93 56.16 2dmh s PHE 59 Cb -0.08 0.01 -0.05 0.00 0.51 0.00 0.00 43.02 43.41 2dmh s PHE 59 CO 0.00 -0.08 0.55 -0.51 0.70 0.00 0.00 175.22 175.88 2dmh s ASP 60 N -0.16 6.83 -0.01 1.36 1.01 -1.26 -1.06 116.67 123.37 2dmh s ASP 60 Ca -0.02 0.99 0.22 0.00 0.71 0.00 0.00 52.55 54.45 2dmh s ASP 60 Cb -0.02 -2.33 -0.30 0.00 1.01 0.00 0.00 42.92 41.29 2dmh s ASP 60 CO 0.00 0.03 0.56 0.18 0.21 0.00 0.00 175.17 176.16 2dmh n LEU 61 N 3.29 0.14 -3.25 1.23 4.77 -0.72 -4.94 117.00 117.53 2dmh n LEU 61 Ca -0.06 -0.01 -0.19 0.00 -0.03 0.00 0.00 56.01 55.72 2dmh n LEU 61 Cb 0.51 -0.01 0.07 0.00 -2.33 0.00 0.00 43.42 41.67 2dmh n LEU 61 CO 0.44 0.00 0.18 0.54 -1.33 0.00 0.00 177.39 177.22 2dmh n ARG 62 N -2.24 -6.76 -0.75 3.23 1.74 -1.01 -1.51 116.66 109.37 2dmh n ARG 62 Ca -0.03 0.75 0.00 0.00 -0.77 0.00 0.00 57.85 57.80 2dmh n ARG 62 Cb 0.55 -5.54 0.00 0.00 -1.02 0.00 0.00 32.46 26.45 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 -1.60 0.71 3.56 -0.13 0.00 0.11 -4.96 105.19 102.88 2dmh n GLY 63 Ca -0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.82 4.61 0.92 -0.61 -1.09 -0.57 -4.88 121.20 116.76 2dmh s ILE 64 Ca 0.00 0.64 -0.12 0.00 -2.23 0.00 0.00 60.65 58.95 2dmh s ILE 64 Cb 0.00 -4.33 0.14 0.00 -1.58 0.00 0.00 42.46 36.69 2dmh s ILE 64 CO 0.00 -0.69 1.09 -2.16 -1.23 0.00 0.00 174.94 171.95 2dmh s PRO 65 N 3.40 1.08 0.80 2.79 0.04 -1.26 -4.80 135.00 137.05 2dmh s PRO 65 Ca 0.33 0.75 -0.09 0.00 0.04 0.00 0.00 61.00 62.03 2dmh s PRO 65 Cb -0.12 -1.79 0.12 0.00 0.04 0.00 0.00 34.50 32.75 2dmh s PRO 65 CO 0.22 -2.35 1.13 -0.51 0.04 0.00 0.00 177.00 175.53 2dmh s LEU 66 N -6.27 2.79 0.37 -3.56 1.43 -1.26 -5.10 118.68 107.08 2dmh s LEU 66 Ca 0.64 0.25 -0.08 0.00 -1.03 0.00 0.00 54.13 53.90 2dmh s LEU 66 Cb -0.18 -2.61 0.03 0.00 0.03 0.00 0.00 46.19 43.46 2dmh s LEU 66 CO 0.57 -2.06 0.64 1.51 0.23 0.00 0.00 176.35 177.24 2dmh s ASP 67 N -4.69 0.54 0.00 2.29 1.47 -1.26 -4.91 116.67 110.11 2dmh s ASP 67 Ca 0.66 -1.36 0.21 0.00 1.18 0.00 0.00 52.55 53.23 2dmh s ASP 67 Cb -0.07 0.77 0.90 0.00 -0.34 0.00 0.00 42.92 44.18 2dmh s ASP 67 CO 0.48 -1.52 1.66 0.49 0.68 0.00 0.00 175.17 176.96 2dmh n PHE 68 N -0.56 0.00 0.63 2.11 3.01 -1.26 -2.39 117.46 119.00 2dmh n PHE 68 Ca -0.04 0.00 0.10 0.00 1.01 0.00 0.00 57.45 58.53 2dmh n PHE 68 Cb 0.61 -0.47 -0.12 0.00 -0.01 0.00 0.00 39.48 39.50 2dmh n PHE 68 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 2dmh n SER 69 N -1.47 0.63 -4.76 4.37 7.64 -1.26 -4.68 113.62 114.10 2dmh n SER 69 Ca 0.06 -0.59 -0.40 0.00 1.01 0.00 0.00 58.87 58.95 2dmh n SER 69 Cb 0.23 1.29 -0.06 0.00 -1.01 0.00 0.00 64.21 64.65 2dmh n SER 69 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2dmh s SER 70 N -3.58 7.57 0.20 6.43 0.01 -1.01 -5.03 113.70 118.30 2dmh s SER 70 Ca 0.02 1.87 -0.17 0.00 1.31 0.00 0.00 55.95 58.98 2dmh s SER 70 Cb 0.15 -2.58 0.02 0.00 0.21 0.00 0.00 66.02 63.83 2dmh s SER 70 CO 0.87 0.16 0.52 -0.94 0.41 0.00 0.00 173.24 174.27 2dmh s SER 71 N -1.20 -0.24 0.06 2.44 1.04 -1.26 -2.20 113.70 112.34 2dmh s SER 71 Ca 0.40 -0.52 0.06 0.00 0.48 0.00 0.00 55.95 56.37 2dmh s SER 71 Cb -0.25 0.58 -0.04 0.00 0.10 0.00 0.00 66.02 66.42 2dmh s SER 71 CO 0.30 -1.07 -0.11 -0.22 0.98 0.00 0.00 173.24 173.13 2dmh s LEU 72 N -2.89 3.00 -0.29 2.42 2.96 0.30 -4.91 118.68 119.28 2dmh s LEU 72 Ca 0.10 -0.33 -0.02 0.00 -0.22 0.00 0.00 54.13 53.66 2dmh s LEU 72 Cb -0.01 -1.77 0.04 0.00 0.50 0.00 0.00 46.19 44.95 2dmh s LEU 72 CO -0.02 0.22 -0.01 -0.83 -1.32 0.00 0.00 176.35 174.39 2dmh s GLY 73 N -1.85 1.73 -0.45 7.98 0.00 -1.23 -1.08 107.32 112.41 2dmh s GLY 73 Ca 0.19 -1.68 -0.16 0.00 0.00 0.00 0.00 44.72 43.07 2dmh s GLY 73 CO 0.10 0.65 0.37 -0.42 0.00 0.00 0.00 173.10 173.81 2dmh s ILE 74 N 1.28 5.22 -0.25 0.90 -1.09 0.82 -3.14 121.20 124.95 2dmh s ILE 74 Ca -0.04 -0.87 -0.05 0.00 -2.23 0.00 0.00 60.65 57.47 2dmh s ILE 74 Cb -0.19 -4.06 -0.00 0.00 -1.58 0.00 0.00 42.46 36.63 2dmh s ILE 74 CO -0.02 -0.49 -0.00 -0.63 -1.23 0.00 0.00 174.94 172.58 2dmh s ILE 75 N 1.71 3.55 -0.39 2.92 1.01 -0.92 -0.27 121.20 128.82 2dmh s ILE 75 Ca 0.05 -0.60 -0.10 0.00 0.00 0.00 0.00 60.65 60.01 2dmh s ILE 75 Cb -0.22 -2.71 0.05 0.00 0.01 0.00 0.00 42.46 39.59 2dmh s ILE 75 CO 0.08 0.29 0.22 -0.69 0.00 0.00 0.00 174.94 174.84 2dmh s VAL 76 N 1.47 4.33 0.53 2.92 1.01 -0.45 -1.93 120.40 128.28 2dmh s VAL 76 Ca 0.04 -1.13 0.01 0.00 0.00 0.00 0.00 61.98 60.90 2dmh s VAL 76 Cb -0.15 -3.52 0.00 0.00 0.00 0.00 0.00 36.38 32.71 2dmh s VAL 76 CO -0.01 -0.35 0.08 -0.54 0.00 0.00 0.00 175.10 174.28 2dmh s LYS 77 N 1.48 2.23 -0.38 2.72 1.02 -1.16 -2.26 119.74 123.39 2dmh s LYS 77 Ca 0.02 -2.37 -0.13 0.00 0.02 0.00 0.00 55.97 53.51 2dmh s LYS 77 Cb -0.21 -1.62 0.01 0.00 -0.52 0.00 0.00 37.83 35.49 2dmh s LYS 77 CO 0.04 -0.45 0.25 -0.51 -0.92 0.00 0.00 175.35 173.77 2dmh s ASP 78 N -3.97 5.96 0.39 2.83 1.01 -1.26 -1.72 116.67 119.91 2dmh s ASP 78 Ca 0.08 -0.81 0.24 0.00 0.71 0.00 0.00 52.55 52.77 2dmh s ASP 78 Cb 0.00 -2.11 1.39 0.00 1.01 0.00 0.00 42.92 43.21 2dmh s ASP 78 CO 0.05 -0.37 1.58 0.15 0.21 0.00 0.00 175.17 176.78 2dmh h PHE 79 N 8.53 0.74 -0.13 4.23 3.57 -1.29 0.38 116.94 132.96 2dmh h PHE 79 Ca -0.28 0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.31 2dmh h PHE 79 Cb 1.12 -0.17 -0.06 0.00 2.79 0.00 0.00 35.95 39.63 2dmh h PHE 79 CO 0.58 -0.42 -0.28 0.93 -2.23 0.00 0.00 178.31 176.90 2dmh h GLU 80 N 0.01 -0.33 -6.00 1.11 4.39 -1.93 -3.36 114.58 108.46 2dmh h GLU 80 Ca 0.86 0.02 -0.51 0.00 0.34 0.00 0.00 59.36 60.07 2dmh h GLU 80 Cb 2.42 0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 31.12 2dmh h GLU 80 CO -0.68 -0.22 1.38 0.95 -1.16 0.00 0.00 179.01 179.28 2dmh s THR 81 N -6.04 3.33 -0.40 1.13 -4.23 0.13 -4.93 115.64 104.62 2dmh s THR 81 Ca -0.15 0.24 -0.01 0.00 -1.18 0.00 0.00 61.69 60.59 2dmh s THR 81 Cb 0.11 -3.72 0.11 0.00 1.34 0.00 0.00 72.50 70.34 2dmh s THR 81 CO 0.67 -0.64 0.18 -0.63 -0.54 0.00 0.00 174.62 173.66 2dmh s ILE 82 N 8.99 3.10 0.00 2.99 -1.09 -1.26 -4.69 121.20 129.24 2dmh s ILE 82 Ca 0.75 -2.16 0.00 0.00 -2.23 0.00 0.00 60.65 57.01 2dmh s ILE 82 Cb -0.16 -3.15 0.00 0.00 -1.58 0.00 0.00 42.46 37.57 2dmh s ILE 82 CO 0.25 -0.68 0.00 0.61 -1.23 0.00 0.00 174.94 173.89 2dmh n GLY 83 N 4.47 3.45 3.76 6.18 0.00 -1.26 -5.09 105.19 116.70 2dmh n GLY 83 Ca -0.01 -0.96 -0.35 0.00 0.00 0.00 0.00 46.02 44.70 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 3.12 -0.19 1.61 -1.52 -1.26 -4.90 119.66 116.52 2dmh s GLN 84 Ca 0.00 1.72 -0.05 0.00 -1.95 0.00 0.00 55.36 55.08 2dmh s GLN 84 Cb 0.00 -1.96 -0.11 0.00 -0.22 0.00 0.00 33.01 30.72 2dmh s GLN 84 CO 0.00 -1.06 3.16 0.09 -0.25 0.00 0.00 175.29 177.23 2dmh n ASN 85 N -1.51 5.78 -4.40 5.90 3.02 -1.26 -4.79 115.26 118.01 2dmh n ASN 85 Ca 0.13 -2.79 -0.45 0.00 -0.03 0.00 0.00 54.58 51.44 2dmh n ASN 85 Cb 0.50 -1.32 -0.00 0.00 -0.61 0.00 0.00 39.78 38.35 2dmh n ASN 85 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2dmh s LYS 86 N -0.23 4.14 0.19 3.52 2.20 -1.26 -5.02 119.74 123.28 2dmh s LYS 86 Ca 0.60 -2.90 -0.15 0.00 -0.36 0.00 0.00 55.97 53.15 2dmh s LYS 86 Cb 0.33 -4.79 -0.07 0.00 -1.51 0.00 0.00 37.83 31.78 2dmh s LYS 86 CO -0.09 -1.49 0.60 -0.48 -0.36 0.00 0.00 175.35 173.53 2dmh s LEU 87 N 0.10 4.30 -0.17 5.43 0.05 -1.26 -4.42 118.68 122.70 2dmh s LEU 87 Ca 0.36 1.15 -0.22 0.00 0.05 0.00 0.00 54.13 55.47 2dmh s LEU 87 Cb -0.07 -3.45 -0.22 0.00 -2.05 0.00 0.00 46.19 40.40 2dmh s LEU 87 CO -0.04 0.04 0.40 0.40 -0.55 0.00 0.00 176.35 176.60 2dmh h ILE 88 N 2.62 1.12 -1.21 1.48 2.04 -1.80 -3.45 117.51 118.30 2dmh h ILE 88 Ca -0.48 -2.26 0.16 0.00 1.00 0.00 0.00 64.86 63.28 2dmh h ILE 88 Cb 1.19 2.57 -0.31 0.00 -0.74 0.00 0.00 36.82 39.53 2dmh h ILE 88 CO 0.66 0.47 0.76 -0.83 0.00 0.00 0.00 178.15 179.20 2dmh s GLY 89 N -4.76 0.25 0.22 5.37 0.00 -1.04 -4.54 107.32 102.82 2dmh s GLY 89 Ca -0.25 3.34 0.11 0.00 0.00 0.00 0.00 44.72 47.92 2dmh s GLY 89 CO 0.65 2.00 -0.21 -0.51 0.00 0.00 0.00 173.10 175.03 2dmh s THR 90 N 0.19 2.25 -0.13 0.90 -4.23 0.83 -1.34 115.64 114.11 2dmh s THR 90 Ca 0.05 -2.18 -0.10 0.00 -1.18 0.00 0.00 61.69 58.28 2dmh s THR 90 Cb -0.05 -2.14 0.04 0.00 1.34 0.00 0.00 72.50 71.69 2dmh s THR 90 CO -0.13 -0.31 0.34 0.00 -0.54 0.00 0.00 174.62 173.98 2dmh s ALA 91 N -2.19 -0.84 -0.25 3.99 0.00 0.63 -1.80 121.76 121.30 2dmh s ALA 91 Ca 0.24 1.08 -0.06 0.00 0.00 0.00 0.00 51.96 53.21 2dmh s ALA 91 Cb -0.06 -0.64 -0.02 0.00 0.00 0.00 0.00 23.12 22.41 2dmh s ALA 91 CO 0.11 -0.19 0.04 0.99 0.00 0.00 0.00 175.76 176.72 2dmh s THR 92 N 0.58 4.00 -0.27 0.00 2.01 -1.26 -0.13 115.64 120.58 2dmh s THR 92 Ca -0.03 -0.37 -0.11 0.00 0.31 0.00 0.00 61.69 61.49 2dmh s THR 92 Cb -0.05 -2.90 -0.05 0.00 0.01 0.00 0.00 72.50 69.51 2dmh s THR 92 CO -0.03 0.30 0.17 -0.69 -0.69 0.00 0.00 174.62 173.68 2dmh s VAL 93 N 1.56 5.23 -0.21 3.82 1.01 -0.24 -4.94 120.40 126.62 2dmh s VAL 93 Ca 0.05 0.14 -0.29 0.00 0.00 0.00 0.00 61.98 61.88 2dmh s VAL 93 Cb -0.15 -3.48 -0.00 0.00 0.00 0.00 0.00 36.38 32.75 2dmh s VAL 93 CO 0.02 0.28 1.15 0.00 0.00 0.00 0.00 175.10 176.55 2dmh s ALA 94 N 1.56 3.65 -1.72 5.51 0.00 -1.26 -0.54 121.76 128.96 2dmh s ALA 94 Ca 0.07 0.28 0.31 0.00 0.00 0.00 0.00 51.96 52.62 2dmh s ALA 94 Cb -0.15 -3.60 1.72 0.00 0.00 0.00 0.00 23.12 21.09 2dmh s ALA 94 CO 0.09 -1.17 2.14 1.28 0.00 0.00 0.00 175.76 178.10 2dmh n LEU 95 N 6.55 0.01 0.27 0.00 4.77 -0.93 -3.55 117.00 124.11 2dmh n LEU 95 Ca 0.13 0.14 0.18 0.00 -0.03 0.00 0.00 56.01 56.43 2dmh n LEU 95 Cb 0.46 -0.14 0.96 0.00 -2.33 0.00 0.00 43.42 42.37 2dmh n LEU 95 CO 0.55 0.00 1.05 0.07 -1.33 0.00 0.00 177.39 177.72 2dmh h LYS 96 N 0.01 0.00 0.00 3.23 2.10 -1.68 0.15 116.57 120.37 2dmh h LYS 96 Ca 0.00 0.00 -0.05 0.00 -2.00 0.00 0.00 60.65 58.60 2dmh h LYS 96 Cb 0.14 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.46 2dmh h LYS 96 CO 0.00 0.00 -0.63 -0.44 -2.00 0.00 0.00 179.45 176.38 2dmh h ASP 97 N 0.00 0.00 0.45 7.07 3.32 -1.91 -3.32 116.42 122.03 2dmh h ASP 97 Ca 0.00 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 56.75 2dmh h ASP 97 Cb 0.03 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.53 2dmh h ASP 97 CO 0.00 0.20 -1.76 0.18 -1.72 0.00 0.00 179.24 176.15 2dmh n LEU 98 N -2.97 0.85 -4.25 1.55 4.77 0.42 -4.96 117.00 112.41 2dmh n LEU 98 Ca 0.00 0.39 -0.39 0.00 -0.03 0.00 0.00 56.01 55.98 2dmh n LEU 98 Cb 0.63 0.17 0.02 0.00 -2.33 0.00 0.00 43.42 41.91 2dmh n LEU 98 CO 0.39 0.40 -0.63 0.35 -1.33 0.00 0.00 177.39 176.57 2dmh n THR 99 N -3.03 0.24 -0.83 -5.08 -2.24 -0.63 -4.65 114.28 98.06 2dmh n THR 99 Ca -0.18 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.10 2dmh n THR 99 Cb 1.06 -0.08 0.00 0.00 -2.10 0.00 0.00 70.33 69.21 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 2.52 -0.73 2.26 3.38 0.00 -1.26 -4.94 105.19 106.41 2dmh n GLY 100 Ca 0.07 -1.60 -0.32 0.00 0.00 0.00 0.00 46.02 44.17 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 7.02 -3.64 1.61 2.03 -1.26 -4.84 116.55 120.48 2dmh n ASP 101 Ca 0.00 -3.78 -0.05 0.00 0.52 0.00 0.00 54.79 51.48 2dmh n ASP 101 Cb 0.00 -0.85 -0.06 0.00 -0.72 0.00 0.00 41.12 39.49 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 -3.77 0.24 0.21 -0.67 -2.07 -1.26 -5.00 119.66 107.35 2dmh s GLN 102 Ca 0.62 0.20 -0.32 0.00 -1.82 0.00 0.00 55.36 54.04 2dmh s GLN 102 Cb 0.49 0.12 -0.14 0.00 -1.09 0.00 0.00 33.01 32.38 2dmh s GLN 102 CO 0.00 -0.05 1.36 0.45 -1.32 0.00 0.00 175.29 175.74 2dmh n SER 103 N 1.43 2.39 -3.66 12.60 2.88 -1.26 -4.75 113.62 123.24 2dmh n SER 103 Ca -0.09 1.14 -0.17 0.00 -1.33 0.00 0.00 58.87 58.42 2dmh n SER 103 Cb 0.57 -1.36 -0.16 0.00 -0.75 0.00 0.00 64.21 62.51 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 -0.23 0.04 -0.34 -1.46 3.52 -0.85 -4.98 118.95 114.64 2dmh s ARG 104 Ca 0.71 0.53 -0.02 0.00 -0.13 0.00 0.00 55.73 56.83 2dmh s ARG 104 Cb -0.72 -0.34 0.07 0.00 -1.56 0.00 0.00 34.95 32.40 2dmh s ARG 104 CO 0.49 -0.33 0.07 -1.54 -0.81 0.00 0.00 175.30 173.18 2dmh s SER 105 N 2.29 5.01 -0.23 -2.12 1.04 -1.26 -1.98 113.70 116.44 2dmh s SER 105 Ca 0.03 -1.57 -0.08 0.00 0.48 0.00 0.00 55.95 54.82 2dmh s SER 105 Cb -0.12 -1.75 -0.03 0.00 0.10 0.00 0.00 66.02 64.22 2dmh s SER 105 CO -0.06 -0.36 0.08 -0.76 0.98 0.00 0.00 173.24 173.12 2dmh s LEU 106 N 1.20 3.59 -0.50 2.42 1.43 -1.00 -4.98 118.68 120.84 2dmh s LEU 106 Ca 0.00 -0.11 -0.27 0.00 -1.03 0.00 0.00 54.13 52.72 2dmh s LEU 106 Cb -0.21 -1.95 -0.02 0.00 0.03 0.00 0.00 46.19 44.04 2dmh s LEU 106 CO -0.02 0.02 1.80 -2.16 0.23 0.00 0.00 176.35 176.21 2dmh s PRO 107 N 1.30 2.95 -0.64 1.29 0.04 -1.26 -3.55 135.00 135.13 2dmh s PRO 107 Ca 0.05 0.90 -0.22 0.00 0.04 0.00 0.00 61.00 61.77 2dmh s PRO 107 Cb -0.15 -4.29 0.07 0.00 0.04 0.00 0.00 34.50 30.17 2dmh s PRO 107 CO 0.04 -2.33 0.92 0.71 0.04 0.00 0.00 177.00 176.38 2dmh s TYR 108 N 8.01 2.73 0.41 0.56 2.02 0.23 -4.97 117.35 126.33 2dmh s TYR 108 Ca 0.71 -0.53 0.05 0.00 -0.37 0.00 0.00 57.07 56.93 2dmh s TYR 108 Cb -0.16 -4.21 -0.06 0.00 -0.40 0.00 0.00 41.96 37.12 2dmh s TYR 108 CO 0.26 -1.56 0.02 0.15 -1.57 0.00 0.00 175.55 172.85 2dmh s LYS 109 N 3.87 1.93 -1.38 -0.62 1.02 -1.26 -0.21 119.74 123.09 2dmh s LYS 109 Ca 0.22 -2.12 -0.09 0.00 0.02 0.00 0.00 55.97 54.00 2dmh s LYS 109 Cb -0.17 -1.41 0.02 0.00 -0.52 0.00 0.00 37.83 35.75 2dmh s LYS 109 CO 0.11 -0.15 1.12 1.28 -0.92 0.00 0.00 175.35 176.79 2dmh n LEU 110 N -0.95 -3.29 -4.65 3.17 4.77 -1.26 -4.94 117.00 109.85 2dmh n LEU 110 Ca -0.07 -0.60 -0.42 0.00 -0.03 0.00 0.00 56.01 54.89 2dmh n LEU 110 Cb 0.67 -2.94 -0.04 0.00 -2.33 0.00 0.00 43.42 38.78 2dmh n LEU 110 CO 0.45 0.59 0.69 -0.63 -1.33 0.00 0.00 177.39 177.17 2dmh s ILE 111 N -3.33 4.81 -0.42 -0.08 1.01 -1.25 -4.96 121.20 116.98 2dmh s ILE 111 Ca 0.54 1.66 -0.28 0.00 0.00 0.00 0.00 60.65 62.56 2dmh s ILE 111 Cb -0.24 -4.15 0.02 0.00 0.01 0.00 0.00 42.46 38.10 2dmh s ILE 111 CO 0.75 -0.08 1.07 -0.44 0.00 0.00 0.00 174.94 176.24 2dmh s SER 112 N 1.29 6.69 0.30 3.58 0.01 -1.26 -3.41 113.70 120.90 2dmh s SER 112 Ca 0.37 0.58 -0.26 0.00 1.31 0.00 0.00 55.95 57.95 2dmh s SER 112 Cb -0.15 -2.52 -0.10 0.00 0.21 0.00 0.00 66.02 63.46 2dmh s SER 112 CO 0.08 -1.08 0.91 -0.76 0.41 0.00 0.00 173.24 172.79 2dmh s LEU 113 N 4.04 4.37 0.17 2.44 1.43 -0.77 -4.84 118.68 125.52 2dmh s LEU 113 Ca 0.45 1.79 0.09 0.00 -1.03 0.00 0.00 54.13 55.42 2dmh s LEU 113 Cb -0.09 -3.91 -0.04 0.00 0.03 0.00 0.00 46.19 42.17 2dmh s LEU 113 CO 0.25 -0.03 -0.19 -0.76 0.23 0.00 0.00 176.35 175.85 2dmh s LEU 114 N -1.95 2.44 0.00 1.79 1.43 -0.74 -1.42 118.68 120.22 2dmh s LEU 114 Ca 0.48 -0.87 -0.04 0.00 -1.03 0.00 0.00 54.13 52.68 2dmh s LEU 114 Cb -0.19 -0.87 0.10 0.00 0.03 0.00 0.00 46.19 45.25 2dmh s LEU 114 CO 0.24 -0.01 0.62 -0.46 0.23 0.00 0.00 176.35 176.97 2dmh n ASN 115 N 0.27 0.45 0.15 2.29 0.23 -1.16 -0.12 115.26 117.38 2dmh n ASN 115 Ca -0.13 -1.47 0.11 0.00 -0.53 0.00 0.00 54.58 52.56 2dmh n ASN 115 Cb 0.57 -0.44 0.55 0.00 -2.08 0.00 0.00 39.78 38.38 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 -2.23 0.16 0.01 -3.83 0.28 -1.26 -1.54 120.64 112.23 2dmh n GLU 116 Ca 0.09 0.56 -0.12 0.00 -0.16 0.00 0.00 57.16 57.54 2dmh n GLU 116 Cb 0.32 -1.92 -0.14 0.00 1.43 0.00 0.00 31.44 31.13 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 0.08 0.00 3.44 6.56 -2.01 -3.48 116.57 121.16 2dmh h LYS 117 Ca 0.00 -0.14 0.00 0.00 -1.06 0.00 0.00 60.65 59.45 2dmh h LYS 117 Cb 0.12 0.05 0.00 0.00 -0.57 0.00 0.00 32.23 31.84 2dmh h LYS 117 CO 0.00 0.77 0.00 0.41 -2.06 0.00 0.00 179.45 178.57 2dmh n GLY 118 N 1.61 1.29 3.96 3.86 0.00 -0.59 -5.12 105.19 110.21 2dmh n GLY 118 Ca -0.16 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.22 2.60 -0.86 1.61 -1.52 -1.26 -4.83 119.66 115.18 2dmh s GLN 119 Ca 0.00 -0.66 -0.24 0.00 -1.95 0.00 0.00 55.36 52.52 2dmh s GLN 119 Cb 0.00 -2.46 0.06 0.00 -0.22 0.00 0.00 33.01 30.39 2dmh s GLN 119 CO 0.00 -0.70 1.28 -0.51 -0.25 0.00 0.00 175.29 175.11 2dmh s ASP 120 N -4.40 6.35 0.34 5.90 1.01 -1.26 -2.96 116.67 121.65 2dmh s ASP 120 Ca 0.56 -1.11 0.08 0.00 0.71 0.00 0.00 52.55 52.79 2dmh s ASP 120 Cb -0.10 -2.52 0.80 0.00 1.01 0.00 0.00 42.92 42.10 2dmh s ASP 120 CO 0.39 -1.56 1.84 0.71 0.21 0.00 0.00 175.17 176.77 2dmh h THR 121 N 6.29 0.80 0.00 -1.27 1.35 -1.58 -3.46 112.91 115.04 2dmh h THR 121 Ca -0.04 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.57 2dmh h THR 121 Cb 1.03 0.02 0.00 0.00 -1.73 0.00 0.00 68.15 67.48 2dmh h THR 121 CO 1.30 0.13 0.00 0.61 -0.25 0.00 0.00 175.52 177.31 2dmh n GLY 122 N -1.41 0.96 3.41 5.82 0.00 -1.25 -4.85 105.19 107.86 2dmh n GLY 122 Ca 0.19 -0.07 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 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 2.68 -0.12 4.61 0.00 -1.19 -4.63 121.76 121.12 2dmh s ALA 123 Ca 0.00 -0.90 0.01 0.00 0.00 0.00 0.00 51.96 51.07 2dmh s ALA 123 Cb 0.00 -1.20 -0.01 0.00 0.00 0.00 0.00 23.12 21.90 2dmh s ALA 123 CO 0.00 0.32 -0.15 0.95 0.00 0.00 0.00 175.76 176.87 2dmh s THR 124 N 0.11 2.86 -0.08 0.00 -4.23 -0.39 -1.86 115.64 112.05 2dmh s THR 124 Ca -0.05 -0.74 0.03 0.00 -1.18 0.00 0.00 61.69 59.75 2dmh s THR 124 Cb -0.15 -2.18 0.00 0.00 1.34 0.00 0.00 72.50 71.52 2dmh s THR 124 CO 0.04 0.53 -0.19 -0.51 -0.54 0.00 0.00 174.62 173.96 2dmh s ILE 125 N 0.28 1.67 -0.17 2.99 2.07 -1.22 -0.69 121.20 126.14 2dmh s ILE 125 Ca -0.11 -0.80 -0.19 0.00 -1.41 0.00 0.00 60.65 58.14 2dmh s ILE 125 Cb -0.16 -1.46 -0.03 0.00 0.13 0.00 0.00 42.46 40.93 2dmh s ILE 125 CO 0.06 0.47 0.55 1.51 -1.91 0.00 0.00 174.94 175.62 2dmh s ASP 126 N 0.43 6.65 0.02 4.50 -4.77 0.42 -3.92 116.67 120.00 2dmh s ASP 126 Ca -0.16 0.79 -0.02 0.00 -3.30 0.00 0.00 52.55 49.86 2dmh s ASP 126 Cb -0.17 -2.31 -0.02 0.00 -1.09 0.00 0.00 42.92 39.33 2dmh s ASP 126 CO 0.06 -0.15 0.00 -0.76 0.70 0.00 0.00 175.17 175.03 2dmh s LEU 127 N 1.38 2.11 -0.28 2.11 1.43 0.71 -2.48 118.68 123.66 2dmh s LEU 127 Ca 0.27 -0.47 -0.01 0.00 -1.03 0.00 0.00 54.13 52.89 2dmh s LEU 127 Cb -0.16 0.22 0.09 0.00 0.03 0.00 0.00 46.19 46.38 2dmh s LEU 127 CO 0.11 -0.33 0.07 -0.69 0.23 0.00 0.00 176.35 175.73 2dmh s VAL 128 N -1.59 0.99 0.10 -1.59 1.01 -0.38 0.75 120.40 119.69 2dmh s VAL 128 Ca -0.14 -1.30 -0.06 0.00 0.00 0.00 0.00 61.98 60.48 2dmh s VAL 128 Cb -0.09 -1.64 -0.05 0.00 0.00 0.00 0.00 36.38 34.60 2dmh s VAL 128 CO -0.01 -0.52 0.35 -0.63 0.00 0.00 0.00 175.10 174.28 2dmh s ILE 129 N 1.58 5.20 -0.03 2.22 1.01 -1.23 -1.31 121.20 128.64 2dmh s ILE 129 Ca 0.06 0.11 -0.01 0.00 0.00 0.00 0.00 60.65 60.81 2dmh s ILE 129 Cb -0.18 -3.62 0.03 0.00 0.01 0.00 0.00 42.46 38.71 2dmh s ILE 129 CO -0.19 0.16 0.06 -0.83 0.00 0.00 0.00 174.94 174.14 2dmh s GLY 130 N -2.17 0.11 0.10 6.18 0.00 -0.45 -2.37 107.32 108.72 2dmh s GLY 130 Ca 0.36 0.33 -0.01 0.00 0.00 0.00 0.00 44.72 45.41 2dmh s GLY 130 CO 0.22 0.98 0.26 -0.47 0.00 0.00 0.00 173.10 174.09 2dmh s TYR 131 N 1.46 3.50 -0.04 1.90 5.04 -0.84 -2.26 117.35 126.11 2dmh s TYR 131 Ca -0.05 0.30 -0.02 0.00 -2.44 0.00 0.00 57.07 54.87 2dmh s TYR 131 Cb -0.13 -1.80 0.03 0.00 0.35 0.00 0.00 41.96 40.41 2dmh s TYR 131 CO -0.03 0.54 0.05 0.34 -1.34 0.00 0.00 175.55 175.10 2dmh s ASP 132 N -2.62 1.11 0.07 4.32 2.15 -1.25 -2.00 116.67 118.44 2dmh s ASP 132 Ca 0.36 0.06 -0.31 0.00 0.43 0.00 0.00 52.55 53.10 2dmh s ASP 132 Cb -0.12 -0.17 -0.07 0.00 -0.30 0.00 0.00 42.92 42.26 2dmh s ASP 132 CO 0.27 -0.24 1.40 -2.16 -0.17 0.00 0.00 175.17 174.27 2dmh s PRO 133 N 2.07 4.31 0.59 4.34 0.04 -1.26 -3.97 135.00 141.12 2dmh s PRO 133 Ca 0.04 2.03 -0.18 0.00 0.04 0.00 0.00 61.00 62.93 2dmh s PRO 133 Cb -0.12 -3.40 -0.03 0.00 0.04 0.00 0.00 34.50 30.99 2dmh s PRO 133 CO -0.03 -0.49 1.12 -1.25 0.04 0.00 0.00 177.00 176.39 2dmh s PRO 134 N 1.67 3.13 -0.10 0.56 0.04 -1.26 -4.74 135.00 134.30 2dmh s PRO 134 Ca 0.64 1.52 -0.01 0.00 0.04 0.00 0.00 61.00 63.20 2dmh s PRO 134 Cb -0.34 -1.98 0.03 0.00 0.04 0.00 0.00 34.50 32.24 2dmh s PRO 134 CO 0.29 -1.01 -0.05 -1.12 0.04 0.00 0.00 177.00 175.15 2dmh s SER 135 N -2.10 1.98 -0.07 6.66 0.01 0.19 -4.93 113.70 115.43 2dmh s SER 135 Ca 0.70 -0.23 -0.30 0.00 1.31 0.00 0.00 55.95 57.43 2dmh s SER 135 Cb -0.23 -0.69 0.11 0.00 0.21 0.00 0.00 66.02 65.43 2dmh s SER 135 CO 0.33 -0.15 0.98 -0.83 0.41 0.00 0.00 173.24 173.98 2dmh s GLY 136 N 1.81 -0.39 -0.93 3.44 0.00 -1.26 -3.03 107.32 106.96 2dmh s GLY 136 Ca 0.05 1.32 -0.24 0.00 0.00 0.00 0.00 44.72 45.85 2dmh s GLY 136 CO -0.07 0.50 1.94 2.56 0.00 0.00 0.00 173.10 178.03 2dmh s PRO 137 N -2.62 2.56 -0.40 2.90 0.04 -1.26 -4.89 135.00 131.33 2dmh s PRO 137 Ca 0.05 -0.37 -0.37 0.00 0.04 0.00 0.00 61.00 60.36 2dmh s PRO 137 Cb -0.01 -5.08 -0.16 0.00 0.04 0.00 0.00 34.50 29.30 2dmh s PRO 137 CO -0.06 -3.42 1.37 0.43 0.04 0.00 0.00 177.00 175.35 2dmh n SER 138 N 13.98 0.87 -3.54 6.66 7.64 -1.26 -4.88 113.62 133.08 2dmh n SER 138 Ca 0.40 0.85 -0.08 0.00 1.01 0.00 0.00 58.87 61.05 2dmh n SER 138 Cb 0.47 -0.70 -0.03 0.00 -1.01 0.00 0.00 64.21 62.94 2dmh n SER 138 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2dmh s SER 139 N 2.93 -0.32 0.00 6.43 1.04 -1.26 -5.33 113.70 117.19 2dmh s SER 139 Ca 0.86 0.12 0.15 0.00 0.48 0.00 0.00 55.95 57.55 2dmh s SER 139 Cb -1.19 0.31 0.12 0.00 0.10 0.00 0.00 66.02 65.36 2dmh s SER 139 CO 0.62 -0.46 0.96 0.61 0.98 0.00 0.00 173.24 175.95