#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 7.06 -0.03 1.61 0.01 -1.26 -5.01 113.70 116.08 2dlu s SER 2 Ca 0.00 -3.00 -0.15 0.00 1.31 0.00 0.00 55.95 54.11 2dlu s SER 2 Cb 0.00 -2.34 -0.05 0.00 0.21 0.00 0.00 66.02 63.83 2dlu s SER 2 CO 0.00 -0.67 0.41 -0.55 0.41 0.00 0.00 173.24 172.84 2dlu s SER 3 N 2.54 6.77 -1.05 2.44 0.15 -1.26 -4.45 113.70 118.83 2dlu s SER 3 Ca 0.37 0.91 -0.17 0.00 0.70 0.00 0.00 55.95 57.76 2dlu s SER 3 Cb -0.05 -2.25 -0.00 0.00 -1.71 0.00 0.00 66.02 62.01 2dlu s SER 3 CO -0.04 0.26 0.75 0.61 1.20 0.00 0.00 173.24 176.01 2dlu n GLY 4 N 2.17 -1.06 3.72 9.45 0.00 -1.26 -4.95 105.19 113.27 2dlu n GLY 4 Ca -0.13 0.47 -0.35 0.00 0.00 0.00 0.00 46.02 46.01 2dlu n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dlu s SER 5 N -3.35 6.18 0.20 1.61 0.15 -1.26 -5.10 113.70 112.14 2dlu s SER 5 Ca 0.36 0.22 0.08 0.00 0.70 0.00 0.00 55.95 57.30 2dlu s SER 5 Cb -0.14 -2.09 -0.04 0.00 -1.71 0.00 0.00 66.02 62.05 2dlu s SER 5 CO 0.87 0.17 0.01 -0.55 1.20 0.00 0.00 173.24 174.94 2dlu s SER 6 N 0.39 4.77 0.00 5.45 0.15 -1.26 -5.05 113.70 118.15 2dlu s SER 6 Ca 0.08 -0.44 0.00 0.00 0.70 0.00 0.00 55.95 56.28 2dlu s SER 6 Cb -0.11 -1.00 0.00 0.00 -1.71 0.00 0.00 66.02 63.20 2dlu s SER 6 CO -0.02 0.06 0.00 0.61 1.20 0.00 0.00 173.24 175.09 2dlu n GLY 7 N -0.38 -0.41 3.57 9.45 0.00 -1.26 -5.05 105.19 111.12 2dlu n GLY 7 Ca -0.09 0.43 -0.27 0.00 0.00 0.00 0.00 46.02 46.08 2dlu n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dlu s PRO 8 N 0.49 2.53 -0.14 1.61 0.04 -1.26 -4.87 135.00 133.40 2dlu s PRO 8 Ca 0.00 -0.75 -0.04 0.00 0.04 0.00 0.00 61.00 60.25 2dlu s PRO 8 Cb 0.00 -5.16 0.07 0.00 0.04 0.00 0.00 34.50 29.45 2dlu s PRO 8 CO 0.00 -3.69 0.23 -2.00 0.04 0.00 0.00 177.00 171.58 2dlu s GLU 9 N 6.72 0.13 -0.34 4.56 2.56 -1.26 -5.11 118.70 125.97 2dlu s GLU 9 Ca 0.69 0.59 -0.42 0.00 0.00 0.00 0.00 54.97 55.84 2dlu s GLU 9 Cb -0.04 -0.33 -0.16 0.00 2.00 0.00 0.00 34.13 35.60 2dlu s GLU 9 CO 0.06 -0.37 1.74 2.41 -0.56 0.00 0.00 175.26 178.54 2dlu n THR 10 N 5.34 0.24 -3.34 -1.70 -1.04 -1.26 -4.94 114.28 107.57 2dlu n THR 10 Ca -0.06 -0.05 -0.22 0.00 -2.04 0.00 0.00 64.05 61.68 2dlu n THR 10 Cb 0.50 -1.07 0.04 0.00 -1.82 0.00 0.00 70.33 67.98 2dlu n THR 10 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 2dlu s VAL 11 N 3.61 1.90 -0.46 12.58 -7.23 -1.26 -4.99 120.40 124.56 2dlu s VAL 11 Ca 1.01 -1.17 -0.43 0.00 -1.81 0.00 0.00 61.98 59.58 2dlu s VAL 11 Cb -1.17 -2.07 -0.18 0.00 0.56 0.00 0.00 36.38 33.53 2dlu s VAL 11 CO 0.69 0.00 2.06 0.00 -0.31 0.00 0.00 175.10 177.54 2dlu s TRP 13 N 5.71 -0.47 0.23 0.00 0.52 -1.26 -4.66 118.94 119.01 2dlu s TRP 13 Ca 1.15 0.63 -0.04 0.00 0.02 0.00 0.00 56.10 57.86 2dlu s TRP 13 Cb -1.36 0.35 0.23 0.00 -1.15 0.00 0.00 33.47 31.54 2dlu s TRP 13 CO 0.65 -0.62 1.70 0.78 0.02 0.00 0.00 176.95 179.48 2dlu h GLY 14 N 2.92 0.93 -4.18 0.98 0.00 -1.00 -3.46 103.07 99.26 2dlu h GLY 14 Ca -0.30 -0.68 0.05 0.00 0.00 0.00 0.00 47.33 46.41 2dlu h GLY 14 CO 0.40 0.62 0.46 -1.58 0.00 0.00 0.00 176.54 176.45 2dlu s HIS 15 N -4.90 -0.43 -0.12 5.60 5.65 -1.09 -5.00 115.29 115.00 2dlu s HIS 15 Ca -0.10 0.67 -0.04 0.00 0.25 0.00 0.00 55.06 55.84 2dlu s HIS 15 Cb 0.14 0.46 0.05 0.00 -1.18 0.00 0.00 32.58 32.05 2dlu s HIS 15 CO 0.83 -0.43 0.09 0.08 -0.65 0.00 0.00 174.74 174.66 2dlu s VAL 16 N -1.44 -0.12 0.17 0.89 1.01 -1.26 -2.91 120.40 116.74 2dlu s VAL 16 Ca -0.03 0.06 0.07 0.00 0.00 0.00 0.00 61.98 62.09 2dlu s VAL 16 Cb -0.00 -0.42 -0.04 0.00 0.00 0.00 0.00 36.38 35.91 2dlu s VAL 16 CO 0.02 -0.11 -0.15 -0.70 0.00 0.00 0.00 175.10 174.16 2dlu s GLU 17 N 2.17 1.23 -0.28 2.72 2.56 -1.02 -5.02 118.70 121.06 2dlu s GLU 17 Ca 0.03 -1.45 -0.07 0.00 0.00 0.00 0.00 54.97 53.48 2dlu s GLU 17 Cb -0.14 -1.10 -0.00 0.00 2.00 0.00 0.00 34.13 34.88 2dlu s GLU 17 CO -0.07 0.20 0.07 -2.00 -0.56 0.00 0.00 175.26 172.90 2dlu s GLU 18 N -3.20 3.28 -0.19 4.30 2.12 -1.26 -1.83 118.70 121.92 2dlu s GLU 18 Ca 0.17 -0.72 -0.20 0.00 0.36 0.00 0.00 54.97 54.58 2dlu s GLU 18 Cb -0.03 -3.34 -0.03 0.00 0.26 0.00 0.00 34.13 30.99 2dlu s GLU 18 CO 0.06 -0.35 0.58 0.08 -0.54 0.00 0.00 175.26 175.08 2dlu s VAL 19 N 1.54 5.06 -0.35 3.70 1.01 0.08 -4.88 120.40 126.56 2dlu s VAL 19 Ca 0.04 1.08 -0.09 0.00 0.00 0.00 0.00 61.98 63.01 2dlu s VAL 19 Cb -0.16 -3.90 0.03 0.00 0.00 0.00 0.00 36.38 32.35 2dlu s VAL 19 CO 0.02 0.15 0.16 -0.70 0.00 0.00 0.00 175.10 174.74 2dlu s GLU 20 N 1.71 2.83 -0.24 2.72 -6.30 -1.26 -1.63 118.70 116.53 2dlu s GLU 20 Ca 0.27 -1.06 0.02 0.00 -2.50 0.00 0.00 54.97 51.70 2dlu s GLU 20 Cb -0.16 -3.61 0.05 0.00 0.00 0.00 0.00 34.13 30.42 2dlu s GLU 20 CO 0.10 -0.64 -0.13 -0.51 0.02 0.00 0.00 175.26 174.10 2dlu s LEU 21 N 1.51 3.13 -0.20 2.70 1.43 -0.41 -4.93 118.68 121.90 2dlu s LEU 21 Ca 0.01 -1.22 -0.24 0.00 -1.03 0.00 0.00 54.13 51.65 2dlu s LEU 21 Cb -0.19 -1.52 -0.01 0.00 0.03 0.00 0.00 46.19 44.50 2dlu s LEU 21 CO 0.05 -0.15 0.78 -0.63 0.23 0.00 0.00 176.35 176.63 2dlu s ILE 22 N 1.15 4.90 -0.23 -0.59 1.01 -1.26 -1.85 121.20 124.34 2dlu s ILE 22 Ca -0.06 1.49 -0.29 0.00 0.00 0.00 0.00 60.65 61.79 2dlu s ILE 22 Cb -0.18 -4.08 -0.01 0.00 0.01 0.00 0.00 42.46 38.20 2dlu s ILE 22 CO -0.07 0.01 1.40 0.21 0.00 0.00 0.00 174.94 176.50 2dlu s ASN 23 N 1.25 6.65 -0.13 3.58 3.84 0.04 -4.91 114.94 125.25 2dlu s ASN 23 Ca 0.34 1.50 -0.16 0.00 0.21 0.00 0.00 52.86 54.76 2dlu s ASN 23 Cb -0.16 -2.54 -0.14 0.00 -0.55 0.00 0.00 41.25 37.87 2dlu s ASN 23 CO 0.10 -1.05 0.36 -0.78 -2.79 0.00 0.00 177.10 172.94 2dlu h ASP 24 N 9.46 0.00 0.00 -4.21 1.82 -1.91 -3.46 116.42 118.12 2dlu h ASP 24 Ca -0.29 -0.50 0.00 0.00 -0.39 0.00 0.00 57.03 55.85 2dlu h ASP 24 Cb 1.12 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.13 2dlu h ASP 24 CO 1.00 0.85 0.00 0.61 -1.61 0.00 0.00 179.24 180.09 2dlu n GLY 25 N 1.66 -1.53 0.51 -0.78 0.00 -1.26 -5.00 105.19 98.78 2dlu n GLY 25 Ca -0.08 0.36 -0.19 0.00 0.00 0.00 0.00 46.02 46.11 2dlu n GLY 25 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2dlu h SER 26 N 0.00 -1.34 -1.39 1.61 0.02 -2.01 -3.49 113.55 106.95 2dlu h SER 26 Ca 0.00 0.10 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 2dlu h SER 26 Cb 0.00 0.42 0.00 0.00 0.14 0.00 0.00 62.40 62.96 2dlu h SER 26 CO 0.00 -0.70 0.00 0.61 -1.14 0.00 0.00 176.83 175.60 2dlu n GLY 27 N -1.59 -0.24 0.12 -3.77 0.00 -1.26 -4.96 105.19 93.50 2dlu n GLY 27 Ca -0.13 -1.51 -0.13 0.00 0.00 0.00 0.00 46.02 44.25 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 0.33 0.00 0.99 3.38 -1.96 -3.45 115.31 114.60 2dlu h LEU 28 Ca 0.00 -0.47 0.00 0.00 0.09 0.00 0.00 57.88 57.50 2dlu h LEU 28 Cb 0.00 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.66 2dlu h LEU 28 CO 0.00 0.73 0.00 0.61 0.09 0.00 0.00 178.44 179.87 2dlu n GLY 29 N 0.18 2.72 3.75 0.83 0.00 -1.26 -3.87 105.19 107.53 2dlu n GLY 29 Ca -0.06 -0.65 -0.42 0.00 0.00 0.00 0.00 46.02 44.89 2dlu n GLY 29 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2dlu n PHE 30 N 0.00 2.83 -2.26 1.61 1.16 -1.26 -4.29 117.46 115.25 2dlu n PHE 30 Ca 0.00 0.35 -0.25 0.00 -1.87 0.00 0.00 57.45 55.67 2dlu n PHE 30 Cb 0.00 -2.56 0.06 0.00 -1.61 0.00 0.00 39.48 35.37 2dlu n PHE 30 CO 0.00 0.00 0.00 0.20 -1.87 0.00 0.00 176.76 175.09 2dlu s GLY 31 N 0.23 1.69 0.18 4.97 0.00 0.14 -4.96 107.32 109.58 2dlu s GLY 31 Ca 0.60 -0.94 0.08 0.00 0.00 0.00 0.00 44.72 44.46 2dlu s GLY 31 CO 0.55 -0.56 -0.16 -0.26 0.00 0.00 0.00 173.10 172.66 2dlu s ILE 32 N -3.17 1.76 -0.16 0.90 -4.36 -1.26 -2.47 121.20 112.44 2dlu s ILE 32 Ca 0.59 -2.06 -0.07 0.00 -0.26 0.00 0.00 60.65 58.85 2dlu s ILE 32 Cb -0.11 -1.93 0.07 0.00 1.25 0.00 0.00 42.46 41.74 2dlu s ILE 32 CO 0.44 -0.47 0.37 0.54 0.24 0.00 0.00 174.94 176.06 2dlu s VAL 33 N -2.53 -0.27 -0.17 8.37 0.11 0.11 -4.59 120.40 121.43 2dlu s VAL 33 Ca 0.19 0.15 -0.39 0.00 -2.93 0.00 0.00 61.98 59.00 2dlu s VAL 33 Cb -0.03 -0.57 -0.16 0.00 -1.53 0.00 0.00 36.38 34.09 2dlu s VAL 33 CO 0.07 0.06 1.63 0.61 -3.33 0.00 0.00 175.10 174.14 2dlu n GLY 34 N 4.75 0.75 3.34 6.54 0.00 -1.26 -1.27 105.19 118.04 2dlu n GLY 34 Ca -0.17 0.86 -0.33 0.00 0.00 0.00 0.00 46.02 46.38 2dlu n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dlu n GLY 35 N 3.70 -2.36 0.14 -0.02 0.00 0.80 -4.83 105.19 102.61 2dlu n GLY 35 Ca 0.24 -0.75 -0.14 0.00 0.00 0.00 0.00 46.02 45.38 2dlu n GLY 35 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dlu h LYS 36 N -1.65 0.37 0.00 1.61 1.79 -1.90 -3.39 116.57 113.41 2dlu h LYS 36 Ca -0.46 -0.22 -0.18 0.00 -2.18 0.00 0.00 60.65 57.60 2dlu h LYS 36 Cb 1.31 0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 31.94 2dlu h LYS 36 CO 0.34 0.80 -1.70 -2.37 -1.08 0.00 0.00 179.45 175.45 2dlu n THR 37 N -4.50 0.70 -3.59 -0.16 5.66 -1.26 -5.10 114.28 106.03 2dlu n THR 37 Ca -0.07 -0.32 -0.04 0.00 -3.05 0.00 0.00 64.05 60.57 2dlu n THR 37 Cb 0.41 -0.87 -0.02 0.00 -1.55 0.00 0.00 70.33 68.29 2dlu n THR 37 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 2dlu s SER 38 N -4.87 -0.16 0.01 1.09 0.15 -1.26 -5.14 113.70 103.51 2dlu s SER 38 Ca -0.13 -0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.50 2dlu s SER 38 Cb 0.04 0.19 0.00 0.00 -1.71 0.00 0.00 66.02 64.54 2dlu s SER 38 CO 0.33 -0.31 0.00 0.61 1.20 0.00 0.00 173.24 175.06 2dlu n GLY 39 N -0.16 -1.52 3.67 9.45 0.00 -1.16 -4.50 105.19 110.98 2dlu n GLY 39 Ca -0.02 -1.52 -0.26 0.00 0.00 0.00 0.00 46.02 44.23 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 -1.38 3.74 0.16 1.61 1.01 -1.22 -0.14 120.40 124.18 2dlu s VAL 40 Ca 0.00 -1.48 0.05 0.00 0.00 0.00 0.00 61.98 60.55 2dlu s VAL 40 Cb 0.00 -2.90 -0.04 0.00 0.00 0.00 0.00 36.38 33.43 2dlu s VAL 40 CO 0.00 -0.16 -0.11 -0.69 0.00 0.00 0.00 175.10 174.14 2dlu s VAL 41 N -1.82 1.28 -0.55 2.92 1.01 -0.40 -0.94 120.40 121.90 2dlu s VAL 41 Ca 0.28 -2.06 -0.17 0.00 0.00 0.00 0.00 61.98 60.03 2dlu s VAL 41 Cb -0.09 -1.86 0.11 0.00 0.00 0.00 0.00 36.38 34.54 2dlu s VAL 41 CO 0.19 -0.70 0.58 -0.69 0.00 0.00 0.00 175.10 174.49 2dlu s VAL 42 N -3.18 5.03 0.14 2.92 1.01 -1.24 0.06 120.40 125.14 2dlu s VAL 42 Ca 0.17 -1.18 -0.19 0.00 0.00 0.00 0.00 61.98 60.78 2dlu s VAL 42 Cb 0.01 -4.38 0.00 0.00 0.00 0.00 0.00 36.38 32.02 2dlu s VAL 42 CO 0.02 -0.95 1.69 -0.09 0.00 0.00 0.00 175.10 175.78 2dlu h ARG 43 N 9.01 -0.01 -2.86 2.72 9.65 -1.73 0.58 114.38 131.74 2dlu h ARG 43 Ca -0.29 0.00 -0.04 0.00 -1.10 0.00 0.00 59.98 58.55 2dlu h ARG 43 Cb 1.10 0.00 -0.14 0.00 -1.39 0.00 0.00 29.97 29.54 2dlu h ARG 43 CO 1.05 -0.00 0.12 -0.08 2.80 0.00 0.00 179.97 183.86 2dlu s THR 44 N -6.21 0.02 -0.30 0.20 -1.32 -1.26 -4.67 115.64 102.10 2dlu s THR 44 Ca -0.14 -0.14 0.03 0.00 -1.21 0.00 0.00 61.69 60.24 2dlu s THR 44 Cb 0.11 -1.02 0.08 0.00 -1.51 0.00 0.00 72.50 70.17 2dlu s THR 44 CO 0.69 -0.08 -0.01 -0.63 -2.21 0.00 0.00 174.62 172.38 2dlu s ILE 45 N -3.07 2.12 0.14 5.08 1.01 -1.26 0.25 121.20 125.46 2dlu s ILE 45 Ca -0.02 -1.99 -0.25 0.00 0.00 0.00 0.00 60.65 58.39 2dlu s ILE 45 Cb -0.00 -2.44 -0.15 0.00 0.01 0.00 0.00 42.46 39.88 2dlu s ILE 45 CO -0.07 -0.38 0.51 0.52 0.00 0.00 0.00 174.94 175.52 2dlu n VAL 46 N 4.37 1.41 -2.24 2.92 0.31 -1.26 -4.81 118.33 119.03 2dlu n VAL 46 Ca -0.03 -0.35 -0.41 0.00 -0.01 0.00 0.00 64.34 63.54 2dlu n VAL 46 Cb 0.42 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 33.32 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 -0.70 4.43 -1.64 5.55 0.04 -1.26 -3.34 135.00 138.08 2dlu s PRO 47 Ca 0.57 2.05 -0.14 0.00 0.04 0.00 0.00 61.00 63.53 2dlu s PRO 47 Cb -0.83 -3.16 0.12 0.00 0.04 0.00 0.00 34.50 30.67 2dlu s PRO 47 CO 0.47 -0.13 0.66 0.41 0.04 0.00 0.00 177.00 178.44 2dlu n GLY 48 N 1.64 -0.38 0.00 0.56 0.00 -1.26 -4.92 105.19 100.84 2dlu n GLY 48 Ca 0.03 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 -1.59 0.39 0.24 -0.02 0.00 -1.21 -4.79 105.19 98.21 2dlu n GLY 49 Ca -0.03 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.83 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 2.25 -0.07 0.99 7.94 -1.25 -4.31 117.00 122.54 2dlu n LEU 50 Ca 0.00 0.05 -0.15 0.00 -1.11 0.00 0.00 56.01 54.80 2dlu n LEU 50 Cb 0.00 -0.58 -0.13 0.00 0.53 0.00 0.00 43.42 43.24 2dlu n LEU 50 CO 0.00 0.61 0.30 0.00 -1.11 0.00 0.00 177.39 177.19 2dlu h ALA 51 N -0.29 0.03 0.37 1.96 0.00 -1.88 -3.28 119.26 116.16 2dlu h ALA 51 Ca -0.43 -0.57 -0.01 0.00 0.00 0.00 0.00 54.91 53.91 2dlu h ALA 51 Cb 1.52 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.36 2dlu h ALA 51 CO -0.16 0.07 -0.44 0.22 0.00 0.00 0.00 179.25 178.94 2dlu h ASP 52 N -1.00 -1.24 -0.48 0.00 3.58 -1.85 -2.43 116.42 112.99 2dlu h ASP 52 Ca -0.03 0.11 0.04 0.00 0.42 0.00 0.00 57.03 57.57 2dlu h ASP 52 Cb 1.03 0.42 -0.06 0.00 1.72 0.00 0.00 39.33 42.44 2dlu h ASP 52 CO -0.02 -0.56 -0.29 0.03 -2.88 0.00 0.00 179.24 175.52 2dlu h ARG 53 N -0.83 -0.01 -0.92 0.28 3.08 -1.75 0.15 114.38 114.38 2dlu h ARG 53 Ca -0.05 0.00 0.19 0.00 0.07 0.00 0.00 59.98 60.19 2dlu h ARG 53 Cb 0.74 0.00 -0.17 0.00 0.08 0.00 0.00 29.97 30.61 2dlu h ARG 53 CO -0.09 -0.01 -0.21 0.22 -1.07 0.00 0.00 179.97 178.81 2dlu h ASP 54 N -0.01 -0.82 -0.51 7.04 1.82 -1.60 -3.45 116.42 118.89 2dlu h ASP 54 Ca 0.08 0.28 0.00 0.00 -0.39 0.00 0.00 57.03 56.99 2dlu h ASP 54 Cb 0.21 0.56 0.00 0.00 0.68 0.00 0.00 39.33 40.78 2dlu h ASP 54 CO -0.46 -0.30 0.00 0.61 -1.61 0.00 0.00 179.24 177.48 2dlu n GLY 55 N -1.58 0.75 0.28 -0.78 0.00 0.53 -4.97 105.19 99.41 2dlu n GLY 55 Ca 0.15 -0.72 -0.05 0.00 0.00 0.00 0.00 46.02 45.40 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 -0.71 0.13 -3.23 1.61 0.63 -1.26 -5.04 116.66 108.80 2dlu n ARG 56 Ca 0.00 0.04 -0.33 0.00 -0.92 0.00 0.00 57.85 56.64 2dlu n ARG 56 Cb 0.46 -0.98 -0.06 0.00 0.45 0.00 0.00 32.46 32.34 2dlu n ARG 56 CO 0.00 0.00 0.00 -1.17 -2.51 0.00 0.00 177.63 173.95 2dlu s LEU 57 N -5.63 4.13 0.24 6.15 0.20 -1.26 -5.03 118.68 117.48 2dlu s LEU 57 Ca -0.08 1.17 0.11 0.00 0.69 0.00 0.00 54.13 56.03 2dlu s LEU 57 Cb 0.02 -3.88 -0.05 0.00 -0.43 0.00 0.00 46.19 41.86 2dlu s LEU 57 CO 0.12 -0.13 -0.21 -1.58 -0.29 0.00 0.00 176.35 174.26 2dlu s GLN 58 N -2.80 1.59 0.48 1.98 2.00 -1.26 -4.80 119.66 116.85 2dlu s GLN 58 Ca 0.50 -1.67 -0.24 0.00 -2.00 0.00 0.00 55.36 51.96 2dlu s GLN 58 Cb -0.11 -1.71 -0.07 0.00 0.80 0.00 0.00 33.01 31.91 2dlu s GLN 58 CO 0.19 0.33 1.34 0.95 -0.50 0.00 0.00 175.29 177.60 2dlu s THR 59 N -2.29 2.33 -1.11 -0.34 -4.23 -1.26 -3.13 115.64 105.62 2dlu s THR 59 Ca 0.26 0.27 -0.06 0.00 -1.18 0.00 0.00 61.69 60.98 2dlu s THR 59 Cb -0.06 -3.15 0.01 0.00 1.34 0.00 0.00 72.50 70.64 2dlu s THR 59 CO 0.12 0.02 0.96 0.61 -0.54 0.00 0.00 174.62 175.79 2dlu n GLY 60 N 0.63 -0.28 3.65 3.99 0.00 0.20 -4.91 105.19 108.47 2dlu n GLY 60 Ca 0.07 0.08 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 2dlu n GLY 60 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dlu s ASP 61 N -3.44 7.00 -0.86 1.61 1.11 -1.18 -4.61 116.67 116.30 2dlu s ASP 61 Ca 0.39 1.21 -0.25 0.00 0.18 0.00 0.00 52.55 54.08 2dlu s ASP 61 Cb -0.17 -2.53 -0.08 0.00 1.07 0.00 0.00 42.92 41.21 2dlu s ASP 61 CO 0.61 -0.74 2.11 -1.00 1.18 0.00 0.00 175.17 177.32 2dlu s HIS 62 N 3.35 1.57 0.16 4.23 3.76 -1.25 -3.72 115.29 123.39 2dlu s HIS 62 Ca 0.44 1.12 -0.31 0.00 -0.15 0.00 0.00 55.06 56.16 2dlu s HIS 62 Cb -0.14 -3.83 -0.09 0.00 1.11 0.00 0.00 32.58 29.64 2dlu s HIS 62 CO 0.10 -1.70 1.39 0.42 -0.85 0.00 0.00 174.74 174.10 2dlu s ILE 63 N 11.74 3.14 -0.01 0.60 1.01 -0.11 -3.23 121.20 134.33 2dlu s ILE 63 Ca 0.78 0.87 -0.00 0.00 0.00 0.00 0.00 60.65 62.30 2dlu s ILE 63 Cb -0.09 -3.56 -0.01 0.00 0.01 0.00 0.00 42.46 38.82 2dlu s ILE 63 CO 0.03 0.09 -0.01 0.18 0.00 0.00 0.00 174.94 175.23 2dlu n LEU 64 N 3.36 2.19 -4.23 2.97 4.77 -0.87 -3.40 117.00 121.79 2dlu n LEU 64 Ca 0.09 -0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.94 2dlu n LEU 64 Cb 0.42 -0.04 -0.10 0.00 -2.33 0.00 0.00 43.42 41.36 2dlu n LEU 64 CO 0.59 0.38 -0.41 -0.75 -1.33 0.00 0.00 177.39 175.87 2dlu s LYS 65 N -2.03 1.00 -0.26 3.23 2.20 -1.25 -3.14 119.74 119.49 2dlu s LYS 65 Ca -0.02 -1.40 -0.01 0.00 -0.36 0.00 0.00 55.97 54.19 2dlu s LYS 65 Cb 0.01 -0.56 0.15 0.00 -1.51 0.00 0.00 37.83 35.91 2dlu s LYS 65 CO 0.03 0.06 0.41 0.42 -0.36 0.00 0.00 175.35 175.91 2dlu s ILE 66 N -3.25 -0.65 -1.31 5.43 1.01 -1.04 -1.33 121.20 120.07 2dlu s ILE 66 Ca 0.15 -0.15 -0.12 0.00 0.00 0.00 0.00 60.65 60.53 2dlu s ILE 66 Cb 0.02 -0.89 0.10 0.00 0.01 0.00 0.00 42.46 41.70 2dlu s ILE 66 CO -0.00 -0.17 0.51 0.61 0.00 0.00 0.00 174.94 175.89 2dlu n GLY 67 N 5.37 -0.47 1.33 6.18 0.00 0.87 -0.40 105.19 118.07 2dlu n GLY 67 Ca -0.02 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.09 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 -1.13 0.88 3.35 -0.02 0.00 -1.26 -5.05 105.19 101.97 2dlu n GLY 68 Ca 0.02 -0.59 -0.32 0.00 0.00 0.00 0.00 46.02 45.13 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 -2.14 2.48 -1.25 2.61 2.01 0.47 -5.06 115.64 114.76 2dlu s THR 69 Ca 0.00 -0.92 -0.14 0.00 0.31 0.00 0.00 61.69 60.94 2dlu s THR 69 Cb 0.00 -1.94 0.15 0.00 0.01 0.00 0.00 72.50 70.72 2dlu s THR 69 CO 0.00 0.57 1.59 0.59 -0.69 0.00 0.00 174.62 176.69 2dlu n ASN 70 N 2.74 5.10 -1.46 3.53 3.02 -1.26 -2.48 115.26 124.44 2dlu n ASN 70 Ca -0.17 -2.98 -0.08 0.00 -0.03 0.00 0.00 54.58 51.32 2dlu n ASN 70 Cb 0.52 -1.60 0.10 0.00 -0.61 0.00 0.00 39.78 38.20 2dlu n ASN 70 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 2dlu n VAL 71 N 4.79 1.83 -0.12 2.41 0.24 -1.19 -3.91 118.33 122.39 2dlu n VAL 71 Ca 0.40 -0.81 -0.16 0.00 -2.04 0.00 0.00 64.34 61.73 2dlu n VAL 71 Cb 0.42 -0.68 -0.11 0.00 -1.47 0.00 0.00 33.84 32.00 2dlu n VAL 71 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2dlu n GLN 72 N -0.13 0.63 0.07 7.34 1.13 -1.24 -3.91 117.38 121.27 2dlu n GLN 72 Ca 0.24 0.12 0.12 0.00 -1.94 0.00 0.00 57.00 55.54 2dlu n GLN 72 Cb 0.95 -1.48 0.15 0.00 0.11 0.00 0.00 30.24 29.98 2dlu n GLN 72 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 2dlu h GLY 73 N 2.00 0.00 -2.36 1.08 0.00 -1.93 -3.05 103.07 98.81 2dlu h GLY 73 Ca -0.53 0.00 -0.47 0.00 0.00 0.00 0.00 47.33 46.33 2dlu h GLY 73 CO -0.07 0.00 -0.36 -3.16 0.00 0.00 0.00 176.54 172.95 2dlu s MET 74 N -3.19 2.68 0.32 4.80 0.23 -1.26 -4.98 119.30 117.90 2dlu s MET 74 Ca 0.05 -1.38 0.00 0.00 -1.03 0.00 0.00 55.69 53.34 2dlu s MET 74 Cb 0.13 -2.52 -0.03 0.00 -1.53 0.00 0.00 34.83 30.88 2dlu s MET 74 CO 0.73 -0.13 0.52 0.95 -2.03 0.00 0.00 175.02 175.05 2dlu s THR 75 N -2.39 5.12 0.38 3.16 -4.23 -1.26 -4.25 115.64 112.18 2dlu s THR 75 Ca 0.48 -0.47 0.14 0.00 -1.18 0.00 0.00 61.69 60.67 2dlu s THR 75 Cb -0.06 -3.84 0.36 0.00 1.34 0.00 0.00 72.50 70.30 2dlu s THR 75 CO 0.29 -0.49 1.82 0.77 -0.54 0.00 0.00 174.62 176.47 2dlu h SER 76 N 0.98 0.53 -1.00 3.99 4.64 -1.91 0.72 113.55 121.48 2dlu h SER 76 Ca -0.50 0.06 0.21 0.00 -0.47 0.00 0.00 61.79 61.09 2dlu h SER 76 Cb 1.22 -0.03 -0.11 0.00 -0.31 0.00 0.00 62.40 63.16 2dlu h SER 76 CO 0.62 0.19 0.61 -0.08 -0.87 0.00 0.00 176.83 177.30 2dlu h GLU 77 N 0.51 0.69 0.00 4.77 4.81 -1.99 0.58 114.58 123.95 2dlu h GLU 77 Ca 0.52 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.71 2dlu h GLU 77 Cb 1.16 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.38 2dlu h GLU 77 CO -0.25 0.45 -0.39 1.04 -0.73 0.00 0.00 179.01 179.13 2dlu n GLN 78 N -4.80 0.20 0.13 1.92 6.02 0.21 -3.83 117.38 117.23 2dlu n GLN 78 Ca 0.24 0.09 -0.23 0.00 -0.01 0.00 0.00 57.00 57.09 2dlu n GLN 78 Cb 0.63 -1.66 -0.15 0.00 1.02 0.00 0.00 30.24 30.07 2dlu n GLN 78 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 2dlu h VAL 79 N 0.00 1.26 -0.92 5.09 2.07 0.52 -3.33 116.25 120.95 2dlu h VAL 79 Ca 0.00 -2.73 0.21 0.00 0.82 0.00 0.00 66.70 65.00 2dlu h VAL 79 Cb 0.67 2.98 -0.17 0.00 -1.52 0.00 0.00 31.29 33.25 2dlu h VAL 79 CO 0.00 0.83 -0.13 0.00 0.02 0.00 0.00 177.57 178.29 2dlu n ALA 80 N -2.71 0.32 -0.09 1.67 0.00 0.01 0.17 120.51 119.88 2dlu n ALA 80 Ca -0.17 1.00 -0.08 0.00 0.00 0.00 0.00 53.44 54.19 2dlu n ALA 80 Cb 1.09 -0.65 0.08 0.00 0.00 0.00 0.00 19.45 19.97 2dlu n ALA 80 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.50 176.94 2dlu h GLN 81 N 0.00 0.78 -0.21 0.00 3.07 -1.79 -3.12 115.11 113.84 2dlu h GLN 81 Ca 0.48 -0.32 0.06 0.00 0.09 0.00 0.00 58.65 58.96 2dlu h GLN 81 Cb 0.85 -0.03 -0.06 0.00 0.08 0.00 0.00 27.48 28.32 2dlu h GLN 81 CO -0.91 0.94 -0.19 0.28 0.09 0.00 0.00 178.83 179.03 2dlu h VAL 82 N 0.68 0.49 -0.88 1.86 2.07 0.16 0.30 116.25 120.93 2dlu h VAL 82 Ca 0.09 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.70 2dlu h VAL 82 Cb 0.74 0.49 -0.06 0.00 -1.52 0.00 0.00 31.29 30.94 2dlu h VAL 82 CO 0.06 0.00 0.57 -0.07 0.02 0.00 0.00 177.57 178.15 2dlu h LEU 83 N -0.20 0.82 -0.33 2.57 3.38 -1.32 -0.63 115.31 119.61 2dlu h LEU 83 Ca 0.13 0.02 -0.18 0.00 0.09 0.00 0.00 57.88 57.93 2dlu h LEU 83 Cb 0.39 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 2dlu h LEU 83 CO -0.33 0.50 -0.52 0.03 0.09 0.00 0.00 178.44 178.22 2dlu h ARG 84 N 0.92 0.87 -0.34 1.13 3.08 -1.15 -3.23 114.38 115.66 2dlu h ARG 84 Ca 0.40 -0.53 -0.02 0.00 0.07 0.00 0.00 59.98 59.90 2dlu h ARG 84 Cb 0.33 0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.42 2dlu h ARG 84 CO -0.16 1.17 0.15 -0.91 -1.07 0.00 0.00 179.97 179.14 2dlu h ASN 85 N 0.67 0.46 -0.74 7.04 2.35 0.50 -3.16 115.58 122.71 2dlu h ASN 85 Ca 0.02 -0.15 0.08 0.00 -0.55 0.00 0.00 56.30 55.70 2dlu h ASN 85 Cb 1.12 -0.12 -0.10 0.00 0.05 0.00 0.00 38.32 39.27 2dlu h ASN 85 CO 0.12 0.49 -0.40 0.00 -1.65 0.00 0.00 177.43 175.99 2dlu n GLY 87 N -1.23 1.04 0.07 0.00 0.00 -1.20 -4.82 105.19 99.06 2dlu n GLY 87 Ca 0.03 -0.99 -0.05 0.00 0.00 0.00 0.00 46.02 45.02 2dlu n GLY 87 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2dlu n ASN 88 N 0.00 1.09 -4.62 1.61 0.23 -1.26 -4.72 115.26 107.58 2dlu n ASN 88 Ca 0.00 0.18 -0.43 0.00 -0.53 0.00 0.00 54.58 53.81 2dlu n ASN 88 Cb 0.00 -0.63 -0.02 0.00 -2.08 0.00 0.00 39.78 37.05 2dlu n ASN 88 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 2dlu s SER 89 N -5.09 6.65 -0.33 0.53 1.04 -1.26 -0.78 113.70 114.46 2dlu s SER 89 Ca -0.16 1.06 -0.04 0.00 0.48 0.00 0.00 55.95 57.28 2dlu s SER 89 Cb 0.02 -2.54 0.05 0.00 0.10 0.00 0.00 66.02 63.65 2dlu s SER 89 CO 0.24 -1.12 0.07 -0.69 0.98 0.00 0.00 173.24 172.71 2dlu s VAL 90 N 4.44 3.45 -0.40 5.02 1.01 -0.77 -4.96 120.40 128.19 2dlu s VAL 90 Ca 0.55 -1.27 -0.10 0.00 0.00 0.00 0.00 61.98 61.16 2dlu s VAL 90 Cb -0.15 -2.98 0.05 0.00 0.00 0.00 0.00 36.38 33.31 2dlu s VAL 90 CO 0.24 -0.17 0.23 -0.13 0.00 0.00 0.00 175.10 175.27 2dlu s ARG 91 N 1.33 2.72 -0.02 2.72 0.52 -1.26 -1.29 118.95 123.67 2dlu s ARG 91 Ca -0.03 -1.26 0.03 0.00 -0.52 0.00 0.00 55.73 53.94 2dlu s ARG 91 Cb -0.20 -3.75 -0.03 0.00 0.52 0.00 0.00 34.95 31.49 2dlu s ARG 91 CO 0.01 -0.82 -0.08 -1.64 0.02 0.00 0.00 175.30 172.79 2dlu s MET 92 N 1.49 2.60 -0.56 3.54 -1.94 -0.65 -0.09 119.30 123.69 2dlu s MET 92 Ca 0.02 -0.67 -0.18 0.00 -1.71 0.00 0.00 55.69 53.15 2dlu s MET 92 Cb -0.21 -2.51 0.10 0.00 2.01 0.00 0.00 34.83 34.22 2dlu s MET 92 CO 0.04 0.62 0.61 -0.51 -0.01 0.00 0.00 175.02 175.78 2dlu s LEU 93 N -1.17 5.58 -0.05 -0.03 1.43 -0.44 -0.74 118.68 123.25 2dlu s LEU 93 Ca 0.15 -1.46 -0.04 0.00 -1.03 0.00 0.00 54.13 51.75 2dlu s LEU 93 Cb -0.11 -2.28 -0.04 0.00 0.03 0.00 0.00 46.19 43.79 2dlu s LEU 93 CO 0.05 -0.98 0.13 0.68 0.23 0.00 0.00 176.35 176.46 2dlu s VAL 94 N 2.30 5.23 0.09 -1.59 -7.23 -0.76 -2.06 120.40 116.38 2dlu s VAL 94 Ca 0.09 -0.10 0.07 0.00 -1.81 0.00 0.00 61.98 60.23 2dlu s VAL 94 Cb -0.25 -3.36 -0.03 0.00 0.56 0.00 0.00 36.38 33.29 2dlu s VAL 94 CO 0.06 0.45 -0.19 0.00 -0.31 0.00 0.00 175.10 175.11 2dlu s ALA 95 N -1.17 1.59 0.26 1.32 0.00 -1.20 -2.44 121.76 120.12 2dlu s ALA 95 Ca 0.21 -1.16 -0.06 0.00 0.00 0.00 0.00 51.96 50.95 2dlu s ALA 95 Cb -0.12 -0.20 -0.01 0.00 0.00 0.00 0.00 23.12 22.79 2dlu s ALA 95 CO 0.12 0.30 0.36 -0.98 0.00 0.00 0.00 175.76 175.56 2dlu s ARG 96 N -1.83 1.52 -1.15 0.00 1.70 -1.15 -3.77 118.95 114.28 2dlu s ARG 96 Ca 0.04 -1.50 -0.04 0.00 -0.47 0.00 0.00 55.73 53.75 2dlu s ARG 96 Cb -0.10 0.40 -0.03 0.00 -0.57 0.00 0.00 34.95 34.65 2dlu s ARG 96 CO 0.04 -0.60 0.91 -0.25 -1.08 0.00 0.00 175.30 174.32 2dlu n ASP 97 N -0.60 -4.15 -4.67 -2.89 9.92 -1.26 -2.68 116.55 110.22 2dlu n ASP 97 Ca 0.00 -0.72 -0.42 0.00 -0.53 0.00 0.00 54.79 53.12 2dlu n ASP 97 Cb 0.63 -4.88 -0.03 0.00 -0.64 0.00 0.00 41.12 36.20 2dlu n ASP 97 CO 0.00 0.00 0.00 -2.16 0.13 0.00 0.00 177.20 175.17 2dlu s PRO 98 N -5.08 4.23 0.48 -0.24 0.04 -1.26 -0.97 135.00 132.21 2dlu s PRO 98 Ca 0.23 2.01 -0.17 0.00 0.04 0.00 0.00 61.00 63.12 2dlu s PRO 98 Cb -0.04 -3.74 -0.14 0.00 0.04 0.00 0.00 34.50 30.61 2dlu s PRO 98 CO 0.76 -0.70 -0.12 0.00 0.04 0.00 0.00 177.00 176.98 2dlu n ALA 99 N 6.19 -3.02 0.00 8.56 0.00 -1.26 -4.81 120.51 126.16 2dlu n ALA 99 Ca 0.15 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.54 2dlu n ALA 99 Cb 0.43 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.53 2dlu n ALA 99 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dlu n GLY 100 N 2.41 0.61 2.26 0.00 0.00 -1.26 -4.85 105.19 104.35 2dlu n GLY 100 Ca 0.08 -2.18 -0.29 0.00 0.00 0.00 0.00 46.02 43.62 2dlu n GLY 100 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2dlu n ASP 101 N 1.00 5.94 -4.35 1.61 5.75 -1.26 -5.06 116.55 120.18 2dlu n ASP 101 Ca 0.00 -3.77 -0.32 0.00 -0.01 0.00 0.00 54.79 50.70 2dlu n ASP 101 Cb 0.00 -0.61 0.17 0.00 -1.03 0.00 0.00 41.12 39.66 2dlu n ASP 101 CO 0.00 0.00 0.00 2.30 -0.11 0.00 0.00 177.20 179.39 2dlu n ILE 102 N -0.72 0.00 -3.63 2.12 -5.35 -1.26 -4.96 119.36 105.56 2dlu n ILE 102 Ca 0.50 -0.29 -0.39 0.00 -0.27 0.00 0.00 62.75 62.30 2dlu n ILE 102 Cb 0.77 -0.68 -0.10 0.00 -1.74 0.00 0.00 39.64 37.89 2dlu n ILE 102 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 2dlu s SER 103 N -1.99 5.55 0.51 7.28 0.01 -1.26 -5.07 113.70 118.72 2dlu s SER 103 Ca 0.58 -1.88 -0.19 0.00 1.31 0.00 0.00 55.95 55.77 2dlu s SER 103 Cb -0.16 -1.95 -0.12 0.00 0.21 0.00 0.00 66.02 64.00 2dlu s SER 103 CO 0.66 -0.62 0.33 1.33 0.41 0.00 0.00 173.24 175.35 2dlu n VAL 104 N 4.81 1.44 -0.04 3.43 0.24 -1.26 -4.92 118.33 122.03 2dlu n VAL 104 Ca -0.07 -0.50 -0.12 0.00 -2.04 0.00 0.00 64.34 61.61 2dlu n VAL 104 Cb 0.41 -0.42 -0.10 0.00 -1.47 0.00 0.00 33.84 32.25 2dlu n VAL 104 CO 0.00 0.00 0.00 0.71 -2.14 0.00 0.00 176.83 175.40 2dlu h THR 105 N 0.31 1.42 -6.68 3.34 1.35 -2.06 -3.47 112.91 107.12 2dlu h THR 105 Ca -0.43 -1.79 -0.54 0.00 -0.55 0.00 0.00 66.41 63.11 2dlu h THR 105 Cb 1.42 2.56 -0.17 0.00 -1.73 0.00 0.00 68.15 70.23 2dlu h THR 105 CO 0.47 0.43 -0.85 -1.20 -0.25 0.00 0.00 175.52 174.12 2dlu n SER 106 N -4.73 -2.63 -3.83 5.36 7.64 -1.26 -4.94 113.62 109.23 2dlu n SER 106 Ca -0.09 -1.01 -0.12 0.00 1.01 0.00 0.00 58.87 58.67 2dlu n SER 106 Cb 0.36 -2.84 -0.10 0.00 -1.01 0.00 0.00 64.21 60.62 2dlu n SER 106 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2dlu s GLY 107 N -3.55 -0.04 0.39 0.23 0.00 -1.26 -5.15 107.32 97.94 2dlu s GLY 107 Ca 0.56 0.12 -0.26 0.00 0.00 0.00 0.00 44.72 45.15 2dlu s GLY 107 CO 0.92 -0.02 1.19 2.56 0.00 0.00 0.00 173.10 177.75 2dlu s PRO 108 N -1.04 4.07 -0.52 2.90 0.04 -1.26 -5.02 135.00 134.17 2dlu s PRO 108 Ca -0.11 1.90 0.04 0.00 0.04 0.00 0.00 61.00 62.86 2dlu s PRO 108 Cb -0.06 -2.72 0.14 0.00 0.04 0.00 0.00 34.50 31.90 2dlu s PRO 108 CO 0.02 -0.32 0.29 -1.54 0.04 0.00 0.00 177.00 175.48 2dlu s SER 109 N -1.04 4.15 -0.12 6.66 1.04 -1.26 -5.08 113.70 118.05 2dlu s SER 109 Ca 0.56 -3.04 0.01 0.00 0.48 0.00 0.00 55.95 53.97 2dlu s SER 109 Cb -0.32 -1.45 -0.01 0.00 0.10 0.00 0.00 66.02 64.33 2dlu s SER 109 CO 0.41 -0.22 -0.16 -0.55 0.98 0.00 0.00 173.24 173.70 2dlu s SER 110 N -0.29 3.75 0.00 7.02 0.15 -1.26 -5.10 113.70 117.97 2dlu s SER 110 Ca 0.19 -0.39 0.00 0.00 0.70 0.00 0.00 55.95 56.45 2dlu s SER 110 Cb -0.22 -1.52 0.00 0.00 -1.71 0.00 0.00 66.02 62.57 2dlu s SER 110 CO -0.03 0.17 0.00 0.61 1.20 0.00 0.00 173.24 175.19