#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5o h SER 2 N 0.00 0.56 -3.34 1.61 0.87 -2.12 -3.44 113.55 107.71 1x5o h SER 2 Ca 0.00 -0.58 -0.49 0.00 -1.23 0.00 0.00 61.79 59.49 1x5o h SER 2 Cb 0.00 -0.16 -0.35 0.00 -0.44 0.00 0.00 62.40 61.45 1x5o h SER 2 CO 0.00 1.04 -0.80 -0.55 -0.53 0.00 0.00 176.83 175.99 1x5o s SER 3 N -6.50 1.73 0.29 6.23 0.15 -1.26 -5.13 113.70 109.22 1x5o s SER 3 Ca -0.13 -0.25 -0.14 0.00 0.70 0.00 0.00 55.95 56.13 1x5o s SER 3 Cb 0.06 -0.73 0.05 0.00 -1.71 0.00 0.00 66.02 63.69 1x5o s SER 3 CO 0.80 -0.05 0.72 0.61 1.20 0.00 0.00 173.24 176.52 1x5o n GLY 4 N 4.33 1.04 3.62 9.45 0.00 -1.26 -5.12 105.19 117.25 1x5o n GLY 4 Ca -0.19 -1.20 -0.43 0.00 0.00 0.00 0.00 46.02 44.21 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 -2.83 6.37 -0.09 1.61 0.01 -1.26 -4.98 113.70 112.53 1x5o s SER 5 Ca 0.15 1.23 -0.00 0.00 1.31 0.00 0.00 55.95 58.63 1x5o s SER 5 Cb -0.04 -2.54 0.02 0.00 0.21 0.00 0.00 66.02 63.68 1x5o s SER 5 CO 0.09 -1.33 -0.06 -0.94 0.41 0.00 0.00 173.24 171.41 1x5o s SER 6 N 4.06 1.79 0.00 2.44 1.04 -1.26 -5.08 113.70 116.69 1x5o s SER 6 Ca 0.66 -0.22 0.00 0.00 0.48 0.00 0.00 55.95 56.87 1x5o s SER 6 Cb -0.19 -0.67 0.00 0.00 0.10 0.00 0.00 66.02 65.26 1x5o s SER 6 CO 0.29 -0.11 0.00 0.61 0.98 0.00 0.00 173.24 175.01 1x5o n GLY 7 N 4.73 -1.01 2.95 7.32 0.00 -1.26 -5.05 105.19 112.86 1x5o n GLY 7 Ca -0.14 -1.49 -0.15 0.00 0.00 0.00 0.00 46.02 44.24 1x5o n GLY 7 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1x5o s LEU 8 N -2.10 -0.13 0.38 0.99 1.98 -1.26 -5.16 118.68 113.39 1x5o s LEU 8 Ca 0.00 0.49 -0.05 0.00 -2.89 0.00 0.00 54.13 51.67 1x5o s LEU 8 Cb 0.00 0.54 -0.05 0.00 0.66 0.00 0.00 46.19 47.34 1x5o s LEU 8 CO 0.00 -0.23 0.67 -1.59 -1.89 0.00 0.00 176.35 173.31 1x5o s LYS 9 N 2.24 3.61 -0.04 1.98 -2.85 -1.26 -5.10 119.74 118.32 1x5o s LYS 9 Ca 0.01 0.11 -0.30 0.00 -1.00 0.00 0.00 55.97 54.79 1x5o s LYS 9 Cb -0.12 -2.51 0.11 0.00 -2.06 0.00 0.00 37.83 33.25 1x5o s LYS 9 CO -0.07 0.02 1.01 0.00 0.10 0.00 0.00 175.35 176.41 1x5o s ALA 10 N -2.39 -1.90 0.08 0.59 0.00 -1.26 -5.18 121.76 111.69 1x5o s ALA 10 Ca 0.46 1.08 0.02 0.00 0.00 0.00 0.00 51.96 53.52 1x5o s ALA 10 Cb -0.10 0.28 -0.03 0.00 0.00 0.00 0.00 23.12 23.26 1x5o s ALA 10 CO 0.36 -0.72 -0.08 -1.54 0.00 0.00 0.00 175.76 173.78 1x5o s SER 11 N -2.47 1.12 0.00 0.00 1.04 -1.26 -5.14 113.70 106.99 1x5o s SER 11 Ca 0.08 -0.80 0.00 0.00 0.48 0.00 0.00 55.95 55.70 1x5o s SER 11 Cb -0.01 0.05 0.00 0.00 0.10 0.00 0.00 66.02 66.17 1x5o s SER 11 CO -0.06 -0.32 0.00 0.61 0.98 0.00 0.00 173.24 174.44 1x5o n GLY 12 N 0.63 3.89 3.71 7.32 0.00 -1.26 -5.15 105.19 114.33 1x5o n GLY 12 Ca -0.17 -0.27 -0.34 0.00 0.00 0.00 0.00 46.02 45.24 1x5o n GLY 12 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1x5o s VAL 13 N 0.07 2.16 -0.05 1.61 -7.23 -1.26 -5.04 120.40 110.66 1x5o s VAL 13 Ca 0.00 0.08 0.01 0.00 -1.81 0.00 0.00 61.98 60.26 1x5o s VAL 13 Cb 0.00 -2.65 0.02 0.00 0.56 0.00 0.00 36.38 34.31 1x5o s VAL 13 CO 0.00 -0.04 -0.06 -1.58 -0.31 0.00 0.00 175.10 173.11 1x5o s GLN 14 N -3.91 0.99 -0.27 4.82 2.00 -1.26 -5.09 119.66 116.94 1x5o s GLN 14 Ca 0.75 -0.17 -0.37 0.00 -2.00 0.00 0.00 55.36 53.58 1x5o s GLN 14 Cb -0.30 -0.94 -0.13 0.00 0.80 0.00 0.00 33.01 32.43 1x5o s GLN 14 CO 0.46 -0.06 1.96 0.00 -0.50 0.00 0.00 175.29 177.16 1x5o n ALA 15 N 3.99 0.57 -2.11 1.58 0.00 -1.26 -4.81 120.51 118.47 1x5o n ALA 15 Ca -0.25 0.18 -0.29 0.00 0.00 0.00 0.00 53.44 53.09 1x5o n ALA 15 Cb 0.51 -2.42 -0.05 0.00 0.00 0.00 0.00 19.45 17.49 1x5o n ALA 15 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1x5o s GLN 16 N 4.78 2.65 -1.76 0.00 -0.21 -1.26 -4.12 119.66 119.75 1x5o s GLN 16 Ca 1.02 -0.91 -0.15 0.00 0.02 0.00 0.00 55.36 55.34 1x5o s GLN 16 Cb -0.90 -5.20 0.15 0.00 1.00 0.00 0.00 33.01 28.05 1x5o s GLN 16 CO 0.56 -3.60 0.38 -1.33 -2.12 0.00 0.00 175.29 169.18 1x5o n MET 17 N 8.51 -0.86 -4.01 2.91 2.81 -1.26 -4.89 117.12 120.33 1x5o n MET 17 Ca 0.43 0.13 -0.31 0.00 -1.81 0.00 0.00 57.70 56.14 1x5o n MET 17 Cb 0.47 -4.30 -0.15 0.00 -0.71 0.00 0.00 33.22 28.53 1x5o n MET 17 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1x5o s ALA 18 N -3.68 2.81 -0.11 3.04 0.00 -1.26 -4.98 121.76 117.58 1x5o s ALA 18 Ca 0.52 -2.42 -0.07 0.00 0.00 0.00 0.00 51.96 49.99 1x5o s ALA 18 Cb -0.30 -1.91 -0.02 0.00 0.00 0.00 0.00 23.12 20.88 1x5o s ALA 18 CO 1.02 -1.63 -0.13 0.87 0.00 0.00 0.00 175.76 175.88 1x5o h LYS 19 N 7.65 0.00 -5.74 0.00 1.79 -1.95 -3.47 116.57 114.85 1x5o h LYS 19 Ca -0.06 0.00 -0.58 0.00 -2.18 0.00 0.00 60.65 57.83 1x5o h LYS 19 Cb 1.02 0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 31.59 1x5o h LYS 19 CO 0.51 0.00 -0.17 -0.65 -1.08 0.00 0.00 179.45 178.07 1x5o s GLN 20 N -1.98 4.30 -0.28 3.15 -0.21 -1.26 -5.06 119.66 118.32 1x5o s GLN 20 Ca -0.11 0.41 -0.12 0.00 0.02 0.00 0.00 55.36 55.56 1x5o s GLN 20 Cb 0.02 -3.41 -0.05 0.00 1.00 0.00 0.00 33.01 30.56 1x5o s GLN 20 CO 0.17 0.22 0.23 -0.65 -2.12 0.00 0.00 175.29 173.13 1x5o s GLN 21 N 0.44 3.97 0.20 2.91 1.11 -1.26 -5.08 119.66 121.96 1x5o s GLN 21 Ca 0.25 -0.24 -0.17 0.00 0.01 0.00 0.00 55.36 55.20 1x5o s GLN 21 Cb -0.15 -3.65 -0.08 0.00 -1.01 0.00 0.00 33.01 28.12 1x5o s GLN 21 CO 0.10 -0.19 0.66 -1.21 0.01 0.00 0.00 175.29 174.66 1x5o s GLU 22 N 1.79 4.14 0.00 2.91 0.41 -1.26 -4.92 118.70 121.77 1x5o s GLU 22 Ca 0.09 0.72 0.00 0.00 -0.41 0.00 0.00 54.97 55.36 1x5o s GLU 22 Cb -0.16 -2.87 0.00 0.00 -1.78 0.00 0.00 34.13 29.33 1x5o s GLU 22 CO 0.11 0.41 0.66 1.04 -0.49 0.00 0.00 175.26 176.98 1x5o n GLN 23 N 0.67 0.96 -3.19 1.61 1.13 -1.26 -4.88 117.38 112.41 1x5o n GLN 23 Ca -0.03 -0.82 -0.24 0.00 -1.94 0.00 0.00 57.00 53.98 1x5o n GLN 23 Cb 0.51 -0.66 -0.06 0.00 0.11 0.00 0.00 30.24 30.15 1x5o n GLN 23 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 1x5o n ASP 24 N -0.16 2.21 0.00 1.08 2.03 -1.26 -4.90 116.55 115.55 1x5o n ASP 24 Ca 0.00 -3.19 0.07 0.00 0.52 0.00 0.00 54.79 52.19 1x5o n ASP 24 Cb 0.42 -0.62 0.33 0.00 -0.72 0.00 0.00 41.12 40.52 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 0.61 0.09 0.09 -0.67 -0.04 -1.26 -2.60 135.00 131.21 1x5o n PRO 25 Ca 0.27 0.21 -0.06 0.00 -0.04 0.00 0.00 63.50 63.87 1x5o n PRO 25 Cb 0.50 -1.50 0.04 0.00 -0.04 0.00 0.00 33.50 32.50 1x5o n PRO 25 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 1x5o h THR 26 N 0.00 1.50 -3.46 0.52 1.35 -1.90 -3.42 112.91 107.49 1x5o h THR 26 Ca 0.00 -2.53 -0.54 0.00 -0.55 0.00 0.00 66.41 62.80 1x5o h THR 26 Cb 0.20 2.38 -0.03 0.00 -1.73 0.00 0.00 68.15 68.96 1x5o h THR 26 CO 0.00 0.73 0.23 0.21 -0.25 0.00 0.00 175.52 176.44 1x5o s ASN 27 N -6.87 7.30 -0.12 5.36 3.84 -1.07 -2.02 114.94 121.36 1x5o s ASN 27 Ca -0.02 1.55 -0.01 0.00 0.21 0.00 0.00 52.86 54.59 1x5o s ASN 27 Cb 0.11 -2.51 -0.02 0.00 -0.55 0.00 0.00 41.25 38.28 1x5o s ASN 27 CO 0.81 -0.03 -0.09 -0.76 -2.79 0.00 0.00 177.10 174.23 1x5o s LEU 28 N 0.07 2.96 -0.64 3.21 1.43 -0.41 -2.57 118.68 122.73 1x5o s LEU 28 Ca 0.42 -0.20 -0.21 0.00 -1.03 0.00 0.00 54.13 53.11 1x5o s LEU 28 Cb -0.21 -1.67 0.08 0.00 0.03 0.00 0.00 46.19 44.42 1x5o s LEU 28 CO 0.25 0.22 0.87 -0.47 0.23 0.00 0.00 176.35 177.46 1x5o s TYR 29 N 0.01 2.80 -0.27 0.29 6.14 -0.58 -3.45 117.35 122.30 1x5o s TYR 29 Ca -0.02 -0.72 -0.08 0.00 0.64 0.00 0.00 57.07 56.88 1x5o s TYR 29 Cb -0.14 -4.19 -0.02 0.00 0.42 0.00 0.00 41.96 38.03 1x5o s TYR 29 CO 0.04 -1.52 0.10 0.42 0.64 0.00 0.00 175.55 175.22 1x5o s ILE 30 N 3.53 4.41 0.36 3.14 1.01 -1.15 -2.03 121.20 130.47 1x5o s ILE 30 Ca 0.18 -0.25 0.01 0.00 0.00 0.00 0.00 60.65 60.59 1x5o s ILE 30 Cb -0.19 -3.13 -0.00 0.00 0.01 0.00 0.00 42.46 39.15 1x5o s ILE 30 CO 0.08 0.25 0.03 -1.54 0.00 0.00 0.00 174.94 173.76 1x5o n SER 31 N 4.94 2.60 -3.02 3.58 3.41 -0.20 -0.81 113.62 124.12 1x5o n SER 31 Ca -0.15 -2.67 -0.15 0.00 -0.26 0.00 0.00 58.87 55.64 1x5o n SER 31 Cb 0.51 0.39 0.07 0.00 -0.26 0.00 0.00 64.21 64.92 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 -1.33 -2.48 -4.73 4.04 4.13 0.04 -2.59 115.26 112.33 1x5o n ASN 32 Ca -0.13 -0.50 -0.28 0.00 1.68 0.00 0.00 54.58 55.34 1x5o n ASN 32 Cb 0.48 -4.32 -0.07 0.00 -1.54 0.00 0.00 39.78 34.33 1x5o n ASN 32 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1x5o s LEU 33 N -5.68 3.59 0.28 3.41 1.43 -0.13 -4.60 118.68 116.97 1x5o s LEU 33 Ca 0.06 -0.19 -0.29 0.00 -1.03 0.00 0.00 54.13 52.68 1x5o s LEU 33 Cb -0.03 -2.25 -0.10 0.00 0.03 0.00 0.00 46.19 43.84 1x5o s LEU 33 CO 0.60 0.12 1.25 -2.16 0.23 0.00 0.00 176.35 176.39 1x5o s PRO 34 N -2.74 4.44 0.44 1.29 0.04 -1.26 -3.94 135.00 133.27 1x5o s PRO 34 Ca 0.28 2.06 0.29 0.00 0.04 0.00 0.00 61.00 63.68 1x5o s PRO 34 Cb -0.11 -3.14 1.59 0.00 0.04 0.00 0.00 34.50 32.89 1x5o s PRO 34 CO 0.21 -0.09 1.90 -0.07 0.04 0.00 0.00 177.00 178.98 1x5o h LEU 35 N 4.05 0.00 -2.64 -3.56 3.38 -1.92 0.82 115.31 115.44 1x5o h LEU 35 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1x5o h LEU 35 Cb 1.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 1x5o h LEU 35 CO 0.69 0.00 0.00 -1.20 0.09 0.00 0.00 178.44 178.02 1x5o n SER 36 N -2.54 4.06 -4.81 -0.43 7.64 -1.26 -4.59 113.62 111.69 1x5o n SER 36 Ca -0.02 -2.52 -0.34 0.00 1.01 0.00 0.00 58.87 57.01 1x5o n SER 36 Cb 0.05 -0.57 -0.06 0.00 -1.01 0.00 0.00 64.21 62.62 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 -2.05 4.14 0.08 1.43 0.00 0.28 -5.00 119.30 118.18 1x5o s MET 37 Ca 0.38 1.21 0.05 0.00 0.00 0.00 0.00 55.69 57.33 1x5o s MET 37 Cb 0.27 -2.21 -0.03 0.00 0.00 0.00 0.00 34.83 32.87 1x5o s MET 37 CO 0.14 -0.12 -0.13 0.16 0.00 0.00 0.00 175.02 175.07 1x5o s ASP 38 N -2.07 1.66 0.64 1.11 1.47 -1.26 -5.00 116.67 113.22 1x5o s ASP 38 Ca 0.63 -0.68 0.21 0.00 1.18 0.00 0.00 52.55 53.88 1x5o s ASP 38 Cb -0.12 -0.04 1.06 0.00 -0.34 0.00 0.00 42.92 43.48 1x5o s ASP 38 CO 0.16 -0.13 1.58 -0.33 0.68 0.00 0.00 175.17 177.13 1x5o h GLU 39 N 4.03 0.00 0.18 2.11 5.08 -1.96 0.83 114.58 124.86 1x5o h GLU 39 Ca -0.40 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 57.95 1x5o h GLU 39 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1x5o h GLU 39 CO 0.44 0.00 -0.09 0.37 -1.00 0.00 0.00 179.01 178.74 1x5o h GLN 40 N 0.00 -0.23 -0.03 2.33 5.75 -1.99 -3.08 115.11 117.86 1x5o h GLN 40 Ca 0.11 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.63 1x5o h GLN 40 Cb 1.45 0.05 -0.00 0.00 1.07 0.00 0.00 27.48 30.05 1x5o h GLN 40 CO -0.00 0.19 0.02 1.49 -2.65 0.00 0.00 178.83 177.87 1x5o h GLU 41 N -0.82 0.04 -1.11 1.69 4.57 -1.26 0.31 114.58 118.01 1x5o h GLU 41 Ca -0.02 -0.00 0.31 0.00 -1.18 0.00 0.00 59.36 58.46 1x5o h GLU 41 Cb 0.52 -0.01 -0.07 0.00 -0.16 0.00 0.00 28.75 29.03 1x5o h GLU 41 CO 0.04 0.03 0.76 1.25 -1.18 0.00 0.00 179.01 179.90 1x5o h LEU 42 N 0.04 0.23 0.15 1.64 5.85 -1.52 0.13 115.31 121.83 1x5o h LEU 42 Ca 0.01 0.05 -0.36 0.00 0.84 0.00 0.00 57.88 58.42 1x5o h LEU 42 Cb -0.00 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 1x5o h LEU 42 CO -0.01 0.03 -1.90 -0.08 -0.34 0.00 0.00 178.44 176.14 1x5o h GLU 43 N 0.20 0.31 -0.99 1.25 4.81 -1.29 -3.30 114.58 115.57 1x5o h GLU 43 Ca 0.59 -0.52 0.06 0.00 -0.13 0.00 0.00 59.36 59.36 1x5o h GLU 43 Cb 1.89 0.20 -0.07 0.00 0.63 0.00 0.00 28.75 31.40 1x5o h GLU 43 CO -0.17 1.24 0.64 -0.91 -0.73 0.00 0.00 179.01 179.08 1x5o h ASN 44 N 0.08 1.02 0.44 1.04 4.21 0.17 1.25 115.58 123.79 1x5o h ASN 44 Ca -0.39 0.01 -0.09 0.00 1.21 0.00 0.00 56.30 57.04 1x5o h ASN 44 Cb 2.06 -0.21 -0.01 0.00 -1.12 0.00 0.00 38.32 39.04 1x5o h ASN 44 CO 0.12 0.65 -0.42 0.00 -1.29 0.00 0.00 177.43 176.49 1x5o h MET 45 N 1.16 0.00 -0.01 0.81 -0.00 -0.99 -2.68 114.93 113.22 1x5o h MET 45 Ca 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 60.13 1x5o h MET 45 Cb 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.77 1x5o h MET 45 CO -0.17 0.42 -0.55 1.28 -0.00 0.00 0.00 176.91 177.89 1x5o n LEU 46 N -4.01 1.45 0.53 -0.10 4.77 -0.31 -4.43 117.00 114.90 1x5o n LEU 46 Ca -0.02 -0.53 -0.21 0.00 -0.03 0.00 0.00 56.01 55.23 1x5o n LEU 46 Cb 0.45 -0.05 -0.10 0.00 -2.33 0.00 0.00 43.42 41.39 1x5o n LEU 46 CO 0.39 0.29 0.54 0.11 -1.33 0.00 0.00 177.39 177.39 1x5o h LYS 47 N 1.41 -1.30 0.00 3.23 1.57 0.19 -0.96 116.57 120.71 1x5o h LYS 47 Ca 0.00 0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1x5o h LYS 47 Cb 0.62 0.29 0.00 0.00 0.08 0.00 0.00 32.23 33.23 1x5o h LYS 47 CO 0.00 -0.87 0.00 -0.35 -0.57 0.00 0.00 179.45 177.66 1x5o n PRO 48 N -5.67 0.49 -0.13 3.15 -0.04 -1.25 -2.80 135.00 128.74 1x5o n PRO 48 Ca -0.17 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.06 1x5o n PRO 48 Cb 0.53 -1.39 -0.11 0.00 -0.04 0.00 0.00 33.50 32.49 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 -0.89 0.00 -3.60 0.54 3.01 -0.92 -5.09 117.46 110.51 1x5o n PHE 49 Ca 0.09 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.56 1x5o n PHE 49 Cb 0.04 -1.00 -0.01 0.00 -0.01 0.00 0.00 39.48 38.50 1x5o n PHE 49 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1x5o s GLY 50 N -6.12 -0.36 -0.41 1.37 0.00 -0.41 -4.95 107.32 96.44 1x5o s GLY 50 Ca -0.37 1.33 -0.30 0.00 0.00 0.00 0.00 44.72 45.39 1x5o s GLY 50 CO 0.56 0.38 2.32 -0.18 0.00 0.00 0.00 173.10 176.17 1x5o n GLN 51 N -0.27 1.23 -2.48 2.90 7.27 -1.26 -4.41 117.38 120.35 1x5o n GLN 51 Ca -0.03 0.24 -0.42 0.00 0.07 0.00 0.00 57.00 56.86 1x5o n GLN 51 Cb 0.60 -2.92 -0.02 0.00 2.41 0.00 0.00 30.24 30.31 1x5o n GLN 51 CO 0.00 0.00 0.00 0.08 0.07 0.00 0.00 177.06 177.21 1x5o s VAL 52 N 9.35 3.98 -0.01 1.69 1.01 -1.26 -2.99 120.40 132.17 1x5o s VAL 52 Ca 1.06 0.94 -0.23 0.00 0.00 0.00 0.00 61.98 63.75 1x5o s VAL 52 Cb -0.52 -4.49 -0.15 0.00 0.00 0.00 0.00 36.38 31.22 1x5o s VAL 52 CO 0.38 -1.06 1.05 0.40 0.00 0.00 0.00 175.10 175.87 1x5o h ILE 53 N 6.32 0.54 -3.26 2.22 1.08 -1.69 -3.48 117.51 119.24 1x5o h ILE 53 Ca -0.26 -0.68 -0.10 0.00 -0.39 0.00 0.00 64.86 63.44 1x5o h ILE 53 Cb 1.08 0.82 -0.17 0.00 -3.07 0.00 0.00 36.82 35.48 1x5o h ILE 53 CO 1.14 0.11 -0.25 -0.55 -0.69 0.00 0.00 178.15 177.91 1x5o s SER 54 N -5.06 -0.13 0.01 1.72 0.15 -1.23 -5.02 113.70 104.12 1x5o s SER 54 Ca -0.13 -0.15 0.00 0.00 0.70 0.00 0.00 55.95 56.37 1x5o s SER 54 Cb 0.01 0.35 -0.01 0.00 -1.71 0.00 0.00 66.02 64.67 1x5o s SER 54 CO 0.47 -0.59 -0.02 0.42 1.20 0.00 0.00 173.24 174.72 1x5o s THR 55 N -2.37 0.10 0.07 6.45 -4.23 -1.26 -1.96 115.64 112.44 1x5o s THR 55 Ca -0.06 -0.26 -0.09 0.00 -1.18 0.00 0.00 61.69 60.10 1x5o s THR 55 Cb -0.01 -0.13 -0.00 0.00 1.34 0.00 0.00 72.50 73.69 1x5o s THR 55 CO -0.02 -0.10 0.19 -0.60 -0.54 0.00 0.00 174.62 173.55 1x5o s ARG 56 N -0.37 0.78 -0.17 3.99 3.52 -0.43 -5.00 118.95 121.26 1x5o s ARG 56 Ca -0.03 -0.85 -0.02 0.00 -0.13 0.00 0.00 55.73 54.71 1x5o s ARG 56 Cb -0.03 0.32 0.05 0.00 -1.56 0.00 0.00 34.95 33.73 1x5o s ARG 56 CO -0.00 -0.24 -0.00 0.42 -0.81 0.00 0.00 175.30 174.67 1x5o s ILE 57 N -3.40 0.74 0.23 4.11 -1.09 -1.26 -0.90 121.20 119.63 1x5o s ILE 57 Ca 0.01 -0.52 -0.32 0.00 -2.23 0.00 0.00 60.65 57.60 1x5o s ILE 57 Cb 0.03 -1.08 -0.13 0.00 -1.58 0.00 0.00 42.46 39.69 1x5o s ILE 57 CO -0.08 -0.03 1.47 0.18 -1.23 0.00 0.00 174.94 175.25 1x5o n LEU 58 N 4.99 3.25 -4.46 2.97 4.77 -0.11 -4.90 117.00 123.50 1x5o n LEU 58 Ca -0.10 1.13 -0.30 0.00 -0.03 0.00 0.00 56.01 56.72 1x5o n LEU 58 Cb 0.48 -1.45 -0.12 0.00 -2.33 0.00 0.00 43.42 40.00 1x5o n LEU 58 CO 0.14 -0.37 -0.51 -0.13 -1.33 0.00 0.00 177.39 175.19 1x5o s ARG 59 N -0.11 1.77 0.94 3.23 0.52 -1.26 -1.23 118.95 122.80 1x5o s ARG 59 Ca 0.70 -1.17 -0.16 0.00 -0.52 0.00 0.00 55.73 54.58 1x5o s ARG 59 Cb -0.64 -2.08 0.23 0.00 0.52 0.00 0.00 34.95 32.98 1x5o s ARG 59 CO 0.47 0.49 0.88 -3.47 0.02 0.00 0.00 175.30 173.68 1x5o n ASP 60 N 1.00 -1.65 0.24 0.23 2.03 0.14 -4.77 116.55 113.78 1x5o n ASP 60 Ca -0.16 -1.06 0.09 0.00 0.52 0.00 0.00 54.79 54.18 1x5o n ASP 60 Cb 0.53 -0.79 0.62 0.00 -0.72 0.00 0.00 41.12 40.76 1x5o n ASP 60 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 1x5o h SER 61 N -2.25 0.00 0.39 1.67 4.64 -2.00 -1.14 113.55 114.86 1x5o h SER 61 Ca -0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 1x5o h SER 61 Cb 0.98 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.07 1x5o h SER 61 CO 0.21 0.14 -0.47 -1.54 -0.87 0.00 0.00 176.83 174.30 1x5o n SER 62 N -4.06 0.70 -0.06 4.97 3.41 -1.26 -4.94 113.62 112.39 1x5o n SER 62 Ca -0.02 -0.49 0.00 0.00 -0.26 0.00 0.00 58.87 58.09 1x5o n SER 62 Cb 0.22 0.28 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 1x5o n SER 62 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1x5o n GLY 63 N 1.46 1.31 3.30 5.00 0.00 -0.43 -5.09 105.19 110.73 1x5o n GLY 63 Ca 0.07 -0.20 -0.33 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.12 2.72 0.33 2.61 2.01 -1.26 -4.72 115.64 115.22 1x5o s THR 64 Ca 0.00 -0.76 -0.16 0.00 0.31 0.00 0.00 61.69 61.07 1x5o s THR 64 Cb 0.00 -2.14 -0.12 0.00 0.01 0.00 0.00 72.50 70.25 1x5o s THR 64 CO 0.00 0.52 0.05 -0.24 -0.69 0.00 0.00 174.62 174.26 1x5o n SER 65 N 3.80 -2.37 -0.54 3.53 2.88 -1.26 0.26 113.62 119.92 1x5o n SER 65 Ca -0.19 0.63 0.08 0.00 -1.33 0.00 0.00 58.87 58.06 1x5o n SER 65 Cb 0.52 -0.70 0.20 0.00 -0.75 0.00 0.00 64.21 63.49 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 1.08 2.08 -1.88 -1.46 1.74 -0.37 -4.58 116.66 113.27 1x5o n ARG 66 Ca 0.09 -2.77 -0.19 0.00 -0.77 0.00 0.00 57.85 54.20 1x5o n ARG 66 Cb 0.32 -1.69 -0.05 0.00 -1.02 0.00 0.00 32.46 30.03 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 -0.98 0.95 2.79 -0.13 0.00 -1.25 -4.86 105.19 101.70 1x5o n GLY 67 Ca 0.20 -0.09 -0.21 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.81 0.33 -0.02 1.61 1.01 -1.26 -0.78 120.40 118.48 1x5o s VAL 68 Ca 0.00 0.11 0.06 0.00 0.00 0.00 0.00 61.98 62.14 1x5o s VAL 68 Cb 0.00 -0.47 -0.01 0.00 0.00 0.00 0.00 36.38 35.90 1x5o s VAL 68 CO 0.00 0.23 -0.19 -0.83 0.00 0.00 0.00 175.10 174.31 1x5o s GLY 69 N 1.70 0.94 -0.25 4.51 0.00 0.01 -0.94 107.32 113.28 1x5o s GLY 69 Ca 0.00 -0.80 -0.09 0.00 0.00 0.00 0.00 44.72 43.84 1x5o s GLY 69 CO -0.04 -0.61 0.12 -1.36 0.00 0.00 0.00 173.10 171.22 1x5o s PHE 70 N -0.33 3.16 -0.04 1.90 0.08 -0.08 -2.94 117.98 119.74 1x5o s PHE 70 Ca 0.04 -0.13 0.06 0.00 0.12 0.00 0.00 56.93 57.02 1x5o s PHE 70 Cb -0.09 -2.28 -0.01 0.00 -0.57 0.00 0.00 43.02 40.07 1x5o s PHE 70 CO 0.00 -0.21 -0.24 0.00 -0.10 0.00 0.00 175.22 174.67 1x5o s ALA 71 N 1.52 2.03 -0.31 5.36 0.00 -1.22 -1.32 121.76 127.82 1x5o s ALA 71 Ca 0.06 -1.00 -0.05 0.00 0.00 0.00 0.00 51.96 50.98 1x5o s ALA 71 Cb -0.15 -0.60 0.03 0.00 0.00 0.00 0.00 23.12 22.40 1x5o s ALA 71 CO 0.06 0.42 0.05 0.50 0.00 0.00 0.00 175.76 176.80 1x5o s ARG 72 N -0.27 2.69 0.61 0.00 3.52 -0.83 -1.28 118.95 123.40 1x5o s ARG 72 Ca 0.01 -1.11 -0.10 0.00 -0.13 0.00 0.00 55.73 54.39 1x5o s ARG 72 Cb -0.12 -3.31 -0.04 0.00 -1.56 0.00 0.00 34.95 29.92 1x5o s ARG 72 CO 0.02 -0.57 1.01 -1.64 -0.81 0.00 0.00 175.30 173.30 1x5o s MET 73 N 1.37 3.56 0.41 5.12 -1.94 -0.85 -1.87 119.30 125.09 1x5o s MET 73 Ca -0.02 0.68 0.10 0.00 -1.71 0.00 0.00 55.69 54.74 1x5o s MET 73 Cb -0.19 -2.11 0.90 0.00 2.01 0.00 0.00 34.83 35.44 1x5o s MET 73 CO 0.01 -0.55 1.99 1.05 -0.01 0.00 0.00 175.02 177.51 1x5o h GLU 74 N -0.27 0.53 -2.40 2.03 4.11 -1.87 -3.46 114.58 113.26 1x5o h GLU 74 Ca -0.44 -0.03 0.11 0.00 0.07 0.00 0.00 59.36 59.06 1x5o h GLU 74 Cb 1.19 -0.12 -0.13 0.00 0.50 0.00 0.00 28.75 30.19 1x5o h GLU 74 CO 0.62 0.35 0.45 -1.12 0.07 0.00 0.00 179.01 179.38 1x5o s SER 75 N -6.33 -0.35 0.23 3.06 0.01 -1.26 -5.04 113.70 104.01 1x5o s SER 75 Ca -0.08 -0.09 -0.07 0.00 1.31 0.00 0.00 55.95 57.01 1x5o s SER 75 Cb 0.19 0.44 0.37 0.00 0.21 0.00 0.00 66.02 67.23 1x5o s SER 75 CO 0.75 -0.73 1.73 0.74 0.41 0.00 0.00 173.24 176.13 1x5o h THR 76 N 2.00 0.68 -0.98 1.44 2.02 -1.87 -1.22 112.91 114.98 1x5o h THR 76 Ca -0.24 -0.13 0.34 0.00 0.77 0.00 0.00 66.41 67.15 1x5o h THR 76 Cb 1.25 0.26 -0.18 0.00 -1.74 0.00 0.00 68.15 67.74 1x5o h THR 76 CO 0.30 0.07 0.27 1.21 0.37 0.00 0.00 175.52 177.75 1x5o n GLU 77 N -5.04 -0.07 -0.03 6.66 2.13 -1.26 0.09 120.64 123.12 1x5o n GLU 77 Ca 0.11 1.41 -0.15 0.00 0.66 0.00 0.00 57.16 59.19 1x5o n GLU 77 Cb 0.35 -2.38 -0.11 0.00 0.27 0.00 0.00 31.44 29.57 1x5o n GLU 77 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 1x5o h LYS 78 N 0.00 0.14 -0.70 5.31 1.79 -1.63 -3.35 116.57 118.13 1x5o h LYS 78 Ca 0.71 -0.15 0.06 0.00 -2.18 0.00 0.00 60.65 59.10 1x5o h LYS 78 Cb 1.71 0.04 -0.08 0.00 -1.58 0.00 0.00 32.23 32.32 1x5o h LYS 78 CO -0.84 0.90 -0.41 0.00 -1.08 0.00 0.00 179.45 178.02 1x5o n GLU 80 N -4.58 -0.18 -0.15 0.00 1.02 -0.84 0.19 120.64 116.10 1x5o n GLU 80 Ca 0.01 1.42 -0.06 0.00 -0.02 0.00 0.00 57.16 58.51 1x5o n GLU 80 Cb 0.18 -2.11 0.00 0.00 -0.02 0.00 0.00 31.44 29.50 1x5o n GLU 80 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1x5o h ALA 81 N 1.43 -0.04 0.02 0.62 0.00 -0.88 0.20 119.26 120.61 1x5o h ALA 81 Ca 0.35 0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.41 1x5o h ALA 81 Cb 0.58 0.66 -0.02 0.00 0.00 0.00 0.00 17.79 19.01 1x5o h ALA 81 CO -0.92 -0.65 -0.19 0.28 0.00 0.00 0.00 179.25 177.76 1x5o h VAL 82 N -0.19 0.00 -0.28 0.00 2.07 0.04 -1.16 116.25 116.73 1x5o h VAL 82 Ca 0.20 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.76 1x5o h VAL 82 Cb 0.52 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.22 1x5o h VAL 82 CO -0.57 0.00 -0.51 0.40 0.02 0.00 0.00 177.57 176.91 1x5o h ILE 83 N -0.26 0.00 -1.26 4.57 2.04 -1.15 1.23 117.51 122.69 1x5o h ILE 83 Ca 0.00 0.00 0.39 0.00 1.00 0.00 0.00 64.86 66.25 1x5o h ILE 83 Cb 0.27 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.23 1x5o h ILE 83 CO -0.12 0.00 0.82 1.23 0.00 0.00 0.00 178.15 180.08 1x5o h GLY 84 N -0.43 1.17 0.00 5.37 0.00 -0.83 0.43 103.07 108.78 1x5o h GLY 84 Ca 0.05 -0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.25 1x5o h GLY 84 CO -0.49 -0.30 0.00 1.42 0.00 0.00 0.00 176.54 177.17 1x5o n HIS 85 N -4.63 0.00 -0.34 5.60 8.25 0.32 -4.50 115.22 119.92 1x5o n HIS 85 Ca 0.34 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.87 1x5o n HIS 85 Cb 1.29 -0.17 0.17 0.00 1.12 0.00 0.00 29.99 32.40 1x5o n HIS 85 CO 0.00 0.00 0.00 0.74 0.64 0.00 0.00 176.34 177.72 1x5o h PHE 86 N 0.00 -0.39 0.00 4.41 -1.00 0.15 -3.39 116.94 116.72 1x5o h PHE 86 Ca 0.00 0.08 -0.38 0.00 2.81 0.00 0.00 57.97 60.48 1x5o h PHE 86 Cb 0.00 0.32 -0.11 0.00 3.61 0.00 0.00 35.95 39.78 1x5o h PHE 86 CO 0.00 -0.41 1.88 -1.71 -1.61 0.00 0.00 178.31 176.46 1x5o n ASN 87 N -5.57 -0.96 -0.13 2.17 2.85 0.15 0.18 115.26 113.95 1x5o n ASN 87 Ca 0.17 -0.34 0.00 0.00 -0.11 0.00 0.00 54.58 54.30 1x5o n ASN 87 Cb 0.54 -0.61 0.00 0.00 1.24 0.00 0.00 39.78 40.96 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 5.52 1.11 3.76 8.20 0.00 -1.18 -4.96 105.19 117.64 1x5o n GLY 88 Ca 0.65 -0.28 -0.32 0.00 0.00 0.00 0.00 46.02 46.06 1x5o n GLY 88 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x5o s LYS 89 N -1.97 2.17 -0.16 1.61 -0.14 0.47 -4.89 119.74 116.84 1x5o s LYS 89 Ca 0.00 -2.34 -0.04 0.00 -1.36 0.00 0.00 55.97 52.23 1x5o s LYS 89 Cb 0.00 -1.58 0.06 0.00 -1.68 0.00 0.00 37.83 34.62 1x5o s LYS 89 CO 0.00 -0.34 0.07 -0.06 -0.76 0.00 0.00 175.35 174.26 1x5o s PHE 90 N -2.85 0.36 0.42 3.18 0.40 -1.26 -1.60 117.98 116.63 1x5o s PHE 90 Ca 0.11 -0.36 -0.22 0.00 -0.60 0.00 0.00 56.93 55.86 1x5o s PHE 90 Cb 0.02 -0.74 -0.11 0.00 0.51 0.00 0.00 43.02 42.70 1x5o s PHE 90 CO 0.06 -0.49 0.95 0.96 0.70 0.00 0.00 175.22 177.40 1x5o s ILE 91 N 2.08 4.36 0.89 0.64 -4.36 -1.26 -5.07 121.20 118.49 1x5o s ILE 91 Ca 0.02 1.53 -0.14 0.00 -0.26 0.00 0.00 60.65 61.80 1x5o s ILE 91 Cb -0.16 -3.65 0.15 0.00 1.25 0.00 0.00 42.46 40.05 1x5o s ILE 91 CO -0.08 -0.26 1.26 -1.59 0.24 0.00 0.00 174.94 174.51 1x5o s LYS 92 N -3.03 1.21 0.08 0.37 -2.85 -1.26 -4.81 119.74 109.45 1x5o s LYS 92 Ca 0.61 -0.21 0.03 0.00 -1.00 0.00 0.00 55.97 55.40 1x5o s LYS 92 Cb -0.10 -1.90 -0.03 0.00 -2.06 0.00 0.00 37.83 33.73 1x5o s LYS 92 CO 0.15 -2.05 -0.10 0.95 0.10 0.00 0.00 175.35 174.39 1x5o s THR 93 N -3.75 0.85 0.99 3.79 -4.23 -1.26 -5.05 115.64 106.98 1x5o s THR 93 Ca 0.69 -1.49 -0.12 0.00 -1.18 0.00 0.00 61.69 59.58 1x5o s THR 93 Cb -0.07 -1.18 0.18 0.00 1.34 0.00 0.00 72.50 72.78 1x5o s THR 93 CO 0.51 -0.50 1.09 -2.16 -0.54 0.00 0.00 174.62 173.02 1x5o s PRO 94 N -2.47 0.47 -0.43 3.99 0.04 -1.26 -4.93 135.00 130.42 1x5o s PRO 94 Ca 0.01 0.54 -0.28 0.00 0.04 0.00 0.00 61.00 61.32 1x5o s PRO 94 Cb -0.05 -1.74 -0.01 0.00 0.04 0.00 0.00 34.50 32.74 1x5o s PRO 94 CO -0.00 -2.71 1.75 -1.25 0.04 0.00 0.00 177.00 174.83 1x5o s PRO 95 N -4.96 3.17 0.00 0.56 0.04 -1.26 -2.62 135.00 129.92 1x5o s PRO 95 Ca 0.65 1.10 0.00 0.00 0.04 0.00 0.00 61.00 62.79 1x5o s PRO 95 Cb -0.19 -4.22 0.00 0.00 0.04 0.00 0.00 34.50 30.13 1x5o s PRO 95 CO 0.58 -2.07 0.00 0.41 0.04 0.00 0.00 177.00 175.96 1x5o n GLY 96 N 5.45 1.33 3.35 0.56 0.00 -1.26 -5.13 105.19 109.48 1x5o n GLY 96 Ca 0.21 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.98 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 -1.97 1.99 -0.25 1.61 1.01 -1.08 -5.12 120.40 116.60 1x5o s VAL 97 Ca 0.00 -1.77 -0.21 0.00 0.00 0.00 0.00 61.98 60.00 1x5o s VAL 97 Cb 0.00 -1.84 -0.02 0.00 0.00 0.00 0.00 36.38 34.53 1x5o s VAL 97 CO 0.00 -0.09 0.66 -0.55 0.00 0.00 0.00 175.10 175.11 1x5o s SER 98 N -2.26 6.62 0.35 3.32 0.15 -1.26 -4.84 113.70 115.77 1x5o s SER 98 Ca 0.13 0.76 -0.28 0.00 0.70 0.00 0.00 55.95 57.26 1x5o s SER 98 Cb -0.09 -2.35 -0.10 0.00 -1.71 0.00 0.00 66.02 61.77 1x5o s SER 98 CO 0.06 -0.39 1.30 0.00 1.20 0.00 0.00 173.24 175.41 1x5o s ALA 99 N 2.54 3.42 0.88 5.45 0.00 -1.26 -4.86 121.76 127.92 1x5o s ALA 99 Ca 0.27 1.24 -0.11 0.00 0.00 0.00 0.00 51.96 53.36 1x5o s ALA 99 Cb -0.15 -3.48 0.12 0.00 0.00 0.00 0.00 23.12 19.61 1x5o s ALA 99 CO 0.08 -0.68 1.09 -1.25 0.00 0.00 0.00 175.76 175.00 1x5o s PRO 100 N -1.93 1.42 -0.11 0.00 0.04 -1.26 -5.01 135.00 128.15 1x5o s PRO 100 Ca 0.51 0.88 0.10 0.00 0.04 0.00 0.00 61.00 62.53 1x5o s PRO 100 Cb -0.39 -1.82 -0.14 0.00 0.04 0.00 0.00 34.50 32.18 1x5o s PRO 100 CO 0.51 -2.14 0.05 2.41 0.04 0.00 0.00 177.00 177.87 1x5o n THR 101 N -3.82 0.76 -3.25 1.26 -1.04 -1.26 -5.01 114.28 101.92 1x5o n THR 101 Ca 0.07 -0.48 -0.31 0.00 -2.04 0.00 0.00 64.05 61.29 1x5o n THR 101 Cb 0.55 -0.65 -0.05 0.00 -1.82 0.00 0.00 70.33 68.36 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 -2.30 3.81 1.25 -2.82 2.02 -1.26 -5.09 118.70 114.31 1x5o s GLU 102 Ca -0.06 0.35 -0.21 0.00 0.02 0.00 0.00 54.97 55.07 1x5o s GLU 102 Cb 0.04 -2.55 0.31 0.00 0.10 0.00 0.00 34.13 32.02 1x5o s GLU 102 CO 0.48 0.20 1.12 -1.25 0.02 0.00 0.00 175.26 175.82 1x5o s PRO 103 N -3.15 -1.61 -0.36 0.39 0.04 -1.26 -4.95 135.00 124.10 1x5o s PRO 103 Ca 0.49 -0.21 -0.15 0.00 0.04 0.00 0.00 61.00 61.17 1x5o s PRO 103 Cb -0.11 -1.56 -0.01 0.00 0.04 0.00 0.00 34.50 32.86 1x5o s PRO 103 CO 0.23 -3.94 0.34 -0.51 0.04 0.00 0.00 177.00 173.16 1x5o s LEU 104 N -7.05 4.58 -0.11 -3.56 1.43 -0.63 -4.69 118.68 108.66 1x5o s LEU 104 Ca 0.72 -0.40 -0.25 0.00 -1.03 0.00 0.00 54.13 53.18 1x5o s LEU 104 Cb -0.07 -2.28 -0.03 0.00 0.03 0.00 0.00 46.19 43.84 1x5o s LEU 104 CO 0.56 -0.36 0.77 -0.22 0.23 0.00 0.00 176.35 177.33 1x5o s LEU 105 N 1.93 4.26 -0.01 1.79 2.96 -1.07 -3.09 118.68 125.45 1x5o s LEU 105 Ca 0.10 1.21 0.05 0.00 -0.22 0.00 0.00 54.13 55.27 1x5o s LEU 105 Cb -0.17 -3.18 -0.01 0.00 0.50 0.00 0.00 46.19 43.33 1x5o s LEU 105 CO 0.11 -0.24 -0.16 0.00 -1.32 0.00 0.00 176.35 174.74 1x5o s LYS 107 N -0.40 0.71 -0.89 0.00 -2.85 -0.86 -4.95 119.74 110.50 1x5o s LYS 107 Ca 0.06 1.13 -0.24 0.00 -1.00 0.00 0.00 55.97 55.92 1x5o s LYS 107 Cb -0.06 0.19 -0.22 0.00 -2.06 0.00 0.00 37.83 35.68 1x5o s LYS 107 CO -0.01 -0.13 2.49 1.19 0.10 0.00 0.00 175.35 178.99 1x5o n PHE 108 N 3.93 0.62 -1.09 1.78 3.72 -1.26 -1.52 117.46 123.64 1x5o n PHE 108 Ca -0.19 0.21 -0.34 0.00 -0.05 0.00 0.00 57.45 57.08 1x5o n PHE 108 Cb 0.58 -1.98 0.12 0.00 -0.94 0.00 0.00 39.48 37.26 1x5o n PHE 108 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1x5o n SER 109 N 10.94 0.26 -0.71 4.37 2.88 -1.06 -4.86 113.62 125.44 1x5o n SER 109 Ca 0.60 0.55 0.00 0.00 -1.33 0.00 0.00 58.87 58.69 1x5o n SER 109 Cb 0.18 -1.42 0.00 0.00 -0.75 0.00 0.00 64.21 62.22 1x5o n SER 109 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x5o n GLY 110 N 0.85 1.28 3.77 0.46 0.00 -1.26 -4.61 105.19 105.68 1x5o n GLY 110 Ca 0.12 -1.94 -0.36 0.00 0.00 0.00 0.00 46.02 43.84 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 2.30 3.55 0.01 1.61 0.04 -1.26 -4.73 135.00 136.52 1x5o s PRO 111 Ca 0.00 1.69 -0.21 0.00 0.04 0.00 0.00 61.00 62.52 1x5o s PRO 111 Cb 0.00 -2.20 -0.18 0.00 0.04 0.00 0.00 34.50 32.16 1x5o s PRO 111 CO 0.00 -0.71 1.23 1.03 0.04 0.00 0.00 177.00 178.59 1x5o h SER 112 N 1.61 0.35 -4.12 6.66 0.87 -1.97 -3.45 113.55 113.50 1x5o h SER 112 Ca -0.50 -0.59 -0.51 0.00 -1.23 0.00 0.00 61.79 58.96 1x5o h SER 112 Cb 1.26 -0.10 0.20 0.00 -0.44 0.00 0.00 62.40 63.32 1x5o h SER 112 CO 0.58 0.88 0.16 -1.54 -0.53 0.00 0.00 176.83 176.39 1x5o n SER 113 N -4.50 0.01 0.00 6.23 3.41 -1.26 -5.29 113.62 112.21 1x5o n SER 113 Ca -0.08 0.35 0.00 0.00 -0.26 0.00 0.00 58.87 58.88 1x5o n SER 113 Cb 0.44 -1.44 0.00 0.00 -0.26 0.00 0.00 64.21 62.94 1x5o n SER 113 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49