#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5d s SER 2 N 0.00 4.46 -0.18 1.61 0.01 -1.26 -5.08 113.70 113.26 1x5d s SER 2 Ca 0.00 -1.91 -0.29 0.00 1.31 0.00 0.00 55.95 55.07 1x5d s SER 2 Cb 0.00 -1.35 0.12 0.00 0.21 0.00 0.00 66.02 64.99 1x5d s SER 2 CO 0.00 -0.38 0.96 -0.44 0.41 0.00 0.00 173.24 173.80 1x5d s SER 3 N 1.17 -0.43 -0.28 2.44 0.01 -1.26 -4.91 113.70 110.43 1x5d s SER 3 Ca 0.09 0.59 0.07 0.00 1.31 0.00 0.00 55.95 58.01 1x5d s SER 3 Cb -0.18 0.51 0.46 0.00 0.21 0.00 0.00 66.02 67.01 1x5d s SER 3 CO -0.13 -0.32 1.19 0.61 0.41 0.00 0.00 173.24 175.00 1x5d n GLY 4 N 1.18 6.31 3.27 3.44 0.00 -1.14 -4.86 105.19 113.39 1x5d n GLY 4 Ca -0.12 -2.57 -0.22 0.00 0.00 0.00 0.00 46.02 43.12 1x5d n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1x5d n SER 5 N -0.74 -5.96 -3.23 1.61 7.64 -1.26 -4.97 113.62 106.71 1x5d n SER 5 Ca 0.42 -0.43 0.04 0.00 1.01 0.00 0.00 58.87 59.91 1x5d n SER 5 Cb 0.95 -4.64 -0.03 0.00 -1.01 0.00 0.00 64.21 59.48 1x5d n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1x5d s SER 6 N -3.13 -0.32 0.00 6.43 0.01 -1.26 -5.13 113.70 110.30 1x5d s SER 6 Ca 0.47 0.34 0.00 0.00 1.31 0.00 0.00 55.95 58.06 1x5d s SER 6 Cb -0.20 1.32 0.00 0.00 0.21 0.00 0.00 66.02 67.35 1x5d s SER 6 CO 0.58 -0.06 0.00 0.61 0.41 0.00 0.00 173.24 174.77 1x5d n GLY 7 N 5.03 0.76 2.00 3.44 0.00 -1.26 -1.93 105.19 113.24 1x5d n GLY 7 Ca -0.08 -0.34 -0.14 0.00 0.00 0.00 0.00 46.02 45.47 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 -2.31 4.13 -4.71 1.61 2.03 -1.26 -4.69 116.55 111.35 1x5d n ASP 8 Ca 0.00 -3.27 -0.42 0.00 0.52 0.00 0.00 54.79 51.62 1x5d n ASP 8 Cb 0.00 -0.77 -0.03 0.00 -0.72 0.00 0.00 41.12 39.60 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 -2.85 3.59 -0.09 5.18 1.01 -0.81 -4.79 120.40 121.63 1x5d s VAL 9 Ca 0.50 1.12 -0.13 0.00 0.00 0.00 0.00 61.98 63.48 1x5d s VAL 9 Cb 0.41 -3.72 -0.05 0.00 0.00 0.00 0.00 36.38 33.03 1x5d s VAL 9 CO 0.11 0.08 0.30 -0.63 0.00 0.00 0.00 175.10 174.96 1x5d s ILE 10 N 1.25 5.26 -0.21 2.22 1.01 -0.82 -2.89 121.20 127.01 1x5d s ILE 10 Ca 0.63 0.57 -0.11 0.00 0.00 0.00 0.00 60.65 61.74 1x5d s ILE 10 Cb -0.34 -3.61 -0.05 0.00 0.01 0.00 0.00 42.46 38.48 1x5d s ILE 10 CO 0.29 0.51 0.16 -0.70 0.00 0.00 0.00 174.94 175.20 1x5d s GLU 11 N -0.42 4.16 0.31 2.79 2.12 -1.26 0.27 118.70 126.67 1x5d s GLU 11 Ca 0.19 -0.20 0.10 0.00 0.36 0.00 0.00 54.97 55.41 1x5d s GLU 11 Cb -0.14 -3.46 -0.06 0.00 0.26 0.00 0.00 34.13 30.73 1x5d s GLU 11 CO 0.07 0.21 -0.12 -0.51 -0.54 0.00 0.00 175.26 174.38 1x5d s LEU 12 N 0.61 2.65 0.45 2.70 1.43 -1.20 -4.99 118.68 120.33 1x5d s LEU 12 Ca 0.09 -1.15 0.03 0.00 -1.03 0.00 0.00 54.13 52.07 1x5d s LEU 12 Cb -0.12 -0.95 -0.02 0.00 0.03 0.00 0.00 46.19 45.13 1x5d s LEU 12 CO 0.01 -0.17 0.09 0.42 0.23 0.00 0.00 176.35 176.93 1x5d s THR 13 N -2.67 0.75 0.63 5.49 -4.23 -1.25 -4.81 115.64 109.55 1x5d s THR 13 Ca 0.31 -2.00 0.36 0.00 -1.18 0.00 0.00 61.69 59.18 1x5d s THR 13 Cb 0.01 -2.26 0.39 0.00 1.34 0.00 0.00 72.50 71.98 1x5d s THR 13 CO 0.15 0.00 2.26 0.44 -0.54 0.00 0.00 174.62 176.93 1x5d h ASP 14 N 1.62 0.00 0.00 3.99 3.32 -1.98 0.30 116.42 123.67 1x5d h ASP 14 Ca -0.38 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.61 1x5d h ASP 14 Cb 1.29 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.83 1x5d h ASP 14 CO 0.62 0.00 -1.48 0.47 -1.72 0.00 0.00 179.24 177.12 1x5d n ASP 15 N -3.42 2.89 -1.77 6.45 9.92 -1.26 -4.51 116.55 124.85 1x5d n ASP 15 Ca -0.02 0.00 0.08 0.00 -0.53 0.00 0.00 54.79 54.32 1x5d n ASP 15 Cb 0.14 1.16 0.39 0.00 -0.64 0.00 0.00 41.12 42.16 1x5d n ASP 15 CO 0.00 0.00 0.00 -0.24 0.13 0.00 0.00 177.20 177.09 1x5d n SER 16 N -2.01 5.31 -0.10 -2.24 2.88 -0.86 -3.96 113.62 112.64 1x5d n SER 16 Ca -0.06 -2.69 -0.10 0.00 -1.33 0.00 0.00 58.87 54.68 1x5d n SER 16 Cb 0.44 -0.64 -0.15 0.00 -0.75 0.00 0.00 64.21 63.11 1x5d n SER 16 CO 0.00 0.00 0.00 0.33 -1.23 0.00 0.00 175.04 174.14 1x5d n PHE 17 N 0.91 0.00 -0.10 0.66 -0.00 1.00 -3.91 117.46 116.02 1x5d n PHE 17 Ca 0.27 0.00 -0.19 0.00 -0.00 0.00 0.00 57.45 57.54 1x5d n PHE 17 Cb 1.06 -0.98 -0.09 0.00 -0.00 0.00 0.00 39.48 39.47 1x5d n PHE 17 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.76 176.51 1x5d n ASP 18 N -2.77 1.87 0.00 -2.13 9.92 -1.26 -2.81 116.55 119.37 1x5d n ASP 18 Ca -0.33 0.45 0.02 0.00 -0.53 0.00 0.00 54.79 54.40 1x5d n ASP 18 Cb 1.14 -0.91 0.08 0.00 -0.64 0.00 0.00 41.12 40.79 1x5d n ASP 18 CO 0.00 0.00 0.00 2.29 0.13 0.00 0.00 177.20 179.62 1x5d n LYS 19 N -4.45 0.01 -0.05 -1.24 2.85 -1.25 0.92 118.16 114.95 1x5d n LYS 19 Ca -0.29 0.39 -0.01 0.00 -1.05 0.00 0.00 58.31 57.35 1x5d n LYS 19 Cb 0.61 -1.50 -0.12 0.00 -0.65 0.00 0.00 35.03 33.38 1x5d n LYS 19 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1x5d n ASN 20 N -1.45 1.43 -0.09 -5.58 3.02 -1.26 -4.10 115.26 107.23 1x5d n ASN 20 Ca 0.01 0.00 -0.13 0.00 -0.03 0.00 0.00 54.58 54.43 1x5d n ASN 20 Cb 0.04 1.19 -0.04 0.00 -0.61 0.00 0.00 39.78 40.36 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 -2.34 1.46 0.22 2.41 0.31 -0.41 -4.39 118.33 115.58 1x5d n VAL 21 Ca -0.15 0.03 0.05 0.00 -0.01 0.00 0.00 64.34 64.25 1x5d n VAL 21 Cb 0.75 -2.17 0.47 0.00 -0.91 0.00 0.00 33.84 31.98 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 -0.91 0.00 0.00 7.52 3.38 0.32 -1.20 115.31 124.42 1x5d h LEU 22 Ca -0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1x5d h LEU 22 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 1x5d h LEU 22 CO -0.10 0.22 0.00 -0.67 0.09 0.00 0.00 178.44 177.98 1x5d n ASP 23 N -4.28 0.00 -3.97 -0.43 2.03 -1.06 -4.70 116.55 104.13 1x5d n ASP 23 Ca -0.02 -1.42 -0.17 0.00 0.52 0.00 0.00 54.79 53.69 1x5d n ASP 23 Cb 0.28 0.00 -0.15 0.00 -0.72 0.00 0.00 41.12 40.53 1x5d n ASP 23 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 1x5d s SER 24 N -1.42 0.82 -0.15 1.67 0.15 -0.45 -4.98 113.70 109.34 1x5d s SER 24 Ca 0.13 -0.12 0.04 0.00 0.70 0.00 0.00 55.95 56.69 1x5d s SER 24 Cb 0.06 -0.13 0.32 0.00 -1.71 0.00 0.00 66.02 64.55 1x5d s SER 24 CO 0.10 0.07 1.24 -0.62 1.20 0.00 0.00 173.24 175.22 1x5d n GLU 25 N 3.05 2.04 -4.31 5.44 4.71 -1.26 -4.80 120.64 125.51 1x5d n GLU 25 Ca -0.15 -1.32 -0.24 0.00 -0.01 0.00 0.00 57.16 55.44 1x5d n GLU 25 Cb 0.57 -1.65 -0.08 0.00 -1.01 0.00 0.00 31.44 29.27 1x5d n GLU 25 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 1x5d s ASP 26 N -0.14 4.35 0.07 1.62 1.01 -1.26 -4.80 116.67 117.52 1x5d s ASP 26 Ca 0.24 -0.66 -0.31 0.00 0.71 0.00 0.00 52.55 52.53 1x5d s ASP 26 Cb 0.19 -0.75 -0.06 0.00 1.01 0.00 0.00 42.92 43.31 1x5d s ASP 26 CO 0.06 0.04 1.30 -0.69 0.21 0.00 0.00 175.17 176.08 1x5d s VAL 27 N -2.13 3.73 -0.26 -1.27 1.01 -1.25 -4.72 120.40 115.51 1x5d s VAL 27 Ca 0.29 1.22 0.02 0.00 0.00 0.00 0.00 61.98 63.51 1x5d s VAL 27 Cb -0.07 -3.78 0.05 0.00 0.00 0.00 0.00 36.38 32.58 1x5d s VAL 27 CO 0.18 0.08 -0.10 0.26 0.00 0.00 0.00 175.10 175.52 1x5d s TRP 28 N 1.29 3.21 -0.41 5.22 0.52 -1.15 -0.97 118.94 126.65 1x5d s TRP 28 Ca 0.61 -2.15 -0.25 0.00 0.02 0.00 0.00 56.10 54.34 1x5d s TRP 28 Cb -0.32 -1.96 0.02 0.00 -1.15 0.00 0.00 33.47 30.05 1x5d s TRP 28 CO 0.29 -0.85 0.88 -1.64 0.02 0.00 0.00 176.95 175.64 1x5d s MET 29 N 1.15 3.67 -0.39 4.98 -1.94 -0.03 -2.78 119.30 123.96 1x5d s MET 29 Ca -0.07 0.31 -0.14 0.00 -1.71 0.00 0.00 55.69 54.08 1x5d s MET 29 Cb -0.19 -3.86 0.02 0.00 2.01 0.00 0.00 34.83 32.81 1x5d s MET 29 CO -0.05 -1.04 0.27 0.08 -0.01 0.00 0.00 175.02 174.27 1x5d s VAL 30 N 3.47 5.09 -0.40 -6.03 1.01 -0.66 -0.10 120.40 122.78 1x5d s VAL 30 Ca 0.35 -0.66 -0.07 0.00 0.00 0.00 0.00 61.98 61.60 1x5d s VAL 30 Cb -0.12 -3.81 0.08 0.00 0.00 0.00 0.00 36.38 32.53 1x5d s VAL 30 CO 0.21 -0.26 0.21 -0.70 0.00 0.00 0.00 175.10 174.56 1x5d s GLU 31 N 1.65 2.45 -0.06 2.72 2.56 -0.64 -1.62 118.70 125.76 1x5d s GLU 31 Ca 0.04 -1.50 -0.30 0.00 0.00 0.00 0.00 54.97 53.21 1x5d s GLU 31 Cb -0.19 -3.65 -0.03 0.00 2.00 0.00 0.00 34.13 32.26 1x5d s GLU 31 CO 0.09 -0.93 1.24 -0.06 -0.56 0.00 0.00 175.26 175.05 1x5d s PHE 32 N 1.34 3.10 0.14 5.30 0.40 -0.07 -2.47 117.98 125.72 1x5d s PHE 32 Ca 0.03 1.13 0.02 0.00 -0.60 0.00 0.00 56.93 57.50 1x5d s PHE 32 Cb -0.22 -3.47 -0.04 0.00 0.51 0.00 0.00 43.02 39.79 1x5d s PHE 32 CO 0.00 -1.54 -0.02 1.52 0.70 0.00 0.00 175.22 175.88 1x5d s TYR 33 N 2.37 1.05 -0.03 0.36 -0.85 -0.24 -2.03 117.35 117.99 1x5d s TYR 33 Ca 0.57 -1.00 0.06 0.00 -0.52 0.00 0.00 57.07 56.19 1x5d s TYR 33 Cb -0.26 -0.60 -0.01 0.00 0.38 0.00 0.00 41.96 41.47 1x5d s TYR 33 CO 0.22 -0.21 -0.22 0.00 -1.52 0.00 0.00 175.55 173.82 1x5d s ALA 34 N -3.68 1.83 -0.49 9.51 0.00 -1.26 -2.95 121.76 124.72 1x5d s ALA 34 Ca 0.19 -0.92 0.23 0.00 0.00 0.00 0.00 51.96 51.46 1x5d s ALA 34 Cb 0.06 -0.50 0.97 0.00 0.00 0.00 0.00 23.12 23.65 1x5d s ALA 34 CO 0.00 0.42 1.70 -0.35 0.00 0.00 0.00 175.76 177.53 1x5d n PRO 35 N 2.69 0.19 -0.13 0.00 -0.04 -1.26 -2.13 135.00 134.31 1x5d n PRO 35 Ca -0.16 0.42 0.06 0.00 -0.04 0.00 0.00 63.50 63.78 1x5d n PRO 35 Cb 0.52 -1.86 0.13 0.00 -0.04 0.00 0.00 33.50 32.25 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 -2.22 0.35 -3.90 0.54 4.27 -1.26 -4.96 117.44 110.26 1x5d n TRP 36 Ca 0.02 -0.37 -0.35 0.00 -3.89 0.00 0.00 57.50 52.91 1x5d n TRP 36 Cb 0.22 -0.02 -0.10 0.00 -1.36 0.00 0.00 31.31 30.05 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 7.14 -0.93 -0.94 0.00 0.00 -1.93 -2.59 103.07 103.82 1x5d h GLY 38 Ca -0.37 0.37 0.36 0.00 0.00 0.00 0.00 47.33 47.69 1x5d h GLY 38 CO 0.67 -0.34 0.39 1.42 0.00 0.00 0.00 176.54 178.68 1x5d n HIS 39 N -5.48 0.98 0.10 5.60 8.25 -1.26 0.35 115.22 123.76 1x5d n HIS 39 Ca -0.13 1.12 -0.13 0.00 -0.26 0.00 0.00 57.72 58.32 1x5d n HIS 39 Cb 0.37 -1.44 -0.08 0.00 1.12 0.00 0.00 29.99 29.95 1x5d n HIS 39 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1x5d h LYS 41 N -0.62 0.21 0.00 0.00 1.79 0.27 1.19 116.57 119.41 1x5d h LYS 41 Ca -0.03 -0.01 -0.16 0.00 -2.18 0.00 0.00 60.65 58.27 1x5d h LYS 41 Cb 0.45 -0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 31.03 1x5d h LYS 41 CO 0.04 0.14 -0.76 -2.95 -1.08 0.00 0.00 179.45 174.84 1x5d h ASN 42 N 0.21 0.00 1.90 0.86 7.08 -1.31 -3.10 115.58 121.22 1x5d h ASN 42 Ca 0.55 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.77 1x5d h ASN 42 Cb 1.12 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.36 1x5d h ASN 42 CO -0.65 0.76 0.00 0.25 -2.08 0.00 0.00 177.43 175.71 1x5d h LEU 43 N 0.00 0.00 -0.83 6.14 5.85 0.18 -3.35 115.31 123.31 1x5d h LEU 43 Ca -0.01 0.00 0.09 0.00 0.84 0.00 0.00 57.88 58.81 1x5d h LEU 43 Cb 1.41 0.00 -0.12 0.00 0.37 0.00 0.00 40.66 42.33 1x5d h LEU 43 CO 0.10 0.00 -0.52 -0.08 -0.34 0.00 0.00 178.44 177.59 1x5d h GLU 44 N 0.00 -0.10 -0.24 1.25 4.81 0.12 0.38 114.58 120.79 1x5d h GLU 44 Ca 0.00 0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 59.14 1x5d h GLU 44 Cb 0.95 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 30.35 1x5d h GLU 44 CO 0.00 -0.07 -0.24 -1.00 -0.73 0.00 0.00 179.01 176.97 1x5d h PRO 45 N -0.11 0.59 -0.53 0.92 0.13 -1.78 -1.45 132.00 129.78 1x5d h PRO 45 Ca 0.18 -0.31 0.12 0.00 -0.87 0.00 0.00 66.00 65.12 1x5d h PRO 45 Cb 0.50 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 31.61 1x5d h PRO 45 CO -0.85 0.91 0.37 0.93 -0.23 0.00 0.00 178.00 179.13 1x5d h GLU 46 N 0.30 0.15 0.05 0.86 3.07 -1.42 -0.47 114.58 117.12 1x5d h GLU 46 Ca 0.04 -0.01 -0.29 0.00 -0.50 0.00 0.00 59.36 58.60 1x5d h GLU 46 Cb 0.80 -0.03 -0.03 0.00 -0.84 0.00 0.00 28.75 28.64 1x5d h GLU 46 CO 0.06 0.10 -1.59 2.35 -1.40 0.00 0.00 179.01 178.53 1x5d h TRP 47 N 0.16 0.18 0.02 4.33 2.91 -0.20 -3.07 115.95 120.27 1x5d h TRP 47 Ca 0.25 -0.13 -0.00 0.00 1.13 0.00 0.00 58.89 60.14 1x5d h TRP 47 Cb 0.78 -0.01 0.00 0.00 -0.51 0.00 0.00 29.16 29.42 1x5d h TRP 47 CO -0.00 1.20 -0.01 0.00 -1.03 0.00 0.00 178.44 178.60 1x5d h ALA 48 N 0.75 -0.03 -0.12 2.65 0.00 -0.06 -2.15 119.26 120.31 1x5d h ALA 48 Ca -0.25 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 1x5d h ALA 48 Cb 1.98 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.77 1x5d h ALA 48 CO 0.11 -0.42 0.04 0.00 0.00 0.00 0.00 179.25 178.97 1x5d h ALA 49 N 0.77 0.16 -0.83 0.00 0.00 -1.31 -2.97 119.26 115.07 1x5d h ALA 49 Ca -0.00 -0.12 0.16 0.00 0.00 0.00 0.00 54.91 54.94 1x5d h ALA 49 Cb 0.20 -0.05 -0.10 0.00 0.00 0.00 0.00 17.79 17.85 1x5d h ALA 49 CO 0.00 -0.23 0.39 0.00 0.00 0.00 0.00 179.25 179.42 1x5d h ALA 50 N 0.85 1.25 -0.92 0.00 0.00 -1.54 0.14 119.26 119.03 1x5d h ALA 50 Ca 0.04 0.11 0.10 0.00 0.00 0.00 0.00 54.91 55.15 1x5d h ALA 50 Cb 0.22 0.04 -0.07 0.00 0.00 0.00 0.00 17.79 17.99 1x5d h ALA 50 CO -0.00 -0.16 0.59 0.00 0.00 0.00 0.00 179.25 179.68 1x5d h ALA 51 N 1.58 1.60 0.11 0.00 0.00 -1.22 0.36 119.26 121.69 1x5d h ALA 51 Ca 0.47 -0.00 -0.25 0.00 0.00 0.00 0.00 54.91 55.12 1x5d h ALA 51 Cb 0.71 -0.22 0.03 0.00 0.00 0.00 0.00 17.79 18.31 1x5d h ALA 51 CO -0.40 0.22 -1.05 1.03 0.00 0.00 0.00 179.25 179.05 1x5d h SER 52 N 0.93 0.73 0.55 0.00 0.87 -0.83 -1.70 113.55 114.10 1x5d h SER 52 Ca 0.42 -0.84 -0.04 0.00 -1.23 0.00 0.00 61.79 60.10 1x5d h SER 52 Cb 0.39 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.11 1x5d h SER 52 CO -0.19 1.50 -0.18 -0.08 -0.53 0.00 0.00 176.83 177.36 1x5d h GLU 53 N 0.06 0.00 0.04 2.24 4.57 -0.28 -1.41 114.58 119.80 1x5d h GLU 53 Ca -0.16 0.00 -0.17 0.00 -1.18 0.00 0.00 59.36 57.85 1x5d h GLU 53 Cb 1.76 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 30.34 1x5d h GLU 53 CO 0.20 0.18 -0.88 0.28 -1.18 0.00 0.00 179.01 177.60 1x5d h VAL 54 N 0.00 1.25 0.00 0.32 2.07 -0.33 -3.02 116.25 116.54 1x5d h VAL 54 Ca -0.00 -2.30 -0.00 0.00 0.82 0.00 0.00 66.70 65.21 1x5d h VAL 54 Cb 0.50 2.76 -0.00 0.00 -1.52 0.00 0.00 31.29 33.03 1x5d h VAL 54 CO 0.02 0.52 -0.02 0.07 0.02 0.00 0.00 177.57 178.18 1x5d h LYS 55 N -0.79 0.00 0.00 1.57 2.10 -1.26 0.40 116.57 118.60 1x5d h LYS 55 Ca -0.22 0.00 -0.26 0.00 -2.00 0.00 0.00 60.65 58.17 1x5d h LYS 55 Cb 1.34 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 32.63 1x5d h LYS 55 CO -0.06 0.02 -1.43 1.05 -2.00 0.00 0.00 179.45 177.03 1x5d h GLU 56 N 0.00 0.01 0.00 0.07 -0.00 -1.37 0.65 114.58 113.93 1x5d h GLU 56 Ca -0.00 -0.01 -0.19 0.00 -0.00 0.00 0.00 59.36 59.16 1x5d h GLU 56 Cb 0.27 0.00 -0.03 0.00 -0.00 0.00 0.00 28.75 28.99 1x5d h GLU 56 CO 0.00 0.70 -1.44 1.96 -0.00 0.00 0.00 179.01 180.23 1x5d h GLN 57 N 0.00 0.00 -0.39 1.06 4.20 -1.24 -3.33 115.11 115.42 1x5d h GLN 57 Ca -0.18 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.53 1x5d h GLN 57 Cb 1.92 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.70 1x5d h GLN 57 CO 0.10 0.33 0.00 0.25 -0.67 0.00 0.00 178.83 178.85 1x5d n THR 58 N -2.93 0.50 -2.15 -0.54 -2.24 0.14 -4.94 114.28 102.11 1x5d n THR 58 Ca -0.11 -0.73 -0.19 0.00 -2.27 0.00 0.00 64.05 60.75 1x5d n THR 58 Cb 0.88 0.94 -0.03 0.00 -2.10 0.00 0.00 70.33 70.02 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 1.44 -1.47 0.00 -0.78 4.01 -0.99 -1.17 118.16 119.20 1x5d n LYS 59 Ca 0.19 0.99 0.00 0.00 -0.51 0.00 0.00 58.31 58.98 1x5d n LYS 59 Cb 0.59 -5.49 0.00 0.00 -0.51 0.00 0.00 35.03 29.63 1x5d n LYS 59 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1x5d n GLY 60 N -0.92 1.99 0.17 0.72 0.00 0.22 -4.95 105.19 102.42 1x5d n GLY 60 Ca -0.22 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.75 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 2.83 -0.25 -6.59 1.61 1.63 -1.41 -3.36 116.57 111.04 1x5d h LYS 61 Ca 0.00 0.02 -0.55 0.00 -0.85 0.00 0.00 60.65 59.26 1x5d h LYS 61 Cb 0.00 0.06 -0.07 0.00 -0.60 0.00 0.00 32.23 31.61 1x5d h LYS 61 CO 0.00 -0.16 0.98 0.08 -3.45 0.00 0.00 179.45 176.89 1x5d s VAL 62 N -3.97 4.02 0.22 2.00 1.01 -1.26 -3.76 120.40 118.67 1x5d s VAL 62 Ca -0.06 0.92 -0.02 0.00 0.00 0.00 0.00 61.98 62.83 1x5d s VAL 62 Cb 0.02 -4.72 -0.05 0.00 0.00 0.00 0.00 36.38 31.64 1x5d s VAL 62 CO 0.21 -1.32 0.43 -0.54 0.00 0.00 0.00 175.10 173.89 1x5d s LYS 63 N 4.93 3.55 -0.15 2.72 1.02 -0.14 -4.05 119.74 127.62 1x5d s LYS 63 Ca 0.43 -0.24 0.01 0.00 0.02 0.00 0.00 55.97 56.19 1x5d s LYS 63 Cb -0.07 -2.79 0.02 0.00 -0.52 0.00 0.00 37.83 34.47 1x5d s LYS 63 CO 0.26 0.35 -0.17 -0.51 -0.92 0.00 0.00 175.35 174.36 1x5d s LEU 64 N -3.37 1.86 0.13 3.17 1.02 -1.26 -0.85 118.68 119.37 1x5d s LEU 64 Ca 0.40 -0.53 0.07 0.00 0.02 0.00 0.00 54.13 54.09 1x5d s LEU 64 Cb -0.11 -1.27 -0.04 0.00 0.02 0.00 0.00 46.19 44.79 1x5d s LEU 64 CO 0.29 -0.01 -0.18 0.00 0.02 0.00 0.00 176.35 176.47 1x5d s ALA 65 N 1.25 1.75 0.22 4.21 0.00 0.86 -1.95 121.76 128.08 1x5d s ALA 65 Ca 0.01 -1.32 0.10 0.00 0.00 0.00 0.00 51.96 50.75 1x5d s ALA 65 Cb -0.14 -0.17 -0.04 0.00 0.00 0.00 0.00 23.12 22.77 1x5d s ALA 65 CO -0.08 0.24 -0.11 0.00 0.00 0.00 0.00 175.76 175.80 1x5d s ALA 66 N -1.72 2.91 -0.06 0.00 0.00 0.14 -1.62 121.76 121.41 1x5d s ALA 66 Ca 0.10 -1.60 -0.05 0.00 0.00 0.00 0.00 51.96 50.41 1x5d s ALA 66 Cb -0.07 -0.62 0.02 0.00 0.00 0.00 0.00 23.12 22.45 1x5d s ALA 66 CO 0.05 0.39 0.15 0.08 0.00 0.00 0.00 175.76 176.42 1x5d s VAL 67 N -1.97 -0.01 -0.52 0.00 1.01 -1.03 -3.25 120.40 114.63 1x5d s VAL 67 Ca 0.27 0.04 -0.22 0.00 0.00 0.00 0.00 61.98 62.06 1x5d s VAL 67 Cb -0.08 -0.22 0.04 0.00 0.00 0.00 0.00 36.38 36.13 1x5d s VAL 67 CO 0.15 0.02 0.82 -0.62 0.00 0.00 0.00 175.10 175.47 1x5d s ASP 68 N 0.31 6.32 0.12 3.32 -1.08 -1.26 -1.07 116.67 123.32 1x5d s ASP 68 Ca -0.02 -0.47 0.07 0.00 -0.52 0.00 0.00 52.55 51.62 1x5d s ASP 68 Cb -0.03 -2.38 0.40 0.00 -1.46 0.00 0.00 42.92 39.44 1x5d s ASP 68 CO -0.01 -1.06 1.19 0.00 0.52 0.00 0.00 175.17 175.80 1x5d n ALA 69 N 6.93 0.93 0.15 3.66 0.00 -1.15 -0.19 120.51 130.84 1x5d n ALA 69 Ca -0.01 0.07 0.10 0.00 0.00 0.00 0.00 53.44 53.60 1x5d n ALA 69 Cb 0.47 -1.02 0.07 0.00 0.00 0.00 0.00 19.45 18.97 1x5d n ALA 69 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1x5d h THR 70 N 0.00 0.11 0.00 0.00 1.35 -1.90 -3.37 112.91 109.10 1x5d h THR 70 Ca 0.00 -1.18 -0.17 0.00 -0.55 0.00 0.00 66.41 64.51 1x5d h THR 70 Cb 0.10 1.84 -0.03 0.00 -1.73 0.00 0.00 68.15 68.33 1x5d h THR 70 CO 0.00 0.06 -1.66 0.52 -0.25 0.00 0.00 175.52 174.19 1x5d n VAL 71 N -2.93 0.66 -3.03 6.82 0.31 0.73 -4.92 118.33 115.97 1x5d n VAL 71 Ca 0.01 -0.33 -0.43 0.00 -0.01 0.00 0.00 64.34 63.58 1x5d n VAL 71 Cb 0.58 -0.84 -0.06 0.00 -0.91 0.00 0.00 33.84 32.61 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 -4.65 6.35 -0.17 4.52 0.01 0.72 -4.86 114.94 116.86 1x5d s ASN 72 Ca -0.10 -0.29 0.02 0.00 -0.71 0.00 0.00 52.86 51.78 1x5d s ASN 72 Cb 0.03 -2.35 -0.11 0.00 0.41 0.00 0.00 41.25 39.23 1x5d s ASN 72 CO 0.33 -0.88 -0.14 0.00 -1.51 0.00 0.00 177.10 174.90 1x5d n GLN 73 N 6.54 0.51 -0.33 -0.60 1.13 -1.26 -3.71 117.38 119.65 1x5d n GLN 73 Ca -0.00 0.09 0.05 0.00 -1.94 0.00 0.00 57.00 55.21 1x5d n GLN 73 Cb 0.48 -1.34 0.21 0.00 0.11 0.00 0.00 30.24 29.70 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 0.92 0.03 5.09 2.07 -1.95 0.47 116.25 122.87 1x5d h VAL 74 Ca -0.38 -0.31 -0.11 0.00 0.82 0.00 0.00 66.70 66.72 1x5d h VAL 74 Cb 1.60 -0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.29 1x5d h VAL 74 CO -0.05 0.17 -0.56 -0.07 0.02 0.00 0.00 177.57 177.07 1x5d h LEU 75 N 0.92 0.08 -0.96 2.57 3.38 -1.91 -2.61 115.31 116.78 1x5d h LEU 75 Ca 0.46 -0.85 0.21 0.00 0.09 0.00 0.00 57.88 57.78 1x5d h LEU 75 Cb 0.43 -0.03 -0.11 0.00 0.09 0.00 0.00 40.66 41.04 1x5d h LEU 75 CO -0.26 1.23 0.54 0.00 0.09 0.00 0.00 178.44 180.04 1x5d h ALA 76 N -0.13 1.61 0.13 1.53 0.00 -1.60 -0.49 119.26 120.31 1x5d h ALA 76 Ca -0.14 0.11 -0.30 0.00 0.00 0.00 0.00 54.91 54.59 1x5d h ALA 76 Cb 1.22 0.00 0.03 0.00 0.00 0.00 0.00 17.79 19.04 1x5d h ALA 76 CO -0.04 -0.18 -1.25 1.03 0.00 0.00 0.00 179.25 178.81 1x5d h SER 77 N 0.62 0.80 -0.44 0.00 0.87 -1.04 1.14 113.55 115.51 1x5d h SER 77 Ca 0.58 -0.76 0.09 0.00 -1.23 0.00 0.00 61.79 60.47 1x5d h SER 77 Cb 1.00 -0.25 -0.09 0.00 -0.44 0.00 0.00 62.40 62.61 1x5d h SER 77 CO -0.44 1.57 -0.21 -0.09 -0.53 0.00 0.00 176.83 177.13 1x5d h ARG 78 N 0.24 -0.12 0.00 2.24 2.43 -0.70 -2.77 114.38 115.69 1x5d h ARG 78 Ca -0.18 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.00 1x5d h ARG 78 Cb 1.93 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 31.50 1x5d h ARG 78 CO 0.23 -0.08 -1.86 0.66 -1.51 0.00 0.00 179.97 177.41 1x5d n TYR 79 N -5.39 0.00 -1.47 2.20 4.01 -0.80 -5.05 117.16 110.66 1x5d n TYR 79 Ca 0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.77 1x5d n TYR 79 Cb 0.30 -0.43 0.00 0.00 -0.31 0.00 0.00 39.34 38.90 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 1.31 -0.82 3.26 2.72 0.00 0.33 -5.04 105.19 106.96 1x5d n GLY 80 Ca -0.03 -0.13 -0.38 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.91 3.86 0.00 -0.61 -1.09 0.20 -4.86 121.20 117.79 1x5d s ILE 81 Ca 0.00 -1.30 0.00 0.00 -2.23 0.00 0.00 60.65 57.12 1x5d s ILE 81 Cb 0.00 -3.28 0.00 0.00 -1.58 0.00 0.00 42.46 37.60 1x5d s ILE 81 CO 0.00 -0.32 0.00 -2.11 -1.23 0.00 0.00 174.94 171.28 1x5d n ARG 82 N 4.82 2.22 -3.53 2.79 1.85 -1.26 -4.91 116.66 118.64 1x5d n ARG 82 Ca -0.11 0.00 -0.41 0.00 -1.00 0.00 0.00 57.85 56.33 1x5d n ARG 82 Cb 0.44 -0.88 -0.08 0.00 -1.05 0.00 0.00 32.46 30.89 1x5d n ARG 82 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 1x5d s GLY 83 N -2.01 2.13 0.17 2.89 0.00 -1.26 -5.07 107.32 104.16 1x5d s GLY 83 Ca 0.00 -2.66 0.00 0.00 0.00 0.00 0.00 44.72 42.07 1x5d s GLY 83 CO 0.00 1.13 0.34 -1.36 0.00 0.00 0.00 173.10 173.20 1x5d s PHE 84 N 1.17 3.49 0.83 1.90 0.08 -1.26 -4.09 117.98 120.10 1x5d s PHE 84 Ca 0.07 0.26 -0.11 0.00 0.12 0.00 0.00 56.93 57.27 1x5d s PHE 84 Cb -0.25 -1.78 0.09 0.00 -0.57 0.00 0.00 43.02 40.51 1x5d s PHE 84 CO -0.01 0.45 1.09 -1.25 -0.10 0.00 0.00 175.22 175.40 1x5d s PRO 85 N -3.21 1.81 -0.20 0.24 0.04 -1.26 -4.93 135.00 127.49 1x5d s PRO 85 Ca 0.37 1.02 -0.04 0.00 0.04 0.00 0.00 61.00 62.38 1x5d s PRO 85 Cb -0.11 -1.86 0.07 0.00 0.04 0.00 0.00 34.50 32.64 1x5d s PRO 85 CO 0.29 -1.91 0.08 0.99 0.04 0.00 0.00 177.00 176.48 1x5d s THR 86 N -2.92 0.12 -0.26 1.26 2.01 -0.86 -4.95 115.64 110.05 1x5d s THR 86 Ca 0.62 -0.41 -0.12 0.00 0.31 0.00 0.00 61.69 62.09 1x5d s THR 86 Cb -0.18 -0.81 -0.05 0.00 0.01 0.00 0.00 72.50 71.48 1x5d s THR 86 CO 0.56 -0.35 0.25 -0.63 -0.69 0.00 0.00 174.62 173.77 1x5d s ILE 87 N 2.03 5.28 -0.05 1.82 1.01 -1.26 -0.89 121.20 129.14 1x5d s ILE 87 Ca 0.03 0.32 0.01 0.00 0.00 0.00 0.00 60.65 61.01 1x5d s ILE 87 Cb -0.16 -3.58 0.02 0.00 0.01 0.00 0.00 42.46 38.74 1x5d s ILE 87 CO -0.14 0.25 -0.06 -0.54 0.00 0.00 0.00 174.94 174.45 1x5d s LYS 88 N 1.62 1.00 0.03 2.79 -0.14 -0.64 -1.80 119.74 122.61 1x5d s LYS 88 Ca 0.10 -0.17 -0.16 0.00 -1.36 0.00 0.00 55.97 54.38 1x5d s LYS 88 Cb -0.15 -0.94 -0.06 0.00 -1.68 0.00 0.00 37.83 35.00 1x5d s LYS 88 CO 0.09 -0.05 0.46 0.42 -0.76 0.00 0.00 175.35 175.51 1x5d s ILE 89 N 0.82 4.94 -0.27 2.17 1.09 -1.11 -1.66 121.20 127.19 1x5d s ILE 89 Ca -0.12 0.94 0.01 0.00 -1.10 0.00 0.00 60.65 60.38 1x5d s ILE 89 Cb -0.15 -3.76 0.07 0.00 -1.06 0.00 0.00 42.46 37.56 1x5d s ILE 89 CO 0.01 0.56 -0.01 -0.36 -0.10 0.00 0.00 174.94 175.04 1x5d s PHE 90 N -1.11 2.54 0.43 3.97 0.40 -1.12 -1.99 117.98 121.11 1x5d s PHE 90 Ca 0.26 -1.99 0.01 0.00 -0.60 0.00 0.00 56.93 54.61 1x5d s PHE 90 Cb -0.17 -1.85 -0.01 0.00 0.51 0.00 0.00 43.02 41.50 1x5d s PHE 90 CO 0.15 -0.82 0.64 -0.65 0.70 0.00 0.00 175.22 175.24 1x5d s GLN 91 N 1.34 3.14 -0.43 0.44 -1.52 -1.26 -2.91 119.66 118.46 1x5d s GLN 91 Ca -0.00 -0.49 -0.20 0.00 -1.95 0.00 0.00 55.36 52.71 1x5d s GLN 91 Cb -0.19 -2.59 0.02 0.00 -0.22 0.00 0.00 33.01 30.04 1x5d s GLN 91 CO -0.09 -0.18 0.63 0.21 -0.25 0.00 0.00 175.29 175.61 1x5d s LYS 92 N -4.49 3.29 0.00 2.91 2.47 -1.26 -4.20 119.74 118.46 1x5d s LYS 92 Ca 0.47 -0.37 0.00 0.00 -1.56 0.00 0.00 55.97 54.50 1x5d s LYS 92 Cb -0.10 -3.94 0.00 0.00 -1.46 0.00 0.00 37.83 32.33 1x5d s LYS 92 CO 0.37 -0.99 0.00 0.41 0.16 0.00 0.00 175.35 175.31 1x5d n GLY 93 N 5.02 3.10 3.95 5.54 0.00 -1.26 -5.05 105.19 116.50 1x5d n GLY 93 Ca -0.02 -0.93 -0.23 0.00 0.00 0.00 0.00 46.02 44.84 1x5d n GLY 93 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1x5d s GLU 94 N 0.00 3.46 0.58 1.61 2.02 -1.26 -5.08 118.70 120.03 1x5d s GLU 94 Ca 0.00 -0.59 -0.18 0.00 0.02 0.00 0.00 54.97 54.22 1x5d s GLU 94 Cb 0.00 -2.85 -0.04 0.00 0.10 0.00 0.00 34.13 31.35 1x5d s GLU 94 CO 0.00 0.38 1.15 -1.54 0.02 0.00 0.00 175.26 175.27 1x5d s SER 95 N -3.77 5.40 0.44 -0.19 1.04 -1.26 -4.29 113.70 111.08 1x5d s SER 95 Ca 0.36 2.21 -0.24 0.00 0.48 0.00 0.00 55.95 58.76 1x5d s SER 95 Cb -0.10 -2.58 -0.08 0.00 0.10 0.00 0.00 66.02 63.37 1x5d s SER 95 CO 0.30 -1.44 1.17 -2.16 0.98 0.00 0.00 173.24 172.10 1x5d s PRO 96 N -3.47 3.83 0.47 4.02 0.04 -1.26 -4.67 135.00 133.97 1x5d s PRO 96 Ca 0.73 1.80 0.08 0.00 0.04 0.00 0.00 61.00 63.65 1x5d s PRO 96 Cb -0.25 -2.48 0.02 0.00 0.04 0.00 0.00 34.50 31.82 1x5d s PRO 96 CO 0.32 -0.50 0.53 0.14 0.04 0.00 0.00 177.00 177.53 1x5d s VAL 97 N -1.50 2.54 -0.29 -0.36 -7.23 -0.84 -4.96 120.40 107.76 1x5d s VAL 97 Ca 0.62 -1.17 -0.03 0.00 -1.81 0.00 0.00 61.98 59.58 1x5d s VAL 97 Cb -0.29 -2.72 0.04 0.00 0.56 0.00 0.00 36.38 33.96 1x5d s VAL 97 CO 0.36 0.00 0.01 1.51 -0.31 0.00 0.00 175.10 176.67 1x5d s ASP 98 N -4.33 4.83 0.09 4.85 -4.77 -1.26 -2.74 116.67 113.33 1x5d s ASP 98 Ca 0.52 -1.07 -0.30 0.00 -3.30 0.00 0.00 52.55 48.40 1x5d s ASP 98 Cb -0.06 -1.74 -0.05 0.00 -1.09 0.00 0.00 42.92 39.98 1x5d s ASP 98 CO 0.31 -0.23 0.98 -0.47 0.70 0.00 0.00 175.17 176.47 1x5d s TYR 99 N 1.33 3.76 -0.13 2.11 6.14 -0.74 -5.01 117.35 124.80 1x5d s TYR 99 Ca -0.02 1.75 -0.08 0.00 0.64 0.00 0.00 57.07 59.36 1x5d s TYR 99 Cb -0.19 -3.09 0.05 0.00 0.42 0.00 0.00 41.96 39.15 1x5d s TYR 99 CO -0.01 0.07 0.32 -0.51 0.64 0.00 0.00 175.55 176.06 1x5d s ASP 100 N 0.25 -0.37 0.00 4.32 1.11 -1.26 -4.51 116.67 116.22 1x5d s ASP 100 Ca 0.49 0.68 0.00 0.00 0.18 0.00 0.00 52.55 53.89 1x5d s ASP 100 Cb -0.23 0.59 0.00 0.00 1.07 0.00 0.00 42.92 44.34 1x5d s ASP 100 CO 0.30 -0.16 0.00 0.61 1.18 0.00 0.00 175.17 177.09 1x5d n GLY 101 N 3.95 -0.12 3.78 0.21 0.00 -1.26 -5.12 105.19 106.62 1x5d n GLY 101 Ca -0.22 -0.50 -0.36 0.00 0.00 0.00 0.00 46.02 44.94 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 2.70 -0.38 -0.02 0.00 -1.26 -4.96 107.32 103.40 1x5d s GLY 102 Ca 0.00 0.82 0.06 0.00 0.00 0.00 0.00 44.72 45.60 1x5d s GLY 102 CO 0.00 1.23 1.59 0.54 0.00 0.00 0.00 173.10 176.46 1x5d n ARG 103 N -0.65 2.37 -5.21 2.90 1.74 -1.26 -4.43 116.66 112.12 1x5d n ARG 103 Ca 0.08 -3.37 -0.32 0.00 -0.77 0.00 0.00 57.85 53.48 1x5d n ARG 103 Cb 0.50 -2.04 -0.16 0.00 -1.02 0.00 0.00 32.46 29.74 1x5d n ARG 103 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1x5d s THR 104 N -3.80 2.20 0.36 0.55 -4.23 -1.26 -4.88 115.64 104.58 1x5d s THR 104 Ca 0.51 -1.02 0.29 0.00 -1.18 0.00 0.00 61.69 60.30 1x5d s THR 104 Cb 0.44 -1.80 0.44 0.00 1.34 0.00 0.00 72.50 72.91 1x5d s THR 104 CO 0.02 0.57 1.15 -2.11 -0.54 0.00 0.00 174.62 173.71 1x5d n ARG 105 N 2.87 -0.02 0.26 3.99 1.85 -1.17 0.79 116.66 125.23 1x5d n ARG 105 Ca -0.17 0.88 -0.17 0.00 -1.00 0.00 0.00 57.85 57.39 1x5d n ARG 105 Cb 0.52 -1.83 -0.08 0.00 -1.05 0.00 0.00 32.46 30.01 1x5d n ARG 105 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 1x5d h SER 106 N 0.00 -1.08 0.08 2.89 0.87 -1.94 0.56 113.55 114.93 1x5d h SER 106 Ca 0.67 0.09 -0.00 0.00 -1.23 0.00 0.00 61.79 61.31 1x5d h SER 106 Cb 2.37 0.36 0.00 0.00 -0.44 0.00 0.00 62.40 64.69 1x5d h SER 106 CO -0.21 -0.56 -0.04 0.44 -0.53 0.00 0.00 176.83 175.93 1x5d h ASP 107 N -0.84 -0.09 -1.06 6.23 3.32 0.06 -1.21 116.42 122.83 1x5d h ASP 107 Ca -0.04 -0.45 0.29 0.00 0.02 0.00 0.00 57.03 56.85 1x5d h ASP 107 Cb 0.74 0.02 -0.11 0.00 0.22 0.00 0.00 39.33 40.20 1x5d h ASP 107 CO -0.05 0.43 0.66 0.40 -1.72 0.00 0.00 179.24 178.96 1x5d h ILE 108 N -0.65 0.44 0.05 0.35 2.04 -1.30 -0.45 117.51 117.99 1x5d h ILE 108 Ca -0.01 -0.14 -0.09 0.00 1.00 0.00 0.00 64.86 65.62 1x5d h ILE 108 Cb 0.53 0.01 0.01 0.00 -0.74 0.00 0.00 36.82 36.63 1x5d h ILE 108 CO 0.02 0.07 -0.38 0.58 0.00 0.00 0.00 178.15 178.44 1x5d h VAL 109 N 0.40 1.62 -1.05 1.67 2.07 -0.86 -3.08 116.25 117.01 1x5d h VAL 109 Ca 0.66 -2.30 0.28 0.00 0.82 0.00 0.00 66.70 66.15 1x5d h VAL 109 Cb 1.59 3.14 -0.08 0.00 -1.52 0.00 0.00 31.29 34.42 1x5d h VAL 109 CO -0.41 0.63 0.71 -1.28 0.02 0.00 0.00 177.57 177.24 1x5d h SER 110 N -0.62 0.30 0.05 0.57 0.87 0.15 -0.80 113.55 114.07 1x5d h SER 110 Ca -0.06 0.05 -0.00 0.00 -1.23 0.00 0.00 61.79 60.55 1x5d h SER 110 Cb 1.24 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.21 1x5d h SER 110 CO 0.07 0.06 -0.02 -0.09 -0.53 0.00 0.00 176.83 176.32 1x5d h ARG 111 N 0.27 -0.06 -1.11 2.24 9.65 -1.32 -3.16 114.38 120.88 1x5d h ARG 111 Ca 0.57 0.00 0.33 0.00 -1.10 0.00 0.00 59.98 59.78 1x5d h ARG 111 Cb 1.69 0.01 -0.12 0.00 -1.39 0.00 0.00 29.97 30.16 1x5d h ARG 111 CO -0.20 0.56 0.70 0.00 2.80 0.00 0.00 179.97 183.83 1x5d h ALA 112 N 0.06 2.29 0.25 2.80 0.00 -1.07 0.34 119.26 123.93 1x5d h ALA 112 Ca -0.01 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1x5d h ALA 112 Cb 0.65 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1x5d h ALA 112 CO 0.01 -0.82 -0.12 -0.07 0.00 0.00 0.00 179.25 178.25 1x5d h LEU 113 N 0.29 -0.28 -1.41 0.00 3.38 -1.46 0.32 115.31 116.15 1x5d h LEU 113 Ca 0.70 -0.17 0.39 0.00 0.09 0.00 0.00 57.88 58.89 1x5d h LEU 113 Cb 1.86 0.07 -0.12 0.00 0.09 0.00 0.00 40.66 42.56 1x5d h LEU 113 CO -0.42 0.02 0.81 -0.78 0.09 0.00 0.00 178.44 178.16 1x5d h ASP 114 N -0.61 0.29 0.12 -0.43 3.58 -0.90 0.14 116.42 118.60 1x5d h ASP 114 Ca -0.03 0.12 -0.33 0.00 0.42 0.00 0.00 57.03 57.21 1x5d h ASP 114 Cb 0.44 0.09 -0.01 0.00 1.72 0.00 0.00 39.33 41.57 1x5d h ASP 114 CO 0.06 -0.11 -1.72 -0.07 -2.88 0.00 0.00 179.24 174.51 1x5d h LEU 115 N 0.16 0.40 -1.46 2.28 3.38 -1.31 -3.33 115.31 115.43 1x5d h LEU 115 Ca 0.76 -0.88 0.43 0.00 0.09 0.00 0.00 57.88 58.28 1x5d h LEU 115 Cb 2.31 -0.13 -0.12 0.00 0.09 0.00 0.00 40.66 42.81 1x5d h LEU 115 CO -0.38 1.75 0.87 0.15 0.09 0.00 0.00 178.44 180.92 1x5d h PHE 116 N -0.14 0.48 0.01 1.13 3.57 0.24 0.28 116.94 122.52 1x5d h PHE 116 Ca -0.37 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.15 1x5d h PHE 116 Cb 1.90 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 40.52 1x5d h PHE 116 CO 0.10 -0.16 -0.00 1.03 -2.23 0.00 0.00 178.31 177.04 1x5d h SER 117 N 0.10 -0.01 -0.87 0.41 0.87 -1.56 0.23 113.55 112.72 1x5d h SER 117 Ca 0.80 -0.69 0.22 0.00 -1.23 0.00 0.00 61.79 60.89 1x5d h SER 117 Cb 2.55 0.00 -0.15 0.00 -0.44 0.00 0.00 62.40 64.36 1x5d h SER 117 CO -0.37 0.70 0.06 0.44 -0.53 0.00 0.00 176.83 177.13 1x5d h ASP 118 N -0.73 -0.32 0.00 6.23 5.19 -0.57 -3.32 116.42 122.90 1x5d h ASP 118 Ca -0.00 0.23 0.00 0.00 -0.62 0.00 0.00 57.03 56.64 1x5d h ASP 118 Cb 0.70 0.38 0.00 0.00 0.18 0.00 0.00 39.33 40.59 1x5d h ASP 118 CO 0.00 -0.24 0.00 -0.46 -3.12 0.00 0.00 179.24 175.43 1x5d n ASN 119 N -5.37 0.00 -4.72 6.45 0.23 -0.91 -4.97 115.26 105.97 1x5d n ASN 119 Ca 0.19 0.05 -0.40 0.00 -0.53 0.00 0.00 54.58 53.88 1x5d n ASN 119 Cb 0.62 -0.25 0.02 0.00 -2.08 0.00 0.00 39.78 38.09 1x5d n ASN 119 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1x5d n ALA 120 N -1.84 1.49 -2.17 -2.53 0.00 0.79 -4.91 120.51 111.34 1x5d n ALA 120 Ca 0.00 0.24 -0.42 0.00 0.00 0.00 0.00 53.44 53.26 1x5d n ALA 120 Cb 0.00 -2.30 -0.03 0.00 0.00 0.00 0.00 19.45 17.12 1x5d n ALA 120 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1x5d s PRO 121 N -2.34 4.25 0.88 0.00 0.04 -1.26 -4.03 135.00 132.53 1x5d s PRO 121 Ca 0.62 2.02 -0.11 0.00 0.04 0.00 0.00 61.00 63.57 1x5d s PRO 121 Cb -0.48 -3.68 0.12 0.00 0.04 0.00 0.00 34.50 30.49 1x5d s PRO 121 CO 0.57 -0.66 1.09 -1.25 0.04 0.00 0.00 177.00 176.79 1x5d s PRO 122 N 2.88 1.41 0.13 0.56 0.04 -1.26 -4.98 135.00 133.79 1x5d s PRO 122 Ca 0.66 0.88 -0.31 0.00 0.04 0.00 0.00 61.00 62.27 1x5d s PRO 122 Cb -0.32 -1.82 -0.08 0.00 0.04 0.00 0.00 34.50 32.32 1x5d s PRO 122 CO 0.26 -2.15 1.34 -1.25 0.04 0.00 0.00 177.00 175.25 1x5d s PRO 123 N -4.93 4.35 -0.68 0.56 0.04 -1.26 -4.97 135.00 128.11 1x5d s PRO 123 Ca 0.63 2.04 -0.24 0.00 0.04 0.00 0.00 61.00 63.47 1x5d s PRO 123 Cb -0.18 -3.24 0.06 0.00 0.04 0.00 0.00 34.50 31.18 1x5d s PRO 123 CO 0.57 -0.36 1.04 -2.00 0.04 0.00 0.00 177.00 176.29 1x5d s GLU 124 N 0.73 3.13 0.14 4.56 2.56 -1.26 -5.01 118.70 123.56 1x5d s GLU 124 Ca 0.62 -0.70 0.11 0.00 0.00 0.00 0.00 54.97 54.99 1x5d s GLU 124 Cb -0.36 -4.23 -0.04 0.00 2.00 0.00 0.00 34.13 31.50 1x5d s GLU 124 CO 0.32 -1.90 -0.26 -0.51 -0.56 0.00 0.00 175.26 172.36 1x5d s LEU 125 N 4.45 2.36 0.34 2.70 1.43 -1.26 -5.13 118.68 123.57 1x5d s LEU 125 Ca 0.25 -0.77 -0.26 0.00 -1.03 0.00 0.00 54.13 52.32 1x5d s LEU 125 Cb -0.15 -1.22 -0.10 0.00 0.03 0.00 0.00 46.19 44.76 1x5d s LEU 125 CO 0.11 0.17 0.99 -0.22 0.23 0.00 0.00 176.35 177.63 1x5d s LEU 126 N -2.20 4.32 0.17 1.79 2.96 -1.26 -4.96 118.68 119.49 1x5d s LEU 126 Ca 0.16 1.95 -0.33 0.00 -0.22 0.00 0.00 54.13 55.69 1x5d s LEU 126 Cb -0.10 -4.00 -0.16 0.00 0.50 0.00 0.00 46.19 42.43 1x5d s LEU 126 CO 0.07 -0.18 1.08 -1.84 -1.32 0.00 0.00 176.35 174.16 1x5d n GLU 127 N 0.49 0.97 -3.90 1.98 0.28 -1.26 -4.98 120.64 114.22 1x5d n GLU 127 Ca 0.02 0.34 -0.11 0.00 -0.16 0.00 0.00 57.16 57.26 1x5d n GLU 127 Cb 0.49 -1.78 -0.12 0.00 1.43 0.00 0.00 31.44 31.46 1x5d n GLU 127 CO 0.00 0.00 0.00 -1.12 -0.16 0.00 0.00 177.13 175.85 1x5d s SER 128 N -0.15 0.06 0.00 -1.84 0.01 -1.26 -5.16 113.70 105.36 1x5d s SER 128 Ca 0.73 -0.16 0.00 0.00 1.31 0.00 0.00 55.95 57.82 1x5d s SER 128 Cb -0.88 0.15 0.00 0.00 0.21 0.00 0.00 66.02 65.50 1x5d s SER 128 CO 0.54 -0.21 0.00 0.61 0.41 0.00 0.00 173.24 174.59 1x5d n GLY 129 N 2.13 3.73 3.76 3.44 0.00 -1.26 -5.16 105.19 111.83 1x5d n GLY 129 Ca -0.19 -1.19 -0.31 0.00 0.00 0.00 0.00 46.02 44.33 1x5d n GLY 129 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x5d s PRO 130 N -0.12 2.14 -0.26 1.61 0.04 -1.26 -5.07 135.00 132.09 1x5d s PRO 130 Ca 0.00 1.13 -0.01 0.00 0.04 0.00 0.00 61.00 62.16 1x5d s PRO 130 Cb 0.00 -1.89 0.15 0.00 0.04 0.00 0.00 34.50 32.80 1x5d s PRO 130 CO 0.00 -1.71 0.41 0.45 0.04 0.00 0.00 177.00 176.18 1x5d s SER 131 N -3.40 0.17 -0.11 6.66 0.15 -1.26 -5.14 113.70 110.78 1x5d s SER 131 Ca 0.61 0.06 -0.23 0.00 0.70 0.00 0.00 55.95 57.09 1x5d s SER 131 Cb -0.17 1.19 -0.03 0.00 -1.71 0.00 0.00 66.02 65.30 1x5d s SER 131 CO 0.56 -0.32 0.70 -0.55 1.20 0.00 0.00 173.24 174.84 1x5d s SER 132 N 2.57 6.92 0.00 5.45 0.15 -1.26 -5.37 113.70 122.15 1x5d s SER 132 Ca 0.12 1.11 0.16 0.00 0.70 0.00 0.00 55.95 58.05 1x5d s SER 132 Cb -0.14 -2.40 0.13 0.00 -1.71 0.00 0.00 66.02 61.89 1x5d s SER 132 CO -0.21 -0.19 1.02 0.61 1.20 0.00 0.00 173.24 175.67