#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5l h SER 2 N 0.00 -0.08 -4.25 1.61 4.64 -2.12 -3.46 113.55 109.88 1x5l h SER 2 Ca 0.00 -0.33 -0.10 0.00 -0.47 0.00 0.00 61.79 60.89 1x5l h SER 2 Cb 0.00 0.02 -0.22 0.00 -0.31 0.00 0.00 62.40 61.89 1x5l h SER 2 CO 0.00 0.30 -0.13 -0.55 -0.87 0.00 0.00 176.83 175.58 1x5l s SER 3 N -5.47 -0.47 0.79 4.97 0.15 -1.26 -5.15 113.70 107.27 1x5l s SER 3 Ca -0.15 0.78 -0.17 0.00 0.70 0.00 0.00 55.95 57.11 1x5l s SER 3 Cb 0.02 0.81 -0.14 0.00 -1.71 0.00 0.00 66.02 65.00 1x5l s SER 3 CO 0.64 -0.28 -0.44 0.61 1.20 0.00 0.00 173.24 174.97 1x5l n GLY 4 N 2.28 -3.88 3.51 9.45 0.00 -1.26 -4.93 105.19 110.35 1x5l n GLY 4 Ca -0.16 -0.54 -0.35 0.00 0.00 0.00 0.00 46.02 44.97 1x5l n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x5l s SER 5 N -1.05 5.19 0.51 1.61 0.01 -1.26 -5.04 113.70 113.68 1x5l s SER 5 Ca 0.48 -0.11 0.05 0.00 1.31 0.00 0.00 55.95 57.69 1x5l s SER 5 Cb -0.31 -1.90 0.02 0.00 0.21 0.00 0.00 66.02 64.03 1x5l s SER 5 CO 0.75 0.07 0.33 -0.94 0.41 0.00 0.00 173.24 173.85 1x5l s SER 6 N 1.01 4.59 0.11 2.44 1.04 -1.26 -5.00 113.70 116.63 1x5l s SER 6 Ca 0.03 -1.22 0.00 0.00 0.48 0.00 0.00 55.95 55.24 1x5l s SER 6 Cb -0.14 0.21 0.00 0.00 0.10 0.00 0.00 66.02 66.19 1x5l s SER 6 CO 0.03 -0.96 0.00 0.61 0.98 0.00 0.00 173.24 173.90 1x5l n GLY 7 N -1.62 0.97 3.55 7.32 0.00 -1.26 -4.97 105.19 109.18 1x5l n GLY 7 Ca -0.03 -1.22 -0.25 0.00 0.00 0.00 0.00 46.02 44.52 1x5l n GLY 7 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1x5l s GLN 8 N 0.00 1.84 0.69 1.61 -1.52 -1.26 -5.15 119.66 115.87 1x5l s GLN 8 Ca 0.00 -2.06 -0.11 0.00 -1.95 0.00 0.00 55.36 51.23 1x5l s GLN 8 Cb 0.00 -1.16 0.01 0.00 -0.22 0.00 0.00 33.01 31.64 1x5l s GLN 8 CO 0.00 -0.20 1.08 0.00 -0.25 0.00 0.00 175.29 175.93 1x5l s ALA 9 N -3.05 2.93 0.49 6.09 0.00 -1.26 -4.74 121.76 122.22 1x5l s ALA 9 Ca 0.31 -0.30 -0.07 0.00 0.00 0.00 0.00 51.96 51.90 1x5l s ALA 9 Cb 0.08 -3.03 -0.04 0.00 0.00 0.00 0.00 23.12 20.12 1x5l s ALA 9 CO 0.15 -1.06 0.83 0.00 0.00 0.00 0.00 175.76 175.67 1x5l s ALA 10 N -3.33 3.34 0.44 0.00 0.00 -1.26 -4.66 121.76 116.29 1x5l s ALA 10 Ca 0.58 -0.39 -0.24 0.00 0.00 0.00 0.00 51.96 51.91 1x5l s ALA 10 Cb -0.11 -2.69 -0.08 0.00 0.00 0.00 0.00 23.12 20.24 1x5l s ALA 10 CO 0.52 -0.36 1.17 -1.25 0.00 0.00 0.00 175.76 175.85 1x5l s PRO 11 N -4.68 3.84 1.23 0.00 0.04 -1.22 -4.72 135.00 129.50 1x5l s PRO 11 Ca 0.49 1.81 -0.15 0.00 0.04 0.00 0.00 61.00 63.20 1x5l s PRO 11 Cb -0.10 -2.50 0.30 0.00 0.04 0.00 0.00 34.50 32.24 1x5l s PRO 11 CO 0.44 -0.49 0.90 -1.13 0.04 0.00 0.00 177.00 176.77 1x5l n SER 12 N -0.31 -2.27 -4.60 6.66 3.41 -0.08 -3.96 113.62 112.47 1x5l n SER 12 Ca 0.06 -0.30 -0.40 0.00 -0.26 0.00 0.00 58.87 57.97 1x5l n SER 12 Cb 0.47 -1.18 -0.08 0.00 -0.26 0.00 0.00 64.21 63.16 1x5l n SER 12 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 1x5l s GLN 13 N -4.38 3.95 0.10 4.33 0.74 -1.26 -4.66 119.66 118.48 1x5l s GLN 13 Ca 0.67 0.11 -0.31 0.00 0.05 0.00 0.00 55.36 55.89 1x5l s GLN 13 Cb -0.23 -3.69 -0.09 0.00 1.10 0.00 0.00 33.01 30.10 1x5l s GLN 13 CO 0.65 -0.39 1.71 0.08 -0.55 0.00 0.00 175.29 176.79 1x5l s VAL 14 N 2.24 2.79 -0.17 1.34 1.01 -1.26 -4.88 120.40 121.47 1x5l s VAL 14 Ca 0.18 0.31 0.11 0.00 0.00 0.00 0.00 61.98 62.59 1x5l s VAL 14 Cb -0.16 -3.20 0.22 0.00 0.00 0.00 0.00 36.38 33.24 1x5l s VAL 14 CO 0.10 0.00 1.14 1.33 0.00 0.00 0.00 175.10 177.68 1x5l n VAL 15 N 4.64 1.54 -4.02 2.92 0.24 -1.26 -4.15 118.33 118.24 1x5l n VAL 15 Ca 0.16 -1.65 -0.33 0.00 -2.04 0.00 0.00 64.34 60.48 1x5l n VAL 15 Cb 0.39 0.09 -0.15 0.00 -1.47 0.00 0.00 33.84 32.71 1x5l n VAL 15 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1x5l s VAL 16 N -2.03 2.39 -0.04 3.34 1.01 -1.26 -4.91 120.40 118.90 1x5l s VAL 16 Ca 0.21 -1.73 -0.02 0.00 0.00 0.00 0.00 61.98 60.44 1x5l s VAL 16 Cb 0.17 -2.47 0.02 0.00 0.00 0.00 0.00 36.38 34.10 1x5l s VAL 16 CO 0.04 -0.17 0.09 -0.63 0.00 0.00 0.00 175.10 174.43 1x5l s ILE 17 N 1.10 -0.02 0.29 2.22 1.01 -1.26 -3.33 121.20 121.20 1x5l s ILE 17 Ca -0.04 0.07 0.03 0.00 0.00 0.00 0.00 60.65 60.70 1x5l s ILE 17 Cb -0.20 -0.14 -0.04 0.00 0.01 0.00 0.00 42.46 42.09 1x5l s ILE 17 CO -0.05 0.03 0.15 -0.13 0.00 0.00 0.00 174.94 174.94 1x5l s ARG 18 N 0.43 1.53 -0.35 2.79 0.52 0.17 -4.93 118.95 119.11 1x5l s ARG 18 Ca -0.03 -1.86 -0.01 0.00 -0.52 0.00 0.00 55.73 53.31 1x5l s ARG 18 Cb -0.05 -0.05 0.09 0.00 0.52 0.00 0.00 34.95 35.46 1x5l s ARG 18 CO -0.02 -0.43 0.10 -1.14 0.02 0.00 0.00 175.30 173.83 1x5l s GLN 19 N -3.87 2.04 0.02 3.54 0.74 -1.26 -0.62 119.66 120.25 1x5l s GLN 19 Ca 0.37 -1.64 -0.25 0.00 0.05 0.00 0.00 55.36 53.89 1x5l s GLN 19 Cb 0.05 -3.35 -0.18 0.00 1.10 0.00 0.00 33.01 30.63 1x5l s GLN 19 CO 0.17 -0.88 1.38 0.93 -0.55 0.00 0.00 175.29 176.34 1x5l h GLU 20 N 7.93 -0.13 -3.08 1.67 4.39 -1.85 -3.46 114.58 120.05 1x5l h GLU 20 Ca -0.14 0.01 -0.14 0.00 0.34 0.00 0.00 59.36 59.43 1x5l h GLU 20 Cb 1.05 0.03 -0.23 0.00 -0.10 0.00 0.00 28.75 29.49 1x5l h GLU 20 CO 0.60 0.18 -0.36 1.03 -1.16 0.00 0.00 179.01 179.31 1x5l s ARG 21 N -4.89 0.46 -0.19 2.33 0.52 -1.26 -5.03 118.95 110.89 1x5l s ARG 21 Ca -0.15 0.14 0.00 0.00 -0.52 0.00 0.00 55.73 55.20 1x5l s ARG 21 Cb 0.03 0.21 0.04 0.00 0.52 0.00 0.00 34.95 35.75 1x5l s ARG 21 CO 0.63 -0.09 -0.08 0.00 0.02 0.00 0.00 175.30 175.78 1x5l s ALA 22 N -0.47 1.80 0.00 2.13 0.00 -1.26 -0.94 121.76 123.02 1x5l s ALA 22 Ca -0.06 -1.06 0.00 0.00 0.00 0.00 0.00 51.96 50.84 1x5l s ALA 22 Cb -0.04 -1.22 0.00 0.00 0.00 0.00 0.00 23.12 21.87 1x5l s ALA 22 CO 0.02 -0.80 0.00 0.41 0.00 0.00 0.00 175.76 175.38 1x5l n GLY 23 N 4.76 2.38 0.06 0.00 0.00 0.34 -4.81 105.19 107.92 1x5l n GLY 23 Ca -0.14 -2.06 -0.09 0.00 0.00 0.00 0.00 46.02 43.73 1x5l n GLY 23 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1x5l h GLN 24 N 0.00 0.00 -0.09 1.61 4.15 -1.94 -2.36 115.11 116.48 1x5l h GLN 24 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1x5l h GLN 24 Cb 0.00 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.69 1x5l h GLN 24 CO 0.00 0.67 0.00 0.25 -1.93 0.00 0.00 178.83 177.82 1x5l n THR 25 N -4.67 1.75 -3.96 2.39 -2.24 -1.26 -3.91 114.28 102.39 1x5l n THR 25 Ca -0.07 -1.84 -0.09 0.00 -2.27 0.00 0.00 64.05 59.79 1x5l n THR 25 Cb 0.32 -0.05 -0.09 0.00 -2.10 0.00 0.00 70.33 68.41 1x5l n THR 25 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1x5l s SER 26 N -2.15 0.25 -0.15 3.42 1.04 -1.26 -1.71 113.70 113.14 1x5l s SER 26 Ca 0.28 -0.68 -0.20 0.00 0.48 0.00 0.00 55.95 55.83 1x5l s SER 26 Cb 0.23 0.24 0.05 0.00 0.10 0.00 0.00 66.02 66.64 1x5l s SER 26 CO 0.05 -0.57 0.53 -0.69 0.98 0.00 0.00 173.24 173.53 1x5l s VAL 27 N -3.18 0.01 0.12 5.02 1.01 -0.53 -0.51 120.40 122.34 1x5l s VAL 27 Ca -0.00 -0.07 0.07 0.00 0.00 0.00 0.00 61.98 61.98 1x5l s VAL 27 Cb 0.02 -0.77 -0.04 0.00 0.00 0.00 0.00 36.38 35.59 1x5l s VAL 27 CO -0.07 -0.04 -0.10 -0.55 0.00 0.00 0.00 175.10 174.34 1x5l s SER 28 N -0.20 4.39 0.13 3.32 0.15 -0.11 0.68 113.70 122.05 1x5l s SER 28 Ca -0.04 -0.42 0.06 0.00 0.70 0.00 0.00 55.95 56.25 1x5l s SER 28 Cb -0.03 -0.82 -0.04 0.00 -1.71 0.00 0.00 66.02 63.41 1x5l s SER 28 CO 0.03 0.16 -0.14 -0.76 1.20 0.00 0.00 173.24 173.73 1x5l s LEU 29 N -2.33 2.42 -0.12 3.45 1.43 -0.64 -3.37 118.68 119.52 1x5l s LEU 29 Ca 0.22 -0.83 -0.03 0.00 -1.03 0.00 0.00 54.13 52.46 1x5l s LEU 29 Cb -0.11 -0.55 0.05 0.00 0.03 0.00 0.00 46.19 45.61 1x5l s LEU 29 CO 0.14 -0.15 0.06 -0.22 0.23 0.00 0.00 176.35 176.41 1x5l s LEU 30 N -2.52 0.41 0.01 1.79 2.96 0.21 -3.52 118.68 118.03 1x5l s LEU 30 Ca 0.10 -0.33 0.03 0.00 -0.22 0.00 0.00 54.13 53.70 1x5l s LEU 30 Cb -0.04 -0.28 -0.01 0.00 0.50 0.00 0.00 46.19 46.36 1x5l s LEU 30 CO 0.03 -0.29 -0.10 -1.66 -1.32 0.00 0.00 176.35 173.02 1x5l s TRP 31 N 2.09 0.84 0.39 5.38 -2.14 -1.19 0.41 118.94 124.72 1x5l s TRP 31 Ca 0.03 -0.25 -0.02 0.00 2.66 0.00 0.00 56.10 58.52 1x5l s TRP 31 Cb -0.14 -0.52 -0.04 0.00 -3.10 0.00 0.00 33.47 29.67 1x5l s TRP 31 CO -0.06 -0.01 0.64 1.14 -2.66 0.00 0.00 176.95 175.99 1x5l s GLN 32 N -0.65 3.53 0.61 3.25 -2.07 -1.21 -4.77 119.66 118.36 1x5l s GLN 32 Ca 0.01 -0.09 -0.18 0.00 -1.82 0.00 0.00 55.36 53.28 1x5l s GLN 32 Cb -0.05 -2.56 -0.04 0.00 -1.09 0.00 0.00 33.01 29.27 1x5l s GLN 32 CO 0.00 0.03 0.99 0.39 -1.32 0.00 0.00 175.29 175.39 1x5l n GLU 33 N -1.82 0.90 -2.26 9.60 4.71 -1.26 -4.81 120.64 125.71 1x5l n GLU 33 Ca -0.02 0.35 -0.40 0.00 -0.01 0.00 0.00 57.16 57.08 1x5l n GLU 33 Cb 0.55 -2.20 -0.03 0.00 -1.01 0.00 0.00 31.44 28.76 1x5l n GLU 33 CO 0.00 0.00 0.00 -1.25 0.09 0.00 0.00 177.13 175.97 1x5l s PRO 34 N -2.82 4.39 0.20 3.49 0.04 -1.26 -4.92 135.00 134.11 1x5l s PRO 34 Ca 0.77 2.02 -0.16 0.00 0.04 0.00 0.00 61.00 63.67 1x5l s PRO 34 Cb -0.41 -3.04 0.19 0.00 0.04 0.00 0.00 34.50 31.28 1x5l s PRO 34 CO 0.46 -0.09 1.35 0.39 0.04 0.00 0.00 177.00 179.16 1x5l n GLU 35 N 0.79 -0.22 -3.83 4.56 1.02 -1.26 -3.63 120.64 118.07 1x5l n GLU 35 Ca 0.00 1.34 -0.30 0.00 -0.02 0.00 0.00 57.16 58.18 1x5l n GLU 35 Cb 0.43 -1.99 -0.15 0.00 -0.02 0.00 0.00 31.44 29.72 1x5l n GLU 35 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1x5l s GLN 36 N -5.80 1.02 0.40 3.49 -0.21 -1.26 -4.98 119.66 112.32 1x5l s GLN 36 Ca -0.12 -1.22 0.19 0.00 0.02 0.00 0.00 55.36 54.23 1x5l s GLN 36 Cb 0.17 -2.38 0.84 0.00 1.00 0.00 0.00 33.01 32.64 1x5l s GLN 36 CO 0.62 -0.90 1.82 -1.00 -2.12 0.00 0.00 175.29 173.71 1x5l h PRO 37 N 7.96 0.00 -6.13 2.91 0.13 -1.93 -0.18 132.00 134.76 1x5l h PRO 37 Ca -0.12 0.00 -0.44 0.00 -0.87 0.00 0.00 66.00 64.57 1x5l h PRO 37 Cb 1.03 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.19 1x5l h PRO 37 CO 0.47 0.33 -0.76 0.09 -0.23 0.00 0.00 178.00 177.89 1x5l n ASN 38 N -3.67 -4.21 0.00 1.44 3.02 -1.26 -3.43 115.26 107.15 1x5l n ASN 38 Ca -0.01 -0.73 0.00 0.00 -0.03 0.00 0.00 54.58 53.81 1x5l n ASN 38 Cb 0.43 -4.22 0.00 0.00 -0.61 0.00 0.00 39.78 35.38 1x5l n ASN 38 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1x5l n GLY 39 N -1.70 0.83 3.70 7.41 0.00 -1.26 -4.69 105.19 109.48 1x5l n GLY 39 Ca -0.06 -2.01 -0.40 0.00 0.00 0.00 0.00 46.02 43.55 1x5l n GLY 39 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1x5l s ILE 40 N -1.45 5.03 -0.29 -0.61 1.09 -1.26 -5.03 121.20 118.67 1x5l s ILE 40 Ca 0.00 1.43 -0.22 0.00 -1.10 0.00 0.00 60.65 60.76 1x5l s ILE 40 Cb 0.00 -4.04 -0.01 0.00 -1.06 0.00 0.00 42.46 37.36 1x5l s ILE 40 CO 0.00 0.21 0.73 -0.63 -0.10 0.00 0.00 174.94 175.15 1x5l s ILE 41 N 1.09 4.87 -0.05 2.92 1.01 -1.26 -4.05 121.20 125.72 1x5l s ILE 41 Ca 0.36 1.14 -0.13 0.00 0.00 0.00 0.00 60.65 62.03 1x5l s ILE 41 Cb -0.17 -4.07 -0.07 0.00 0.01 0.00 0.00 42.46 38.15 1x5l s ILE 41 CO 0.16 -0.15 0.52 -0.07 0.00 0.00 0.00 174.94 175.40 1x5l h LEU 42 N 9.26 -0.33 -8.20 2.97 3.38 -1.84 -3.49 115.31 117.05 1x5l h LEU 42 Ca -0.25 -0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.63 1x5l h LEU 42 Cb 1.11 0.09 -0.07 0.00 0.09 0.00 0.00 40.66 41.87 1x5l h LEU 42 CO 0.84 0.13 -0.01 -1.83 0.09 0.00 0.00 178.44 177.67 1x5l s GLU 43 N -2.94 1.74 -0.22 1.13 -1.05 -1.25 -4.75 118.70 111.35 1x5l s GLU 43 Ca -0.07 -1.29 0.02 0.00 -0.15 0.00 0.00 54.97 53.48 1x5l s GLU 43 Cb 0.01 0.52 0.04 0.00 -0.44 0.00 0.00 34.13 34.25 1x5l s GLU 43 CO 0.22 -0.75 -0.15 0.71 0.95 0.00 0.00 175.26 176.23 1x5l s TYR 44 N -3.64 3.02 -0.08 4.83 1.51 0.94 -2.96 117.35 120.98 1x5l s TYR 44 Ca 0.20 -1.99 -0.27 0.00 -1.01 0.00 0.00 57.07 54.01 1x5l s TYR 44 Cb -0.02 -1.92 -0.02 0.00 -0.11 0.00 0.00 41.96 39.88 1x5l s TYR 44 CO 0.11 -0.84 0.88 -1.21 -1.11 0.00 0.00 175.55 173.37 1x5l s GLU 45 N 1.20 4.44 -0.15 -0.62 8.01 -0.94 -2.08 118.70 128.55 1x5l s GLU 45 Ca -0.02 1.17 -0.00 0.00 0.01 0.00 0.00 54.97 56.13 1x5l s GLU 45 Cb -0.17 -3.50 -0.01 0.00 -4.31 0.00 0.00 34.13 26.15 1x5l s GLU 45 CO -0.09 -0.14 -0.14 0.42 0.01 0.00 0.00 175.26 175.32 1x5l s ILE 46 N 1.44 2.87 -0.21 -1.63 1.01 0.44 -1.83 121.20 123.28 1x5l s ILE 46 Ca 0.44 -0.71 -0.07 0.00 0.00 0.00 0.00 60.65 60.31 1x5l s ILE 46 Cb -0.18 -2.22 -0.03 0.00 0.01 0.00 0.00 42.46 40.04 1x5l s ILE 46 CO 0.20 0.51 0.05 -0.75 0.00 0.00 0.00 174.94 174.95 1x5l s LYS 47 N 0.69 3.78 -0.05 2.79 2.20 -0.69 -0.01 119.74 128.44 1x5l s LYS 47 Ca -0.07 -0.43 0.01 0.00 -0.36 0.00 0.00 55.97 55.13 1x5l s LYS 47 Cb -0.15 -3.23 0.02 0.00 -1.51 0.00 0.00 37.83 32.95 1x5l s LYS 47 CO 0.02 0.04 -0.07 1.52 -0.36 0.00 0.00 175.35 176.50 1x5l s TYR 48 N 0.99 1.02 0.13 4.03 1.13 -0.99 -1.69 117.35 121.97 1x5l s TYR 48 Ca 0.03 -0.34 -0.05 0.00 -1.41 0.00 0.00 57.07 55.30 1x5l s TYR 48 Cb -0.14 -0.83 -0.02 0.00 -1.10 0.00 0.00 41.96 39.87 1x5l s TYR 48 CO 0.03 -0.23 0.16 1.52 -2.51 0.00 0.00 175.55 174.52 1x5l s TYR 49 N 0.85 0.53 -0.27 -3.49 -0.85 -1.18 -3.51 117.35 109.43 1x5l s TYR 49 Ca -0.12 -0.93 -0.28 0.00 -0.52 0.00 0.00 57.07 55.22 1x5l s TYR 49 Cb -0.15 -0.23 -0.06 0.00 0.38 0.00 0.00 41.96 41.90 1x5l s TYR 49 CO 0.01 -0.59 2.26 0.39 -1.52 0.00 0.00 175.55 176.09 1x5l n GLU 50 N -0.12 1.75 -0.14 -3.49 1.02 -1.22 -1.58 120.64 116.85 1x5l n GLU 50 Ca -0.08 0.43 -0.07 0.00 -0.02 0.00 0.00 57.16 57.41 1x5l n GLU 50 Cb 0.63 -3.20 -0.01 0.00 -0.02 0.00 0.00 31.44 28.83 1x5l n GLU 50 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 1x5l h LYS 51 N 15.54 -0.23 -0.37 3.49 1.63 -0.17 -1.48 116.57 134.98 1x5l h LYS 51 Ca -0.37 0.02 -0.11 0.00 -0.85 0.00 0.00 60.65 59.33 1x5l h LYS 51 Cb 1.25 0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 32.92 1x5l h LYS 51 CO 1.00 -0.15 -0.21 0.22 -3.45 0.00 0.00 179.45 176.85 1x5l h ASP 52 N -0.24 0.82 -3.26 4.20 3.58 -1.89 -3.39 116.42 116.24 1x5l h ASP 52 Ca 0.18 -0.42 -0.74 0.00 0.42 0.00 0.00 57.03 56.48 1x5l h ASP 52 Cb 0.55 -0.23 -0.25 0.00 1.72 0.00 0.00 39.33 41.12 1x5l h ASP 52 CO -0.58 1.06 -0.33 -0.54 -2.88 0.00 0.00 179.24 175.97 1x5l s LYS 53 N -4.57 2.84 -0.37 0.28 -0.14 -0.56 -5.04 119.74 112.17 1x5l s LYS 53 Ca -0.12 -1.54 -0.12 0.00 -1.36 0.00 0.00 55.97 52.83 1x5l s LYS 53 Cb 0.10 -4.09 0.02 0.00 -1.68 0.00 0.00 37.83 32.18 1x5l s LYS 53 CO 0.84 -1.13 0.23 -2.00 -0.76 0.00 0.00 175.35 172.52 1x5l s GLU 54 N 1.55 2.98 0.36 1.68 -6.30 -1.20 -3.42 118.70 114.35 1x5l s GLU 54 Ca 0.04 -0.99 0.09 0.00 -2.50 0.00 0.00 54.97 51.60 1x5l s GLU 54 Cb -0.26 -3.78 -0.06 0.00 0.00 0.00 0.00 34.13 30.02 1x5l s GLU 54 CO 0.04 -0.66 -0.00 0.00 0.02 0.00 0.00 175.26 174.65 1x5l s MET 55 N 1.61 1.99 0.19 4.30 0.23 -1.26 -5.04 119.30 121.31 1x5l s MET 55 Ca 0.03 -1.89 -0.09 0.00 -1.03 0.00 0.00 55.69 52.71 1x5l s MET 55 Cb -0.19 -1.80 0.11 0.00 -1.53 0.00 0.00 34.83 31.42 1x5l s MET 55 CO 0.08 0.07 1.73 0.37 -2.03 0.00 0.00 175.02 175.24 1x5l h GLN 56 N 1.83 1.08 -6.60 3.16 5.75 -2.04 -3.40 115.11 114.89 1x5l h GLN 56 Ca -0.43 -0.23 -0.56 0.00 -0.15 0.00 0.00 58.65 57.28 1x5l h GLN 56 Cb 1.25 -0.16 -0.06 0.00 1.07 0.00 0.00 27.48 29.58 1x5l h GLN 56 CO 0.71 0.93 1.02 -1.54 -2.65 0.00 0.00 178.83 177.30 1x5l s SER 57 N -6.33 6.43 0.18 -0.69 1.04 -1.26 -5.00 113.70 108.07 1x5l s SER 57 Ca -0.12 0.65 0.11 0.00 0.48 0.00 0.00 55.95 57.06 1x5l s SER 57 Cb 0.14 -2.54 -0.04 0.00 0.10 0.00 0.00 66.02 63.68 1x5l s SER 57 CO 0.83 -1.39 -0.20 -0.72 0.98 0.00 0.00 173.24 172.75 1x5l s TYR 58 N 5.11 2.41 0.16 5.02 1.13 -1.26 -5.04 117.35 124.88 1x5l s TYR 58 Ca 0.56 -0.31 -0.03 0.00 -1.41 0.00 0.00 57.07 55.87 1x5l s TYR 58 Cb -0.11 -1.20 -0.05 0.00 -1.10 0.00 0.00 41.96 39.50 1x5l s TYR 58 CO 0.32 0.49 0.37 0.45 -2.51 0.00 0.00 175.55 174.67 1x5l s SER 59 N -2.66 6.44 0.06 -0.18 0.15 -1.23 -5.02 113.70 111.26 1x5l s SER 59 Ca 0.22 0.49 0.05 0.00 0.70 0.00 0.00 55.95 57.40 1x5l s SER 59 Cb -0.08 -2.05 -0.03 0.00 -1.71 0.00 0.00 66.02 62.15 1x5l s SER 59 CO 0.11 0.02 -0.13 -0.89 1.20 0.00 0.00 173.24 173.55 1x5l s THR 60 N -1.73 1.04 -0.07 6.45 2.01 -1.26 -2.35 115.64 119.73 1x5l s THR 60 Ca 0.40 -1.20 0.01 0.00 0.31 0.00 0.00 61.69 61.21 1x5l s THR 60 Cb -0.12 -1.00 0.02 0.00 0.01 0.00 0.00 72.50 71.42 1x5l s THR 60 CO 0.27 -0.19 -0.09 -0.22 -0.69 0.00 0.00 174.62 173.71 1x5l s LEU 61 N -1.56 1.42 -0.03 4.42 2.96 0.98 -4.93 118.68 121.93 1x5l s LEU 61 Ca -0.02 -0.24 -0.17 0.00 -0.22 0.00 0.00 54.13 53.48 1x5l s LEU 61 Cb -0.09 -0.71 -0.05 0.00 0.50 0.00 0.00 46.19 45.84 1x5l s LEU 61 CO 0.02 -0.03 0.46 -0.54 -1.32 0.00 0.00 176.35 174.94 1x5l s LYS 62 N 1.00 4.14 -0.03 1.98 3.01 -1.26 -0.42 119.74 128.16 1x5l s LYS 62 Ca -0.09 0.48 0.01 0.00 -1.01 0.00 0.00 55.97 55.36 1x5l s LYS 62 Cb -0.15 -3.31 0.03 0.00 -1.01 0.00 0.00 37.83 33.39 1x5l s LYS 62 CO -0.00 0.47 -0.01 0.00 0.51 0.00 0.00 175.35 176.31 1x5l s ALA 63 N -0.40 0.42 -0.10 5.17 0.00 -0.88 -4.96 121.76 121.01 1x5l s ALA 63 Ca 0.25 0.10 0.15 0.00 0.00 0.00 0.00 51.96 52.46 1x5l s ALA 63 Cb -0.17 -0.35 -0.07 0.00 0.00 0.00 0.00 23.12 22.53 1x5l s ALA 63 CO 0.13 -0.06 1.13 -0.39 0.00 0.00 0.00 175.76 176.57 1x5l h VAL 64 N 6.21 0.82 -1.35 0.00 -1.51 -1.88 0.27 116.25 118.81 1x5l h VAL 64 Ca -0.41 -2.31 -0.51 0.00 -1.23 0.00 0.00 66.70 62.24 1x5l h VAL 64 Cb 1.14 2.32 -0.03 0.00 -2.13 0.00 0.00 31.29 32.59 1x5l h VAL 64 CO 0.47 0.47 -0.36 0.28 -1.23 0.00 0.00 177.57 177.20 1x5l s THR 65 N -2.89 2.48 -2.00 7.19 -1.32 -1.26 -4.84 115.64 113.00 1x5l s THR 65 Ca 0.00 -1.36 0.11 0.00 -1.21 0.00 0.00 61.69 59.23 1x5l s THR 65 Cb 0.08 -2.84 0.31 0.00 -1.51 0.00 0.00 72.50 68.54 1x5l s THR 65 CO 0.79 0.00 1.20 0.35 -2.21 0.00 0.00 174.62 174.75 1x5l n THR 66 N -1.60 0.00 -4.69 5.08 -2.24 -1.26 -4.67 114.28 104.90 1x5l n THR 66 Ca 0.03 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.57 1x5l n THR 66 Cb 0.62 -0.38 -0.16 0.00 -2.10 0.00 0.00 70.33 68.31 1x5l n THR 66 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1x5l s ARG 67 N -2.00 1.47 0.15 -0.78 0.52 -1.26 -3.17 118.95 113.88 1x5l s ARG 67 Ca 0.16 -0.52 -0.13 0.00 -0.52 0.00 0.00 55.73 54.73 1x5l s ARG 67 Cb 0.08 -1.32 0.01 0.00 0.52 0.00 0.00 34.95 34.24 1x5l s ARG 67 CO 0.13 0.22 0.35 0.00 0.02 0.00 0.00 175.30 176.02 1x5l s ALA 68 N 0.02 -0.46 -0.08 2.13 0.00 -1.23 -4.84 121.76 117.29 1x5l s ALA 68 Ca -0.02 -0.51 -0.02 0.00 0.00 0.00 0.00 51.96 51.41 1x5l s ALA 68 Cb -0.10 0.76 0.03 0.00 0.00 0.00 0.00 23.12 23.82 1x5l s ALA 68 CO 0.01 -0.67 0.03 0.99 0.00 0.00 0.00 175.76 176.12 1x5l s THR 69 N -3.89 0.24 -0.52 0.00 2.01 -1.26 -1.62 115.64 110.60 1x5l s THR 69 Ca 0.10 0.11 -0.24 0.00 0.31 0.00 0.00 61.69 61.97 1x5l s THR 69 Cb 0.02 -0.49 0.04 0.00 0.01 0.00 0.00 72.50 72.07 1x5l s THR 69 CO -0.05 0.15 0.92 -0.69 -0.69 0.00 0.00 174.62 174.27 1x5l s VAL 70 N 2.02 4.43 0.21 3.82 1.01 0.21 -4.88 120.40 127.22 1x5l s VAL 70 Ca 0.04 0.43 0.07 0.00 0.00 0.00 0.00 61.98 62.52 1x5l s VAL 70 Cb -0.13 -4.49 -0.04 0.00 0.00 0.00 0.00 36.38 31.72 1x5l s VAL 70 CO -0.05 -1.00 0.11 -0.44 0.00 0.00 0.00 175.10 173.72 1x5l s SER 71 N 2.62 5.25 0.00 3.32 0.01 -1.26 -1.45 113.70 122.19 1x5l s SER 71 Ca 0.32 -0.29 0.00 0.00 1.31 0.00 0.00 55.95 57.29 1x5l s SER 71 Cb -0.12 -1.27 0.00 0.00 0.21 0.00 0.00 66.02 64.84 1x5l s SER 71 CO 0.22 0.02 0.00 0.61 0.41 0.00 0.00 173.24 174.50 1x5l n GLY 72 N -0.69 0.87 3.78 3.44 0.00 -0.69 -5.00 105.19 106.90 1x5l n GLY 72 Ca -0.08 -0.30 -0.26 0.00 0.00 0.00 0.00 46.02 45.39 1x5l n GLY 72 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1x5l s LEU 73 N -0.57 2.96 -0.04 0.99 1.43 -0.74 -5.07 118.68 117.64 1x5l s LEU 73 Ca 0.00 -1.16 -0.10 0.00 -1.03 0.00 0.00 54.13 51.84 1x5l s LEU 73 Cb 0.00 -1.33 -0.05 0.00 0.03 0.00 0.00 46.19 44.84 1x5l s LEU 73 CO 0.00 -0.69 0.28 -0.54 0.23 0.00 0.00 176.35 175.63 1x5l s LYS 74 N -3.98 3.66 0.79 1.70 1.02 -1.26 -4.55 119.74 117.12 1x5l s LYS 74 Ca 0.36 0.09 -0.11 0.00 0.02 0.00 0.00 55.97 56.34 1x5l s LYS 74 Cb 0.02 -3.17 0.07 0.00 -0.52 0.00 0.00 37.83 34.23 1x5l s LYS 74 CO 0.20 0.71 1.09 -1.25 -0.92 0.00 0.00 175.35 175.19 1x5l s PRO 75 N -1.24 2.08 -1.45 -1.68 0.04 -1.25 -3.86 135.00 127.64 1x5l s PRO 75 Ca 0.22 1.11 -0.02 0.00 0.04 0.00 0.00 61.00 62.35 1x5l s PRO 75 Cb -0.14 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.52 1x5l s PRO 75 CO 0.10 -1.75 0.26 0.41 0.04 0.00 0.00 177.00 176.07 1x5l n GLY 76 N -1.19 -0.22 3.17 0.56 0.00 -1.19 -4.81 105.19 101.51 1x5l n GLY 76 Ca 0.09 0.17 -0.09 0.00 0.00 0.00 0.00 46.02 46.19 1x5l n GLY 76 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1x5l s THR 77 N -4.11 -0.60 0.34 2.61 2.01 -1.25 -4.98 115.64 109.66 1x5l s THR 77 Ca 0.03 0.15 -0.29 0.00 0.31 0.00 0.00 61.69 61.89 1x5l s THR 77 Cb -0.01 -0.65 -0.10 0.00 0.01 0.00 0.00 72.50 71.74 1x5l s THR 77 CO 0.94 0.05 1.35 -0.13 -0.69 0.00 0.00 174.62 176.13 1x5l s ARG 78 N 2.57 4.31 -0.01 4.92 0.52 -1.26 -3.96 118.95 126.03 1x5l s ARG 78 Ca 0.01 2.29 0.04 0.00 -0.52 0.00 0.00 55.73 57.55 1x5l s ARG 78 Cb -0.13 -3.05 -0.01 0.00 0.52 0.00 0.00 34.95 32.28 1x5l s ARG 78 CO -0.12 -0.26 -0.13 0.71 0.02 0.00 0.00 175.30 175.51 1x5l s TYR 79 N -1.09 1.14 -0.40 -0.53 2.02 0.02 0.58 117.35 119.09 1x5l s TYR 79 Ca 0.50 -0.22 -0.15 0.00 -0.37 0.00 0.00 57.07 56.83 1x5l s TYR 79 Cb -0.41 -0.73 0.01 0.00 -0.40 0.00 0.00 41.96 40.43 1x5l s TYR 79 CO 0.55 -0.02 0.31 0.08 -1.57 0.00 0.00 175.55 174.90 1x5l s VAL 80 N -0.34 5.24 0.14 0.71 1.01 -0.62 -2.12 120.40 124.43 1x5l s VAL 80 Ca 0.05 -0.52 -0.04 0.00 0.00 0.00 0.00 61.98 61.47 1x5l s VAL 80 Cb -0.05 -3.90 -0.05 0.00 0.00 0.00 0.00 36.38 32.37 1x5l s VAL 80 CO -0.00 -0.27 0.35 -0.36 0.00 0.00 0.00 175.10 174.82 1x5l s PHE 81 N 1.76 3.48 -0.23 5.22 0.08 -0.95 -3.11 117.98 124.23 1x5l s PHE 81 Ca 0.06 0.49 -0.04 0.00 0.12 0.00 0.00 56.93 57.56 1x5l s PHE 81 Cb -0.18 -1.95 0.12 0.00 -0.57 0.00 0.00 43.02 40.43 1x5l s PHE 81 CO 0.11 0.45 0.38 -0.65 -0.10 0.00 0.00 175.22 175.40 1x5l s GLN 82 N -2.71 0.33 0.03 0.44 -0.21 -0.68 -1.93 119.66 114.92 1x5l s GLN 82 Ca 0.40 0.66 -0.17 0.00 0.02 0.00 0.00 55.36 56.27 1x5l s GLN 82 Cb -0.12 -0.28 -0.06 0.00 1.00 0.00 0.00 33.01 33.55 1x5l s GLN 82 CO 0.26 -0.53 0.47 0.08 -2.12 0.00 0.00 175.29 173.45 1x5l s VAL 83 N 2.55 4.91 0.03 1.09 1.01 -1.26 -1.71 120.40 127.02 1x5l s VAL 83 Ca 0.09 0.99 -0.02 0.00 0.00 0.00 0.00 61.98 63.04 1x5l s VAL 83 Cb -0.14 -3.79 -0.02 0.00 0.00 0.00 0.00 36.38 32.43 1x5l s VAL 83 CO -0.15 0.56 0.00 0.00 0.00 0.00 0.00 175.10 175.52 1x5l s ARG 84 N -1.11 0.45 -0.02 2.72 1.70 -0.76 0.35 118.95 122.28 1x5l s ARG 84 Ca 0.26 -0.78 0.01 0.00 -0.47 0.00 0.00 55.73 54.75 1x5l s ARG 84 Cb -0.18 0.16 -0.03 0.00 -0.57 0.00 0.00 34.95 34.33 1x5l s ARG 84 CO 0.16 -0.09 -0.01 0.00 -1.08 0.00 0.00 175.30 174.28 1x5l s ALA 85 N -2.31 3.24 -0.04 7.88 0.00 -1.26 -2.23 121.76 127.03 1x5l s ALA 85 Ca -0.08 -0.92 0.01 0.00 0.00 0.00 0.00 51.96 50.97 1x5l s ALA 85 Cb -0.03 -1.34 0.02 0.00 0.00 0.00 0.00 23.12 21.77 1x5l s ALA 85 CO -0.04 0.63 -0.06 0.50 0.00 0.00 0.00 175.76 176.79 1x5l s ARG 86 N -1.36 0.92 0.40 0.00 3.52 -1.15 -1.71 118.95 119.56 1x5l s ARG 86 Ca 0.18 -0.15 0.06 0.00 -0.13 0.00 0.00 55.73 55.68 1x5l s ARG 86 Cb -0.11 -0.88 -0.07 0.00 -1.56 0.00 0.00 34.95 32.32 1x5l s ARG 86 CO 0.08 -0.05 0.02 0.95 -0.81 0.00 0.00 175.30 175.49 1x5l s THR 87 N 0.80 1.78 0.16 4.11 -4.23 -0.33 -2.35 115.64 115.58 1x5l s THR 87 Ca -0.11 -2.00 -0.15 0.00 -1.18 0.00 0.00 61.69 58.25 1x5l s THR 87 Cb -0.14 -2.89 0.04 0.00 1.34 0.00 0.00 72.50 70.85 1x5l s THR 87 CO 0.01 0.00 1.82 -1.28 -0.54 0.00 0.00 174.62 174.63 1x5l h SER 88 N 1.79 0.55 0.94 3.99 0.87 -1.97 -3.15 113.55 116.57 1x5l h SER 88 Ca -0.43 -0.02 -0.05 0.00 -1.23 0.00 0.00 61.79 60.06 1x5l h SER 88 Cb 1.25 -0.14 0.01 0.00 -0.44 0.00 0.00 62.40 63.08 1x5l h SER 88 CO 0.78 0.40 -0.45 0.00 -0.53 0.00 0.00 176.83 177.03 1x5l h ALA 89 N 1.17 -1.26 -3.00 6.23 0.00 -1.91 -3.48 119.26 117.00 1x5l h ALA 89 Ca 0.17 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1x5l h ALA 89 Cb -0.07 0.49 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1x5l h ALA 89 CO -0.04 -1.20 0.00 0.41 0.00 0.00 0.00 179.25 178.42 1x5l n GLY 90 N -1.59 4.56 3.46 0.00 0.00 -1.19 -4.93 105.19 105.50 1x5l n GLY 90 Ca -0.16 -0.60 -0.14 0.00 0.00 0.00 0.00 46.02 45.11 1x5l n GLY 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x5l n GLY 92 N 2.30 0.88 3.20 0.00 0.00 -0.69 -4.72 105.19 106.15 1x5l n GLY 92 Ca -0.15 -0.67 -0.10 0.00 0.00 0.00 0.00 46.02 45.10 1x5l n GLY 92 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1x5l s ARG 93 N 0.06 0.99 0.61 1.61 0.52 -1.26 -4.93 118.95 116.55 1x5l s ARG 93 Ca 0.00 -1.38 -0.18 0.00 -0.52 0.00 0.00 55.73 53.64 1x5l s ARG 93 Cb 0.00 0.28 -0.03 0.00 0.52 0.00 0.00 34.95 35.72 1x5l s ARG 93 CO 0.00 -0.31 1.23 -0.06 0.02 0.00 0.00 175.30 176.18 1x5l s PHE 94 N -4.03 2.31 1.04 -0.53 0.08 -1.26 -4.41 117.98 111.18 1x5l s PHE 94 Ca 0.23 1.51 -0.17 0.00 0.12 0.00 0.00 56.93 58.62 1x5l s PHE 94 Cb 0.06 -3.53 0.22 0.00 -0.57 0.00 0.00 43.02 39.21 1x5l s PHE 94 CO 0.02 -2.38 1.22 -1.12 -0.10 0.00 0.00 175.22 172.86 1x5l s SER 95 N -1.57 2.39 0.41 1.36 0.01 0.16 -4.86 113.70 111.59 1x5l s SER 95 Ca 0.78 0.49 -0.24 0.00 1.31 0.00 0.00 55.95 58.29 1x5l s SER 95 Cb -0.32 -0.67 -0.11 0.00 0.21 0.00 0.00 66.02 65.13 1x5l s SER 95 CO 0.35 -3.20 0.97 0.00 0.41 0.00 0.00 173.24 171.77 1x5l n GLN 96 N -4.12 1.27 -1.53 12.44 6.02 -1.26 -4.71 117.38 125.50 1x5l n GLN 96 Ca 0.13 0.46 -0.40 0.00 -0.01 0.00 0.00 57.00 57.18 1x5l n GLN 96 Cb 0.59 -1.98 -0.06 0.00 1.02 0.00 0.00 30.24 29.81 1x5l n GLN 96 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1x5l n ALA 97 N -0.50 0.85 -2.10 -1.58 0.00 -1.26 -4.79 120.51 111.13 1x5l n ALA 97 Ca 0.10 -0.59 -0.36 0.00 0.00 0.00 0.00 53.44 52.58 1x5l n ALA 97 Cb 0.39 -2.89 -0.06 0.00 0.00 0.00 0.00 19.45 16.89 1x5l n ALA 97 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 1x5l s MET 98 N 7.88 4.23 -0.12 0.00 1.75 -0.81 -4.97 119.30 127.25 1x5l s MET 98 Ca 1.08 0.85 0.02 0.00 -1.25 0.00 0.00 55.69 56.38 1x5l s MET 98 Cb -0.51 -2.83 0.01 0.00 2.84 0.00 0.00 34.83 34.34 1x5l s MET 98 CO 0.35 0.37 -0.17 -1.21 -0.65 0.00 0.00 175.02 173.71 1x5l s GLU 99 N -2.08 2.49 -0.04 4.11 2.02 -1.26 -2.24 118.70 121.70 1x5l s GLU 99 Ca 0.44 -0.66 -0.03 0.00 0.02 0.00 0.00 54.97 54.75 1x5l s GLU 99 Cb -0.16 -2.08 0.02 0.00 0.10 0.00 0.00 34.13 32.01 1x5l s GLU 99 CO 0.21 -0.06 0.10 0.08 0.02 0.00 0.00 175.26 175.60 1x5l s VAL 100 N 0.96 -0.02 -0.07 2.63 1.01 -0.90 -5.01 120.40 119.00 1x5l s VAL 100 Ca -0.06 0.07 0.02 0.00 0.00 0.00 0.00 61.98 62.01 1x5l s VAL 100 Cb -0.15 -0.15 -0.03 0.00 0.00 0.00 0.00 36.38 36.05 1x5l s VAL 100 CO -0.02 0.03 -0.10 -0.70 0.00 0.00 0.00 175.10 174.30 1x5l s GLU 101 N 0.46 2.74 0.56 2.72 2.12 -1.26 -0.80 118.70 125.24 1x5l s GLU 101 Ca -0.03 -0.62 -0.01 0.00 0.36 0.00 0.00 54.97 54.66 1x5l s GLU 101 Cb -0.05 -2.52 0.03 0.00 0.26 0.00 0.00 34.13 31.84 1x5l s GLU 101 CO -0.02 0.59 0.81 0.95 -0.54 0.00 0.00 175.26 177.05 1x5l s THR 102 N -0.63 3.08 -0.07 -1.70 -4.23 -1.25 -4.94 115.64 105.90 1x5l s THR 102 Ca 0.09 -0.46 -0.30 0.00 -1.18 0.00 0.00 61.69 59.85 1x5l s THR 102 Cb -0.11 -3.19 -0.04 0.00 1.34 0.00 0.00 72.50 70.50 1x5l s THR 102 CO 0.01 -0.15 1.35 -0.83 -0.54 0.00 0.00 174.62 174.46 1x5l s GLY 103 N -4.37 1.80 0.82 3.99 0.00 -0.89 -3.80 107.32 104.86 1x5l s GLY 103 Ca 0.55 0.71 -0.14 0.00 0.00 0.00 0.00 44.72 45.84 1x5l s GLY 103 CO 0.40 2.52 1.01 0.28 0.00 0.00 0.00 173.10 177.31 1x5l n LYS 104 N 5.97 0.11 -2.04 2.90 4.01 -1.26 -3.17 118.16 124.68 1x5l n LYS 104 Ca 0.13 0.11 -0.34 0.00 -0.51 0.00 0.00 58.31 57.70 1x5l n LYS 104 Cb 0.44 -2.28 -0.04 0.00 -0.51 0.00 0.00 35.03 32.65 1x5l n LYS 104 CO 0.00 0.00 0.00 -1.25 -1.11 0.00 0.00 177.40 175.04 1x5l s PRO 105 N -3.88 2.60 -0.16 1.97 0.04 -1.26 -4.77 135.00 129.54 1x5l s PRO 105 Ca 0.70 0.26 -0.29 0.00 0.04 0.00 0.00 61.00 61.71 1x5l s PRO 105 Cb -0.29 -4.65 -0.01 0.00 0.04 0.00 0.00 34.50 29.59 1x5l s PRO 105 CO 0.54 -2.99 1.24 -1.12 0.04 0.00 0.00 177.00 174.71 1x5l s SER 106 N 8.09 6.96 0.33 6.66 0.01 -1.26 -5.00 113.70 129.49 1x5l s SER 106 Ca 0.68 1.68 0.07 0.00 1.31 0.00 0.00 55.95 59.69 1x5l s SER 106 Cb -0.10 -2.54 -0.03 0.00 0.21 0.00 0.00 66.02 63.56 1x5l s SER 106 CO 0.12 -0.74 0.25 0.61 0.41 0.00 0.00 173.24 173.90 1x5l n GLY 107 N 3.57 3.00 3.56 3.44 0.00 -1.26 -5.08 105.19 112.43 1x5l n GLY 107 Ca 0.13 -1.91 -0.27 0.00 0.00 0.00 0.00 46.02 43.97 1x5l n GLY 107 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x5l s PRO 108 N -3.32 2.56 0.76 1.61 0.04 -1.26 -4.95 135.00 130.43 1x5l s PRO 108 Ca 0.36 -0.31 -0.03 0.00 0.04 0.00 0.00 61.00 61.06 1x5l s PRO 108 Cb 0.02 -5.07 0.14 0.00 0.04 0.00 0.00 34.50 29.63 1x5l s PRO 108 CO 0.25 -3.38 1.04 -1.12 0.04 0.00 0.00 177.00 173.83 1x5l s SER 109 N 8.00 4.18 0.24 6.66 0.01 -1.26 -5.11 113.70 126.42 1x5l s SER 109 Ca 0.70 -0.26 0.06 0.00 1.31 0.00 0.00 55.95 57.77 1x5l s SER 109 Cb -0.07 -0.08 -0.03 0.00 0.21 0.00 0.00 66.02 66.05 1x5l s SER 109 CO -0.01 -1.98 0.25 -0.94 0.41 0.00 0.00 173.24 170.97 1x5l s SER 110 N -4.75 5.79 0.00 2.44 1.04 -1.26 -5.32 113.70 111.63 1x5l s SER 110 Ca 0.67 -0.14 0.00 0.00 0.48 0.00 0.00 55.95 56.97 1x5l s SER 110 Cb -0.05 -1.56 0.00 0.00 0.10 0.00 0.00 66.02 64.51 1x5l s SER 110 CO 0.46 -0.04 0.00 0.61 0.98 0.00 0.00 173.24 175.24