#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5o n SER 2 N 0.00 4.72 -0.30 1.61 2.88 -1.26 -4.89 113.62 116.38 1x5o n SER 2 Ca 0.00 -3.67 -0.12 0.00 -1.33 0.00 0.00 58.87 53.75 1x5o n SER 2 Cb 0.00 -0.38 -0.10 0.00 -0.75 0.00 0.00 64.21 62.98 1x5o n SER 2 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 1x5o h SER 3 N 2.30 -2.04 0.00 -3.46 0.87 -2.11 -3.47 113.55 105.64 1x5o h SER 3 Ca 0.33 0.29 0.00 0.00 -1.23 0.00 0.00 61.79 61.18 1x5o h SER 3 Cb 1.38 0.88 0.00 0.00 -0.44 0.00 0.00 62.40 64.21 1x5o h SER 3 CO 0.76 -0.30 0.00 0.61 -0.53 0.00 0.00 176.83 177.36 1x5o n GLY 4 N -1.30 1.06 3.85 5.77 0.00 -1.26 -5.13 105.19 108.17 1x5o n GLY 4 Ca -0.00 -0.07 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 1x5o n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x5o s SER 5 N 0.00 6.58 -0.44 1.61 0.01 -1.26 -5.05 113.70 115.14 1x5o s SER 5 Ca 0.00 1.50 0.02 0.00 1.31 0.00 0.00 55.95 58.79 1x5o s SER 5 Cb 0.00 -2.48 0.15 0.00 0.21 0.00 0.00 66.02 63.89 1x5o s SER 5 CO 0.00 -0.59 0.28 -0.44 0.41 0.00 0.00 173.24 172.90 1x5o s SER 6 N -3.17 3.23 0.04 2.44 0.01 -1.26 -5.07 113.70 109.92 1x5o s SER 6 Ca 0.58 -2.74 0.00 0.00 1.31 0.00 0.00 55.95 55.10 1x5o s SER 6 Cb -0.10 -0.86 0.00 0.00 0.21 0.00 0.00 66.02 65.27 1x5o s SER 6 CO 0.33 -0.24 0.00 0.61 0.41 0.00 0.00 173.24 174.35 1x5o n GLY 7 N 3.36 1.47 2.63 3.44 0.00 -1.26 -4.77 105.19 110.05 1x5o n GLY 7 Ca 0.14 0.68 -0.16 0.00 0.00 0.00 0.00 46.02 46.68 1x5o n GLY 7 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1x5o n LEU 8 N 0.00 -2.34 -4.97 0.99 7.94 -1.26 -5.01 117.00 112.35 1x5o n LEU 8 Ca 0.00 -0.20 -0.21 0.00 -1.11 0.00 0.00 56.01 54.49 1x5o n LEU 8 Cb 0.00 -2.24 -0.00 0.00 0.53 0.00 0.00 43.42 41.71 1x5o n LEU 8 CO 0.00 0.16 0.12 -0.54 -1.11 0.00 0.00 177.39 176.02 1x5o s LYS 9 N -5.34 3.23 -0.18 1.96 1.02 -1.26 -5.12 119.74 114.05 1x5o s LYS 9 Ca 0.21 -0.70 -0.28 0.00 0.02 0.00 0.00 55.97 55.22 1x5o s LYS 9 Cb -0.09 -2.74 0.10 0.00 -0.52 0.00 0.00 37.83 34.58 1x5o s LYS 9 CO 0.26 0.06 0.86 0.00 -0.92 0.00 0.00 175.35 175.61 1x5o s ALA 10 N -2.26 -1.87 0.34 5.17 0.00 -1.26 -5.19 121.76 116.69 1x5o s ALA 10 Ca 0.43 1.67 -0.17 0.00 0.00 0.00 0.00 51.96 53.88 1x5o s ALA 10 Cb -0.10 -0.77 0.04 0.00 0.00 0.00 0.00 23.12 22.29 1x5o s ALA 10 CO 0.33 -0.32 0.74 0.45 0.00 0.00 0.00 175.76 176.97 1x5o s SER 11 N -0.52 -0.08 0.00 0.00 0.15 -1.26 -5.17 113.70 106.82 1x5o s SER 11 Ca -0.03 -0.92 0.00 0.00 0.70 0.00 0.00 55.95 55.70 1x5o s SER 11 Cb -0.02 0.79 0.00 0.00 -1.71 0.00 0.00 66.02 65.07 1x5o s SER 11 CO 0.02 -1.52 0.00 0.61 1.20 0.00 0.00 173.24 173.55 1x5o n GLY 12 N -0.50 3.58 3.84 9.45 0.00 -1.26 -5.14 105.19 115.17 1x5o n GLY 12 Ca -0.06 -0.38 -0.37 0.00 0.00 0.00 0.00 46.02 45.22 1x5o n GLY 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x5o s VAL 13 N 0.00 5.48 -0.18 1.61 0.11 -1.26 -5.09 120.40 121.07 1x5o s VAL 13 Ca 0.00 0.20 -0.11 0.00 -2.93 0.00 0.00 61.98 59.14 1x5o s VAL 13 Cb 0.00 -3.41 0.06 0.00 -1.53 0.00 0.00 36.38 31.49 1x5o s VAL 13 CO 0.00 0.58 0.44 -1.10 -3.33 0.00 0.00 175.10 171.69 1x5o s GLN 14 N -0.69 0.44 -0.12 1.54 -0.21 -1.26 -5.16 119.66 114.20 1x5o s GLN 14 Ca 0.13 0.80 -0.31 0.00 0.02 0.00 0.00 55.36 56.00 1x5o s GLN 14 Cb -0.12 0.03 0.13 0.00 1.00 0.00 0.00 33.01 34.05 1x5o s GLN 14 CO 0.03 -0.14 1.05 0.00 -2.12 0.00 0.00 175.29 174.11 1x5o s ALA 15 N 1.24 -1.95 0.35 6.09 0.00 -1.26 -5.18 121.76 121.04 1x5o s ALA 15 Ca -0.08 1.38 0.08 0.00 0.00 0.00 0.00 51.96 53.34 1x5o s ALA 15 Cb -0.07 -0.08 -0.04 0.00 0.00 0.00 0.00 23.12 22.92 1x5o s ALA 15 CO -0.11 -0.56 0.17 -0.65 0.00 0.00 0.00 175.76 174.60 1x5o s GLN 16 N -2.40 2.40 -0.68 0.00 1.11 -1.26 -5.05 119.66 113.78 1x5o s GLN 16 Ca 0.06 -1.55 0.00 0.00 0.01 0.00 0.00 55.36 53.88 1x5o s GLN 16 Cb -0.01 -2.19 0.39 0.00 -1.01 0.00 0.00 33.01 30.19 1x5o s GLN 16 CO -0.05 0.07 1.75 -0.12 0.01 0.00 0.00 175.29 176.94 1x5o n MET 17 N -1.20 2.97 -3.56 2.91 1.56 -1.26 -4.97 117.12 113.58 1x5o n MET 17 Ca -0.02 -3.77 -0.07 0.00 -0.27 0.00 0.00 57.70 53.56 1x5o n MET 17 Cb 0.61 -2.27 -0.02 0.00 2.15 0.00 0.00 33.22 33.70 1x5o n MET 17 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1x5o s ALA 18 N -3.87 -1.75 -0.02 -5.12 0.00 -1.26 -5.09 121.76 104.64 1x5o s ALA 18 Ca 0.53 0.73 -0.02 0.00 0.00 0.00 0.00 51.96 53.20 1x5o s ALA 18 Cb 0.44 0.52 -0.02 0.00 0.00 0.00 0.00 23.12 24.06 1x5o s ALA 18 CO -0.26 -0.79 -0.05 0.36 0.00 0.00 0.00 175.76 175.02 1x5o n LYS 19 N -0.31 0.08 -2.70 0.00 2.85 -1.26 -4.97 118.16 111.84 1x5o n LYS 19 Ca -0.09 0.03 -0.43 0.00 -1.05 0.00 0.00 58.31 56.78 1x5o n LYS 19 Cb 0.62 -0.63 -0.03 0.00 -0.65 0.00 0.00 35.03 34.34 1x5o n LYS 19 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 177.40 176.70 1x5o s GLN 20 N -2.08 3.68 0.32 -1.58 -1.52 -1.26 -5.02 119.66 112.20 1x5o s GLN 20 Ca -0.05 0.44 -0.26 0.00 -1.95 0.00 0.00 55.36 53.54 1x5o s GLN 20 Cb 0.02 -3.90 -0.10 0.00 -0.22 0.00 0.00 33.01 28.81 1x5o s GLN 20 CO 0.07 -1.26 0.95 1.14 -0.25 0.00 0.00 175.29 175.94 1x5o s GLN 21 N 4.07 4.57 -0.13 2.91 -2.07 -1.26 -5.06 119.66 122.69 1x5o s GLN 21 Ca 0.43 1.36 -0.05 0.00 -1.82 0.00 0.00 55.36 55.27 1x5o s GLN 21 Cb -0.09 -2.81 0.06 0.00 -1.09 0.00 0.00 33.01 29.08 1x5o s GLN 21 CO 0.28 0.26 0.27 -1.21 -1.32 0.00 0.00 175.29 173.58 1x5o s GLU 22 N -2.03 0.18 0.00 9.60 2.02 -1.26 -4.90 118.70 122.31 1x5o s GLU 22 Ca 0.50 0.72 0.00 0.00 0.02 0.00 0.00 54.97 56.21 1x5o s GLU 22 Cb -0.19 -0.03 0.00 0.00 0.10 0.00 0.00 34.13 34.00 1x5o s GLU 22 CO 0.25 -0.25 0.51 0.00 0.02 0.00 0.00 175.26 175.79 1x5o n GLN 23 N 5.04 -0.07 -3.29 1.61 10.64 -1.26 -4.84 117.38 125.21 1x5o n GLN 23 Ca -0.12 -0.60 -0.25 0.00 -1.83 0.00 0.00 57.00 54.20 1x5o n GLN 23 Cb 0.51 -0.89 -0.07 0.00 -0.86 0.00 0.00 30.24 28.92 1x5o n GLN 23 CO 0.00 0.00 0.00 -3.47 -1.83 0.00 0.00 177.06 171.76 1x5o n ASP 24 N -0.09 1.76 0.00 2.61 2.03 -1.26 -4.91 116.55 116.69 1x5o n ASP 24 Ca 0.00 -3.03 0.08 0.00 0.52 0.00 0.00 54.79 52.36 1x5o n ASP 24 Cb 0.11 -0.65 0.46 0.00 -0.72 0.00 0.00 41.12 40.31 1x5o n ASP 24 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1x5o n PRO 25 N 1.14 0.49 -0.53 -0.67 -0.04 -1.26 -3.93 135.00 130.21 1x5o n PRO 25 Ca 0.25 0.00 0.41 0.00 -0.04 0.00 0.00 63.50 64.12 1x5o n PRO 25 Cb 0.48 -1.49 0.65 0.00 -0.04 0.00 0.00 33.50 33.09 1x5o n PRO 25 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1x5o n THR 26 N -0.99 -0.08 -3.34 0.52 -2.24 -1.26 -4.21 114.28 102.68 1x5o n THR 26 Ca 0.12 1.35 -0.34 0.00 -2.27 0.00 0.00 64.05 62.91 1x5o n THR 26 Cb 0.05 -2.24 -0.06 0.00 -2.10 0.00 0.00 70.33 65.99 1x5o n THR 26 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1x5o s ASN 27 N -4.04 6.76 0.15 3.42 -0.87 -1.25 -1.01 114.94 118.09 1x5o s ASN 27 Ca -0.05 1.07 0.11 0.00 -1.57 0.00 0.00 52.86 52.42 1x5o s ASN 27 Cb 0.24 -2.28 -0.04 0.00 -0.02 0.00 0.00 41.25 39.14 1x5o s ASN 27 CO 0.73 -0.00 -0.25 -0.76 -2.57 0.00 0.00 177.10 174.24 1x5o s LEU 28 N -2.39 2.36 -0.44 0.60 1.43 -0.63 -3.28 118.68 116.33 1x5o s LEU 28 Ca 0.43 -0.78 -0.12 0.00 -1.03 0.00 0.00 54.13 52.63 1x5o s LEU 28 Cb -0.13 -1.17 0.07 0.00 0.03 0.00 0.00 46.19 44.99 1x5o s LEU 28 CO 0.20 0.15 0.31 -0.47 0.23 0.00 0.00 176.35 176.77 1x5o s TYR 29 N -1.29 3.28 -0.30 0.29 6.14 0.32 -3.76 117.35 122.04 1x5o s TYR 29 Ca 0.16 -1.16 0.02 0.00 0.64 0.00 0.00 57.07 56.73 1x5o s TYR 29 Cb -0.09 -2.97 0.07 0.00 0.42 0.00 0.00 41.96 39.39 1x5o s TYR 29 CO 0.07 -0.79 -0.02 0.42 0.64 0.00 0.00 175.55 175.87 1x5o s ILE 30 N 1.55 2.45 0.31 3.14 1.01 -1.18 -0.64 121.20 127.84 1x5o s ILE 30 Ca 0.03 -1.80 0.03 0.00 0.00 0.00 0.00 60.65 58.91 1x5o s ILE 30 Cb -0.23 -2.55 0.03 0.00 0.01 0.00 0.00 42.46 39.72 1x5o s ILE 30 CO 0.05 -0.24 0.22 -1.54 0.00 0.00 0.00 174.94 173.43 1x5o n SER 31 N 4.44 2.03 -2.90 3.58 3.41 -0.91 -0.83 113.62 122.43 1x5o n SER 31 Ca -0.08 -2.08 -0.13 0.00 -0.26 0.00 0.00 58.87 56.31 1x5o n SER 31 Cb 0.42 -0.01 0.07 0.00 -0.26 0.00 0.00 64.21 64.42 1x5o n SER 31 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1x5o n ASN 32 N -1.88 -3.07 -4.72 4.04 3.02 0.22 -2.62 115.26 110.25 1x5o n ASN 32 Ca -0.02 -0.51 -0.28 0.00 -0.03 0.00 0.00 54.58 53.75 1x5o n ASN 32 Cb 0.36 -4.16 -0.07 0.00 -0.61 0.00 0.00 39.78 35.30 1x5o n ASN 32 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1x5o s LEU 33 N -5.27 3.55 0.24 3.41 1.43 0.59 -4.48 118.68 118.15 1x5o s LEU 33 Ca 0.10 -0.21 -0.30 0.00 -1.03 0.00 0.00 54.13 52.70 1x5o s LEU 33 Cb -0.01 -2.22 -0.09 0.00 0.03 0.00 0.00 46.19 43.89 1x5o s LEU 33 CO 0.58 0.12 1.27 -2.16 0.23 0.00 0.00 176.35 176.39 1x5o s PRO 34 N -2.72 4.42 0.15 1.29 0.04 -1.26 -4.00 135.00 132.91 1x5o s PRO 34 Ca 0.28 2.05 0.09 0.00 0.04 0.00 0.00 61.00 63.46 1x5o s PRO 34 Cb -0.11 -3.17 0.49 0.00 0.04 0.00 0.00 34.50 31.76 1x5o s PRO 34 CO 0.20 -0.17 1.24 1.28 0.04 0.00 0.00 177.00 179.59 1x5o n LEU 35 N 2.00 0.24 -1.21 -3.56 4.77 -1.26 0.29 117.00 118.26 1x5o n LEU 35 Ca 0.04 0.57 0.10 0.00 -0.03 0.00 0.00 56.01 56.69 1x5o n LEU 35 Cb 0.43 -0.59 0.29 0.00 -2.33 0.00 0.00 43.42 41.22 1x5o n LEU 35 CO 0.57 -0.65 0.74 -1.20 -1.33 0.00 0.00 177.39 175.53 1x5o n SER 36 N -1.80 3.53 -4.77 -1.43 7.64 -1.26 -4.59 113.62 110.94 1x5o n SER 36 Ca -0.01 -2.06 -0.38 0.00 1.01 0.00 0.00 58.87 57.44 1x5o n SER 36 Cb 0.08 -0.44 -0.03 0.00 -1.01 0.00 0.00 64.21 62.80 1x5o n SER 36 CO 0.00 0.00 0.00 -0.32 -3.01 0.00 0.00 175.04 171.71 1x5o s MET 37 N -1.24 4.24 0.08 1.43 0.00 0.14 -4.99 119.30 118.95 1x5o s MET 37 Ca 0.43 1.71 0.06 0.00 0.00 0.00 0.00 55.69 57.89 1x5o s MET 37 Cb 0.23 -2.75 -0.03 0.00 0.00 0.00 0.00 34.83 32.28 1x5o s MET 37 CO 0.28 -0.13 -0.17 0.16 0.00 0.00 0.00 175.02 175.16 1x5o s ASP 38 N -1.23 2.07 0.54 1.11 -4.77 -1.26 -5.00 116.67 108.13 1x5o s ASP 38 Ca 0.54 -0.62 0.44 0.00 -3.30 0.00 0.00 52.55 49.61 1x5o s ASP 38 Cb -0.28 -0.10 1.51 0.00 -1.09 0.00 0.00 42.92 42.96 1x5o s ASP 38 CO 0.35 0.00 1.43 -0.62 0.70 0.00 0.00 175.17 177.04 1x5o n GLU 39 N 1.30 0.00 0.29 2.11 1.02 -1.26 -0.15 120.64 123.97 1x5o n GLU 39 Ca -0.20 1.02 -0.12 0.00 -0.02 0.00 0.00 57.16 57.84 1x5o n GLU 39 Cb 0.54 -2.38 -0.06 0.00 -0.02 0.00 0.00 31.44 29.52 1x5o n GLU 39 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 1x5o h GLN 40 N 0.00 -0.74 -0.43 3.49 4.15 -1.97 -3.20 115.11 116.41 1x5o h GLN 40 Ca 0.82 0.05 0.09 0.00 0.77 0.00 0.00 58.65 60.37 1x5o h GLN 40 Cb 3.45 0.17 -0.09 0.00 0.21 0.00 0.00 27.48 31.22 1x5o h GLN 40 CO -0.01 -0.50 -0.30 1.49 -1.93 0.00 0.00 178.83 177.59 1x5o h GLU 41 N -0.98 -0.20 -1.75 1.69 4.57 -0.94 0.28 114.58 117.24 1x5o h GLU 41 Ca -0.08 0.01 0.53 0.00 -1.18 0.00 0.00 59.36 58.64 1x5o h GLU 41 Cb 0.59 0.05 -0.09 0.00 -0.16 0.00 0.00 28.75 29.14 1x5o h GLU 41 CO 0.13 -0.14 1.23 1.25 -1.18 0.00 0.00 179.01 180.31 1x5o h LEU 42 N -0.21 0.06 0.04 1.64 5.85 -1.54 0.29 115.31 121.44 1x5o h LEU 42 Ca 0.19 0.04 -0.33 0.00 0.84 0.00 0.00 57.88 58.62 1x5o h LEU 42 Cb 0.52 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.55 1x5o h LEU 42 CO -0.55 -0.06 -1.84 1.21 -0.34 0.00 0.00 178.44 176.86 1x5o n GLU 43 N -4.17 0.64 -0.34 1.25 2.13 0.73 -3.78 120.64 117.10 1x5o n GLU 43 Ca 0.42 0.38 0.28 0.00 0.66 0.00 0.00 57.16 58.89 1x5o n GLU 43 Cb 1.83 -1.67 0.59 0.00 0.27 0.00 0.00 31.44 32.45 1x5o n GLU 43 CO 0.00 0.00 0.00 -0.91 -0.41 0.00 0.00 177.13 175.81 1x5o h ASN 44 N -0.54 0.31 0.41 4.31 2.35 0.21 1.96 115.58 124.59 1x5o h ASN 44 Ca -0.46 0.07 -0.23 0.00 -0.55 0.00 0.00 56.30 55.14 1x5o h ASN 44 Cb 1.66 0.03 0.00 0.00 0.05 0.00 0.00 38.32 40.06 1x5o h ASN 44 CO -0.13 0.03 -0.96 0.00 -1.65 0.00 0.00 177.43 174.71 1x5o h MET 45 N 0.26 0.36 -0.01 0.81 -0.00 -1.29 -3.17 114.93 111.88 1x5o h MET 45 Ca 0.62 -0.41 0.00 0.00 -0.00 0.00 0.00 59.70 59.91 1x5o h MET 45 Cb 1.84 0.12 0.00 0.00 -0.00 0.00 0.00 31.60 33.57 1x5o h MET 45 CO -0.25 1.09 -0.15 1.28 -0.00 0.00 0.00 176.91 178.89 1x5o n LEU 46 N -3.71 1.62 0.41 -0.10 4.77 0.19 -4.33 117.00 115.84 1x5o n LEU 46 Ca -0.06 -0.52 -0.17 0.00 -0.03 0.00 0.00 56.01 55.23 1x5o n LEU 46 Cb 0.85 -0.04 -0.08 0.00 -2.33 0.00 0.00 43.42 41.82 1x5o n LEU 46 CO 0.51 0.28 0.44 0.11 -1.33 0.00 0.00 177.39 177.41 1x5o h LYS 47 N 2.31 -1.03 0.00 3.23 1.57 0.28 -1.56 116.57 121.37 1x5o h LYS 47 Ca 0.00 0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1x5o h LYS 47 Cb 0.61 0.23 0.00 0.00 0.08 0.00 0.00 32.23 33.15 1x5o h LYS 47 CO 0.00 -0.68 0.00 -0.35 -0.57 0.00 0.00 179.45 177.85 1x5o n PRO 48 N -5.49 0.49 -0.11 3.15 -0.04 -1.26 -2.59 135.00 129.16 1x5o n PRO 48 Ca -0.13 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.18 1x5o n PRO 48 Cb 0.42 -1.35 -0.11 0.00 -0.04 0.00 0.00 33.50 32.42 1x5o n PRO 48 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1x5o n PHE 49 N -0.85 0.00 0.00 0.54 3.01 -1.07 -5.10 117.46 113.99 1x5o n PHE 49 Ca 0.08 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.54 1x5o n PHE 49 Cb 0.04 -0.89 0.00 0.00 -0.01 0.00 0.00 39.48 38.62 1x5o n PHE 49 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1x5o n GLY 50 N 2.32 -0.22 3.59 1.37 0.00 -0.61 -4.94 105.19 106.70 1x5o n GLY 50 Ca -0.39 -0.94 -0.42 0.00 0.00 0.00 0.00 46.02 44.28 1x5o n GLY 50 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1x5o s GLN 51 N -2.00 3.13 -0.09 1.61 2.00 -1.26 -4.35 119.66 118.70 1x5o s GLN 51 Ca 0.00 1.33 -0.30 0.00 -2.00 0.00 0.00 55.36 54.39 1x5o s GLN 51 Cb 0.00 -4.26 -0.03 0.00 0.80 0.00 0.00 33.01 29.52 1x5o s GLN 51 CO 0.00 -2.11 1.22 0.08 -0.50 0.00 0.00 175.29 173.99 1x5o s VAL 52 N 7.67 4.25 -0.16 1.34 1.01 -1.26 -3.06 120.40 130.18 1x5o s VAL 52 Ca 0.80 1.56 -0.18 0.00 0.00 0.00 0.00 61.98 64.16 1x5o s VAL 52 Cb -0.21 -4.00 -0.15 0.00 0.00 0.00 0.00 36.38 32.02 1x5o s VAL 52 CO 0.31 -0.04 0.25 0.40 0.00 0.00 0.00 175.10 176.02 1x5o h ILE 53 N 5.15 0.83 -2.82 2.22 1.08 -1.60 -3.49 117.51 118.88 1x5o h ILE 53 Ca -0.32 -1.82 -0.12 0.00 -0.39 0.00 0.00 64.86 62.22 1x5o h ILE 53 Cb 1.14 1.76 -0.22 0.00 -3.07 0.00 0.00 36.82 36.43 1x5o h ILE 53 CO 0.91 0.28 -0.23 -0.94 -0.69 0.00 0.00 178.15 177.48 1x5o s SER 54 N -6.28 -0.34 -0.02 1.72 1.04 -1.24 -5.00 113.70 103.58 1x5o s SER 54 Ca -0.19 0.50 0.02 0.00 0.48 0.00 0.00 55.95 56.75 1x5o s SER 54 Cb 0.02 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.73 1x5o s SER 54 CO 0.46 -0.30 -0.07 0.42 0.98 0.00 0.00 173.24 174.72 1x5o s THR 55 N -0.54 0.62 0.03 2.02 -4.23 -1.26 -1.05 115.64 111.23 1x5o s THR 55 Ca -0.07 -0.28 -0.00 0.00 -1.18 0.00 0.00 61.69 60.16 1x5o s THR 55 Cb -0.04 -0.56 -0.03 0.00 1.34 0.00 0.00 72.50 73.22 1x5o s THR 55 CO 0.03 0.20 -0.03 -0.60 -0.54 0.00 0.00 174.62 173.67 1x5o s ARG 56 N 0.18 0.43 -0.18 3.99 3.52 -0.41 -4.98 118.95 121.50 1x5o s ARG 56 Ca -0.02 -0.82 -0.00 0.00 -0.13 0.00 0.00 55.73 54.76 1x5o s ARG 56 Cb -0.07 0.10 0.04 0.00 -1.56 0.00 0.00 34.95 33.46 1x5o s ARG 56 CO 0.00 -0.06 -0.07 0.42 -0.81 0.00 0.00 175.30 174.78 1x5o s ILE 57 N -2.23 1.28 0.32 4.11 -1.09 -1.26 -0.66 121.20 121.67 1x5o s ILE 57 Ca -0.08 -0.75 -0.29 0.00 -2.23 0.00 0.00 60.65 57.31 1x5o s ILE 57 Cb -0.04 -1.42 -0.13 0.00 -1.58 0.00 0.00 42.46 39.29 1x5o s ILE 57 CO -0.04 0.14 1.31 0.18 -1.23 0.00 0.00 174.94 175.30 1x5o n LEU 58 N 4.81 3.42 -4.43 2.97 4.77 -0.12 -4.89 117.00 123.54 1x5o n LEU 58 Ca -0.13 1.19 -0.26 0.00 -0.03 0.00 0.00 56.01 56.79 1x5o n LEU 58 Cb 0.47 -1.47 -0.11 0.00 -2.33 0.00 0.00 43.42 39.98 1x5o n LEU 58 CO 0.18 -0.51 -0.51 -0.13 -1.33 0.00 0.00 177.39 175.09 1x5o s ARG 59 N -1.57 1.54 0.57 3.23 0.52 -1.26 -0.69 118.95 121.29 1x5o s ARG 59 Ca 0.58 -1.58 0.04 0.00 -0.52 0.00 0.00 55.73 54.25 1x5o s ARG 59 Cb -0.59 -1.77 0.06 0.00 0.52 0.00 0.00 34.95 33.18 1x5o s ARG 59 CO 0.60 0.37 0.80 -0.51 0.02 0.00 0.00 175.30 176.57 1x5o s ASP 60 N -2.89 5.07 0.32 0.23 1.01 0.27 -4.78 116.67 115.91 1x5o s ASP 60 Ca 0.23 -0.33 0.11 0.00 0.71 0.00 0.00 52.55 53.26 1x5o s ASP 60 Cb -0.07 -0.40 0.95 0.00 1.01 0.00 0.00 42.92 44.41 1x5o s ASP 60 CO 0.11 -1.29 1.70 0.28 0.21 0.00 0.00 175.17 176.17 1x5o h SER 61 N 0.04 0.56 -0.27 0.27 0.02 -1.99 1.09 113.55 113.26 1x5o h SER 61 Ca -0.38 0.16 -0.11 0.00 -0.84 0.00 0.00 61.79 60.63 1x5o h SER 61 Cb 1.28 0.09 -0.06 0.00 0.14 0.00 0.00 62.40 63.85 1x5o h SER 61 CO 0.46 -0.01 0.13 -0.24 -1.14 0.00 0.00 176.83 176.03 1x5o n SER 62 N -4.98 2.98 -3.32 3.07 2.88 -1.26 -4.83 113.62 108.16 1x5o n SER 62 Ca 0.28 -2.44 -0.24 0.00 -1.33 0.00 0.00 58.87 55.15 1x5o n SER 62 Cb 0.84 -0.59 0.02 0.00 -0.75 0.00 0.00 64.21 63.72 1x5o n SER 62 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x5o n GLY 63 N 0.06 -0.50 3.38 0.46 0.00 0.38 -4.96 105.19 103.99 1x5o n GLY 63 Ca 0.15 0.13 -0.33 0.00 0.00 0.00 0.00 46.02 45.97 1x5o n GLY 63 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1x5o s THR 64 N -3.09 3.11 0.38 2.61 2.01 -1.22 -4.72 115.64 114.71 1x5o s THR 64 Ca 0.41 -0.64 -0.18 0.00 0.31 0.00 0.00 61.69 61.59 1x5o s THR 64 Cb -0.20 -2.31 -0.14 0.00 0.01 0.00 0.00 72.50 69.86 1x5o s THR 64 CO 0.51 0.52 0.04 -0.24 -0.69 0.00 0.00 174.62 174.76 1x5o n SER 65 N 3.56 -2.72 -1.07 3.53 2.88 -1.26 0.96 113.62 119.50 1x5o n SER 65 Ca -0.18 0.70 0.08 0.00 -1.33 0.00 0.00 58.87 58.14 1x5o n SER 65 Cb 0.53 -0.79 0.27 0.00 -0.75 0.00 0.00 64.21 63.47 1x5o n SER 65 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1x5o n ARG 66 N 1.23 3.29 -1.88 -1.46 1.74 0.14 -4.55 116.66 115.17 1x5o n ARG 66 Ca 0.09 -2.77 -0.17 0.00 -0.77 0.00 0.00 57.85 54.24 1x5o n ARG 66 Cb 0.37 -1.82 -0.04 0.00 -1.02 0.00 0.00 32.46 29.95 1x5o n ARG 66 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1x5o n GLY 67 N -0.02 0.76 2.82 -0.13 0.00 -1.26 -4.85 105.19 102.52 1x5o n GLY 67 Ca 0.21 -0.19 -0.15 0.00 0.00 0.00 0.00 46.02 45.89 1x5o n GLY 67 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x5o s VAL 68 N -2.73 -0.07 0.06 1.61 1.01 -1.26 0.70 120.40 119.71 1x5o s VAL 68 Ca 0.00 0.23 0.06 0.00 0.00 0.00 0.00 61.98 62.27 1x5o s VAL 68 Cb 0.00 -0.15 -0.03 0.00 0.00 0.00 0.00 36.38 36.20 1x5o s VAL 68 CO 0.00 0.09 -0.17 -0.83 0.00 0.00 0.00 175.10 174.20 1x5o s GLY 69 N 1.26 0.95 -0.23 4.51 0.00 -0.01 -0.94 107.32 112.86 1x5o s GLY 69 Ca -0.07 -0.99 -0.03 0.00 0.00 0.00 0.00 44.72 43.62 1x5o s GLY 69 CO -0.04 -0.97 -0.04 -1.36 0.00 0.00 0.00 173.10 170.68 1x5o s PHE 70 N -1.00 2.99 -0.00 1.90 0.08 0.17 -3.12 117.98 119.00 1x5o s PHE 70 Ca 0.03 -1.14 0.05 0.00 0.12 0.00 0.00 56.93 55.99 1x5o s PHE 70 Cb -0.09 -2.10 -0.03 0.00 -0.57 0.00 0.00 43.02 40.23 1x5o s PHE 70 CO 0.02 -0.61 -0.16 0.00 -0.10 0.00 0.00 175.22 174.37 1x5o s ALA 71 N 1.43 2.63 -0.35 5.36 0.00 -1.25 -1.29 121.76 128.30 1x5o s ALA 71 Ca 0.04 -1.09 -0.05 0.00 0.00 0.00 0.00 51.96 50.87 1x5o s ALA 71 Cb -0.15 -0.86 0.06 0.00 0.00 0.00 0.00 23.12 22.17 1x5o s ALA 71 CO -0.04 0.57 0.11 0.50 0.00 0.00 0.00 175.76 176.90 1x5o s ARG 72 N -1.10 2.48 0.50 0.00 3.52 -0.21 -1.61 118.95 122.53 1x5o s ARG 72 Ca 0.13 -1.32 -0.18 0.00 -0.13 0.00 0.00 55.73 54.23 1x5o s ARG 72 Cb -0.11 -3.43 -0.08 0.00 -1.56 0.00 0.00 34.95 29.77 1x5o s ARG 72 CO 0.03 -0.74 0.99 -1.64 -0.81 0.00 0.00 175.30 173.13 1x5o s MET 73 N 1.33 3.95 0.48 5.12 -1.94 -0.18 -1.51 119.30 126.53 1x5o s MET 73 Ca -0.01 1.05 0.18 0.00 -1.71 0.00 0.00 55.69 55.21 1x5o s MET 73 Cb -0.20 -2.13 1.19 0.00 2.01 0.00 0.00 34.83 35.69 1x5o s MET 73 CO 0.01 -0.28 2.00 1.05 -0.01 0.00 0.00 175.02 177.79 1x5o h GLU 74 N 1.17 0.22 -2.75 2.03 4.11 -1.84 -3.45 114.58 114.07 1x5o h GLU 74 Ca -0.48 -0.01 0.08 0.00 0.07 0.00 0.00 59.36 59.02 1x5o h GLU 74 Cb 1.19 -0.05 -0.09 0.00 0.50 0.00 0.00 28.75 30.30 1x5o h GLU 74 CO 0.61 0.14 0.32 -1.54 0.07 0.00 0.00 179.01 178.61 1x5o s SER 75 N -6.29 -0.34 0.38 3.06 1.04 -1.26 -5.04 113.70 105.26 1x5o s SER 75 Ca -0.06 -0.32 0.11 0.00 0.48 0.00 0.00 55.95 56.15 1x5o s SER 75 Cb 0.19 0.59 0.76 0.00 0.10 0.00 0.00 66.02 67.67 1x5o s SER 75 CO 0.74 -1.04 1.88 0.74 0.98 0.00 0.00 173.24 176.53 1x5o h THR 76 N 2.00 1.21 -1.00 2.02 2.02 -1.89 -2.76 112.91 114.51 1x5o h THR 76 Ca -0.25 -0.95 0.17 0.00 0.77 0.00 0.00 66.41 66.15 1x5o h THR 76 Cb 1.26 1.40 -0.10 0.00 -1.74 0.00 0.00 68.15 68.96 1x5o h THR 76 CO 0.29 0.29 0.60 -0.08 0.37 0.00 0.00 175.52 176.99 1x5o h GLU 77 N 0.14 0.78 0.03 6.66 4.57 -1.99 -1.79 114.58 122.97 1x5o h GLU 77 Ca 0.02 -0.05 -0.14 0.00 -1.18 0.00 0.00 59.36 58.02 1x5o h GLU 77 Cb 0.48 -0.18 0.01 0.00 -0.16 0.00 0.00 28.75 28.91 1x5o h GLU 77 CO 0.03 0.51 -0.56 0.87 -1.18 0.00 0.00 179.01 178.69 1x5o h LYS 78 N 0.80 0.34 -0.96 1.92 1.79 -1.88 -3.33 116.57 115.25 1x5o h LYS 78 Ca 0.56 -0.40 0.17 0.00 -2.18 0.00 0.00 60.65 58.80 1x5o h LYS 78 Cb 0.81 0.12 -0.17 0.00 -1.58 0.00 0.00 32.23 31.41 1x5o h LYS 78 CO -0.36 1.09 -0.32 0.00 -1.08 0.00 0.00 179.45 178.78 1x5o h GLU 80 N 0.00 -0.29 -0.64 0.00 5.08 -1.61 -0.92 114.58 116.21 1x5o h GLU 80 Ca 0.39 0.02 0.11 0.00 -1.00 0.00 0.00 59.36 58.87 1x5o h GLU 80 Cb 0.62 0.07 -0.12 0.00 0.50 0.00 0.00 28.75 29.82 1x5o h GLU 80 CO -0.97 -0.19 -0.35 0.00 -1.00 0.00 0.00 179.01 176.51 1x5o h ALA 81 N 0.22 -0.03 -0.14 3.43 0.00 -0.96 0.29 119.26 122.07 1x5o h ALA 81 Ca 0.11 0.17 0.03 0.00 0.00 0.00 0.00 54.91 55.22 1x5o h ALA 81 Cb 0.56 0.82 -0.05 0.00 0.00 0.00 0.00 17.79 19.12 1x5o h ALA 81 CO -0.67 -0.68 -0.43 0.28 0.00 0.00 0.00 179.25 177.75 1x5o h VAL 82 N -0.15 0.00 -0.12 0.00 2.07 -0.92 -2.20 116.25 114.93 1x5o h VAL 82 Ca 0.24 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.81 1x5o h VAL 82 Cb 0.56 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.26 1x5o h VAL 82 CO -0.72 0.00 -0.37 0.40 0.02 0.00 0.00 177.57 176.90 1x5o h ILE 83 N -0.44 0.21 -1.00 4.57 2.04 -0.68 0.84 117.51 123.06 1x5o h ILE 83 Ca 0.03 0.00 0.39 0.00 1.00 0.00 0.00 64.86 66.28 1x5o h ILE 83 Cb 0.52 0.21 -0.18 0.00 -0.74 0.00 0.00 36.82 36.64 1x5o h ILE 83 CO -0.36 0.00 0.49 1.23 0.00 0.00 0.00 178.15 179.52 1x5o h GLY 84 N -0.45 2.15 0.00 5.37 0.00 -0.54 0.25 103.07 109.84 1x5o h GLY 84 Ca 0.08 -0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.28 1x5o h GLY 84 CO -0.37 -0.73 0.00 1.57 0.00 0.00 0.00 176.54 177.01 1x5o n HIS 85 N -5.25 0.00 -0.35 5.60 -0.00 -0.45 -4.56 115.22 110.21 1x5o n HIS 85 Ca 0.36 0.00 -0.02 0.00 -0.00 0.00 0.00 57.72 58.06 1x5o n HIS 85 Cb 1.19 -0.15 0.02 0.00 -0.00 0.00 0.00 29.99 31.05 1x5o n HIS 85 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.34 177.53 1x5o n PHE 86 N -2.30 -0.02 -1.51 1.57 3.01 0.28 -3.94 117.46 114.56 1x5o n PHE 86 Ca 0.00 1.10 -0.32 0.00 1.01 0.00 0.00 57.45 59.24 1x5o n PHE 86 Cb 0.00 -0.81 -0.16 0.00 -0.01 0.00 0.00 39.48 38.50 1x5o n PHE 86 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 1x5o n ASN 87 N -5.29 -0.01 -0.04 4.37 2.85 0.85 0.19 115.26 118.18 1x5o n ASN 87 Ca 0.08 -0.25 0.00 0.00 -0.11 0.00 0.00 54.58 54.30 1x5o n ASN 87 Cb 0.34 -0.91 0.00 0.00 1.24 0.00 0.00 39.78 40.46 1x5o n ASN 87 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1x5o n GLY 88 N 6.13 1.03 3.38 8.20 0.00 -1.04 -4.93 105.19 117.95 1x5o n GLY 88 Ca 0.62 -0.51 -0.26 0.00 0.00 0.00 0.00 46.02 45.88 1x5o n GLY 88 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1x5o s LYS 89 N -2.80 1.38 -0.22 1.61 2.47 0.49 -4.91 119.74 117.77 1x5o s LYS 89 Ca 0.00 -1.41 -0.03 0.00 -1.56 0.00 0.00 55.97 52.97 1x5o s LYS 89 Cb 0.00 -1.68 -0.00 0.00 -1.46 0.00 0.00 37.83 34.69 1x5o s LYS 89 CO 0.00 0.37 -0.07 -0.06 0.16 0.00 0.00 175.35 175.75 1x5o s PHE 90 N -1.56 2.94 0.06 4.03 0.40 -1.26 -1.85 117.98 120.74 1x5o s PHE 90 Ca 0.16 -1.09 -0.16 0.00 -0.60 0.00 0.00 56.93 55.24 1x5o s PHE 90 Cb -0.08 -2.08 -0.06 0.00 0.51 0.00 0.00 43.02 41.31 1x5o s PHE 90 CO 0.08 -0.60 0.50 0.96 0.70 0.00 0.00 175.22 176.85 1x5o s ILE 91 N 1.44 4.88 1.10 0.64 -4.36 -1.26 -5.08 121.20 118.55 1x5o s ILE 91 Ca 0.05 0.99 -0.18 0.00 -0.26 0.00 0.00 60.65 61.25 1x5o s ILE 91 Cb -0.14 -3.79 0.25 0.00 1.25 0.00 0.00 42.46 40.02 1x5o s ILE 91 CO -0.05 0.51 1.20 -0.54 0.24 0.00 0.00 174.94 176.30 1x5o s LYS 92 N -1.26 -0.39 0.08 0.37 -0.14 -1.26 -4.73 119.74 112.41 1x5o s LYS 92 Ca 0.29 -0.21 0.02 0.00 -1.36 0.00 0.00 55.97 54.70 1x5o s LYS 92 Cb -0.18 -1.71 -0.04 0.00 -1.68 0.00 0.00 37.83 34.23 1x5o s LYS 92 CO 0.17 -3.13 -0.07 0.95 -0.76 0.00 0.00 175.35 172.50 1x5o s THR 93 N -3.39 0.67 1.00 2.17 -4.23 -1.26 -5.02 115.64 105.57 1x5o s THR 93 Ca 0.72 -1.66 -0.12 0.00 -1.18 0.00 0.00 61.69 59.45 1x5o s THR 93 Cb -0.07 -1.34 0.19 0.00 1.34 0.00 0.00 72.50 72.62 1x5o s THR 93 CO 0.55 -0.70 1.09 -2.16 -0.54 0.00 0.00 174.62 172.86 1x5o s PRO 94 N -3.08 0.44 -0.61 3.99 0.04 -1.26 -4.92 135.00 129.60 1x5o s PRO 94 Ca 0.05 0.53 -0.26 0.00 0.04 0.00 0.00 61.00 61.36 1x5o s PRO 94 Cb 0.00 -1.74 -0.02 0.00 0.04 0.00 0.00 34.50 32.78 1x5o s PRO 94 CO -0.03 -2.73 1.87 -1.25 0.04 0.00 0.00 177.00 174.90 1x5o s PRO 95 N -4.96 2.62 0.00 0.56 0.04 -1.26 -2.48 135.00 129.52 1x5o s PRO 95 Ca 0.65 0.62 0.00 0.00 0.04 0.00 0.00 61.00 62.31 1x5o s PRO 95 Cb -0.19 -4.39 0.00 0.00 0.04 0.00 0.00 34.50 29.96 1x5o s PRO 95 CO 0.58 -2.74 0.00 0.41 0.04 0.00 0.00 177.00 175.29 1x5o n GLY 96 N 5.70 -0.04 3.35 0.56 0.00 -1.26 -5.14 105.19 108.37 1x5o n GLY 96 Ca 0.21 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.94 1x5o n GLY 96 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x5o s VAL 97 N -0.95 2.13 -0.23 1.61 1.01 -1.04 -5.11 120.40 117.82 1x5o s VAL 97 Ca 0.00 -1.54 -0.25 0.00 0.00 0.00 0.00 61.98 60.19 1x5o s VAL 97 Cb 0.00 -1.86 -0.01 0.00 0.00 0.00 0.00 36.38 34.52 1x5o s VAL 97 CO 0.00 0.22 0.83 -0.44 0.00 0.00 0.00 175.10 175.71 1x5o s SER 98 N -1.61 6.85 0.40 3.32 0.01 -1.26 -4.77 113.70 116.63 1x5o s SER 98 Ca 0.12 1.06 -0.26 0.00 1.31 0.00 0.00 55.95 58.18 1x5o s SER 98 Cb -0.10 -2.44 -0.09 0.00 0.21 0.00 0.00 66.02 63.60 1x5o s SER 98 CO 0.04 -0.50 1.31 0.00 0.41 0.00 0.00 173.24 174.50 1x5o s ALA 99 N 2.74 3.30 0.96 1.44 0.00 -1.26 -4.81 121.76 124.14 1x5o s ALA 99 Ca 0.35 1.25 -0.12 0.00 0.00 0.00 0.00 51.96 53.44 1x5o s ALA 99 Cb -0.15 -3.49 0.17 0.00 0.00 0.00 0.00 23.12 19.64 1x5o s ALA 99 CO 0.08 -0.81 1.09 -1.25 0.00 0.00 0.00 175.76 174.87 1x5o s PRO 100 N -2.18 0.71 -0.06 0.00 0.04 -1.26 -5.01 135.00 127.24 1x5o s PRO 100 Ca 0.56 0.62 0.05 0.00 0.04 0.00 0.00 61.00 62.27 1x5o s PRO 100 Cb -0.39 -1.76 -0.07 0.00 0.04 0.00 0.00 34.50 32.32 1x5o s PRO 100 CO 0.50 -2.56 0.02 2.41 0.04 0.00 0.00 177.00 177.41 1x5o n THR 101 N -4.08 0.39 -3.28 1.26 -1.04 -1.26 -5.02 114.28 101.25 1x5o n THR 101 Ca 0.06 -0.24 -0.36 0.00 -2.04 0.00 0.00 64.05 61.46 1x5o n THR 101 Cb 0.56 -0.82 -0.06 0.00 -1.82 0.00 0.00 70.33 68.19 1x5o n THR 101 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1x5o s GLU 102 N -2.15 4.08 0.57 -2.82 2.02 -1.26 -5.06 118.70 114.09 1x5o s GLU 102 Ca -0.03 0.62 -0.18 0.00 0.02 0.00 0.00 54.97 55.40 1x5o s GLU 102 Cb 0.02 -2.98 -0.04 0.00 0.10 0.00 0.00 34.13 31.23 1x5o s GLU 102 CO 0.24 0.49 1.12 -1.25 0.02 0.00 0.00 175.26 175.88 1x5o s PRO 103 N -1.81 3.21 -0.14 0.39 0.04 -1.26 -4.88 135.00 130.54 1x5o s PRO 103 Ca 0.37 1.55 -0.29 0.00 0.04 0.00 0.00 61.00 62.67 1x5o s PRO 103 Cb -0.16 -1.99 -0.02 0.00 0.04 0.00 0.00 34.50 32.36 1x5o s PRO 103 CO 0.20 -0.95 1.37 -0.51 0.04 0.00 0.00 177.00 177.14 1x5o s LEU 104 N -4.09 4.20 -0.63 -3.56 1.43 -0.77 -4.68 118.68 110.57 1x5o s LEU 104 Ca 0.71 1.81 -0.22 0.00 -1.03 0.00 0.00 54.13 55.40 1x5o s LEU 104 Cb -0.23 -3.54 0.07 0.00 0.03 0.00 0.00 46.19 42.53 1x5o s LEU 104 CO 0.31 -0.83 0.89 -0.22 0.23 0.00 0.00 176.35 176.73 1x5o s LEU 105 N 3.71 4.61 -0.35 1.79 2.96 -1.08 -2.50 118.68 127.82 1x5o s LEU 105 Ca 0.60 -1.04 -0.14 0.00 -0.22 0.00 0.00 54.13 53.33 1x5o s LEU 105 Cb -0.24 -2.42 -0.01 0.00 0.50 0.00 0.00 46.19 44.01 1x5o s LEU 105 CO 0.19 -1.33 0.28 0.00 -1.32 0.00 0.00 176.35 174.17 1x5o s LYS 107 N 1.80 0.23 -0.48 0.00 -2.85 0.19 -4.72 119.74 113.92 1x5o s LYS 107 Ca 0.07 0.47 -0.45 0.00 -1.00 0.00 0.00 55.97 55.06 1x5o s LYS 107 Cb -0.17 -0.03 -0.19 0.00 -2.06 0.00 0.00 37.83 35.37 1x5o s LYS 107 CO 0.11 -0.12 1.85 1.19 0.10 0.00 0.00 175.35 178.48 1x5o n PHE 108 N 3.80 1.54 0.00 1.78 3.72 -1.26 -0.52 117.46 126.52 1x5o n PHE 108 Ca -0.21 0.92 0.00 0.00 -0.05 0.00 0.00 57.45 58.11 1x5o n PHE 108 Cb 0.55 -2.28 0.00 0.00 -0.94 0.00 0.00 39.48 36.80 1x5o n PHE 108 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1x5o n SER 109 N 5.73 0.00 0.00 4.37 3.41 -1.20 -4.71 113.62 121.22 1x5o n SER 109 Ca 0.41 0.42 0.00 0.00 -0.26 0.00 0.00 58.87 59.43 1x5o n SER 109 Cb -0.03 -0.42 0.00 0.00 -0.26 0.00 0.00 64.21 63.50 1x5o n SER 109 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1x5o n GLY 110 N 2.08 0.71 3.77 5.00 0.00 -1.25 -4.97 105.19 110.52 1x5o n GLY 110 Ca 0.00 -2.13 -0.32 0.00 0.00 0.00 0.00 46.02 43.57 1x5o n GLY 110 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x5o s PRO 111 N -0.77 2.53 0.10 1.61 0.04 -1.26 -4.44 135.00 132.82 1x5o s PRO 111 Ca 0.00 1.29 0.02 0.00 0.04 0.00 0.00 61.00 62.34 1x5o s PRO 111 Cb 0.00 -1.92 -0.04 0.00 0.04 0.00 0.00 34.50 32.58 1x5o s PRO 111 CO 0.00 -1.44 0.20 -1.54 0.04 0.00 0.00 177.00 174.26 1x5o s SER 112 N -2.97 6.14 0.56 6.66 1.04 -1.26 -5.09 113.70 118.78 1x5o s SER 112 Ca 0.64 0.16 -0.18 0.00 0.48 0.00 0.00 55.95 57.05 1x5o s SER 112 Cb -0.19 -1.82 -0.05 0.00 0.10 0.00 0.00 66.02 64.06 1x5o s SER 112 CO 0.49 0.12 1.10 -0.55 0.98 0.00 0.00 173.24 175.38 1x5o s SER 113 N -2.77 5.72 0.00 7.02 0.15 -1.26 -5.27 113.70 117.29 1x5o s SER 113 Ca 0.34 2.04 0.00 0.00 0.70 0.00 0.00 55.95 59.03 1x5o s SER 113 Cb -0.12 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.63 1x5o s SER 113 CO 0.27 -1.22 0.00 0.61 1.20 0.00 0.00 173.24 174.10