#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dlu s SER 2 N 0.00 4.87 -0.13 1.61 0.15 -1.26 -5.09 113.70 113.85 2dlu s SER 2 Ca 0.00 -1.37 -0.29 0.00 0.70 0.00 0.00 55.95 54.99 2dlu s SER 2 Cb 0.00 -1.70 -0.01 0.00 -1.71 0.00 0.00 66.02 62.60 2dlu s SER 2 CO 0.00 -0.28 1.00 -0.55 1.20 0.00 0.00 173.24 174.61 2dlu s SER 3 N 1.27 7.19 0.00 5.45 0.15 -1.26 -4.82 113.70 121.68 2dlu s SER 3 Ca -0.04 1.47 0.00 0.00 0.70 0.00 0.00 55.95 58.08 2dlu s SER 3 Cb -0.20 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.57 2dlu s SER 3 CO -0.02 -0.48 0.00 0.61 1.20 0.00 0.00 173.24 174.55 2dlu n GLY 4 N 3.17 -0.28 0.25 9.45 0.00 -1.26 -5.01 105.19 111.51 2dlu n GLY 4 Ca 0.09 -1.08 -0.06 0.00 0.00 0.00 0.00 46.02 44.97 2dlu n GLY 4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2dlu h SER 5 N 0.00 -0.69 -1.53 1.61 0.02 -2.03 -3.30 113.55 107.63 2dlu h SER 5 Ca 0.00 0.15 -0.59 0.00 -0.84 0.00 0.00 61.79 60.51 2dlu h SER 5 Cb 0.00 0.37 -0.10 0.00 0.14 0.00 0.00 62.40 62.81 2dlu h SER 5 CO 0.00 -0.23 1.33 -0.44 -1.14 0.00 0.00 176.83 176.35 2dlu s SER 6 N -5.13 6.41 0.57 3.07 0.01 -1.26 -4.99 113.70 112.38 2dlu s SER 6 Ca -0.14 -1.21 0.06 0.00 1.31 0.00 0.00 55.95 55.97 2dlu s SER 6 Cb 0.14 -2.56 0.07 0.00 0.21 0.00 0.00 66.02 63.89 2dlu s SER 6 CO 0.70 -1.57 0.79 -0.83 0.41 0.00 0.00 173.24 172.73 2dlu s GLY 7 N 4.57 1.80 -0.28 3.44 0.00 -1.25 -4.97 107.32 110.62 2dlu s GLY 7 Ca 0.42 -1.83 -0.29 0.00 0.00 0.00 0.00 44.72 43.03 2dlu s GLY 7 CO -0.03 -1.43 1.66 2.56 0.00 0.00 0.00 173.10 175.86 2dlu s PRO 8 N -4.73 3.60 -0.48 2.90 0.04 -1.26 -4.89 135.00 130.19 2dlu s PRO 8 Ca 0.61 1.49 0.03 0.00 0.04 0.00 0.00 61.00 63.16 2dlu s PRO 8 Cb -0.07 -4.09 0.46 0.00 0.04 0.00 0.00 34.50 30.84 2dlu s PRO 8 CO 0.39 -1.53 1.64 -0.85 0.04 0.00 0.00 177.00 176.69 2dlu n GLU 9 N 7.99 3.02 -1.48 4.56 -0.00 -1.26 -5.01 120.64 128.46 2dlu n GLU 9 Ca 0.20 -3.65 -0.43 0.00 -0.00 0.00 0.00 57.16 53.28 2dlu n GLU 9 Cb 0.46 -2.25 -0.11 0.00 -0.00 0.00 0.00 31.44 29.53 2dlu n GLU 9 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.13 179.54 2dlu n THR 10 N -0.85 0.00 -0.62 3.84 -1.04 -1.26 -4.89 114.28 109.46 2dlu n THR 10 Ca 0.53 -0.20 -0.18 0.00 -2.04 0.00 0.00 64.05 62.16 2dlu n THR 10 Cb 0.84 -1.11 0.16 0.00 -1.82 0.00 0.00 70.33 68.40 2dlu n THR 10 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 2dlu n VAL 11 N 7.47 0.00 -1.69 12.58 0.24 -1.26 -4.88 118.33 130.79 2dlu n VAL 11 Ca 0.56 -0.21 -0.43 0.00 -2.04 0.00 0.00 64.34 62.22 2dlu n VAL 11 Cb 0.15 -0.98 -0.03 0.00 -1.47 0.00 0.00 33.84 31.51 2dlu n VAL 11 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2dlu n TRP 13 N 5.44 -1.32 -0.11 0.00 7.02 -1.26 -3.44 117.44 123.78 2dlu n TRP 13 Ca 0.18 -2.36 -0.12 0.00 -1.02 0.00 0.00 57.50 54.18 2dlu n TRP 13 Cb 0.36 0.49 -0.14 0.00 -2.42 0.00 0.00 31.31 29.60 2dlu n TRP 13 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2dlu n GLY 14 N -0.57 -0.76 3.30 6.99 0.00 0.30 -4.77 105.19 109.69 2dlu n GLY 14 Ca 0.02 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.77 2dlu n GLY 14 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2dlu s HIS 15 N -2.49 -1.39 -0.22 1.61 5.65 -0.69 -4.98 115.29 112.78 2dlu s HIS 15 Ca -0.18 1.83 -0.02 0.00 0.25 0.00 0.00 55.06 56.94 2dlu s HIS 15 Cb 0.07 0.58 0.01 0.00 -1.18 0.00 0.00 32.58 32.05 2dlu s HIS 15 CO 0.73 -0.77 -0.09 0.08 -0.65 0.00 0.00 174.74 174.04 2dlu s VAL 16 N 2.83 2.90 0.02 0.89 1.01 -1.26 -1.71 120.40 125.06 2dlu s VAL 16 Ca 0.10 -0.74 0.00 0.00 0.00 0.00 0.00 61.98 61.34 2dlu s VAL 16 Cb -0.14 -2.33 -0.02 0.00 0.00 0.00 0.00 36.38 33.89 2dlu s VAL 16 CO -0.19 0.40 -0.04 -0.70 0.00 0.00 0.00 175.10 174.58 2dlu s GLU 17 N 1.39 0.31 0.04 2.72 2.56 -1.09 -5.06 118.70 119.57 2dlu s GLU 17 Ca 0.04 -0.52 -0.00 0.00 0.00 0.00 0.00 54.97 54.49 2dlu s GLU 17 Cb -0.14 -0.01 -0.04 0.00 2.00 0.00 0.00 34.13 35.94 2dlu s GLU 17 CO -0.06 -0.02 0.19 -2.00 -0.56 0.00 0.00 175.26 172.81 2dlu s GLU 18 N -1.18 3.37 -0.13 4.30 -6.30 -1.26 -2.69 118.70 114.81 2dlu s GLU 18 Ca -0.11 -0.43 0.01 0.00 -2.50 0.00 0.00 54.97 51.93 2dlu s GLU 18 Cb -0.08 -3.02 0.02 0.00 0.00 0.00 0.00 34.13 31.05 2dlu s GLU 18 CO -0.01 0.63 -0.15 0.08 0.02 0.00 0.00 175.26 175.83 2dlu s VAL 19 N -1.44 1.52 -0.29 3.70 1.01 -0.15 -4.98 120.40 119.78 2dlu s VAL 19 Ca 0.32 -0.63 -0.06 0.00 0.00 0.00 0.00 61.98 61.61 2dlu s VAL 19 Cb -0.13 -1.41 0.01 0.00 0.00 0.00 0.00 36.38 34.85 2dlu s VAL 19 CO 0.24 0.45 0.07 -0.70 0.00 0.00 0.00 175.10 175.16 2dlu s GLU 20 N 1.25 3.12 -0.14 2.72 2.12 -1.26 -1.57 118.70 124.93 2dlu s GLU 20 Ca -0.01 -0.84 0.02 0.00 0.36 0.00 0.00 54.97 54.51 2dlu s GLU 20 Cb -0.14 -3.33 0.01 0.00 0.26 0.00 0.00 34.13 30.93 2dlu s GLU 20 CO -0.06 -0.42 -0.20 -0.51 -0.54 0.00 0.00 175.26 173.53 2dlu s LEU 21 N 1.49 2.01 -0.26 2.70 1.43 -0.13 -4.95 118.68 120.98 2dlu s LEU 21 Ca 0.03 -0.58 -0.19 0.00 -1.03 0.00 0.00 54.13 52.37 2dlu s LEU 21 Cb -0.17 -1.37 -0.02 0.00 0.03 0.00 0.00 46.19 44.65 2dlu s LEU 21 CO 0.02 0.04 0.55 -0.63 0.23 0.00 0.00 176.35 176.56 2dlu s ILE 22 N 1.00 5.04 -0.75 -0.59 1.01 -1.26 -0.98 121.20 124.68 2dlu s ILE 22 Ca -0.03 0.96 -0.26 0.00 0.00 0.00 0.00 60.65 61.32 2dlu s ILE 22 Cb -0.15 -3.86 0.01 0.00 0.01 0.00 0.00 42.46 38.47 2dlu s ILE 22 CO -0.05 0.07 1.57 0.21 0.00 0.00 0.00 174.94 176.74 2dlu s ASN 23 N 1.51 5.79 -0.55 3.58 3.84 0.51 -4.85 114.94 124.77 2dlu s ASN 23 Ca 0.23 -0.32 -0.02 0.00 0.21 0.00 0.00 52.86 52.96 2dlu s ASN 23 Cb -0.16 -2.55 0.33 0.00 -0.55 0.00 0.00 41.25 38.33 2dlu s ASN 23 CO 0.09 -2.08 2.08 -0.90 -2.79 0.00 0.00 177.10 173.50 2dlu n ASP 24 N 10.97 7.19 0.00 -4.21 5.75 -1.26 -4.80 116.55 130.19 2dlu n ASP 24 Ca 0.17 -3.51 0.00 0.00 -0.01 0.00 0.00 54.79 51.44 2dlu n ASP 24 Cb 0.50 -1.03 0.00 0.00 -1.03 0.00 0.00 41.12 39.56 2dlu n ASP 24 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2dlu n GLY 25 N -0.33 1.48 0.36 6.12 0.00 -1.26 -4.74 105.19 106.83 2dlu n GLY 25 Ca 0.50 -0.03 0.03 0.00 0.00 0.00 0.00 46.02 46.51 2dlu n GLY 25 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dlu n SER 26 N 2.79 -0.47 0.00 1.61 3.41 -1.26 -4.90 113.62 114.80 2dlu n SER 26 Ca 0.00 1.67 0.00 0.00 -0.26 0.00 0.00 58.87 60.28 2dlu n SER 26 Cb 0.00 -0.45 0.00 0.00 -0.26 0.00 0.00 64.21 63.50 2dlu n SER 26 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dlu n GLY 27 N -1.54 3.58 0.32 5.00 0.00 -1.26 -4.89 105.19 106.40 2dlu n GLY 27 Ca 0.13 -1.55 0.07 0.00 0.00 0.00 0.00 46.02 44.67 2dlu n GLY 27 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2dlu h LEU 28 N 0.00 -0.62 0.00 0.99 3.38 -1.95 -3.44 115.31 113.67 2dlu h LEU 28 Ca 0.00 0.26 0.00 0.00 0.09 0.00 0.00 57.88 58.23 2dlu h LEU 28 Cb 0.00 0.49 0.00 0.00 0.09 0.00 0.00 40.66 41.24 2dlu h LEU 28 CO 0.00 -0.29 0.00 0.61 0.09 0.00 0.00 178.44 178.85 2dlu n GLY 29 N -1.52 2.17 3.71 0.83 0.00 -1.26 -4.11 105.19 105.01 2dlu n GLY 29 Ca 0.16 -0.36 -0.42 0.00 0.00 0.00 0.00 46.02 45.41 2dlu n GLY 29 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2dlu s PHE 30 N 0.00 2.93 0.90 1.61 -0.12 -1.26 -4.15 117.98 117.89 2dlu s PHE 30 Ca 0.00 0.60 -0.14 0.00 -0.05 0.00 0.00 56.93 57.34 2dlu s PHE 30 Cb 0.00 -3.90 0.16 0.00 -0.63 0.00 0.00 43.02 38.65 2dlu s PHE 30 CO 0.00 -3.36 1.26 0.20 -0.05 0.00 0.00 175.22 173.27 2dlu s GLY 31 N 1.47 1.72 0.10 1.99 0.00 0.14 -4.97 107.32 107.77 2dlu s GLY 31 Ca 0.70 -1.04 0.04 0.00 0.00 0.00 0.00 44.72 44.42 2dlu s GLY 31 CO 0.31 -0.38 -0.11 -0.26 0.00 0.00 0.00 173.10 172.66 2dlu s ILE 32 N -3.75 1.02 -0.10 0.90 -4.36 -1.26 -3.23 121.20 110.42 2dlu s ILE 32 Ca 0.70 -1.65 -0.08 0.00 -0.26 0.00 0.00 60.65 59.36 2dlu s ILE 32 Cb -0.06 -1.38 0.03 0.00 1.25 0.00 0.00 42.46 42.29 2dlu s ILE 32 CO 0.51 -0.52 0.25 0.54 0.24 0.00 0.00 174.94 175.96 2dlu s VAL 33 N -2.36 -0.01 -1.18 8.37 0.11 0.24 -4.67 120.40 120.89 2dlu s VAL 33 Ca 0.06 0.03 -0.18 0.00 -2.93 0.00 0.00 61.98 58.96 2dlu s VAL 33 Cb -0.03 -0.37 0.10 0.00 -1.53 0.00 0.00 36.38 34.55 2dlu s VAL 33 CO 0.01 0.01 1.54 -0.83 -3.33 0.00 0.00 175.10 172.50 2dlu s GLY 34 N 0.41 1.80 1.24 6.54 0.00 -1.26 -0.60 107.32 115.44 2dlu s GLY 34 Ca -0.02 -2.90 -0.14 0.00 0.00 0.00 0.00 44.72 41.66 2dlu s GLY 34 CO -0.02 2.46 1.00 -0.32 0.00 0.00 0.00 173.10 176.22 2dlu s GLY 35 N 3.94 1.51 0.11 0.20 0.00 -1.26 -4.93 107.32 106.89 2dlu s GLY 35 Ca 0.47 -0.24 -0.19 0.00 0.00 0.00 0.00 44.72 44.76 2dlu s GLY 35 CO 0.01 0.55 1.71 0.50 0.00 0.00 0.00 173.10 175.87 2dlu h LYS 36 N -2.89 0.34 -6.57 2.90 1.57 -1.94 -3.42 116.57 106.56 2dlu h LYS 36 Ca -0.61 -0.04 -0.52 0.00 -1.87 0.00 0.00 60.65 57.61 2dlu h LYS 36 Cb 1.34 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.57 2dlu h LYS 36 CO 0.47 0.32 0.42 0.95 -0.57 0.00 0.00 179.45 181.04 2dlu s THR 37 N -5.83 4.29 0.16 -0.16 -4.23 -1.26 -4.96 115.64 103.65 2dlu s THR 37 Ca -0.13 1.86 -0.31 0.00 -1.18 0.00 0.00 61.69 61.93 2dlu s THR 37 Cb 0.08 -4.19 -0.17 0.00 1.34 0.00 0.00 72.50 69.56 2dlu s THR 37 CO 0.71 0.27 0.72 -1.20 -0.54 0.00 0.00 174.62 174.58 2dlu n SER 38 N 2.89 -0.60 0.00 3.99 7.64 -1.26 -4.77 113.62 121.51 2dlu n SER 38 Ca 0.03 1.14 0.00 0.00 1.01 0.00 0.00 58.87 61.06 2dlu n SER 38 Cb 0.48 -0.99 0.00 0.00 -1.01 0.00 0.00 64.21 62.69 2dlu n SER 38 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dlu n GLY 39 N 1.84 3.03 3.76 0.23 0.00 -1.21 -5.01 105.19 107.84 2dlu n GLY 39 Ca 0.18 -1.26 -0.41 0.00 0.00 0.00 0.00 46.02 44.52 2dlu n GLY 39 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dlu s VAL 40 N 0.00 2.53 0.16 1.61 1.01 -1.23 -4.33 120.40 120.15 2dlu s VAL 40 Ca 0.00 0.50 0.08 0.00 0.00 0.00 0.00 61.98 62.56 2dlu s VAL 40 Cb 0.00 -3.32 -0.04 0.00 0.00 0.00 0.00 36.38 33.02 2dlu s VAL 40 CO 0.00 0.11 -0.10 -0.69 0.00 0.00 0.00 175.10 174.41 2dlu s VAL 41 N -0.75 3.20 -0.37 2.92 1.01 0.23 -1.56 120.40 125.07 2dlu s VAL 41 Ca 0.53 -1.56 -0.21 0.00 0.00 0.00 0.00 61.98 60.74 2dlu s VAL 41 Cb -0.42 -2.56 0.01 0.00 0.00 0.00 0.00 36.38 33.41 2dlu s VAL 41 CO 0.52 -0.04 0.69 -0.69 0.00 0.00 0.00 175.10 175.58 2dlu s VAL 42 N -1.54 4.82 -0.07 2.92 1.01 -1.23 0.79 120.40 127.10 2dlu s VAL 42 Ca 0.23 0.61 -0.15 0.00 0.00 0.00 0.00 61.98 62.68 2dlu s VAL 42 Cb -0.09 -4.14 -0.11 0.00 0.00 0.00 0.00 36.38 32.04 2dlu s VAL 42 CO 0.14 -0.40 0.55 -0.09 0.00 0.00 0.00 175.10 175.30 2dlu h ARG 43 N 8.55 -0.20 -4.18 2.72 9.65 -1.82 0.63 114.38 129.73 2dlu h ARG 43 Ca -0.26 0.01 -0.23 0.00 -1.10 0.00 0.00 59.98 58.41 2dlu h ARG 43 Cb 1.10 0.05 -0.23 0.00 -1.39 0.00 0.00 29.97 29.50 2dlu h ARG 43 CO 0.87 0.12 -0.72 0.95 2.80 0.00 0.00 179.97 183.99 2dlu s THR 44 N -2.72 0.27 -0.37 0.20 -4.23 -1.26 -4.70 115.64 102.84 2dlu s THR 44 Ca -0.09 -0.81 0.03 0.00 -1.18 0.00 0.00 61.69 59.65 2dlu s THR 44 Cb -0.00 -0.36 0.11 0.00 1.34 0.00 0.00 72.50 73.59 2dlu s THR 44 CO 0.31 -0.35 0.10 -0.63 -0.54 0.00 0.00 174.62 173.51 2dlu s ILE 45 N -1.15 2.10 -0.28 2.99 1.01 -1.26 0.28 121.20 124.89 2dlu s ILE 45 Ca -0.11 -2.39 -0.44 0.00 0.00 0.00 0.00 60.65 57.71 2dlu s ILE 45 Cb -0.08 -2.53 -0.20 0.00 0.01 0.00 0.00 42.46 39.65 2dlu s ILE 45 CO -0.00 -0.66 1.37 0.52 0.00 0.00 0.00 174.94 176.16 2dlu n VAL 46 N 4.11 0.00 -1.97 2.92 0.31 -1.26 -4.81 118.33 117.62 2dlu n VAL 46 Ca 0.04 -0.00 -0.34 0.00 -0.01 0.00 0.00 64.34 64.03 2dlu n VAL 46 Cb 0.40 -0.28 0.03 0.00 -0.91 0.00 0.00 33.84 33.08 2dlu n VAL 46 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2dlu s PRO 47 N 1.67 3.04 -1.58 5.55 0.04 -1.26 -3.56 135.00 138.90 2dlu s PRO 47 Ca 0.99 1.48 -0.11 0.00 0.04 0.00 0.00 61.00 63.41 2dlu s PRO 47 Cb -1.40 -1.97 0.11 0.00 0.04 0.00 0.00 34.50 31.27 2dlu s PRO 47 CO 0.71 -1.07 0.26 0.41 0.04 0.00 0.00 177.00 177.35 2dlu n GLY 48 N -0.23 -0.23 0.00 0.56 0.00 -1.26 -4.84 105.19 99.18 2dlu n GLY 48 Ca 0.11 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.25 2dlu n GLY 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dlu n GLY 49 N -1.78 0.89 0.83 -0.02 0.00 -1.23 -4.85 105.19 99.03 2dlu n GLY 49 Ca -0.11 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.86 2dlu n GLY 49 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2dlu n LEU 50 N 0.00 0.58 -0.00 0.99 7.94 -1.26 -4.43 117.00 120.81 2dlu n LEU 50 Ca 0.00 0.09 -0.17 0.00 -1.11 0.00 0.00 56.01 54.82 2dlu n LEU 50 Cb 0.00 -0.22 -0.11 0.00 0.53 0.00 0.00 43.42 43.62 2dlu n LEU 50 CO 0.00 -0.05 0.28 0.00 -1.11 0.00 0.00 177.39 176.51 2dlu h ALA 51 N -0.20 0.06 0.18 1.96 0.00 -1.84 -3.27 119.26 116.16 2dlu h ALA 51 Ca -0.11 -0.55 -0.01 0.00 0.00 0.00 0.00 54.91 54.24 2dlu h ALA 51 Cb 0.93 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.75 2dlu h ALA 51 CO -0.07 0.29 -0.09 0.22 0.00 0.00 0.00 179.25 179.61 2dlu h ASP 52 N -0.19 -0.21 -0.89 0.00 1.82 -1.88 -2.66 116.42 112.42 2dlu h ASP 52 Ca -0.07 -0.07 0.17 0.00 -0.39 0.00 0.00 57.03 56.67 2dlu h ASP 52 Cb 1.25 0.05 -0.16 0.00 0.68 0.00 0.00 39.33 41.15 2dlu h ASP 52 CO 0.10 -0.06 -0.27 0.03 -1.61 0.00 0.00 179.24 177.43 2dlu h ARG 53 N -0.34 -0.02 -0.20 0.28 2.47 -1.78 0.22 114.38 115.02 2dlu h ARG 53 Ca -0.03 0.00 0.01 0.00 -1.26 0.00 0.00 59.98 58.70 2dlu h ARG 53 Cb 0.27 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.58 2dlu h ARG 53 CO 0.04 -0.01 0.11 0.22 0.56 0.00 0.00 179.97 180.89 2dlu h ASP 54 N -0.02 0.17 -0.95 7.04 3.58 -1.58 -3.47 116.42 121.19 2dlu h ASP 54 Ca 0.39 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.83 2dlu h ASP 54 Cb 0.63 -0.03 0.00 0.00 1.72 0.00 0.00 39.33 41.66 2dlu h ASP 54 CO -0.91 0.13 -0.03 0.61 -2.88 0.00 0.00 179.24 176.15 2dlu n GLY 55 N -1.15 0.73 0.82 -0.78 0.00 0.77 -4.98 105.19 100.60 2dlu n GLY 55 Ca -0.03 -0.69 -0.06 0.00 0.00 0.00 0.00 46.02 45.24 2dlu n GLY 55 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2dlu n ARG 56 N -0.83 0.12 -2.59 1.61 3.00 -1.26 -5.03 116.66 111.67 2dlu n ARG 56 Ca -0.00 0.05 -0.39 0.00 -0.00 0.00 0.00 57.85 57.52 2dlu n ARG 56 Cb 0.50 -0.71 -0.05 0.00 0.00 0.00 0.00 32.46 32.21 2dlu n ARG 56 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.63 176.46 2dlu s LEU 57 N -6.38 4.41 0.28 6.15 0.20 -1.26 -5.06 118.68 117.03 2dlu s LEU 57 Ca -0.08 2.07 0.10 0.00 0.69 0.00 0.00 54.13 56.91 2dlu s LEU 57 Cb 0.03 -3.85 -0.04 0.00 -0.43 0.00 0.00 46.19 41.89 2dlu s LEU 57 CO 0.10 -0.18 -0.01 -1.58 -0.29 0.00 0.00 176.35 174.40 2dlu s GLN 58 N -1.80 2.21 0.62 1.98 0.74 -1.26 -4.89 119.66 117.26 2dlu s GLN 58 Ca 0.49 -1.51 -0.16 0.00 0.05 0.00 0.00 55.36 54.23 2dlu s GLN 58 Cb -0.26 -2.09 -0.02 0.00 1.10 0.00 0.00 33.01 31.74 2dlu s GLN 58 CO 0.33 0.31 1.10 0.95 -0.55 0.00 0.00 175.29 177.42 2dlu s THR 59 N -2.38 3.39 -1.70 -0.34 -4.23 -1.26 -3.29 115.64 105.84 2dlu s THR 59 Ca 0.32 0.69 0.00 0.00 -1.18 0.00 0.00 61.69 61.52 2dlu s THR 59 Cb -0.05 -3.21 0.00 0.00 1.34 0.00 0.00 72.50 70.58 2dlu s THR 59 CO 0.20 -0.36 0.00 0.61 -0.54 0.00 0.00 174.62 174.53 2dlu n GLY 60 N -0.51 1.11 3.40 3.99 0.00 0.22 -4.89 105.19 108.51 2dlu n GLY 60 Ca 0.10 -0.20 -0.29 0.00 0.00 0.00 0.00 46.02 45.63 2dlu n GLY 60 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2dlu n ASP 61 N -0.88 -2.33 -3.80 1.61 5.75 -1.21 -4.56 116.55 111.14 2dlu n ASP 61 Ca -0.18 -0.32 -0.28 0.00 -0.01 0.00 0.00 54.79 54.00 2dlu n ASP 61 Cb 0.58 -1.18 -0.12 0.00 -1.03 0.00 0.00 41.12 39.37 2dlu n ASP 61 CO 0.00 0.00 0.00 -1.00 -0.11 0.00 0.00 177.20 176.09 2dlu s HIS 62 N -2.33 2.96 -0.10 2.11 3.76 -1.25 -3.48 115.29 116.97 2dlu s HIS 62 Ca 0.68 -3.07 -0.29 0.00 -0.15 0.00 0.00 55.06 52.22 2dlu s HIS 62 Cb -0.23 -2.33 -0.07 0.00 1.11 0.00 0.00 32.58 31.07 2dlu s HIS 62 CO 0.64 -0.63 2.03 0.42 -0.85 0.00 0.00 174.74 176.35 2dlu s ILE 63 N -0.94 3.09 -0.09 0.60 1.01 -0.60 -3.40 121.20 120.87 2dlu s ILE 63 Ca 0.25 0.10 -0.10 0.00 0.00 0.00 0.00 60.65 60.91 2dlu s ILE 63 Cb -0.06 -3.09 -0.28 0.00 0.01 0.00 0.00 42.46 39.03 2dlu s ILE 63 CO -0.14 -0.03 0.52 -0.07 0.00 0.00 0.00 174.94 175.21 2dlu h LEU 64 N 12.57 0.51 -7.00 2.97 3.38 -1.53 -3.26 115.31 122.94 2dlu h LEU 64 Ca -0.44 -0.94 0.03 0.00 0.09 0.00 0.00 57.88 56.62 2dlu h LEU 64 Cb 1.23 -0.17 -0.23 0.00 0.09 0.00 0.00 40.66 41.58 2dlu h LEU 64 CO 0.96 1.81 0.39 -1.59 0.09 0.00 0.00 178.44 180.10 2dlu s LYS 65 N -2.56 0.68 -0.67 1.13 -2.85 -1.26 -3.89 119.74 110.32 2dlu s LYS 65 Ca -0.19 0.43 -0.17 0.00 -1.00 0.00 0.00 55.97 55.05 2dlu s LYS 65 Cb 0.06 0.33 0.15 0.00 -2.06 0.00 0.00 37.83 36.30 2dlu s LYS 65 CO 0.81 -0.16 0.69 0.42 0.10 0.00 0.00 175.35 177.21 2dlu s ILE 66 N -0.47 5.16 0.00 3.79 1.01 -1.24 -2.47 121.20 126.99 2dlu s ILE 66 Ca -0.02 -1.62 0.00 0.00 0.00 0.00 0.00 60.65 59.02 2dlu s ILE 66 Cb -0.03 -4.46 0.00 0.00 0.01 0.00 0.00 42.46 37.98 2dlu s ILE 66 CO 0.00 -1.05 0.00 0.61 0.00 0.00 0.00 174.94 174.50 2dlu n GLY 67 N 4.93 1.13 0.00 6.18 0.00 0.21 -3.36 105.19 114.28 2dlu n GLY 67 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2dlu n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dlu n GLY 68 N 0.00 0.00 3.38 -0.02 0.00 -1.26 -4.49 105.19 102.80 2dlu n GLY 68 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 2dlu n GLY 68 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dlu s THR 69 N 0.00 2.46 -1.07 2.61 2.01 -1.21 -5.06 115.64 115.37 2dlu s THR 69 Ca 0.00 -1.06 -0.22 0.00 0.31 0.00 0.00 61.69 60.72 2dlu s THR 69 Cb 0.00 -1.93 0.02 0.00 0.01 0.00 0.00 72.50 70.61 2dlu s THR 69 CO 0.00 0.52 1.65 0.54 -0.69 0.00 0.00 174.62 176.64 2dlu s ASN 70 N -0.86 6.19 0.02 3.53 4.22 -1.26 -3.60 114.94 123.17 2dlu s ASN 70 Ca 0.11 -1.54 0.22 0.00 -2.14 0.00 0.00 52.86 49.52 2dlu s ASN 70 Cb -0.10 -2.57 -0.11 0.00 1.28 0.00 0.00 41.25 39.75 2dlu s ASN 70 CO 0.01 -1.81 0.87 1.33 -2.04 0.00 0.00 177.10 175.46 2dlu n VAL 71 N 7.05 0.09 0.19 3.54 0.24 -1.26 -4.37 118.33 123.81 2dlu n VAL 71 Ca 0.39 -0.24 -0.15 0.00 -2.04 0.00 0.00 64.34 62.30 2dlu n VAL 71 Cb 0.49 0.36 -0.08 0.00 -1.47 0.00 0.00 33.84 33.14 2dlu n VAL 71 CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 2dlu h GLN 72 N 0.00 -0.69 0.00 7.34 4.20 -1.84 -1.21 115.11 122.91 2dlu h GLN 72 Ca 0.00 0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.76 2dlu h GLN 72 Cb 0.73 0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.67 2dlu h GLN 72 CO 0.00 -0.46 0.00 0.78 -0.67 0.00 0.00 178.83 178.48 2dlu h GLY 73 N -0.72 0.00 -1.13 3.46 0.00 -1.93 -3.20 103.07 99.54 2dlu h GLY 73 Ca -0.01 0.00 -0.46 0.00 0.00 0.00 0.00 47.33 46.86 2dlu h GLY 73 CO -0.12 0.00 0.22 1.06 0.00 0.00 0.00 176.54 177.70 2dlu s MET 74 N -3.66 2.19 -0.11 4.80 -1.94 -0.46 -5.06 119.30 115.06 2dlu s MET 74 Ca -0.00 -0.28 -0.11 0.00 -1.71 0.00 0.00 55.69 53.59 2dlu s MET 74 Cb 0.09 -2.18 -0.05 0.00 2.01 0.00 0.00 34.83 34.71 2dlu s MET 74 CO 0.39 -1.23 0.25 0.95 -0.01 0.00 0.00 175.02 175.36 2dlu s THR 75 N -3.24 5.32 0.28 2.05 -4.23 -1.26 -4.78 115.64 109.78 2dlu s THR 75 Ca 0.60 0.46 -0.05 0.00 -1.18 0.00 0.00 61.69 61.52 2dlu s THR 75 Cb -0.11 -3.55 0.43 0.00 1.34 0.00 0.00 72.50 70.61 2dlu s THR 75 CO 0.45 0.52 1.50 -1.54 -0.54 0.00 0.00 174.62 175.01 2dlu n SER 76 N 2.61 -0.28 -0.33 3.99 3.41 -1.26 0.15 113.62 121.90 2dlu n SER 76 Ca -0.16 1.65 0.16 0.00 -0.26 0.00 0.00 58.87 60.26 2dlu n SER 76 Cb 0.53 -0.53 0.36 0.00 -0.26 0.00 0.00 64.21 64.31 2dlu n SER 76 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2dlu h GLU 77 N 0.00 0.49 0.00 4.33 4.81 -1.96 1.08 114.58 123.33 2dlu h GLU 77 Ca 0.49 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.69 2dlu h GLU 77 Cb 0.83 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.10 2dlu h GLU 77 CO -0.97 0.32 -0.25 1.04 -0.73 0.00 0.00 179.01 178.42 2dlu n GLN 78 N -4.95 0.12 0.02 1.92 1.13 0.39 -3.70 117.38 112.30 2dlu n GLN 78 Ca 0.25 0.06 -0.16 0.00 -1.94 0.00 0.00 57.00 55.22 2dlu n GLN 78 Cb 0.71 -1.60 -0.14 0.00 0.11 0.00 0.00 30.24 29.32 2dlu n GLN 78 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 2dlu h VAL 79 N 0.00 0.88 -0.90 5.09 2.07 0.26 -3.36 116.25 120.29 2dlu h VAL 79 Ca 0.00 -2.62 0.24 0.00 0.82 0.00 0.00 66.70 65.14 2dlu h VAL 79 Cb 0.60 2.57 -0.14 0.00 -1.52 0.00 0.00 31.29 32.80 2dlu h VAL 79 CO 0.00 0.74 0.31 0.00 0.02 0.00 0.00 177.57 178.64 2dlu h ALA 80 N 0.52 1.39 -0.44 1.67 0.00 -0.40 0.22 119.26 122.22 2dlu h ALA 80 Ca -0.31 0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 2dlu h ALA 80 Cb 2.02 0.27 -0.02 0.00 0.00 0.00 0.00 17.79 20.06 2dlu h ALA 80 CO 0.11 -0.46 0.04 -0.56 0.00 0.00 0.00 179.25 178.38 2dlu h GLN 81 N 0.26 0.75 -1.01 0.00 3.07 -1.76 -2.90 115.11 113.52 2dlu h GLN 81 Ca 0.58 -0.22 0.24 0.00 0.09 0.00 0.00 58.65 59.33 2dlu h GLN 81 Cb 1.17 -0.08 -0.12 0.00 0.08 0.00 0.00 27.48 28.54 2dlu h GLN 81 CO -0.63 0.79 0.61 0.28 0.09 0.00 0.00 178.83 179.97 2dlu h VAL 82 N 0.60 0.57 -0.06 1.86 2.07 -0.71 0.66 116.25 121.24 2dlu h VAL 82 Ca 0.13 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.43 2dlu h VAL 82 Cb 0.43 -0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 30.11 2dlu h VAL 82 CO 0.01 0.11 0.01 -0.07 0.02 0.00 0.00 177.57 177.65 2dlu h LEU 83 N 0.60 0.09 -0.93 2.57 3.38 -1.27 -0.08 115.31 119.68 2dlu h LEU 83 Ca 0.63 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 58.32 2dlu h LEU 83 Cb 1.18 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.91 2dlu h LEU 83 CO -0.44 0.35 0.00 0.08 0.09 0.00 0.00 178.44 178.52 2dlu h ARG 84 N -0.17 0.00 0.18 1.13 0.11 -1.02 -3.09 114.38 111.52 2dlu h ARG 84 Ca 0.02 0.00 -0.29 0.00 0.10 0.00 0.00 59.98 59.80 2dlu h ARG 84 Cb 0.30 0.00 0.02 0.00 1.11 0.00 0.00 29.97 31.40 2dlu h ARG 84 CO 0.00 0.00 -1.39 -0.91 0.10 0.00 0.00 179.97 177.77 2dlu h ASN 85 N 0.00 0.61 -0.78 0.08 2.35 0.57 -3.33 115.58 115.07 2dlu h ASN 85 Ca 0.00 -0.92 0.31 0.00 -0.55 0.00 0.00 56.30 55.14 2dlu h ASN 85 Cb 0.53 -0.20 -0.14 0.00 0.05 0.00 0.00 38.32 38.56 2dlu h ASN 85 CO 0.00 1.64 0.36 0.00 -1.65 0.00 0.00 177.43 177.78 2dlu n GLY 87 N -1.23 1.34 0.40 0.00 0.00 -1.25 -4.84 105.19 99.60 2dlu n GLY 87 Ca 0.28 -0.86 -0.01 0.00 0.00 0.00 0.00 46.02 45.43 2dlu n GLY 87 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2dlu n ASN 88 N 0.00 0.17 -4.67 1.61 4.13 -1.26 -4.77 115.26 110.46 2dlu n ASN 88 Ca 0.00 0.03 -0.43 0.00 1.68 0.00 0.00 54.58 55.86 2dlu n ASN 88 Cb 0.00 -0.33 -0.02 0.00 -1.54 0.00 0.00 39.78 37.88 2dlu n ASN 88 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 2dlu s SER 89 N -4.55 7.08 -0.15 6.41 0.15 -1.26 -0.36 113.70 121.02 2dlu s SER 89 Ca -0.02 1.63 -0.01 0.00 0.70 0.00 0.00 55.95 58.26 2dlu s SER 89 Cb 0.00 -2.55 -0.01 0.00 -1.71 0.00 0.00 66.02 61.75 2dlu s SER 89 CO 0.03 -0.62 -0.12 -0.69 1.20 0.00 0.00 173.24 173.04 2dlu s VAL 90 N 2.70 3.02 -0.22 4.45 1.01 -0.15 -4.98 120.40 126.24 2dlu s VAL 90 Ca 0.51 -0.66 -0.02 0.00 0.00 0.00 0.00 61.98 61.82 2dlu s VAL 90 Cb -0.20 -2.29 0.01 0.00 0.00 0.00 0.00 36.38 33.90 2dlu s VAL 90 CO 0.16 0.51 -0.09 -0.13 0.00 0.00 0.00 175.10 175.55 2dlu s ARG 91 N 0.61 3.11 -0.02 2.72 0.52 -1.26 -0.96 118.95 123.66 2dlu s ARG 91 Ca -0.07 -0.79 0.07 0.00 -0.52 0.00 0.00 55.73 54.42 2dlu s ARG 91 Cb -0.15 -2.89 -0.02 0.00 0.52 0.00 0.00 34.95 32.41 2dlu s ARG 91 CO 0.03 -0.26 -0.25 -1.64 0.02 0.00 0.00 175.30 173.20 2dlu s MET 92 N 1.38 2.07 -0.62 3.54 -1.94 -0.61 0.66 119.30 123.80 2dlu s MET 92 Ca 0.04 -0.89 -0.11 0.00 -1.71 0.00 0.00 55.69 53.02 2dlu s MET 92 Cb -0.15 -1.97 0.16 0.00 2.01 0.00 0.00 34.83 34.89 2dlu s MET 92 CO -0.06 0.51 0.52 -0.51 -0.01 0.00 0.00 175.02 175.47 2dlu s LEU 93 N -0.52 6.05 0.07 -0.03 1.43 -1.03 -0.98 118.68 123.67 2dlu s LEU 93 Ca 0.08 -2.28 -0.05 0.00 -1.03 0.00 0.00 54.13 50.85 2dlu s LEU 93 Cb -0.10 -2.09 -0.05 0.00 0.03 0.00 0.00 46.19 43.98 2dlu s LEU 93 CO -0.00 -0.64 0.31 0.68 0.23 0.00 0.00 176.35 176.93 2dlu s VAL 94 N 0.81 5.25 0.04 -1.59 -7.23 -1.10 -1.32 120.40 115.27 2dlu s VAL 94 Ca 0.11 0.04 0.03 0.00 -1.81 0.00 0.00 61.98 60.35 2dlu s VAL 94 Cb -0.21 -3.61 -0.02 0.00 0.56 0.00 0.00 36.38 33.10 2dlu s VAL 94 CO -0.03 0.19 -0.09 0.00 -0.31 0.00 0.00 175.10 174.87 2dlu s ALA 95 N -1.48 0.65 0.06 1.32 0.00 -1.22 -2.65 121.76 118.43 2dlu s ALA 95 Ca 0.34 -0.77 -0.02 0.00 0.00 0.00 0.00 51.96 51.51 2dlu s ALA 95 Cb -0.13 0.02 -0.03 0.00 0.00 0.00 0.00 23.12 22.97 2dlu s ALA 95 CO 0.22 0.01 0.01 -0.98 0.00 0.00 0.00 175.76 175.02 2dlu s ARG 96 N -1.53 0.66 -1.16 0.00 3.03 -0.70 -3.88 118.95 115.38 2dlu s ARG 96 Ca -0.08 -1.19 -0.05 0.00 2.03 0.00 0.00 55.73 56.44 2dlu s ARG 96 Cb -0.10 0.23 -0.03 0.00 -1.03 0.00 0.00 34.95 34.03 2dlu s ARG 96 CO 0.01 -0.14 0.89 -0.25 -1.13 0.00 0.00 175.30 174.67 2dlu n ASP 97 N 0.07 -4.01 -4.73 -2.89 8.00 -1.26 -1.71 116.55 110.03 2dlu n ASP 97 Ca -0.14 -0.74 -0.30 0.00 0.71 0.00 0.00 54.79 54.32 2dlu n ASP 97 Cb 0.61 -4.74 0.13 0.00 -0.02 0.00 0.00 41.12 37.10 2dlu n ASP 97 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 2dlu s PRO 98 N -5.19 1.46 -0.24 -0.24 0.04 -1.26 0.11 135.00 129.69 2dlu s PRO 98 Ca 0.23 0.89 -0.24 0.00 0.04 0.00 0.00 61.00 61.93 2dlu s PRO 98 Cb -0.04 -1.83 -0.01 0.00 0.04 0.00 0.00 34.50 32.66 2dlu s PRO 98 CO 0.77 -2.12 0.79 0.00 0.04 0.00 0.00 177.00 176.48 2dlu s ALA 99 N -2.93 3.64 0.00 8.56 0.00 -1.22 -4.72 121.76 125.09 2dlu s ALA 99 Ca 0.63 -0.19 0.00 0.00 0.00 0.00 0.00 51.96 52.40 2dlu s ALA 99 Cb -0.18 -3.23 0.00 0.00 0.00 0.00 0.00 23.12 19.71 2dlu s ALA 99 CO 0.57 -0.89 0.00 0.41 0.00 0.00 0.00 175.76 175.85 2dlu n GLY 100 N 3.82 0.84 3.03 0.00 0.00 -1.26 -4.85 105.19 106.77 2dlu n GLY 100 Ca 0.04 -0.84 -0.13 0.00 0.00 0.00 0.00 46.02 45.10 2dlu n GLY 100 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2dlu s ASP 101 N -4.00 -0.18 0.19 1.61 -1.08 -1.26 -5.05 116.67 106.90 2dlu s ASP 101 Ca 0.00 0.36 -0.21 0.00 -0.52 0.00 0.00 52.55 52.18 2dlu s ASP 101 Cb 0.00 0.33 0.14 0.00 -1.46 0.00 0.00 42.92 41.93 2dlu s ASP 101 CO 0.00 -0.09 1.58 0.40 0.52 0.00 0.00 175.17 177.58 2dlu h ILE 102 N 5.20 0.13 -4.35 4.11 2.04 -2.03 -3.40 117.51 119.21 2dlu h ILE 102 Ca -0.30 0.00 -0.58 0.00 1.00 0.00 0.00 64.86 64.98 2dlu h ILE 102 Cb 1.18 0.13 -0.29 0.00 -0.74 0.00 0.00 36.82 37.10 2dlu h ILE 102 CO 0.40 0.00 -0.84 -0.55 0.00 0.00 0.00 178.15 177.16 2dlu s SER 103 N -5.21 2.29 -0.26 1.72 0.15 -1.26 -5.13 113.70 106.01 2dlu s SER 103 Ca -0.14 -0.38 -0.12 0.00 0.70 0.00 0.00 55.95 56.01 2dlu s SER 103 Cb 0.17 -0.24 0.09 0.00 -1.71 0.00 0.00 66.02 64.32 2dlu s SER 103 CO 0.69 0.22 0.60 0.54 1.20 0.00 0.00 173.24 176.50 2dlu s VAL 104 N -0.51 -0.30 -0.29 4.45 0.11 -1.26 -5.16 120.40 117.44 2dlu s VAL 104 Ca 0.07 0.03 -0.25 0.00 -2.93 0.00 0.00 61.98 58.90 2dlu s VAL 104 Cb -0.08 -0.89 0.16 0.00 -1.53 0.00 0.00 36.38 34.04 2dlu s VAL 104 CO -0.00 0.01 1.27 0.28 -3.33 0.00 0.00 175.10 173.33 2dlu s THR 105 N 1.98 0.00 0.50 5.04 -1.32 -1.26 -5.18 115.64 115.40 2dlu s THR 105 Ca -0.08 0.00 0.07 0.00 -1.21 0.00 0.00 61.69 60.47 2dlu s THR 105 Cb -0.08 -1.00 0.02 0.00 -1.51 0.00 0.00 72.50 69.93 2dlu s THR 105 CO -0.18 0.00 0.42 -0.44 -2.21 0.00 0.00 174.62 172.21 2dlu s SER 106 N 0.00 4.79 0.00 8.08 0.01 -1.26 -5.14 113.70 120.19 2dlu s SER 106 Ca 0.06 -1.04 0.00 0.00 1.31 0.00 0.00 55.95 56.28 2dlu s SER 106 Cb -0.05 0.03 0.00 0.00 0.21 0.00 0.00 66.02 66.21 2dlu s SER 106 CO -0.11 -0.95 0.00 0.61 0.41 0.00 0.00 173.24 173.20 2dlu n GLY 107 N -1.71 2.01 0.00 3.44 0.00 -1.26 -4.99 105.19 102.68 2dlu n GLY 107 Ca 0.02 -0.78 0.06 0.00 0.00 0.00 0.00 46.02 45.32 2dlu n GLY 107 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dlu n PRO 108 N 0.00 0.49 -1.01 1.61 -0.04 -1.26 -4.85 135.00 129.94 2dlu n PRO 108 Ca 0.00 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 63.10 2dlu n PRO 108 Cb 0.00 -1.36 -0.10 0.00 -0.04 0.00 0.00 33.50 32.00 2dlu n PRO 108 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dlu n SER 109 N -0.86 0.35 -4.67 3.54 2.88 -1.26 -4.88 113.62 108.73 2dlu n SER 109 Ca 0.08 0.28 -0.23 0.00 -1.33 0.00 0.00 58.87 57.68 2dlu n SER 109 Cb 0.04 -0.66 -0.07 0.00 -0.75 0.00 0.00 64.21 62.76 2dlu n SER 109 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2dlu s SER 110 N 5.62 4.49 0.00 -3.46 1.04 -1.26 -5.24 113.70 114.89 2dlu s SER 110 Ca 0.94 -0.76 0.00 0.00 0.48 0.00 0.00 55.95 56.61 2dlu s SER 110 Cb -0.99 -0.73 0.00 0.00 0.10 0.00 0.00 66.02 64.40 2dlu s SER 110 CO 0.41 -0.14 0.00 0.61 0.98 0.00 0.00 173.24 175.10