#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5d n SER 2 N 0.00 -0.79 -1.94 1.61 2.88 -1.26 -4.80 113.62 109.32 1x5d n SER 2 Ca 0.00 -1.03 -0.13 0.00 -1.33 0.00 0.00 58.87 56.39 1x5d n SER 2 Cb 0.00 -2.90 -0.05 0.00 -0.75 0.00 0.00 64.21 60.50 1x5d n SER 2 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1x5d n SER 3 N -2.92 5.80 0.00 -3.46 2.88 -1.26 -4.90 113.62 109.76 1x5d n SER 3 Ca -0.24 -2.74 0.00 0.00 -1.33 0.00 0.00 58.87 54.56 1x5d n SER 3 Cb 0.65 -1.22 0.00 0.00 -0.75 0.00 0.00 64.21 62.89 1x5d n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x5d n GLY 4 N 1.42 -0.23 0.11 0.46 0.00 -1.26 -4.64 105.19 101.04 1x5d n GLY 4 Ca 0.30 -1.52 -0.22 0.00 0.00 0.00 0.00 46.02 44.57 1x5d n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1x5d n SER 5 N -0.73 1.88 -4.53 1.61 3.41 -1.26 -4.81 113.62 109.19 1x5d n SER 5 Ca 0.00 0.42 -0.43 0.00 -0.26 0.00 0.00 58.87 58.60 1x5d n SER 5 Cb 0.00 -0.92 -0.05 0.00 -0.26 0.00 0.00 64.21 62.98 1x5d n SER 5 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1x5d s SER 6 N -6.89 6.38 0.90 4.04 0.01 -1.26 -4.94 113.70 111.94 1x5d s SER 6 Ca -0.30 -0.23 0.00 0.00 1.31 0.00 0.00 55.95 56.73 1x5d s SER 6 Cb 0.08 -2.40 0.00 0.00 0.21 0.00 0.00 66.02 63.91 1x5d s SER 6 CO 0.53 -1.03 0.00 0.61 0.41 0.00 0.00 173.24 173.76 1x5d n GLY 7 N 5.04 0.72 1.37 3.44 0.00 -1.26 -3.24 105.19 111.26 1x5d n GLY 7 Ca 0.02 -0.84 0.05 0.00 0.00 0.00 0.00 46.02 45.24 1x5d n GLY 7 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1x5d n ASP 8 N -3.10 3.95 -4.67 1.61 2.03 -1.26 -4.76 116.55 110.35 1x5d n ASP 8 Ca 0.00 -2.57 -0.43 0.00 0.52 0.00 0.00 54.79 52.32 1x5d n ASP 8 Cb 0.00 -0.61 -0.02 0.00 -0.72 0.00 0.00 41.12 39.77 1x5d n ASP 8 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1x5d s VAL 9 N -2.09 4.12 -0.08 5.18 1.01 -1.20 -4.65 120.40 122.69 1x5d s VAL 9 Ca 0.34 1.39 -0.14 0.00 0.00 0.00 0.00 61.98 63.58 1x5d s VAL 9 Cb 0.26 -3.90 -0.05 0.00 0.00 0.00 0.00 36.38 32.69 1x5d s VAL 9 CO 0.10 -0.09 0.35 -0.63 0.00 0.00 0.00 175.10 174.83 1x5d s ILE 10 N 3.21 5.20 0.07 2.22 1.01 -0.74 -4.52 121.20 127.65 1x5d s ILE 10 Ca 0.58 0.68 -0.21 0.00 0.00 0.00 0.00 60.65 61.71 1x5d s ILE 10 Cb -0.25 -3.66 -0.06 0.00 0.01 0.00 0.00 42.46 38.49 1x5d s ILE 10 CO 0.19 0.49 0.61 -1.61 0.00 0.00 0.00 174.94 174.62 1x5d s GLU 11 N -0.34 4.28 0.26 2.79 2.02 -1.26 -1.65 118.70 124.80 1x5d s GLU 11 Ca 0.21 0.80 0.10 0.00 0.02 0.00 0.00 54.97 56.10 1x5d s GLU 11 Cb -0.15 -3.27 -0.05 0.00 0.10 0.00 0.00 34.13 30.76 1x5d s GLU 11 CO 0.09 0.55 -0.17 -0.51 0.02 0.00 0.00 175.26 175.24 1x5d s LEU 12 N -0.86 2.58 0.43 1.80 1.43 -1.20 -4.97 118.68 117.90 1x5d s LEU 12 Ca 0.31 -1.04 0.06 0.00 -1.03 0.00 0.00 54.13 52.42 1x5d s LEU 12 Cb -0.20 -0.95 -0.07 0.00 0.03 0.00 0.00 46.19 45.01 1x5d s LEU 12 CO 0.20 -0.05 0.01 -0.89 0.23 0.00 0.00 176.35 175.85 1x5d s THR 13 N -2.67 1.86 0.22 5.49 2.01 -1.26 -4.85 115.64 116.44 1x5d s THR 13 Ca 0.28 -1.99 0.30 0.00 0.31 0.00 0.00 61.69 60.59 1x5d s THR 13 Cb -0.03 -2.85 0.30 0.00 0.01 0.00 0.00 72.50 69.93 1x5d s THR 13 CO 0.12 0.00 1.90 -2.24 -0.69 0.00 0.00 174.62 173.72 1x5d h ASP 14 N 1.68 0.00 0.00 3.53 3.04 -1.99 0.13 116.42 122.82 1x5d h ASP 14 Ca -0.44 0.00 -0.05 0.00 -3.24 0.00 0.00 57.03 53.30 1x5d h ASP 14 Cb 1.25 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.54 1x5d h ASP 14 CO 0.79 0.00 -1.19 0.47 -2.04 0.00 0.00 179.24 177.28 1x5d n ASP 15 N -2.59 3.42 0.27 4.15 8.00 -1.26 -4.65 116.55 123.89 1x5d n ASP 15 Ca -0.02 -0.01 0.15 0.00 0.71 0.00 0.00 54.79 55.62 1x5d n ASP 15 Cb 0.11 -0.06 0.75 0.00 -0.02 0.00 0.00 41.12 41.90 1x5d n ASP 15 CO 0.00 0.00 0.00 -1.28 -0.39 0.00 0.00 177.20 175.53 1x5d h SER 16 N -0.01 0.00 -0.99 -2.24 0.87 -1.90 -2.84 113.55 106.44 1x5d h SER 16 Ca -0.07 0.00 0.16 0.00 -1.23 0.00 0.00 61.79 60.65 1x5d h SER 16 Cb 1.11 0.00 -0.09 0.00 -0.44 0.00 0.00 62.40 62.98 1x5d h SER 16 CO -0.02 0.09 0.62 0.15 -0.53 0.00 0.00 176.83 177.14 1x5d h PHE 17 N 0.00 1.04 0.17 2.24 3.04 -1.00 0.48 116.94 122.91 1x5d h PHE 17 Ca -0.00 0.03 -0.34 0.00 3.98 0.00 0.00 57.97 61.64 1x5d h PHE 17 Cb 0.40 -0.32 0.01 0.00 2.56 0.00 0.00 35.95 38.60 1x5d h PHE 17 CO 0.00 0.32 -1.68 0.38 -2.02 0.00 0.00 178.31 175.31 1x5d h ASP 18 N 0.82 0.56 0.66 0.41 2.03 -1.76 -1.31 116.42 117.84 1x5d h ASP 18 Ca 0.53 -0.81 0.00 0.00 -0.73 0.00 0.00 57.03 56.02 1x5d h ASP 18 Cb 0.74 -0.18 0.00 0.00 -0.83 0.00 0.00 39.33 39.06 1x5d h ASP 18 CO -0.31 1.68 0.00 0.11 -1.03 0.00 0.00 179.24 179.69 1x5d h LYS 19 N 0.10 0.00 0.00 4.15 1.57 -1.28 0.41 116.57 121.51 1x5d h LYS 19 Ca -0.31 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.32 1x5d h LYS 19 Cb 2.08 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 34.36 1x5d h LYS 19 CO 0.18 0.00 -1.86 0.09 -0.57 0.00 0.00 179.45 177.29 1x5d n ASN 20 N -2.72 1.51 -0.04 0.86 3.02 0.16 -4.22 115.26 113.83 1x5d n ASN 20 Ca 0.00 0.00 -0.04 0.00 -0.03 0.00 0.00 54.58 54.52 1x5d n ASN 20 Cb 0.22 1.20 -0.01 0.00 -0.61 0.00 0.00 39.78 40.57 1x5d n ASN 20 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1x5d n VAL 21 N -2.32 0.68 0.22 2.41 0.31 -0.49 -4.20 118.33 114.93 1x5d n VAL 21 Ca -0.15 0.34 -0.15 0.00 -0.01 0.00 0.00 64.34 64.37 1x5d n VAL 21 Cb 0.73 -1.89 -0.08 0.00 -0.91 0.00 0.00 33.84 31.69 1x5d n VAL 21 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1x5d h LEU 22 N -0.46 -0.42 -1.08 7.52 3.38 -0.47 -1.58 115.31 122.20 1x5d h LEU 22 Ca 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1x5d h LEU 22 Cb 0.41 0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1x5d h LEU 22 CO 0.00 -0.27 0.23 -0.78 0.09 0.00 0.00 178.44 177.71 1x5d h ASP 23 N -0.52 0.00 -3.47 -0.43 1.82 -1.08 -3.39 116.42 109.36 1x5d h ASP 23 Ca -0.05 0.00 -0.66 0.00 -0.39 0.00 0.00 57.03 55.93 1x5d h ASP 23 Cb 0.39 0.00 -0.24 0.00 0.68 0.00 0.00 39.33 40.17 1x5d h ASP 23 CO 0.08 0.00 -0.73 -0.55 -1.61 0.00 0.00 179.24 176.44 1x5d s SER 24 N -3.63 4.34 -0.11 2.28 0.15 -0.59 -4.99 113.70 111.14 1x5d s SER 24 Ca -0.02 -0.20 0.02 0.00 0.70 0.00 0.00 55.95 56.45 1x5d s SER 24 Cb 0.05 -1.48 0.20 0.00 -1.71 0.00 0.00 66.02 63.08 1x5d s SER 24 CO 0.15 0.23 1.14 -1.84 1.20 0.00 0.00 173.24 174.11 1x5d n GLU 25 N 3.13 1.57 -4.33 5.44 0.28 -1.26 -4.81 120.64 120.67 1x5d n GLU 25 Ca -0.18 -0.86 -0.24 0.00 -0.16 0.00 0.00 57.16 55.72 1x5d n GLU 25 Cb 0.53 -1.44 -0.09 0.00 1.43 0.00 0.00 31.44 31.87 1x5d n GLU 25 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 1x5d s ASP 26 N 0.19 4.22 0.03 -1.84 1.11 -1.26 -4.95 116.67 114.16 1x5d s ASP 26 Ca 0.16 -0.71 -0.30 0.00 0.18 0.00 0.00 52.55 51.87 1x5d s ASP 26 Cb 0.13 -0.67 -0.05 0.00 1.07 0.00 0.00 42.92 43.39 1x5d s ASP 26 CO 0.04 0.05 1.29 -0.69 1.18 0.00 0.00 175.17 177.03 1x5d s VAL 27 N -2.14 3.87 -0.25 -1.27 1.01 -1.25 -4.75 120.40 115.61 1x5d s VAL 27 Ca 0.29 1.29 -0.00 0.00 0.00 0.00 0.00 61.98 63.55 1x5d s VAL 27 Cb -0.07 -3.83 0.04 0.00 0.00 0.00 0.00 36.38 32.52 1x5d s VAL 27 CO 0.17 0.05 -0.07 0.26 0.00 0.00 0.00 175.10 175.51 1x5d s TRP 28 N 1.73 3.12 -0.66 5.22 0.52 -1.18 -0.79 118.94 126.90 1x5d s TRP 28 Ca 0.61 -1.78 -0.22 0.00 0.02 0.00 0.00 56.10 54.72 1x5d s TRP 28 Cb -0.30 -2.03 0.07 0.00 -1.15 0.00 0.00 33.47 30.06 1x5d s TRP 28 CO 0.27 -0.78 0.96 -1.64 0.02 0.00 0.00 176.95 175.78 1x5d s MET 29 N 1.26 3.12 -0.24 4.98 -1.94 0.48 -3.22 119.30 123.74 1x5d s MET 29 Ca -0.02 -0.86 -0.18 0.00 -1.71 0.00 0.00 55.69 52.92 1x5d s MET 29 Cb -0.18 -4.24 -0.03 0.00 2.01 0.00 0.00 34.83 32.39 1x5d s MET 29 CO -0.05 -1.81 0.50 0.08 -0.01 0.00 0.00 175.02 173.73 1x5d s VAL 30 N 4.01 5.10 -0.33 -6.03 1.01 -0.64 -0.54 120.40 122.98 1x5d s VAL 30 Ca 0.22 0.87 0.03 0.00 0.00 0.00 0.00 61.98 63.10 1x5d s VAL 30 Cb -0.17 -3.82 0.10 0.00 0.00 0.00 0.00 36.38 32.50 1x5d s VAL 30 CO 0.10 0.13 0.06 -0.70 0.00 0.00 0.00 175.10 174.68 1x5d s GLU 31 N 2.02 1.37 0.07 2.72 2.12 -0.75 -0.34 118.70 125.91 1x5d s GLU 31 Ca 0.21 -1.75 -0.31 0.00 0.36 0.00 0.00 54.97 53.49 1x5d s GLU 31 Cb -0.15 -3.02 -0.06 0.00 0.26 0.00 0.00 34.13 31.16 1x5d s GLU 31 CO 0.09 -0.94 1.24 -0.06 -0.54 0.00 0.00 175.26 175.05 1x5d s PHE 32 N 1.01 3.37 0.33 5.30 0.40 0.56 -3.20 117.98 125.76 1x5d s PHE 32 Ca 0.11 1.21 0.04 0.00 -0.60 0.00 0.00 56.93 57.69 1x5d s PHE 32 Cb -0.19 -3.48 -0.03 0.00 0.51 0.00 0.00 43.02 39.83 1x5d s PHE 32 CO -0.11 -1.55 0.19 1.52 0.70 0.00 0.00 175.22 175.97 1x5d s TYR 33 N 1.14 1.66 -0.07 0.36 -0.85 -0.84 -0.87 117.35 117.88 1x5d s TYR 33 Ca 0.60 -1.44 0.04 0.00 -0.52 0.00 0.00 57.07 55.75 1x5d s TYR 33 Cb -0.31 -0.87 0.00 0.00 0.38 0.00 0.00 41.96 41.16 1x5d s TYR 33 CO 0.29 -0.58 -0.20 0.00 -1.52 0.00 0.00 175.55 173.54 1x5d s ALA 34 N -3.50 1.81 -1.23 9.51 0.00 -1.26 -3.26 121.76 123.83 1x5d s ALA 34 Ca 0.35 -0.79 0.14 0.00 0.00 0.00 0.00 51.96 51.66 1x5d s ALA 34 Cb 0.04 -0.66 0.68 0.00 0.00 0.00 0.00 23.12 23.18 1x5d s ALA 34 CO 0.20 0.27 1.43 -0.35 0.00 0.00 0.00 175.76 177.31 1x5d n PRO 35 N 3.38 0.11 -0.19 0.00 -0.04 -1.26 -2.21 135.00 134.79 1x5d n PRO 35 Ca -0.19 0.20 0.09 0.00 -0.04 0.00 0.00 63.50 63.55 1x5d n PRO 35 Cb 0.52 -1.50 0.14 0.00 -0.04 0.00 0.00 33.50 32.62 1x5d n PRO 35 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1x5d n TRP 36 N -1.39 0.00 -4.91 0.54 4.27 -1.26 -5.00 117.44 109.69 1x5d n TRP 36 Ca 0.05 -0.99 -0.32 0.00 -3.89 0.00 0.00 57.50 52.35 1x5d n TRP 36 Cb 0.14 -0.16 -0.17 0.00 -1.36 0.00 0.00 31.31 29.77 1x5d n TRP 36 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1x5d h GLY 38 N 7.02 -0.76 -0.80 0.00 0.00 -1.95 -2.52 103.07 104.06 1x5d h GLY 38 Ca -0.26 0.28 0.33 0.00 0.00 0.00 0.00 47.33 47.68 1x5d h GLY 38 CO 0.52 -0.28 0.45 1.57 0.00 0.00 0.00 176.54 178.80 1x5d n HIS 39 N -5.39 0.85 0.00 5.60 -0.00 -1.26 0.60 115.22 115.62 1x5d n HIS 39 Ca -0.12 0.85 -0.10 0.00 -0.00 0.00 0.00 57.72 58.35 1x5d n HIS 39 Cb 0.31 -1.27 -0.08 0.00 -0.00 0.00 0.00 29.99 28.95 1x5d n HIS 39 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1x5d h LYS 41 N -0.91 0.14 0.00 0.00 1.57 0.58 1.87 116.57 119.82 1x5d h LYS 41 Ca -0.01 -0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 58.68 1x5d h LYS 41 Cb 0.55 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.81 1x5d h LYS 41 CO 0.02 0.09 -0.37 -2.95 -0.57 0.00 0.00 179.45 175.67 1x5d h ASN 42 N 0.15 0.00 1.14 0.86 -1.07 -1.29 -2.95 115.58 112.42 1x5d h ASN 42 Ca 0.64 0.00 0.00 0.00 0.07 0.00 0.00 56.30 57.01 1x5d h ASN 42 Cb 1.41 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.66 1x5d h ASN 42 CO -0.73 0.37 -0.76 0.25 0.07 0.00 0.00 177.43 176.63 1x5d h LEU 43 N 0.00 0.00 -0.97 6.14 5.85 0.26 -3.38 115.31 123.21 1x5d h LEU 43 Ca -0.00 -0.04 0.11 0.00 0.84 0.00 0.00 57.88 58.79 1x5d h LEU 43 Cb 0.94 0.00 -0.13 0.00 0.37 0.00 0.00 40.66 41.84 1x5d h LEU 43 CO 0.05 0.02 -0.50 1.21 -0.34 0.00 0.00 178.44 178.87 1x5d n GLU 44 N -2.65 -0.36 -0.12 1.25 4.07 0.35 0.13 120.64 123.32 1x5d n GLU 44 Ca 0.01 1.48 -0.13 0.00 -0.06 0.00 0.00 57.16 58.46 1x5d n GLU 44 Cb 0.53 -2.18 -0.03 0.00 -0.06 0.00 0.00 31.44 29.70 1x5d n GLU 44 CO 0.00 0.00 0.00 -1.00 -0.06 0.00 0.00 177.13 176.07 1x5d h PRO 45 N 0.00 0.90 -0.29 5.31 0.13 -1.77 -2.32 132.00 133.96 1x5d h PRO 45 Ca 0.22 -0.48 0.05 0.00 -0.87 0.00 0.00 66.00 64.93 1x5d h PRO 45 Cb 0.46 0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.60 1x5d h PRO 45 CO -0.93 1.13 0.20 0.93 -0.23 0.00 0.00 178.00 179.10 1x5d h GLU 46 N 0.71 0.15 0.16 0.86 3.07 -1.12 -1.47 114.58 116.93 1x5d h GLU 46 Ca 0.06 -0.01 -0.31 0.00 -0.50 0.00 0.00 59.36 58.60 1x5d h GLU 46 Cb 0.96 -0.03 0.01 0.00 -0.84 0.00 0.00 28.75 28.84 1x5d h GLU 46 CO 0.09 0.10 -1.49 2.35 -1.40 0.00 0.00 179.01 178.66 1x5d h TRP 47 N 0.15 0.61 0.65 4.33 2.91 -0.20 -2.75 115.95 121.65 1x5d h TRP 47 Ca 0.13 -0.44 -0.03 0.00 1.13 0.00 0.00 58.89 59.67 1x5d h TRP 47 Cb 0.33 -0.02 0.01 0.00 -0.51 0.00 0.00 29.16 28.96 1x5d h TRP 47 CO -0.00 1.44 -0.31 0.00 -1.03 0.00 0.00 178.44 178.54 1x5d h ALA 48 N 0.39 -0.88 -0.36 2.65 0.00 -0.76 -2.08 119.26 118.23 1x5d h ALA 48 Ca -0.24 -0.20 0.07 0.00 0.00 0.00 0.00 54.91 54.55 1x5d h ALA 48 Cb 2.05 0.34 -0.07 0.00 0.00 0.00 0.00 17.79 20.11 1x5d h ALA 48 CO 0.20 -0.98 -0.09 0.00 0.00 0.00 0.00 179.25 178.38 1x5d h ALA 49 N -0.55 0.24 -0.80 0.00 0.00 -1.46 -1.46 119.26 115.23 1x5d h ALA 49 Ca -0.09 0.14 0.14 0.00 0.00 0.00 0.00 54.91 55.10 1x5d h ALA 49 Cb 0.68 0.27 -0.09 0.00 0.00 0.00 0.00 17.79 18.64 1x5d h ALA 49 CO 0.15 -0.46 0.38 0.00 0.00 0.00 0.00 179.25 179.32 1x5d h ALA 50 N 1.36 1.18 -0.51 0.00 0.00 -1.53 0.11 119.26 119.87 1x5d h ALA 50 Ca 0.17 0.09 0.08 0.00 0.00 0.00 0.00 54.91 55.25 1x5d h ALA 50 Cb 0.26 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.00 1x5d h ALA 50 CO -0.37 -0.13 0.14 0.00 0.00 0.00 0.00 179.25 178.90 1x5d h ALA 51 N 1.54 0.60 -0.29 0.00 0.00 -0.54 0.70 119.26 121.28 1x5d h ALA 51 Ca 0.44 0.09 -0.18 0.00 0.00 0.00 0.00 54.91 55.26 1x5d h ALA 51 Cb 0.62 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1x5d h ALA 51 CO -0.37 -0.26 -0.51 0.77 0.00 0.00 0.00 179.25 178.88 1x5d h SER 52 N 0.30 0.94 0.56 0.00 0.02 -0.99 -0.75 113.55 113.64 1x5d h SER 52 Ca 0.25 -0.53 -0.06 0.00 -0.84 0.00 0.00 61.79 60.61 1x5d h SER 52 Cb 0.31 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.57 1x5d h SER 52 CO -0.29 1.29 -0.28 -0.08 -1.14 0.00 0.00 176.83 176.33 1x5d h GLU 53 N 0.63 0.00 0.18 3.45 4.57 -0.21 -0.86 114.58 122.35 1x5d h GLU 53 Ca 0.02 0.00 -0.33 0.00 -1.18 0.00 0.00 59.36 57.86 1x5d h GLU 53 Cb 1.12 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.72 1x5d h GLU 53 CO 0.11 0.28 -1.60 0.28 -1.18 0.00 0.00 179.01 176.91 1x5d h VAL 54 N 0.00 1.11 0.00 0.32 2.07 0.53 -2.93 116.25 117.35 1x5d h VAL 54 Ca -0.00 -2.67 -0.02 0.00 0.82 0.00 0.00 66.70 64.83 1x5d h VAL 54 Cb 0.64 2.84 -0.00 0.00 -1.52 0.00 0.00 31.29 33.25 1x5d h VAL 54 CO 0.04 0.84 -0.12 0.07 0.02 0.00 0.00 177.57 178.42 1x5d h LYS 55 N 0.11 0.00 0.00 1.57 2.10 -1.00 0.23 116.57 119.57 1x5d h LYS 55 Ca -0.28 0.00 -0.14 0.00 -2.00 0.00 0.00 60.65 58.22 1x5d h LYS 55 Cb 2.09 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 33.40 1x5d h LYS 55 CO 0.20 0.12 -1.07 1.05 -2.00 0.00 0.00 179.45 177.75 1x5d h GLU 56 N 0.00 0.00 0.05 0.07 4.11 -1.24 0.62 114.58 118.18 1x5d h GLU 56 Ca -0.00 0.00 -0.37 0.00 0.07 0.00 0.00 59.36 59.06 1x5d h GLU 56 Cb 0.83 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.03 1x5d h GLU 56 CO 0.02 0.38 -2.11 1.04 0.07 0.00 0.00 179.01 178.41 1x5d n GLN 57 N -3.02 0.67 -0.18 1.06 6.02 -1.11 -4.20 117.38 116.63 1x5d n GLN 57 Ca -0.05 0.28 0.00 0.00 -0.01 0.00 0.00 57.00 57.22 1x5d n GLN 57 Cb 0.80 -1.62 0.07 0.00 1.02 0.00 0.00 30.24 30.50 1x5d n GLN 57 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1x5d n THR 58 N -3.69 0.69 -2.42 5.09 -2.24 0.79 -4.82 114.28 107.68 1x5d n THR 58 Ca -0.40 -0.27 -0.11 0.00 -2.27 0.00 0.00 64.05 61.00 1x5d n THR 58 Cb 0.94 -0.56 -0.01 0.00 -2.10 0.00 0.00 70.33 68.61 1x5d n THR 58 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1x5d n LYS 59 N 0.13 -2.27 -1.46 -0.78 4.76 -1.22 0.67 118.16 117.99 1x5d n LYS 59 Ca 0.06 0.55 -0.05 0.00 -2.87 0.00 0.00 58.31 56.00 1x5d n LYS 59 Cb 0.48 -5.13 -0.01 0.00 -1.84 0.00 0.00 35.03 28.53 1x5d n LYS 59 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1x5d n GLY 60 N -0.76 0.54 0.05 0.72 0.00 0.22 -4.96 105.19 100.99 1x5d n GLY 60 Ca -0.13 -0.80 -0.01 0.00 0.00 0.00 0.00 46.02 45.08 1x5d n GLY 60 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1x5d h LYS 61 N 0.00 0.00 -6.19 1.61 1.63 -0.02 -3.43 116.57 110.17 1x5d h LYS 61 Ca -0.10 0.00 -0.58 0.00 -0.85 0.00 0.00 60.65 59.12 1x5d h LYS 61 Cb 0.57 0.00 -0.10 0.00 -0.60 0.00 0.00 32.23 32.10 1x5d h LYS 61 CO 0.13 0.00 0.76 0.08 -3.45 0.00 0.00 179.45 176.98 1x5d s VAL 62 N -1.60 4.20 0.38 2.00 1.01 -1.26 -3.83 120.40 121.31 1x5d s VAL 62 Ca -0.02 0.55 -0.08 0.00 0.00 0.00 0.00 61.98 62.43 1x5d s VAL 62 Cb 0.00 -4.64 -0.06 0.00 0.00 0.00 0.00 36.38 31.69 1x5d s VAL 62 CO 0.03 -1.24 0.71 -0.54 0.00 0.00 0.00 175.10 174.07 1x5d s LYS 63 N 4.45 3.70 -0.15 2.72 1.02 0.03 -4.36 119.74 127.16 1x5d s LYS 63 Ca 0.36 0.30 0.01 0.00 0.02 0.00 0.00 55.97 56.66 1x5d s LYS 63 Cb -0.10 -2.46 0.02 0.00 -0.52 0.00 0.00 37.83 34.77 1x5d s LYS 63 CO 0.22 0.01 -0.17 -0.51 -0.92 0.00 0.00 175.35 173.97 1x5d s LEU 64 N -3.90 1.89 0.27 3.17 1.02 -1.26 -0.39 118.68 119.49 1x5d s LEU 64 Ca 0.49 -0.54 0.04 0.00 0.02 0.00 0.00 54.13 54.14 1x5d s LEU 64 Cb -0.10 -1.30 -0.06 0.00 0.02 0.00 0.00 46.19 44.75 1x5d s LEU 64 CO 0.33 -0.00 0.01 0.00 0.02 0.00 0.00 176.35 176.70 1x5d s ALA 65 N 1.22 2.12 0.27 4.21 0.00 0.30 -1.79 121.76 128.09 1x5d s ALA 65 Ca 0.01 -1.90 0.05 0.00 0.00 0.00 0.00 51.96 50.12 1x5d s ALA 65 Cb -0.14 0.48 -0.06 0.00 0.00 0.00 0.00 23.12 23.41 1x5d s ALA 65 CO -0.08 -0.23 -0.01 0.00 0.00 0.00 0.00 175.76 175.44 1x5d s ALA 66 N -3.29 2.15 -0.15 0.00 0.00 -0.66 -1.82 121.76 118.00 1x5d s ALA 66 Ca 0.32 -1.89 -0.13 0.00 0.00 0.00 0.00 51.96 50.25 1x5d s ALA 66 Cb 0.06 0.42 0.04 0.00 0.00 0.00 0.00 23.12 23.64 1x5d s ALA 66 CO 0.12 -0.20 0.39 0.08 0.00 0.00 0.00 175.76 176.15 1x5d s VAL 67 N -3.24 -0.00 -0.61 0.00 1.01 -1.19 -3.23 120.40 113.14 1x5d s VAL 67 Ca 0.31 0.02 -0.22 0.00 0.00 0.00 0.00 61.98 62.08 1x5d s VAL 67 Cb 0.06 -0.56 0.06 0.00 0.00 0.00 0.00 36.38 35.95 1x5d s VAL 67 CO 0.12 0.01 0.91 -1.81 0.00 0.00 0.00 175.10 174.32 1x5d s ASP 68 N 0.39 6.22 0.01 3.32 1.11 -1.26 -1.99 116.67 124.46 1x5d s ASP 68 Ca -0.01 -0.85 0.01 0.00 0.18 0.00 0.00 52.55 51.87 1x5d s ASP 68 Cb -0.04 -2.40 0.03 0.00 1.07 0.00 0.00 42.92 41.58 1x5d s ASP 68 CO -0.01 -1.32 1.01 0.00 1.18 0.00 0.00 175.17 176.03 1x5d n ALA 69 N 7.42 0.99 0.68 5.23 0.00 -1.20 -0.25 120.51 133.38 1x5d n ALA 69 Ca -0.03 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.54 1x5d n ALA 69 Cb 0.46 -1.00 0.30 0.00 0.00 0.00 0.00 19.45 19.21 1x5d n ALA 69 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1x5d n THR 70 N -1.51 0.36 0.00 0.00 -2.24 -1.26 -4.18 114.28 105.45 1x5d n THR 70 Ca -0.00 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 1x5d n THR 70 Cb 0.01 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 67.97 1x5d n THR 70 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1x5d n VAL 71 N -2.03 0.00 -2.96 2.28 0.31 0.54 -4.97 118.33 111.50 1x5d n VAL 71 Ca 0.05 0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 63.94 1x5d n VAL 71 Cb 0.41 -0.85 -0.05 0.00 -0.91 0.00 0.00 33.84 32.44 1x5d n VAL 71 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 1x5d s ASN 72 N -2.74 6.29 -0.14 4.52 0.01 0.66 -4.83 114.94 118.71 1x5d s ASN 72 Ca 0.00 -0.57 0.09 0.00 -0.71 0.00 0.00 52.86 51.67 1x5d s ASN 72 Cb 0.00 -2.38 -0.15 0.00 0.41 0.00 0.00 41.25 39.13 1x5d s ASN 72 CO 0.00 -1.10 -0.00 0.00 -1.51 0.00 0.00 177.10 174.49 1x5d n GLN 73 N 6.97 1.49 -0.32 -0.60 1.13 -1.26 -3.73 117.38 121.06 1x5d n GLN 73 Ca -0.01 0.02 -0.02 0.00 -1.94 0.00 0.00 57.00 55.05 1x5d n GLN 73 Cb 0.47 -1.34 0.15 0.00 0.11 0.00 0.00 30.24 29.62 1x5d n GLN 73 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 1x5d h VAL 74 N 0.00 1.24 0.00 5.09 2.07 -1.92 -1.35 116.25 121.39 1x5d h VAL 74 Ca -0.36 -0.47 -0.03 0.00 0.82 0.00 0.00 66.70 66.65 1x5d h VAL 74 Cb 1.76 -0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 31.45 1x5d h VAL 74 CO 0.00 0.24 -0.39 -0.07 0.02 0.00 0.00 177.57 177.37 1x5d h LEU 75 N 1.24 0.00 -1.15 2.57 3.38 -1.85 -3.18 115.31 116.31 1x5d h LEU 75 Ca 0.33 -0.13 0.36 0.00 0.09 0.00 0.00 57.88 58.54 1x5d h LEU 75 Cb -0.11 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 40.50 1x5d h LEU 75 CO -0.07 0.77 0.66 0.00 0.09 0.00 0.00 178.44 179.89 1x5d h ALA 76 N -0.87 2.24 0.00 1.53 0.00 -1.64 1.43 119.26 121.96 1x5d h ALA 76 Ca -0.04 0.17 -0.15 0.00 0.00 0.00 0.00 54.91 54.89 1x5d h ALA 76 Cb 0.47 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1x5d h ALA 76 CO -0.02 -0.87 -0.71 1.03 0.00 0.00 0.00 179.25 178.68 1x5d h SER 77 N 0.21 0.00 -0.22 0.00 0.87 -1.40 1.57 113.55 114.59 1x5d h SER 77 Ca 0.76 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 61.30 1x5d h SER 77 Cb 2.01 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.96 1x5d h SER 77 CO -0.55 0.71 0.04 -0.09 -0.53 0.00 0.00 176.83 176.42 1x5d h ARG 78 N 0.00 0.36 0.00 2.24 2.43 0.20 -3.25 114.38 116.35 1x5d h ARG 78 Ca -0.01 -0.09 -0.09 0.00 -0.81 0.00 0.00 59.98 58.98 1x5d h ARG 78 Cb 1.26 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.75 1x5d h ARG 78 CO 0.09 0.49 -1.78 0.66 -1.51 0.00 0.00 179.97 177.92 1x5d n TYR 79 N -4.74 0.35 -1.44 2.20 4.01 -0.75 -5.01 117.16 111.78 1x5d n TYR 79 Ca -0.04 0.11 0.00 0.00 -0.16 0.00 0.00 57.90 57.81 1x5d n TYR 79 Cb 0.18 -0.77 0.00 0.00 -0.31 0.00 0.00 39.34 38.44 1x5d n TYR 79 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1x5d n GLY 80 N 1.35 0.46 3.61 2.72 0.00 0.50 -5.02 105.19 108.81 1x5d n GLY 80 Ca -0.09 -0.35 -0.43 0.00 0.00 0.00 0.00 46.02 45.15 1x5d n GLY 80 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1x5d s ILE 81 N -2.45 4.34 0.00 -0.61 -1.09 0.11 -4.77 121.20 116.74 1x5d s ILE 81 Ca 0.00 1.30 0.00 0.00 -2.23 0.00 0.00 60.65 59.72 1x5d s ILE 81 Cb 0.00 -4.52 0.00 0.00 -1.58 0.00 0.00 42.46 36.36 1x5d s ILE 81 CO 0.00 -0.82 0.00 0.54 -1.23 0.00 0.00 174.94 173.43 1x5d n ARG 82 N 7.43 2.24 -3.62 2.79 1.74 -1.26 -4.87 116.66 121.11 1x5d n ARG 82 Ca 0.11 0.00 -0.40 0.00 -0.77 0.00 0.00 57.85 56.79 1x5d n ARG 82 Cb 0.48 -0.78 -0.11 0.00 -1.02 0.00 0.00 32.46 31.04 1x5d n ARG 82 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1x5d s GLY 83 N -2.03 1.94 0.15 -0.13 0.00 -1.26 -5.08 107.32 100.90 1x5d s GLY 83 Ca 0.00 -1.96 0.03 0.00 0.00 0.00 0.00 44.72 42.79 1x5d s GLY 83 CO 0.00 0.90 0.26 -1.36 0.00 0.00 0.00 173.10 172.90 1x5d s PHE 84 N 1.46 3.43 0.92 1.90 0.08 -1.26 -4.14 117.98 120.37 1x5d s PHE 84 Ca 0.02 0.10 -0.12 0.00 0.12 0.00 0.00 56.93 57.05 1x5d s PHE 84 Cb -0.21 -1.64 0.14 0.00 -0.57 0.00 0.00 43.02 40.73 1x5d s PHE 84 CO 0.04 0.52 1.09 -1.25 -0.10 0.00 0.00 175.22 175.52 1x5d s PRO 85 N -3.18 1.10 -0.23 0.24 0.04 -1.26 -4.98 135.00 126.72 1x5d s PRO 85 Ca 0.34 0.76 -0.04 0.00 0.04 0.00 0.00 61.00 62.10 1x5d s PRO 85 Cb -0.11 -1.80 0.09 0.00 0.04 0.00 0.00 34.50 32.73 1x5d s PRO 85 CO 0.28 -2.33 0.16 0.99 0.04 0.00 0.00 177.00 176.13 1x5d s THR 86 N -2.94 -0.17 -0.24 1.26 2.01 -0.05 -4.97 115.64 110.53 1x5d s THR 86 Ca 0.64 -0.40 -0.13 0.00 0.31 0.00 0.00 61.69 62.11 1x5d s THR 86 Cb -0.18 -0.79 -0.05 0.00 0.01 0.00 0.00 72.50 71.50 1x5d s THR 86 CO 0.57 -0.44 0.26 -0.63 -0.69 0.00 0.00 174.62 173.69 1x5d s ILE 87 N 2.19 5.28 -0.02 1.82 1.01 -1.26 -0.32 121.20 129.91 1x5d s ILE 87 Ca 0.06 0.38 0.04 0.00 0.00 0.00 0.00 60.65 61.13 1x5d s ILE 87 Cb -0.16 -3.60 -0.01 0.00 0.01 0.00 0.00 42.46 38.71 1x5d s ILE 87 CO -0.22 0.28 -0.13 -0.54 0.00 0.00 0.00 174.94 174.33 1x5d s LYS 88 N 1.39 1.11 -0.08 2.79 -0.14 0.54 -0.61 119.74 124.75 1x5d s LYS 88 Ca 0.12 -0.45 -0.02 0.00 -1.36 0.00 0.00 55.97 54.26 1x5d s LYS 88 Cb -0.15 -1.05 -0.03 0.00 -1.68 0.00 0.00 37.83 34.92 1x5d s LYS 88 CO 0.07 0.24 0.02 0.42 -0.76 0.00 0.00 175.35 175.35 1x5d s ILE 89 N -0.17 4.46 -0.20 2.17 1.09 -0.11 -1.61 121.20 126.83 1x5d s ILE 89 Ca 0.02 -0.24 -0.00 0.00 -1.10 0.00 0.00 60.65 59.33 1x5d s ILE 89 Cb -0.06 -2.90 0.05 0.00 -1.06 0.00 0.00 42.46 38.48 1x5d s ILE 89 CO -0.00 0.57 -0.04 -0.36 -0.10 0.00 0.00 174.94 175.01 1x5d s PHE 90 N -0.94 1.89 -0.81 3.97 0.40 -1.20 -0.18 117.98 121.10 1x5d s PHE 90 Ca 0.15 -1.33 0.02 0.00 -0.60 0.00 0.00 56.93 55.16 1x5d s PHE 90 Cb -0.11 -1.38 0.25 0.00 0.51 0.00 0.00 43.02 42.28 1x5d s PHE 90 CO 0.04 -0.68 0.92 1.04 0.70 0.00 0.00 175.22 177.24 1x5d n GLN 91 N 4.82 2.99 -0.99 0.44 6.02 -1.26 -3.08 117.38 126.32 1x5d n GLN 91 Ca -0.12 -4.59 -0.44 0.00 -0.01 0.00 0.00 57.00 51.84 1x5d n GLN 91 Cb 0.46 -2.36 -0.08 0.00 1.02 0.00 0.00 30.24 29.28 1x5d n GLN 91 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 1x5d n LYS 92 N 1.36 0.00 0.00 -1.09 4.81 -1.26 -2.83 118.16 119.15 1x5d n LYS 92 Ca 0.26 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.70 1x5d n LYS 92 Cb 0.38 -1.07 0.00 0.00 0.02 0.00 0.00 35.03 34.35 1x5d n LYS 92 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1x5d n GLY 93 N 4.69 2.33 0.56 3.14 0.00 -1.26 -4.99 105.19 109.67 1x5d n GLY 93 Ca 0.35 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1x5d n GLY 93 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1x5d n GLU 94 N 0.00 0.00 -3.64 1.61 1.02 -1.13 -5.16 120.64 113.34 1x5d n GLU 94 Ca 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 57.16 57.09 1x5d n GLU 94 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 31.36 1x5d n GLU 94 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1x5d s SER 95 N -1.21 -0.16 0.82 1.62 0.15 -1.26 -5.10 113.70 108.56 1x5d s SER 95 Ca 0.00 0.27 -0.11 0.00 0.70 0.00 0.00 55.95 56.81 1x5d s SER 95 Cb 0.00 0.26 0.09 0.00 -1.71 0.00 0.00 66.02 64.66 1x5d s SER 95 CO 0.00 -0.08 1.09 -2.16 1.20 0.00 0.00 173.24 173.29 1x5d s PRO 96 N -0.23 1.86 0.34 5.44 0.04 -1.26 -4.50 135.00 136.68 1x5d s PRO 96 Ca 0.06 1.03 0.06 0.00 0.04 0.00 0.00 61.00 62.19 1x5d s PRO 96 Cb -0.04 -1.86 -0.03 0.00 0.04 0.00 0.00 34.50 32.61 1x5d s PRO 96 CO -0.11 -1.88 0.23 0.14 0.04 0.00 0.00 177.00 175.42 1x5d s VAL 97 N -2.92 0.13 -0.15 -0.36 -7.23 0.74 -4.99 120.40 105.62 1x5d s VAL 97 Ca 0.62 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.79 1x5d s VAL 97 Cb -0.17 -2.46 0.02 0.00 0.56 0.00 0.00 36.38 34.33 1x5d s VAL 97 CO 0.56 0.00 -0.13 1.51 -0.31 0.00 0.00 175.10 176.74 1x5d s ASP 98 N -3.41 2.63 -0.17 4.85 -4.77 -1.26 -0.93 116.67 113.61 1x5d s ASP 98 Ca 0.37 -0.48 -0.29 0.00 -3.30 0.00 0.00 52.55 48.85 1x5d s ASP 98 Cb 0.03 -1.11 -0.02 0.00 -1.09 0.00 0.00 42.92 40.72 1x5d s ASP 98 CO 0.24 -0.08 1.36 -0.47 0.70 0.00 0.00 175.17 176.93 1x5d s TYR 99 N 1.53 2.61 -0.72 2.11 6.14 0.22 -4.95 117.35 124.28 1x5d s TYR 99 Ca 0.05 0.81 0.04 0.00 0.64 0.00 0.00 57.07 58.60 1x5d s TYR 99 Cb -0.13 -3.68 0.17 0.00 0.42 0.00 0.00 41.96 38.75 1x5d s TYR 99 CO -0.10 -2.17 0.52 0.34 0.64 0.00 0.00 175.55 174.78 1x5d s ASP 100 N 2.53 4.99 0.00 4.32 2.15 -1.26 -4.47 116.67 124.93 1x5d s ASP 100 Ca 0.59 -3.77 0.00 0.00 0.43 0.00 0.00 52.55 49.81 1x5d s ASP 100 Cb -0.23 -1.69 0.00 0.00 -0.30 0.00 0.00 42.92 40.70 1x5d s ASP 100 CO 0.20 -0.11 0.00 0.61 -0.17 0.00 0.00 175.17 175.69 1x5d n GLY 101 N 2.13 3.21 3.79 2.66 0.00 -1.26 -5.15 105.19 110.56 1x5d n GLY 101 Ca 0.19 -0.33 -0.36 0.00 0.00 0.00 0.00 46.02 45.51 1x5d n GLY 101 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1x5d s GLY 102 N 0.00 2.74 -0.28 -0.02 0.00 -1.26 -4.95 107.32 103.55 1x5d s GLY 102 Ca 0.00 0.53 0.09 0.00 0.00 0.00 0.00 44.72 45.33 1x5d s GLY 102 CO 0.00 0.95 1.66 -0.96 0.00 0.00 0.00 173.10 174.75 1x5d n ARG 103 N 0.34 3.45 -3.46 2.90 0.00 -1.26 -4.07 116.66 114.56 1x5d n ARG 103 Ca 0.03 -2.65 -0.37 0.00 -0.00 0.00 0.00 57.85 54.86 1x5d n ARG 103 Cb 0.50 -2.10 -0.07 0.00 -0.00 0.00 0.00 32.46 30.80 1x5d n ARG 103 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 1x5d s THR 104 N -2.63 5.26 0.32 8.89 -4.23 -1.26 -4.50 115.64 117.49 1x5d s THR 104 Ca 0.48 0.70 0.24 0.00 -1.18 0.00 0.00 61.69 61.92 1x5d s THR 104 Cb 0.38 -3.70 0.37 0.00 1.34 0.00 0.00 72.50 70.89 1x5d s THR 104 CO 0.12 0.37 1.11 -2.11 -0.54 0.00 0.00 174.62 173.56 1x5d n ARG 105 N 3.60 -0.02 0.36 3.99 1.85 -1.04 0.79 116.66 126.18 1x5d n ARG 105 Ca -0.10 0.88 -0.18 0.00 -1.00 0.00 0.00 57.85 57.44 1x5d n ARG 105 Cb 0.52 -1.75 -0.09 0.00 -1.05 0.00 0.00 32.46 30.08 1x5d n ARG 105 CO 0.00 0.00 0.00 0.77 -0.01 0.00 0.00 177.63 178.39 1x5d h SER 106 N 0.00 -1.16 0.22 2.89 0.02 -1.92 0.45 113.55 114.05 1x5d h SER 106 Ca 0.63 0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 61.64 1x5d h SER 106 Cb 2.08 0.35 0.00 0.00 0.14 0.00 0.00 62.40 64.98 1x5d h SER 106 CO -0.30 -0.66 -0.10 0.44 -1.14 0.00 0.00 176.83 175.07 1x5d h ASP 107 N -1.04 -0.25 -0.83 3.07 5.19 0.10 -0.72 116.42 121.94 1x5d h ASP 107 Ca -0.08 -0.27 0.21 0.00 -0.62 0.00 0.00 57.03 56.27 1x5d h ASP 107 Cb 0.86 0.06 -0.14 0.00 0.18 0.00 0.00 39.33 40.29 1x5d h ASP 107 CO 0.04 0.20 0.10 0.40 -3.12 0.00 0.00 179.24 176.86 1x5d h ILE 108 N -0.75 0.30 -0.07 0.35 2.04 -1.22 0.38 117.51 118.53 1x5d h ILE 108 Ca -0.03 -0.05 -0.05 0.00 1.00 0.00 0.00 64.86 65.73 1x5d h ILE 108 Cb 0.50 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 36.73 1x5d h ILE 108 CO 0.05 0.02 -0.15 0.58 0.00 0.00 0.00 178.15 178.65 1x5d h VAL 109 N 0.14 1.42 -1.00 1.67 2.07 -0.92 -2.46 116.25 117.16 1x5d h VAL 109 Ca 0.49 -1.47 0.23 0.00 0.82 0.00 0.00 66.70 66.77 1x5d h VAL 109 Cb 0.93 2.22 -0.10 0.00 -1.52 0.00 0.00 31.29 32.82 1x5d h VAL 109 CO -0.69 0.41 0.63 -1.28 0.02 0.00 0.00 177.57 176.66 1x5d h SER 110 N -0.27 0.58 0.20 0.57 0.87 0.47 -1.22 113.55 114.76 1x5d h SER 110 Ca 0.00 0.09 -0.01 0.00 -1.23 0.00 0.00 61.79 60.64 1x5d h SER 110 Cb 0.74 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.69 1x5d h SER 110 CO 0.03 0.16 -0.10 -0.09 -0.53 0.00 0.00 176.83 176.30 1x5d h ARG 111 N 0.54 -0.26 -1.12 2.24 9.65 -0.98 -3.26 114.38 121.19 1x5d h ARG 111 Ca 0.58 0.02 0.35 0.00 -1.10 0.00 0.00 59.98 59.82 1x5d h ARG 111 Cb 1.22 0.06 -0.13 0.00 -1.39 0.00 0.00 29.97 29.74 1x5d h ARG 111 CO -0.34 0.09 0.69 0.00 2.80 0.00 0.00 179.97 183.21 1x5d h ALA 112 N -0.56 2.29 -0.91 2.80 0.00 -0.89 0.59 119.26 122.59 1x5d h ALA 112 Ca -0.03 0.13 0.03 0.00 0.00 0.00 0.00 54.91 55.05 1x5d h ALA 112 Cb 0.47 0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.35 1x5d h ALA 112 CO 0.05 -0.86 0.59 -0.07 0.00 0.00 0.00 179.25 178.96 1x5d h LEU 113 N 0.26 0.99 -0.96 0.00 3.38 -1.29 -0.72 115.31 116.97 1x5d h LEU 113 Ca 0.73 -0.01 0.08 0.00 0.09 0.00 0.00 57.88 58.77 1x5d h LEU 113 Cb 1.94 -0.23 -0.07 0.00 0.09 0.00 0.00 40.66 42.39 1x5d h LEU 113 CO -0.47 0.68 0.60 -0.78 0.09 0.00 0.00 178.44 178.57 1x5d h ASP 114 N 1.15 0.94 -0.11 -0.43 3.58 0.15 -2.01 116.42 119.69 1x5d h ASP 114 Ca 0.36 0.02 -0.15 0.00 0.42 0.00 0.00 57.03 57.68 1x5d h ASP 114 Cb -0.01 -0.17 0.01 0.00 1.72 0.00 0.00 39.33 40.87 1x5d h ASP 114 CO -0.11 0.57 -0.50 -0.07 -2.88 0.00 0.00 179.24 176.24 1x5d h LEU 115 N 1.06 0.63 -1.09 2.28 3.38 -1.29 -3.21 115.31 117.07 1x5d h LEU 115 Ca 0.43 -0.64 0.18 0.00 0.09 0.00 0.00 57.88 57.95 1x5d h LEU 115 Cb 0.26 -0.19 -0.10 0.00 0.09 0.00 0.00 40.66 40.73 1x5d h LEU 115 CO -0.20 1.17 0.61 0.15 0.09 0.00 0.00 178.44 180.26 1x5d h PHE 116 N 0.14 1.01 -0.38 1.13 3.57 -0.63 0.46 116.94 122.23 1x5d h PHE 116 Ca -0.03 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.38 1x5d h PHE 116 Cb 1.15 -0.31 -0.07 0.00 2.79 0.00 0.00 35.95 39.51 1x5d h PHE 116 CO 0.11 0.26 0.16 0.43 -2.23 0.00 0.00 178.31 177.04 1x5d n SER 117 N -4.70 3.32 0.00 0.41 7.64 -0.80 -1.64 113.62 117.85 1x5d n SER 117 Ca 0.22 -2.61 0.00 0.00 1.01 0.00 0.00 58.87 57.49 1x5d n SER 117 Cb 0.55 -0.63 0.00 0.00 -1.01 0.00 0.00 64.21 63.13 1x5d n SER 117 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1x5d n ASP 118 N 0.01 2.20 0.00 6.43 -0.08 0.15 -4.92 116.55 120.33 1x5d n ASP 118 Ca 0.21 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.49 1x5d n ASP 118 Cb 0.88 0.18 0.00 0.00 2.34 0.00 0.00 41.12 44.52 1x5d n ASP 118 CO 0.00 0.00 0.00 -0.46 0.12 0.00 0.00 177.20 176.86 1x5d n ASN 119 N -1.36 3.77 -4.71 1.67 6.94 -0.42 -5.07 115.26 116.09 1x5d n ASN 119 Ca 0.00 0.00 -0.31 0.00 -0.02 0.00 0.00 54.58 54.25 1x5d n ASN 119 Cb 0.23 0.02 0.14 0.00 -2.36 0.00 0.00 39.78 37.81 1x5d n ASN 119 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1x5d s ALA 120 N -1.93 1.70 0.46 -2.53 0.00 -0.65 -4.98 121.76 113.82 1x5d s ALA 120 Ca 0.00 0.36 -0.23 0.00 0.00 0.00 0.00 51.96 52.09 1x5d s ALA 120 Cb 0.00 -3.34 -0.07 0.00 0.00 0.00 0.00 23.12 19.70 1x5d s ALA 120 CO 0.00 -2.37 1.17 -1.25 0.00 0.00 0.00 175.76 173.31 1x5d s PRO 121 N -4.77 3.77 0.01 0.00 0.04 -1.26 -4.77 135.00 128.02 1x5d s PRO 121 Ca 0.64 1.78 -0.30 0.00 0.04 0.00 0.00 61.00 63.16 1x5d s PRO 121 Cb -0.20 -2.42 -0.06 0.00 0.04 0.00 0.00 34.50 31.86 1x5d s PRO 121 CO 0.57 -0.55 1.44 -1.25 0.04 0.00 0.00 177.00 177.26 1x5d s PRO 122 N -2.68 4.27 -0.04 0.56 0.04 -1.26 -4.97 135.00 130.91 1x5d s PRO 122 Ca 0.63 2.02 -0.30 0.00 0.04 0.00 0.00 61.00 63.40 1x5d s PRO 122 Cb -0.29 -3.57 -0.05 0.00 0.04 0.00 0.00 34.50 30.63 1x5d s PRO 122 CO 0.35 -0.60 1.49 -1.25 0.04 0.00 0.00 177.00 177.02 1x5d s PRO 123 N 2.42 4.23 1.06 0.56 0.04 -1.26 -4.99 135.00 137.06 1x5d s PRO 123 Ca 0.65 2.02 -0.18 0.00 0.04 0.00 0.00 61.00 63.53 1x5d s PRO 123 Cb -0.33 -3.75 0.04 0.00 0.04 0.00 0.00 34.50 30.50 1x5d s PRO 123 CO 0.27 -0.71 -0.16 -0.85 0.04 0.00 0.00 177.00 175.60 1x5d n GLU 124 N 6.22 -1.02 -2.13 4.56 0.28 -1.26 -4.86 120.64 122.43 1x5d n GLU 124 Ca 0.15 -0.28 -0.42 0.00 -0.16 0.00 0.00 57.16 56.46 1x5d n GLU 124 Cb 0.43 -1.60 -0.03 0.00 1.43 0.00 0.00 31.44 31.67 1x5d n GLU 124 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 1x5d s LEU 125 N 0.51 4.40 -0.23 -1.84 1.02 -1.26 -5.02 118.68 116.26 1x5d s LEU 125 Ca 0.53 2.48 -0.13 0.00 0.02 0.00 0.00 54.13 57.02 1x5d s LEU 125 Cb -0.11 -3.61 0.07 0.00 0.02 0.00 0.00 46.19 42.56 1x5d s LEU 125 CO 0.67 -0.62 0.56 -0.22 0.02 0.00 0.00 176.35 176.76 1x5d s LEU 126 N 0.13 -0.50 -0.03 1.79 2.96 -1.26 -5.06 118.68 116.71 1x5d s LEU 126 Ca 0.60 1.21 -0.02 0.00 -0.22 0.00 0.00 54.13 55.69 1x5d s LEU 126 Cb -0.39 1.89 -0.02 0.00 0.50 0.00 0.00 46.19 48.18 1x5d s LEU 126 CO 0.38 -0.22 -0.06 1.21 -1.32 0.00 0.00 176.35 176.34 1x5d n GLU 127 N 4.14 0.10 -3.66 1.98 0.00 -1.26 -5.07 120.64 116.86 1x5d n GLU 127 Ca -0.21 0.04 -0.07 0.00 0.00 0.00 0.00 57.16 56.92 1x5d n GLU 127 Cb 0.57 -0.66 -0.08 0.00 0.00 0.00 0.00 31.44 31.27 1x5d n GLU 127 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 1x5d s SER 128 N -5.49 -0.81 -0.05 4.31 0.15 -1.26 -5.07 113.70 105.48 1x5d s SER 128 Ca -0.06 1.32 -0.09 0.00 0.70 0.00 0.00 55.95 57.82 1x5d s SER 128 Cb 0.02 1.36 -0.05 0.00 -1.71 0.00 0.00 66.02 65.65 1x5d s SER 128 CO 0.08 -0.22 0.40 1.23 1.20 0.00 0.00 173.24 175.92 1x5d h GLY 129 N 7.28 -0.33 0.74 9.45 0.00 -2.01 -3.28 103.07 114.92 1x5d h GLY 129 Ca -0.29 0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.16 1x5d h GLY 129 CO 0.18 -0.12 0.00 -1.55 0.00 0.00 0.00 176.54 175.05 1x5d n PRO 130 N -4.57 0.49 -0.25 4.80 -0.04 -1.26 -4.02 135.00 130.15 1x5d n PRO 130 Ca -0.04 0.00 0.22 0.00 -0.04 0.00 0.00 63.50 63.64 1x5d n PRO 130 Cb 0.12 -1.37 0.41 0.00 -0.04 0.00 0.00 33.50 32.62 1x5d n PRO 130 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1x5d n SER 131 N -0.87 0.20 0.00 3.54 3.41 -1.24 -3.84 113.62 114.82 1x5d n SER 131 Ca 0.09 1.26 0.00 0.00 -0.26 0.00 0.00 58.87 59.96 1x5d n SER 131 Cb 0.04 -0.59 0.00 0.00 -0.26 0.00 0.00 64.21 63.40 1x5d n SER 131 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1x5d n SER 132 N -4.77 0.01 0.00 4.04 3.41 -1.26 -5.16 113.62 109.89 1x5d n SER 132 Ca 0.27 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.88 1x5d n SER 132 Cb 0.91 -0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.85 1x5d n SER 132 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49