#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5o s SER 2 N 0.00 6.36 0.11 1.61 0.01 -1.26 -5.04 113.70 115.49 1x5o s SER 2 Ca 0.00 0.31 0.00 0.00 1.31 0.00 0.00 55.95 57.57 1x5o s SER 2 Cb 0.00 -1.97 0.00 0.00 0.21 0.00 0.00 66.02 64.26 1x5o s SER 2 CO 0.00 -0.02 0.00 -1.20 0.41 0.00 0.00 173.24 172.43 1x5o n SER 3 N -0.68 0.85 0.00 2.44 7.64 -1.26 -5.05 113.62 117.57 1x5o n SER 3 Ca -0.06 0.16 0.00 0.00 1.01 0.00 0.00 58.87 59.98 1x5o n SER 3 Cb 0.54 -0.23 0.00 0.00 -1.01 0.00 0.00 64.21 63.51 1x5o n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x5o n GLY 4 N 3.23 0.00 3.53 0.23 0.00 -1.26 -5.17 105.19 105.75 1x5o n GLY 4 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 1x5o n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x5o s SER 5 N 0.00 -0.56 -0.13 1.61 0.15 -1.26 -5.07 113.70 108.45 1x5o s SER 5 Ca 0.00 0.55 -0.14 0.00 0.70 0.00 0.00 55.95 57.05 1x5o s SER 5 Cb 0.00 0.47 -0.25 0.00 -1.71 0.00 0.00 66.02 64.53 1x5o s SER 5 CO 0.00 -0.56 0.43 0.77 1.20 0.00 0.00 173.24 175.09 1x5o h SER 6 N 2.76 0.32 0.00 5.45 4.64 -2.06 -3.49 113.55 121.17 1x5o h SER 6 Ca -0.25 -0.82 0.00 0.00 -0.47 0.00 0.00 61.79 60.26 1x5o h SER 6 Cb 1.16 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 1x5o h SER 6 CO 0.36 1.66 0.00 0.61 -0.87 0.00 0.00 176.83 178.60 1x5o n GLY 7 N 1.75 -0.31 3.50 -0.77 0.00 -1.26 -5.10 105.19 103.00 1x5o n GLY 7 Ca -0.28 0.13 -0.43 0.00 0.00 0.00 0.00 46.02 45.44 1x5o n GLY 7 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1x5o s LEU 8 N 0.00 4.11 0.83 0.99 1.43 -1.26 -5.02 118.68 119.77 1x5o s LEU 8 Ca 0.00 -0.53 -0.15 0.00 -1.03 0.00 0.00 54.13 52.42 1x5o s LEU 8 Cb 0.00 -2.70 -0.03 0.00 0.03 0.00 0.00 46.19 43.49 1x5o s LEU 8 CO 0.00 -1.33 0.28 2.29 0.23 0.00 0.00 176.35 177.82 1x5o n LYS 9 N 7.66 0.03 -3.77 1.70 2.85 -1.26 -5.00 118.16 120.37 1x5o n LYS 9 Ca 0.00 0.05 -0.26 0.00 -1.05 0.00 0.00 58.31 57.05 1x5o n LYS 9 Cb 0.47 -1.70 -0.17 0.00 -0.65 0.00 0.00 35.03 32.99 1x5o n LYS 9 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1x5o s ALA 10 N -2.11 0.93 -0.24 0.58 0.00 -1.26 -5.12 121.76 114.55 1x5o s ALA 10 Ca 0.59 -0.48 -0.02 0.00 0.00 0.00 0.00 51.96 52.05 1x5o s ALA 10 Cb -0.28 -0.99 0.02 0.00 0.00 0.00 0.00 23.12 21.86 1x5o s ALA 10 CO 0.65 -0.83 -0.06 -1.12 0.00 0.00 0.00 175.76 174.40 1x5o s SER 11 N 1.88 4.28 -0.41 0.00 0.01 -1.26 -5.04 113.70 113.16 1x5o s SER 11 Ca 0.02 -0.73 0.04 0.00 1.31 0.00 0.00 55.95 56.60 1x5o s SER 11 Cb -0.15 -1.68 0.17 0.00 0.21 0.00 0.00 66.02 64.56 1x5o s SER 11 CO -0.07 -0.10 0.46 -0.83 0.41 0.00 0.00 173.24 173.11 1x5o s GLY 12 N 1.37 -0.13 0.39 3.44 0.00 -1.26 -5.14 107.32 106.00 1x5o s GLY 12 Ca 0.02 -1.06 -0.23 0.00 0.00 0.00 0.00 44.72 43.44 1x5o s GLY 12 CO -0.04 2.87 0.98 -1.34 0.00 0.00 0.00 173.10 175.57 1x5o s VAL 13 N 1.09 4.09 -0.49 1.40 -7.23 -1.26 -5.03 120.40 112.96 1x5o s VAL 13 Ca 0.22 1.52 0.03 0.00 -1.81 0.00 0.00 61.98 61.95 1x5o s VAL 13 Cb -0.08 -3.75 0.13 0.00 0.56 0.00 0.00 36.38 33.25 1x5o s VAL 13 CO -0.07 -0.07 0.26 -1.58 -0.31 0.00 0.00 175.10 173.33 1x5o s GLN 14 N -2.62 1.71 0.02 4.82 -0.44 -1.26 -5.00 119.66 116.89 1x5o s GLN 14 Ca 0.57 -2.40 -0.07 0.00 -2.50 0.00 0.00 55.36 50.96 1x5o s GLN 14 Cb -0.16 -2.93 -0.03 0.00 -1.64 0.00 0.00 33.01 28.25 1x5o s GLN 14 CO 0.21 -1.13 1.12 0.00 0.50 0.00 0.00 175.29 175.98 1x5o h ALA 15 N 6.56 -0.69 -2.01 1.58 0.00 -2.07 -3.45 119.26 119.18 1x5o h ALA 15 Ca -0.05 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.85 1x5o h ALA 15 Cb 0.90 0.50 -0.21 0.00 0.00 0.00 0.00 17.79 18.98 1x5o h ALA 15 CO 0.61 -0.71 0.01 -1.14 0.00 0.00 0.00 179.25 178.01 1x5o s GLN 16 N -3.58 0.70 -0.08 0.00 0.74 -1.26 -5.08 119.66 111.10 1x5o s GLN 16 Ca -0.04 1.23 -0.06 0.00 0.05 0.00 0.00 55.36 56.54 1x5o s GLN 16 Cb 0.01 0.15 -0.03 0.00 1.10 0.00 0.00 33.01 34.23 1x5o s GLN 16 CO 0.13 -0.15 0.23 1.98 -0.55 0.00 0.00 175.29 176.93 1x5o h MET 17 N 7.02 -0.17 -3.63 1.67 1.85 -2.01 -3.49 114.93 116.16 1x5o h MET 17 Ca -0.30 0.01 -0.12 0.00 -0.61 0.00 0.00 59.70 58.69 1x5o h MET 17 Cb 1.23 0.04 -0.06 0.00 0.43 0.00 0.00 31.60 33.23 1x5o h MET 17 CO 0.16 -0.09 -0.03 0.00 -0.40 0.00 0.00 176.91 176.55 1x5o s ALA 18 N -3.00 -0.06 -0.65 0.39 0.00 -1.26 -5.10 121.76 112.08 1x5o s ALA 18 Ca -0.03 -1.04 0.06 0.00 0.00 0.00 0.00 51.96 50.95 1x5o s ALA 18 Cb 0.00 1.00 0.23 0.00 0.00 0.00 0.00 23.12 24.35 1x5o s ALA 18 CO 0.10 -0.87 0.67 0.36 0.00 0.00 0.00 175.76 176.01 1x5o n LYS 19 N -0.48 2.25 -3.17 0.00 0.00 -1.26 -5.06 118.16 110.44 1x5o n LYS 19 Ca -0.02 -4.56 -0.32 0.00 -0.00 0.00 0.00 58.31 53.41 1x5o n LYS 19 Cb 0.61 -2.22 -0.06 0.00 -0.00 0.00 0.00 35.03 33.36 1x5o n LYS 19 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.40 176.75 1x5o s GLN 20 N -2.13 3.95 0.60 -1.58 -1.52 -1.26 -5.08 119.66 112.64 1x5o s GLN 20 Ca 0.36 0.58 -0.07 0.00 -1.95 0.00 0.00 55.36 54.27 1x5o s GLN 20 Cb 0.10 -2.47 -0.00 0.00 -0.22 0.00 0.00 33.01 30.42 1x5o s GLN 20 CO -0.06 0.17 0.93 -0.65 -0.25 0.00 0.00 175.29 175.43 1x5o s GLN 21 N -3.02 3.05 -1.47 2.91 -0.21 -1.26 -4.10 119.66 115.56 1x5o s GLN 21 Ca 0.53 0.17 -0.11 0.00 0.02 0.00 0.00 55.36 55.96 1x5o s GLN 21 Cb -0.10 -2.22 0.07 0.00 1.00 0.00 0.00 33.01 31.76 1x5o s GLN 21 CO 0.19 -0.68 0.77 0.39 -2.12 0.00 0.00 175.29 173.84 1x5o n GLU 22 N -2.63 -4.68 -1.10 2.91 1.02 -1.26 -4.76 120.64 110.14 1x5o n GLU 22 Ca 0.04 0.59 -0.43 0.00 -0.02 0.00 0.00 57.16 57.34 1x5o n GLU 22 Cb 0.57 -5.42 -0.06 0.00 -0.02 0.00 0.00 31.44 26.51 1x5o n GLU 22 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1x5o n GLN 23 N -4.29 0.00 -3.61 3.49 10.64 -1.26 -4.87 117.38 117.49 1x5o n GLN 23 Ca 0.01 0.00 -0.38 0.00 -1.83 0.00 0.00 57.00 54.79 1x5o n GLN 23 Cb 0.54 -1.09 -0.07 0.00 -0.86 0.00 0.00 30.24 28.77 1x5o n GLN 23 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 1x5o s ASP 24 N 0.13 5.87 0.00 2.61 2.15 -1.26 -4.89 116.67 121.28 1x5o s ASP 24 Ca 0.67 -3.21 0.14 0.00 0.43 0.00 0.00 52.55 50.57 1x5o s ASP 24 Cb -0.93 -1.95 0.82 0.00 -0.30 0.00 0.00 42.92 40.56 1x5o s ASP 24 CO 0.42 -0.32 1.24 -0.81 -0.17 0.00 0.00 175.17 175.54 1x5o n PRO 25 N 3.06 0.49 0.24 4.34 -0.04 -1.26 -3.69 135.00 138.13 1x5o n PRO 25 Ca 0.15 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.73 1x5o n PRO 25 Cb 0.39 -1.44 0.49 0.00 -0.04 0.00 0.00 33.50 32.90 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 0.05 -3.57 0.52 1.35 -1.89 -3.40 112.91 105.98 1x5o h THR 26 Ca 0.00 0.00 -0.51 0.00 -0.55 0.00 0.00 66.41 65.35 1x5o h THR 26 Cb 0.00 0.36 -0.02 0.00 -1.73 0.00 0.00 68.15 66.76 1x5o h THR 26 CO 0.00 0.00 -0.01 0.21 -0.25 0.00 0.00 175.52 175.47 1x5o s ASN 27 N -3.95 6.66 -0.04 5.36 2.47 -1.24 -1.55 114.94 122.66 1x5o s ASN 27 Ca -0.02 1.07 0.04 0.00 0.42 0.00 0.00 52.86 54.38 1x5o s ASN 27 Cb 0.07 -2.29 -0.00 0.00 -1.45 0.00 0.00 41.25 37.58 1x5o s ASN 27 CO 0.24 -0.16 -0.17 -0.76 -3.72 0.00 0.00 177.10 172.53 1x5o s LEU 28 N -3.02 1.93 -0.67 3.21 1.43 -0.94 -3.71 118.68 116.91 1x5o s LEU 28 Ca 0.50 -0.34 -0.22 0.00 -1.03 0.00 0.00 54.13 53.04 1x5o s LEU 28 Cb -0.11 -0.95 0.07 0.00 0.03 0.00 0.00 46.19 45.24 1x5o s LEU 28 CO 0.21 0.16 0.96 -0.47 0.23 0.00 0.00 176.35 177.44 1x5o s TYR 29 N -0.02 2.69 -0.25 0.29 6.14 -0.49 -3.85 117.35 121.86 1x5o s TYR 29 Ca -0.02 -0.59 -0.06 0.00 0.64 0.00 0.00 57.07 57.04 1x5o s TYR 29 Cb -0.11 -4.29 -0.01 0.00 0.42 0.00 0.00 41.96 37.97 1x5o s TYR 29 CO 0.02 -1.64 0.04 0.42 0.64 0.00 0.00 175.55 175.03 1x5o s ILE 30 N 3.99 3.97 0.45 3.14 1.01 -1.08 -1.99 121.20 130.69 1x5o s ILE 30 Ca 0.22 -0.39 0.02 0.00 0.00 0.00 0.00 60.65 60.50 1x5o s ILE 30 Cb -0.17 -2.90 -0.01 0.00 0.01 0.00 0.00 42.46 39.40 1x5o s ILE 30 CO 0.09 0.29 0.07 -1.54 0.00 0.00 0.00 174.94 173.86 1x5o n SER 31 N 4.88 2.29 -2.84 3.58 3.41 -0.23 -0.11 113.62 124.60 1x5o n SER 31 Ca -0.16 -3.14 -0.13 0.00 -0.26 0.00 0.00 58.87 55.19 1x5o n SER 31 Cb 0.50 0.68 0.07 0.00 -0.26 0.00 0.00 64.21 65.19 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 -1.42 -2.71 -4.64 4.04 4.13 0.12 -2.53 115.26 112.25 1x5o n ASN 32 Ca -0.13 -0.48 -0.28 0.00 1.68 0.00 0.00 54.58 55.37 1x5o n ASN 32 Cb 0.61 -4.02 -0.08 0.00 -1.54 0.00 0.00 39.78 34.74 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 -5.21 3.25 0.24 3.41 1.43 -0.02 -4.59 118.68 117.19 1x5o s LEU 33 Ca 0.07 -0.39 -0.30 0.00 -1.03 0.00 0.00 54.13 52.48 1x5o s LEU 33 Cb -0.01 -1.94 -0.09 0.00 0.03 0.00 0.00 46.19 44.18 1x5o s LEU 33 CO 0.55 0.12 1.27 -2.16 0.23 0.00 0.00 176.35 176.37 1x5o s PRO 34 N -2.72 4.42 0.58 1.29 0.04 -1.26 -3.93 135.00 133.42 1x5o s PRO 34 Ca 0.26 2.05 0.27 0.00 0.04 0.00 0.00 61.00 63.62 1x5o s PRO 34 Cb -0.10 -3.16 1.60 0.00 0.04 0.00 0.00 34.50 32.88 1x5o s PRO 34 CO 0.17 -0.16 2.10 -0.07 0.04 0.00 0.00 177.00 179.09 1x5o h LEU 35 N 4.61 0.00 0.00 -3.56 3.38 -1.90 0.38 115.31 118.22 1x5o h LEU 35 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 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 0.72 0.00 0.00 -1.20 0.09 0.00 0.00 178.44 178.05 1x5o n SER 36 N -3.94 0.00 -4.72 -0.43 7.64 -1.26 -4.55 113.62 106.36 1x5o n SER 36 Ca 0.02 -1.22 -0.34 0.00 1.01 0.00 0.00 58.87 58.34 1x5o n SER 36 Cb 0.32 0.00 0.10 0.00 -1.01 0.00 0.00 64.21 63.62 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 -2.00 1.99 0.00 1.43 0.00 0.13 -4.95 119.30 115.90 1x5o s MET 37 Ca 0.36 1.70 0.01 0.00 0.00 0.00 0.00 55.69 57.75 1x5o s MET 37 Cb 0.17 -1.82 -0.01 0.00 0.00 0.00 0.00 34.83 33.17 1x5o s MET 37 CO 0.28 -1.94 -0.03 0.16 0.00 0.00 0.00 175.02 173.49 1x5o s ASP 38 N -2.20 0.34 0.57 1.11 -4.77 -1.26 -5.00 116.67 105.46 1x5o s ASP 38 Ca 0.72 -0.13 0.35 0.00 -3.30 0.00 0.00 52.55 50.19 1x5o s ASP 38 Cb -0.27 -0.01 1.20 0.00 -1.09 0.00 0.00 42.92 42.74 1x5o s ASP 38 CO 0.48 -0.02 1.36 -0.62 0.70 0.00 0.00 175.17 177.06 1x5o n GLU 39 N 2.74 0.01 0.20 2.11 4.71 -1.26 -0.30 120.64 128.85 1x5o n GLU 39 Ca -0.14 1.02 -0.08 0.00 -0.01 0.00 0.00 57.16 57.94 1x5o n GLU 39 Cb 0.58 -2.46 -0.04 0.00 -1.01 0.00 0.00 31.44 28.52 1x5o n GLU 39 CO 0.00 0.00 0.00 0.37 0.09 0.00 0.00 177.13 177.59 1x5o h GLN 40 N 0.00 -0.52 -0.60 3.49 4.15 -1.97 -3.16 115.11 116.50 1x5o h GLN 40 Ca 0.65 0.04 0.12 0.00 0.77 0.00 0.00 58.65 60.23 1x5o h GLN 40 Cb 3.18 0.12 -0.11 0.00 0.21 0.00 0.00 27.48 30.88 1x5o h GLN 40 CO -0.01 -0.34 -0.09 1.49 -1.93 0.00 0.00 178.83 177.95 1x5o h GLU 41 N -0.82 0.04 -1.23 1.69 4.57 -1.07 0.41 114.58 118.17 1x5o h GLU 41 Ca -0.05 -0.00 0.36 0.00 -1.18 0.00 0.00 59.36 58.48 1x5o h GLU 41 Cb 0.41 -0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 28.94 1x5o h GLU 41 CO 0.09 0.03 0.89 1.25 -1.18 0.00 0.00 179.01 180.08 1x5o h LEU 42 N 0.04 0.00 0.00 1.64 5.85 -1.53 0.75 115.31 122.07 1x5o h LEU 42 Ca 0.30 0.00 -0.18 0.00 0.84 0.00 0.00 57.88 58.84 1x5o h LEU 42 Cb 0.47 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 1x5o h LEU 42 CO -0.58 0.00 -1.62 1.21 -0.34 0.00 0.00 178.44 177.11 1x5o n GLU 43 N -4.17 0.64 0.17 1.25 0.00 0.12 -3.94 120.64 114.71 1x5o n GLU 43 Ca 0.27 0.14 0.03 0.00 0.00 0.00 0.00 57.16 57.59 1x5o n GLU 43 Cb 1.29 -1.73 0.28 0.00 0.00 0.00 0.00 31.44 31.28 1x5o n GLU 43 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.13 176.22 1x5o h ASN 44 N 0.00 0.00 0.87 4.31 2.35 0.24 0.99 115.58 124.34 1x5o h ASN 44 Ca -0.20 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.38 1x5o h ASN 44 Cb 1.60 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.95 1x5o h ASN 44 CO 0.04 0.46 -0.80 0.00 -1.65 0.00 0.00 177.43 175.48 1x5o h MET 45 N 0.00 0.00 0.00 0.81 -0.00 -1.15 -3.19 114.93 111.41 1x5o h MET 45 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 1x5o h MET 45 Cb 0.94 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.54 1x5o h MET 45 CO 0.06 0.80 -0.85 1.28 -0.00 0.00 0.00 176.91 178.20 1x5o n LEU 46 N -3.53 0.81 0.23 -0.10 4.77 -1.12 -4.45 117.00 113.62 1x5o n LEU 46 Ca -0.00 -0.31 -0.18 0.00 -0.03 0.00 0.00 56.01 55.49 1x5o n LEU 46 Cb 0.78 -0.09 -0.10 0.00 -2.33 0.00 0.00 43.42 41.69 1x5o n LEU 46 CO 0.44 0.20 0.52 0.11 -1.33 0.00 0.00 177.39 177.33 1x5o h LYS 47 N 0.00 -0.89 0.00 3.23 1.79 -0.78 0.65 116.57 120.57 1x5o h LYS 47 Ca 0.00 0.06 0.00 0.00 -2.18 0.00 0.00 60.65 58.53 1x5o h LYS 47 Cb 0.51 0.20 0.00 0.00 -1.58 0.00 0.00 32.23 31.36 1x5o h LYS 47 CO 0.00 -0.59 0.00 -0.35 -1.08 0.00 0.00 179.45 177.43 1x5o n PRO 48 N -5.54 0.49 -0.14 3.15 -0.04 -1.26 -2.97 135.00 128.70 1x5o n PRO 48 Ca -0.11 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.08 1x5o n PRO 48 Cb 0.45 -1.38 -0.10 0.00 -0.04 0.00 0.00 33.50 32.43 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 -0.88 0.00 -3.83 0.54 3.01 -0.27 -5.10 117.46 110.93 1x5o n PHE 49 Ca 0.09 0.00 -0.01 0.00 1.01 0.00 0.00 57.45 58.54 1x5o n PHE 49 Cb 0.04 -0.98 0.01 0.00 -0.01 0.00 0.00 39.48 38.54 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 -5.67 -0.11 -0.45 1.37 0.00 0.06 -5.01 107.32 97.52 1x5o s GLY 50 Ca -0.38 0.04 -0.27 0.00 0.00 0.00 0.00 44.72 44.12 1x5o s GLY 50 CO 0.50 2.35 2.03 1.62 0.00 0.00 0.00 173.10 179.61 1x5o s GLN 51 N -2.36 2.76 -0.02 2.90 0.74 -1.26 -4.38 119.66 118.03 1x5o s GLN 51 Ca 0.21 1.24 -0.30 0.00 0.05 0.00 0.00 55.36 56.56 1x5o s GLN 51 Cb -0.00 -4.38 -0.05 0.00 1.10 0.00 0.00 33.01 29.68 1x5o s GLN 51 CO 0.01 -2.54 1.35 0.08 -0.55 0.00 0.00 175.29 173.64 1x5o s VAL 52 N 9.17 3.89 -0.17 1.34 1.01 -1.26 -2.91 120.40 131.46 1x5o s VAL 52 Ca 0.83 1.24 -0.15 0.00 0.00 0.00 0.00 61.98 63.90 1x5o s VAL 52 Cb -0.19 -3.80 -0.11 0.00 0.00 0.00 0.00 36.38 32.28 1x5o s VAL 52 CO 0.28 -0.01 0.00 -0.38 0.00 0.00 0.00 175.10 174.99 1x5o n ILE 53 N 4.71 1.47 -3.69 2.22 2.08 -0.48 -4.99 119.36 120.67 1x5o n ILE 53 Ca 0.13 0.10 -0.14 0.00 0.56 0.00 0.00 62.75 63.40 1x5o n ILE 53 Cb 0.44 -2.23 -0.07 0.00 -0.75 0.00 0.00 39.64 37.03 1x5o n ILE 53 CO 0.00 0.00 0.00 -0.94 0.56 0.00 0.00 176.55 176.17 1x5o s SER 54 N -6.27 -0.29 0.01 4.38 1.04 -1.23 -4.98 113.70 106.37 1x5o s SER 54 Ca -0.21 0.15 0.00 0.00 0.48 0.00 0.00 55.95 56.37 1x5o s SER 54 Cb 0.04 0.38 -0.01 0.00 0.10 0.00 0.00 66.02 66.53 1x5o s SER 54 CO 0.39 -0.55 -0.02 0.42 0.98 0.00 0.00 173.24 174.47 1x5o s THR 55 N -1.71 0.08 0.04 2.02 -4.23 -1.26 -0.14 115.64 110.44 1x5o s THR 55 Ca -0.10 -0.43 -0.04 0.00 -1.18 0.00 0.00 61.69 59.94 1x5o s THR 55 Cb -0.03 -0.15 -0.02 0.00 1.34 0.00 0.00 72.50 73.64 1x5o s THR 55 CO 0.03 -0.22 0.06 -0.60 -0.54 0.00 0.00 174.62 173.35 1x5o s ARG 56 N -0.67 0.58 -0.18 3.99 3.52 0.27 -4.97 118.95 121.49 1x5o s ARG 56 Ca -0.07 -0.88 -0.01 0.00 -0.13 0.00 0.00 55.73 54.64 1x5o s ARG 56 Cb -0.05 0.22 0.05 0.00 -1.56 0.00 0.00 34.95 33.61 1x5o s ARG 56 CO -0.00 -0.14 -0.03 0.42 -0.81 0.00 0.00 175.30 174.74 1x5o s ILE 57 N -2.94 1.03 0.14 4.11 -1.09 -1.26 -0.46 121.20 120.72 1x5o s ILE 57 Ca -0.02 -0.70 -0.35 0.00 -2.23 0.00 0.00 60.65 57.35 1x5o s ILE 57 Cb 0.01 -1.30 -0.14 0.00 -1.58 0.00 0.00 42.46 39.44 1x5o s ILE 57 CO -0.06 0.01 1.54 0.18 -1.23 0.00 0.00 174.94 175.37 1x5o n LEU 58 N 4.88 2.79 -4.62 2.97 4.77 0.28 -4.85 117.00 123.23 1x5o n LEU 58 Ca -0.11 1.09 -0.28 0.00 -0.03 0.00 0.00 56.01 56.67 1x5o n LEU 58 Cb 0.47 -1.37 -0.09 0.00 -2.33 0.00 0.00 43.42 40.10 1x5o n LEU 58 CO 0.16 -0.45 -0.38 -0.13 -1.33 0.00 0.00 177.39 175.26 1x5o s ARG 59 N 0.92 2.25 0.80 3.23 0.52 -1.26 0.63 118.95 126.04 1x5o s ARG 59 Ca 0.80 -1.06 -0.09 0.00 -0.52 0.00 0.00 55.73 54.86 1x5o s ARG 59 Cb -0.74 -2.33 0.12 0.00 0.52 0.00 0.00 34.95 32.52 1x5o s ARG 59 CO 0.40 0.48 1.12 -0.51 0.02 0.00 0.00 175.30 176.82 1x5o s ASP 60 N -2.55 4.14 0.21 0.23 1.01 0.24 -4.79 116.67 115.16 1x5o s ASP 60 Ca 0.24 0.25 -0.12 0.00 0.71 0.00 0.00 52.55 53.63 1x5o s ASP 60 Cb -0.10 -0.63 0.27 0.00 1.01 0.00 0.00 42.92 43.46 1x5o s ASP 60 CO 0.16 -2.05 1.65 -1.28 0.21 0.00 0.00 175.17 173.86 1x5o h SER 61 N -0.96 -0.41 0.49 0.27 0.87 -2.00 0.37 113.55 112.18 1x5o h SER 61 Ca -0.43 0.17 -0.06 0.00 -1.23 0.00 0.00 61.79 60.24 1x5o h SER 61 Cb 1.28 0.32 -0.01 0.00 -0.44 0.00 0.00 62.40 63.56 1x5o h SER 61 CO 0.49 -0.16 -0.27 -1.28 -0.53 0.00 0.00 176.83 175.08 1x5o h SER 62 N 0.06 0.00 0.00 6.23 0.87 -2.03 -3.46 113.55 115.22 1x5o h SER 62 Ca 0.31 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.87 1x5o h SER 62 Cb 0.50 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.46 1x5o h SER 62 CO -0.58 0.27 0.00 0.61 -0.53 0.00 0.00 176.83 176.60 1x5o n GLY 63 N -0.38 1.23 3.31 5.77 0.00 0.13 -5.13 105.19 110.12 1x5o n GLY 63 Ca -0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.00 2.22 0.43 2.61 2.01 -1.25 -4.71 115.64 114.95 1x5o s THR 64 Ca 0.00 -1.02 -0.18 0.00 0.31 0.00 0.00 61.69 60.81 1x5o s THR 64 Cb 0.00 -1.81 -0.14 0.00 0.01 0.00 0.00 72.50 70.56 1x5o s THR 64 CO 0.00 0.57 -0.05 -0.24 -0.69 0.00 0.00 174.62 174.21 1x5o n SER 65 N 2.75 -3.15 -0.70 3.53 2.88 -1.26 0.81 113.62 118.48 1x5o n SER 65 Ca -0.17 0.65 0.06 0.00 -1.33 0.00 0.00 58.87 58.09 1x5o n SER 65 Cb 0.52 -0.79 0.21 0.00 -0.75 0.00 0.00 64.21 63.40 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 1.34 2.18 -2.07 -1.46 1.74 0.20 -4.55 116.66 114.05 1x5o n ARG 66 Ca 0.08 -2.86 -0.20 0.00 -0.77 0.00 0.00 57.85 54.10 1x5o n ARG 66 Cb 0.41 -1.73 -0.04 0.00 -1.02 0.00 0.00 32.46 30.08 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 -0.92 0.49 2.72 -0.13 0.00 -1.25 -4.84 105.19 101.25 1x5o n GLY 67 Ca 0.22 -0.04 -0.17 0.00 0.00 0.00 0.00 46.02 46.03 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 -2.91 -0.08 0.05 1.61 1.01 -1.26 0.11 120.40 118.93 1x5o s VAL 68 Ca 0.00 0.32 0.07 0.00 0.00 0.00 0.00 61.98 62.36 1x5o s VAL 68 Cb 0.00 -0.11 -0.03 0.00 0.00 0.00 0.00 36.38 36.24 1x5o s VAL 68 CO 0.00 0.13 -0.19 -0.83 0.00 0.00 0.00 175.10 174.21 1x5o s GLY 69 N 1.58 1.06 -0.24 4.51 0.00 0.85 -0.55 107.32 114.53 1x5o s GLY 69 Ca -0.03 -1.03 -0.00 0.00 0.00 0.00 0.00 44.72 43.66 1x5o s GLY 69 CO -0.03 -0.98 -0.09 -1.36 0.00 0.00 0.00 173.10 170.64 1x5o s PHE 70 N -0.87 3.05 -0.02 1.90 0.08 0.39 -2.63 117.98 119.88 1x5o s PHE 70 Ca 0.06 -1.68 0.05 0.00 0.12 0.00 0.00 56.93 55.48 1x5o s PHE 70 Cb -0.09 -2.01 -0.03 0.00 -0.57 0.00 0.00 43.02 40.32 1x5o s PHE 70 CO 0.02 -0.76 -0.17 0.00 -0.10 0.00 0.00 175.22 174.21 1x5o s ALA 71 N 1.29 2.57 -0.40 5.36 0.00 -1.25 -0.57 121.76 128.76 1x5o s ALA 71 Ca -0.00 -1.06 -0.09 0.00 0.00 0.00 0.00 51.96 50.81 1x5o s ALA 71 Cb -0.16 -0.84 0.06 0.00 0.00 0.00 0.00 23.12 22.18 1x5o s ALA 71 CO -0.06 0.56 0.22 0.50 0.00 0.00 0.00 175.76 176.98 1x5o s ARG 72 N -0.93 2.63 0.59 0.00 3.52 0.80 -2.20 118.95 123.36 1x5o s ARG 72 Ca 0.12 -1.36 -0.14 0.00 -0.13 0.00 0.00 55.73 54.23 1x5o s ARG 72 Cb -0.10 -3.71 -0.04 0.00 -1.56 0.00 0.00 34.95 29.53 1x5o s ARG 72 CO 0.02 -0.87 1.03 -1.64 -0.81 0.00 0.00 175.30 173.03 1x5o s MET 73 N 1.44 3.54 0.31 5.12 -1.94 -0.59 -1.38 119.30 125.79 1x5o s MET 73 Ca 0.02 0.94 0.06 0.00 -1.71 0.00 0.00 55.69 55.01 1x5o s MET 73 Cb -0.22 -2.07 0.76 0.00 2.01 0.00 0.00 34.83 35.31 1x5o s MET 73 CO 0.03 -0.62 1.77 1.05 -0.01 0.00 0.00 175.02 177.24 1x5o h GLU 74 N 0.16 0.72 -3.00 2.03 4.11 -1.85 -3.45 114.58 113.31 1x5o h GLU 74 Ca -0.45 -0.04 -0.00 0.00 0.07 0.00 0.00 59.36 58.93 1x5o h GLU 74 Cb 1.20 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.28 1x5o h GLU 74 CO 0.60 0.48 0.27 -1.12 0.07 0.00 0.00 179.01 179.31 1x5o s SER 75 N -5.40 -0.04 0.57 3.06 0.01 -1.26 -5.02 113.70 105.62 1x5o s SER 75 Ca -0.11 -1.05 0.35 0.00 1.31 0.00 0.00 55.95 56.45 1x5o s SER 75 Cb 0.25 0.83 1.54 0.00 0.21 0.00 0.00 66.02 68.85 1x5o s SER 75 CO 0.80 -1.63 2.05 0.74 0.41 0.00 0.00 173.24 175.61 1x5o h THR 76 N 2.00 0.00 -0.65 1.44 2.02 -1.90 -2.97 112.91 112.85 1x5o h THR 76 Ca -0.30 -0.43 0.01 0.00 0.77 0.00 0.00 66.41 66.46 1x5o h THR 76 Cb 1.25 1.43 -0.04 0.00 -1.74 0.00 0.00 68.15 69.06 1x5o h THR 76 CO 0.38 0.00 0.43 1.05 0.37 0.00 0.00 175.52 177.74 1x5o h GLU 77 N 0.00 0.83 -0.09 6.66 4.11 -1.98 -2.86 114.58 121.25 1x5o h GLU 77 Ca -0.00 -0.05 -0.16 0.00 0.07 0.00 0.00 59.36 59.22 1x5o h GLU 77 Cb 0.43 -0.19 0.01 0.00 0.50 0.00 0.00 28.75 29.50 1x5o h GLU 77 CO 0.00 0.55 -0.56 0.87 0.07 0.00 0.00 179.01 179.94 1x5o h LYS 78 N 0.86 0.53 -0.86 1.06 1.79 -1.91 -3.29 116.57 114.75 1x5o h LYS 78 Ca 0.25 -0.46 0.16 0.00 -2.18 0.00 0.00 60.65 58.42 1x5o h LYS 78 Cb -0.06 0.10 -0.16 0.00 -1.58 0.00 0.00 32.23 30.53 1x5o h LYS 78 CO -0.07 1.09 -0.26 0.00 -1.08 0.00 0.00 179.45 179.13 1x5o h GLU 80 N -0.02 -0.37 -1.00 0.00 5.08 -1.58 0.07 114.58 116.76 1x5o h GLU 80 Ca 0.38 0.03 0.16 0.00 -1.00 0.00 0.00 59.36 58.93 1x5o h GLU 80 Cb 0.62 0.08 -0.10 0.00 0.50 0.00 0.00 28.75 29.86 1x5o h GLU 80 CO -0.89 -0.25 0.62 0.00 -1.00 0.00 0.00 179.01 177.50 1x5o h ALA 81 N 0.46 1.60 0.55 3.43 0.00 -1.00 0.22 119.26 124.51 1x5o h ALA 81 Ca 0.10 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1x5o h ALA 81 Cb 0.53 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 18.19 1x5o h ALA 81 CO -0.34 0.07 -0.26 0.28 0.00 0.00 0.00 179.25 179.00 1x5o h VAL 82 N 0.87 0.35 0.09 0.00 2.07 -0.00 -2.01 116.25 117.61 1x5o h VAL 82 Ca 0.54 -0.32 0.01 0.00 0.82 0.00 0.00 66.70 67.75 1x5o h VAL 82 Cb 0.72 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 1x5o h VAL 82 CO -0.33 0.04 -0.16 0.40 0.02 0.00 0.00 177.57 177.54 1x5o h ILE 83 N -0.97 0.64 -0.71 4.57 2.04 -0.56 1.13 117.51 123.64 1x5o h ILE 83 Ca -0.08 0.00 0.18 0.00 1.00 0.00 0.00 64.86 65.96 1x5o h ILE 83 Cb 0.64 0.64 -0.04 0.00 -0.74 0.00 0.00 36.82 37.31 1x5o h ILE 83 CO 0.12 0.00 0.49 1.23 0.00 0.00 0.00 178.15 180.00 1x5o h GLY 84 N -0.31 0.30 0.00 5.37 0.00 -0.64 -0.22 103.07 107.58 1x5o h GLY 84 Ca 0.02 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.28 1x5o h GLY 84 CO -0.09 0.02 0.00 1.57 0.00 0.00 0.00 176.54 178.04 1x5o n HIS 85 N -4.40 0.00 -0.36 5.60 -0.00 -0.74 -4.56 115.22 110.76 1x5o n HIS 85 Ca 0.14 0.00 -0.02 0.00 -0.00 0.00 0.00 57.72 57.84 1x5o n HIS 85 Cb 0.67 -0.17 0.03 0.00 -0.00 0.00 0.00 29.99 30.52 1x5o n HIS 85 CO 0.00 0.00 0.00 0.74 -0.00 0.00 0.00 176.34 177.08 1x5o h PHE 86 N 0.00 -1.09 0.00 1.57 -1.00 0.12 -3.39 116.94 113.15 1x5o h PHE 86 Ca 0.00 0.10 -0.48 0.00 2.81 0.00 0.00 57.97 60.40 1x5o h PHE 86 Cb 0.00 0.62 -0.06 0.00 3.61 0.00 0.00 35.95 40.11 1x5o h PHE 86 CO 0.00 -0.40 1.37 -1.71 -1.61 0.00 0.00 178.31 175.96 1x5o n ASN 87 N -5.46 0.35 -0.09 2.17 5.15 -0.09 0.23 115.26 117.52 1x5o n ASN 87 Ca 0.09 0.27 0.00 0.00 -0.60 0.00 0.00 54.58 54.34 1x5o n ASN 87 Cb 0.39 -0.77 0.00 0.00 -0.53 0.00 0.00 39.78 38.88 1x5o n ASN 87 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1x5o n GLY 88 N 5.68 0.70 3.34 8.20 0.00 -1.18 -4.96 105.19 116.96 1x5o n GLY 88 Ca 0.53 -0.71 -0.25 0.00 0.00 0.00 0.00 46.02 45.59 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 -3.67 1.27 -0.16 1.61 2.47 0.64 -4.91 119.74 116.99 1x5o s LYS 89 Ca 0.00 -1.31 -0.02 0.00 -1.56 0.00 0.00 55.97 53.08 1x5o s LYS 89 Cb 0.00 -1.54 -0.01 0.00 -1.46 0.00 0.00 37.83 34.82 1x5o s LYS 89 CO 0.00 0.34 -0.10 -0.06 0.16 0.00 0.00 175.35 175.70 1x5o s PHE 90 N -1.44 2.88 -0.01 4.03 0.40 -1.26 -1.57 117.98 121.00 1x5o s PHE 90 Ca 0.12 -0.75 -0.15 0.00 -0.60 0.00 0.00 56.93 55.55 1x5o s PHE 90 Cb -0.09 -1.94 -0.06 0.00 0.51 0.00 0.00 43.02 41.45 1x5o s PHE 90 CO 0.06 -0.33 0.42 0.96 0.70 0.00 0.00 175.22 177.03 1x5o s ILE 91 N 0.74 5.04 0.92 0.64 -4.36 -1.26 -5.08 121.20 117.84 1x5o s ILE 91 Ca -0.04 0.85 -0.13 0.00 -0.26 0.00 0.00 60.65 61.07 1x5o s ILE 91 Cb -0.15 -3.72 0.15 0.00 1.25 0.00 0.00 42.46 39.98 1x5o s ILE 91 CO 0.02 0.55 1.16 -0.54 0.24 0.00 0.00 174.94 176.36 1x5o s LYS 92 N -0.88 1.04 0.03 0.37 -0.14 -1.26 -4.80 119.74 114.10 1x5o s LYS 92 Ca 0.24 0.19 0.00 0.00 -1.36 0.00 0.00 55.97 55.04 1x5o s LYS 92 Cb -0.17 -1.84 -0.02 0.00 -1.68 0.00 0.00 37.83 34.12 1x5o s LYS 92 CO 0.13 -2.24 -0.04 0.95 -0.76 0.00 0.00 175.35 173.39 1x5o s THR 93 N -3.34 0.18 1.01 2.17 -4.23 -1.26 -5.06 115.64 105.10 1x5o s THR 93 Ca 0.65 -1.07 -0.12 0.00 -1.18 0.00 0.00 61.69 59.96 1x5o s THR 93 Cb -0.13 -0.50 0.20 0.00 1.34 0.00 0.00 72.50 73.41 1x5o s THR 93 CO 0.53 -0.57 1.09 -2.16 -0.54 0.00 0.00 174.62 172.98 1x5o s PRO 94 N -1.86 0.31 -0.97 3.99 0.04 -1.26 -4.89 135.00 130.35 1x5o s PRO 94 Ca -0.12 0.48 -0.24 0.00 0.04 0.00 0.00 61.00 61.17 1x5o s PRO 94 Cb -0.07 -1.73 -0.06 0.00 0.04 0.00 0.00 34.50 32.68 1x5o s PRO 94 CO -0.02 -2.81 1.95 -1.25 0.04 0.00 0.00 177.00 174.91 1x5o s PRO 95 N -4.96 2.53 0.00 0.56 0.04 -1.26 -2.28 135.00 129.63 1x5o s PRO 95 Ca 0.66 -0.50 0.00 0.00 0.04 0.00 0.00 61.00 61.19 1x5o s PRO 95 Cb -0.19 -5.11 0.00 0.00 0.04 0.00 0.00 34.50 29.25 1x5o s PRO 95 CO 0.58 -3.53 0.00 0.41 0.04 0.00 0.00 177.00 174.49 1x5o n GLY 96 N 6.60 -0.06 3.11 0.56 0.00 -1.26 -5.11 105.19 109.02 1x5o n GLY 96 Ca 0.41 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.08 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 0.00 3.03 -0.46 1.61 1.01 -0.97 -5.06 120.40 119.57 1x5o s VAL 97 Ca 0.00 -2.02 -0.45 0.00 0.00 0.00 0.00 61.98 59.51 1x5o s VAL 97 Cb 0.00 -3.06 -0.19 0.00 0.00 0.00 0.00 36.38 33.14 1x5o s VAL 97 CO 0.00 -0.59 1.77 -1.20 0.00 0.00 0.00 175.10 175.09 1x5o n SER 98 N 4.52 1.33 -4.77 3.32 7.64 -1.26 -4.63 113.62 119.78 1x5o n SER 98 Ca -0.02 1.02 -0.39 0.00 1.01 0.00 0.00 58.87 60.48 1x5o n SER 98 Cb 0.42 -0.94 -0.03 0.00 -1.01 0.00 0.00 64.21 62.65 1x5o n SER 98 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1x5o s ALA 99 N 3.97 3.32 1.13 -0.43 0.00 -1.26 -4.73 121.76 123.77 1x5o s ALA 99 Ca 1.08 1.02 -0.17 0.00 0.00 0.00 0.00 51.96 53.89 1x5o s ALA 99 Cb -1.41 -3.39 0.25 0.00 0.00 0.00 0.00 23.12 18.58 1x5o s ALA 99 CO 0.74 -0.44 1.10 -1.25 0.00 0.00 0.00 175.76 175.91 1x5o s PRO 100 N -1.91 -0.68 0.00 0.00 0.04 -1.26 -5.02 135.00 126.17 1x5o s PRO 100 Ca 0.51 0.13 0.00 0.00 0.04 0.00 0.00 61.00 61.68 1x5o s PRO 100 Cb -0.33 -1.64 0.00 0.00 0.04 0.00 0.00 34.50 32.56 1x5o s PRO 100 CO 0.43 -3.39 0.00 2.41 0.04 0.00 0.00 177.00 176.49 1x5o n THR 101 N -4.57 0.00 -3.45 1.26 -1.04 -1.26 -5.05 114.28 100.16 1x5o n THR 101 Ca 0.10 0.00 -0.29 0.00 -2.04 0.00 0.00 64.05 61.83 1x5o n THR 101 Cb 0.59 -0.46 -0.03 0.00 -1.82 0.00 0.00 70.33 68.60 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 -1.90 3.61 1.04 -2.82 0.41 -1.26 -5.09 118.70 112.68 1x5o s GLU 102 Ca 0.00 -0.08 -0.13 0.00 -0.41 0.00 0.00 54.97 54.35 1x5o s GLU 102 Cb 0.00 -2.71 0.21 0.00 -1.78 0.00 0.00 34.13 29.85 1x5o s GLU 102 CO 0.00 0.28 1.09 -1.25 -0.49 0.00 0.00 175.26 174.90 1x5o s PRO 103 N -3.41 0.11 -0.24 0.39 0.04 -1.26 -4.94 135.00 125.68 1x5o s PRO 103 Ca 0.42 0.41 -0.20 0.00 0.04 0.00 0.00 61.00 61.68 1x5o s PRO 103 Cb -0.11 -1.71 -0.02 0.00 0.04 0.00 0.00 34.50 32.70 1x5o s PRO 103 CO 0.29 -2.93 0.60 -0.51 0.04 0.00 0.00 177.00 174.49 1x5o s LEU 104 N -6.56 4.09 -0.26 -3.56 1.43 -0.61 -4.71 118.68 108.50 1x5o s LEU 104 Ca 0.66 0.70 -0.17 0.00 -1.03 0.00 0.00 54.13 54.29 1x5o s LEU 104 Cb -0.18 -2.81 -0.03 0.00 0.03 0.00 0.00 46.19 43.20 1x5o s LEU 104 CO 0.58 -0.31 0.47 -0.22 0.23 0.00 0.00 176.35 177.09 1x5o s LEU 105 N 2.25 4.05 -0.04 1.79 2.96 -1.05 -3.12 118.68 125.52 1x5o s LEU 105 Ca 0.26 0.45 0.04 0.00 -0.22 0.00 0.00 54.13 54.66 1x5o s LEU 105 Cb -0.16 -2.59 -0.00 0.00 0.50 0.00 0.00 46.19 43.94 1x5o s LEU 105 CO 0.09 -0.25 -0.17 0.00 -1.32 0.00 0.00 176.35 174.70 1x5o s LYS 107 N 0.04 0.71 -0.77 0.00 -2.85 -0.84 -4.89 119.74 111.14 1x5o s LYS 107 Ca -0.04 0.93 -0.29 0.00 -1.00 0.00 0.00 55.97 55.57 1x5o s LYS 107 Cb -0.12 0.30 -0.15 0.00 -2.06 0.00 0.00 37.83 35.80 1x5o s LYS 107 CO 0.02 -0.10 2.57 1.19 0.10 0.00 0.00 175.35 179.13 1x5o n PHE 108 N 3.07 0.95 0.14 1.78 3.72 -1.26 -1.39 117.46 124.46 1x5o n PHE 108 Ca -0.15 0.26 -0.14 0.00 -0.05 0.00 0.00 57.45 57.36 1x5o n PHE 108 Cb 0.56 -2.48 -0.07 0.00 -0.94 0.00 0.00 39.48 36.55 1x5o n PHE 108 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1x5o h SER 109 N 15.45 -1.08 0.00 4.37 0.87 -1.87 -3.46 113.55 127.83 1x5o h SER 109 Ca -0.13 0.12 0.00 0.00 -1.23 0.00 0.00 61.79 60.54 1x5o h SER 109 Cb 1.29 0.40 0.00 0.00 -0.44 0.00 0.00 62.40 63.65 1x5o h SER 109 CO 1.29 -0.47 0.00 0.61 -0.53 0.00 0.00 176.83 177.73 1x5o n GLY 110 N -1.45 0.27 0.00 5.77 0.00 -1.26 -4.63 105.19 103.88 1x5o n GLY 110 Ca -0.07 -2.19 0.07 0.00 0.00 0.00 0.00 46.02 43.82 1x5o n GLY 110 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x5o n PRO 111 N 0.00 0.15 -1.29 1.61 -0.04 -1.26 -4.08 135.00 130.09 1x5o n PRO 111 Ca 0.00 0.18 -0.43 0.00 -0.04 0.00 0.00 63.50 63.20 1x5o n PRO 111 Cb 0.00 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 31.94 1x5o n PRO 111 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1x5o n SER 112 N -1.34 -1.85 -4.50 3.54 2.88 -1.26 -4.74 113.62 106.35 1x5o n SER 112 Ca 0.06 0.95 -0.31 0.00 -1.33 0.00 0.00 58.87 58.24 1x5o n SER 112 Cb 0.13 -0.88 0.18 0.00 -0.75 0.00 0.00 64.21 62.90 1x5o n SER 112 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1x5o n SER 113 N 2.04 -1.20 0.00 -3.46 2.88 -1.26 -4.98 113.62 107.65 1x5o n SER 113 Ca 0.14 0.16 0.00 0.00 -1.33 0.00 0.00 58.87 57.85 1x5o n SER 113 Cb 0.30 -1.28 0.00 0.00 -0.75 0.00 0.00 64.21 62.48 1x5o n SER 113 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42