#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 -0.73 -2.38 1.61 0.87 -2.10 -3.45 113.55 107.37 1x5l h SER 2 Ca 0.00 -0.01 -0.61 0.00 -1.23 0.00 0.00 61.79 59.94 1x5l h SER 2 Cb 0.00 0.19 -0.14 0.00 -0.44 0.00 0.00 62.40 62.01 1x5l h SER 2 CO 0.00 -0.43 -0.75 -0.94 -0.53 0.00 0.00 176.83 174.18 1x5l s SER 3 N -4.52 3.72 0.00 6.23 1.04 -1.26 -5.11 113.70 113.80 1x5l s SER 3 Ca -0.16 -0.94 0.00 0.00 0.48 0.00 0.00 55.95 55.33 1x5l s SER 3 Cb 0.02 -0.38 0.00 0.00 0.10 0.00 0.00 66.02 65.76 1x5l s SER 3 CO 0.55 0.05 0.00 0.61 0.98 0.00 0.00 173.24 175.43 1x5l n GLY 4 N -0.51 1.49 0.32 7.32 0.00 -1.26 -4.92 105.19 107.63 1x5l n GLY 4 Ca -0.06 -0.14 0.14 0.00 0.00 0.00 0.00 46.02 45.96 1x5l n GLY 4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1x5l h SER 5 N 0.00 -0.12 -3.61 1.61 0.02 -2.02 -3.40 113.55 106.02 1x5l h SER 5 Ca 0.00 0.22 -0.57 0.00 -0.84 0.00 0.00 61.79 60.61 1x5l h SER 5 Cb 0.00 0.33 0.15 0.00 0.14 0.00 0.00 62.40 63.02 1x5l h SER 5 CO 0.00 -0.23 0.25 -1.20 -1.14 0.00 0.00 176.83 174.51 1x5l n SER 6 N -5.30 1.32 0.00 3.07 7.64 -1.26 -4.95 113.62 114.14 1x5l n SER 6 Ca 0.23 0.88 0.00 0.00 1.01 0.00 0.00 58.87 60.99 1x5l n SER 6 Cb 0.74 -1.43 0.00 0.00 -1.01 0.00 0.00 64.21 62.51 1x5l n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x5l n GLY 7 N 1.14 2.89 3.67 0.23 0.00 -1.26 -5.01 105.19 106.85 1x5l n GLY 7 Ca 0.12 0.06 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 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 4.05 4.24 0.79 1.61 -0.21 -1.26 -4.98 119.66 123.89 1x5l s GLN 8 Ca 0.00 1.88 -0.14 0.00 0.02 0.00 0.00 55.36 57.12 1x5l s GLN 8 Cb 0.00 -3.75 0.04 0.00 1.00 0.00 0.00 33.01 30.31 1x5l s GLN 8 CO 0.00 -0.68 0.99 0.00 -2.12 0.00 0.00 175.29 173.48 1x5l n ALA 9 N 6.26 -0.49 -1.48 6.09 0.00 -1.26 -4.66 120.51 124.97 1x5l n ALA 9 Ca 0.14 -0.30 -0.34 0.00 0.00 0.00 0.00 53.44 52.94 1x5l n ALA 9 Cb 0.44 -2.12 0.07 0.00 0.00 0.00 0.00 19.45 17.83 1x5l n ALA 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1x5l s ALA 10 N -2.03 2.31 1.13 0.00 0.00 -1.26 -4.77 121.76 117.14 1x5l s ALA 10 Ca 0.71 0.80 -0.10 0.00 0.00 0.00 0.00 51.96 53.37 1x5l s ALA 10 Cb -0.31 -3.42 0.15 0.00 0.00 0.00 0.00 23.12 19.55 1x5l s ALA 10 CO 0.53 -1.54 0.55 -0.35 0.00 0.00 0.00 175.76 174.95 1x5l n PRO 11 N -2.39 -2.09 -3.29 0.00 -0.04 -1.21 -4.74 135.00 121.24 1x5l n PRO 11 Ca 0.12 -0.87 -0.38 0.00 -0.04 0.00 0.00 63.50 62.33 1x5l n PRO 11 Cb 0.51 -0.82 -0.06 0.00 -0.04 0.00 0.00 33.50 33.09 1x5l n PRO 11 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1x5l s SER 12 N -2.98 6.77 -0.29 3.54 0.15 0.36 -4.93 113.70 116.31 1x5l s SER 12 Ca 0.36 0.92 -0.30 0.00 0.70 0.00 0.00 55.95 57.63 1x5l s SER 12 Cb -0.03 -2.31 -0.07 0.00 -1.71 0.00 0.00 66.02 61.90 1x5l s SER 12 CO 0.27 0.03 2.25 1.67 1.20 0.00 0.00 173.24 178.66 1x5l n GLN 13 N 3.38 1.61 -1.52 5.44 7.27 -1.26 -4.59 117.38 127.71 1x5l n GLN 13 Ca -0.07 0.41 -0.40 0.00 0.07 0.00 0.00 57.00 57.00 1x5l n GLN 13 Cb 0.52 -3.04 -0.08 0.00 2.41 0.00 0.00 30.24 30.05 1x5l n GLN 13 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 1x5l n VAL 14 N 7.65 -0.00 0.96 1.69 0.31 -1.26 -4.74 118.33 122.94 1x5l n VAL 14 Ca 0.34 -0.45 0.11 0.00 -0.01 0.00 0.00 64.34 64.34 1x5l n VAL 14 Cb 0.40 -1.86 0.04 0.00 -0.91 0.00 0.00 33.84 31.50 1x5l n VAL 14 CO 0.00 0.00 0.00 0.55 -1.32 0.00 0.00 176.83 176.06 1x5l n VAL 15 N 7.70 0.00 -3.08 2.52 3.14 -1.26 -4.48 118.33 122.86 1x5l n VAL 15 Ca 0.47 -0.36 -0.44 0.00 -2.96 0.00 0.00 64.34 61.05 1x5l n VAL 15 Cb 0.32 1.34 -0.06 0.00 -1.06 0.00 0.00 33.84 34.39 1x5l n VAL 15 CO 0.00 0.00 0.00 -0.69 -6.46 0.00 0.00 176.83 169.68 1x5l s VAL 16 N -2.21 4.76 -0.07 1.55 1.01 -1.26 -5.00 120.40 119.18 1x5l s VAL 16 Ca 0.21 -0.39 -0.03 0.00 0.00 0.00 0.00 61.98 61.77 1x5l s VAL 16 Cb 0.18 -4.38 0.04 0.00 0.00 0.00 0.00 36.38 32.22 1x5l s VAL 16 CO 0.44 -0.92 0.13 -0.63 0.00 0.00 0.00 175.10 174.12 1x5l s ILE 17 N 2.94 -0.15 0.13 2.22 1.01 -1.26 -2.35 121.20 123.74 1x5l s ILE 17 Ca 0.18 0.29 0.03 0.00 0.00 0.00 0.00 60.65 61.15 1x5l s ILE 17 Cb -0.18 -0.24 -0.04 0.00 0.01 0.00 0.00 42.46 42.00 1x5l s ILE 17 CO 0.13 0.12 -0.08 -0.13 0.00 0.00 0.00 174.94 174.98 1x5l s ARG 18 N 1.79 0.99 -0.45 2.79 0.52 0.14 -4.97 118.95 119.75 1x5l s ARG 18 Ca -0.02 -1.42 -0.10 0.00 -0.52 0.00 0.00 55.73 53.67 1x5l s ARG 18 Cb -0.12 -0.45 0.09 0.00 0.52 0.00 0.00 34.95 35.00 1x5l s ARG 18 CO -0.05 0.02 0.31 -1.14 0.02 0.00 0.00 175.30 174.46 1x5l s GLN 19 N -3.79 2.62 0.02 3.54 0.74 -1.26 -0.17 119.66 121.35 1x5l s GLN 19 Ca 0.16 -1.56 -0.27 0.00 0.05 0.00 0.00 55.36 53.74 1x5l s GLN 19 Cb 0.04 -3.89 -0.15 0.00 1.10 0.00 0.00 33.01 30.10 1x5l s GLN 19 CO -0.01 -1.06 1.17 0.93 -0.55 0.00 0.00 175.29 175.77 1x5l h GLU 20 N 8.48 -0.81 -4.42 1.67 4.39 -1.87 -3.48 114.58 118.54 1x5l h GLU 20 Ca -0.23 0.06 -0.20 0.00 0.34 0.00 0.00 59.36 59.32 1x5l h GLU 20 Cb 1.08 0.18 -0.14 0.00 -0.10 0.00 0.00 28.75 29.78 1x5l h GLU 20 CO 0.82 -0.50 -0.55 1.03 -1.16 0.00 0.00 179.01 178.65 1x5l s ARG 21 N -4.77 1.20 -0.18 2.33 1.81 -1.25 -5.03 118.95 113.05 1x5l s ARG 21 Ca -0.14 -1.53 -0.07 0.00 -1.72 0.00 0.00 55.73 52.26 1x5l s ARG 21 Cb 0.02 0.29 0.08 0.00 -0.45 0.00 0.00 34.95 34.89 1x5l s ARG 21 CO 0.46 -0.40 0.40 0.00 -0.68 0.00 0.00 175.30 175.08 1x5l s ALA 22 N -4.12 -1.07 0.00 2.13 0.00 -1.26 -1.69 121.76 115.75 1x5l s ALA 22 Ca 0.34 1.45 0.00 0.00 0.00 0.00 0.00 51.96 53.75 1x5l s ALA 22 Cb 0.06 -1.19 0.00 0.00 0.00 0.00 0.00 23.12 21.99 1x5l s ALA 22 CO 0.10 -0.61 0.00 0.41 0.00 0.00 0.00 175.76 175.65 1x5l n GLY 23 N 5.08 2.58 0.09 0.00 0.00 -0.34 -4.83 105.19 107.77 1x5l n GLY 23 Ca -0.12 -1.84 -0.16 0.00 0.00 0.00 0.00 46.02 43.90 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 -0.07 1.61 4.15 -1.94 0.47 115.11 119.33 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 0.68 0.00 0.25 -1.93 0.00 0.00 178.83 177.83 1x5l n THR 25 N -4.50 1.79 -4.04 2.39 -2.24 -1.26 -3.35 114.28 103.07 1x5l n THR 25 Ca -0.24 -1.93 -0.08 0.00 -2.27 0.00 0.00 64.05 59.53 1x5l n THR 25 Cb 0.54 -0.09 -0.09 0.00 -2.10 0.00 0.00 70.33 68.59 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 -2.31 0.37 -0.21 3.42 1.04 -1.26 -0.81 113.70 113.93 1x5l s SER 26 Ca 0.29 -0.93 -0.14 0.00 0.48 0.00 0.00 55.95 55.65 1x5l s SER 26 Cb 0.24 0.25 0.06 0.00 0.10 0.00 0.00 66.02 66.68 1x5l s SER 26 CO 0.04 -0.65 0.53 -0.69 0.98 0.00 0.00 173.24 173.45 1x5l s VAL 27 N -3.92 -0.01 -0.11 5.02 1.01 -0.32 -1.20 120.40 120.87 1x5l s VAL 27 Ca 0.09 0.04 -0.12 0.00 0.00 0.00 0.00 61.98 61.99 1x5l s VAL 27 Cb 0.07 -0.76 -0.05 0.00 0.00 0.00 0.00 36.38 35.64 1x5l s VAL 27 CO -0.09 0.02 0.26 -0.55 0.00 0.00 0.00 175.10 174.74 1x5l s SER 28 N 1.22 6.50 -0.01 3.32 0.15 -0.68 -0.14 113.70 124.06 1x5l s SER 28 Ca -0.07 0.59 0.07 0.00 0.70 0.00 0.00 55.95 57.24 1x5l s SER 28 Cb -0.06 -2.16 -0.02 0.00 -1.71 0.00 0.00 66.02 62.07 1x5l s SER 28 CO -0.12 0.26 -0.24 -0.76 1.20 0.00 0.00 173.24 173.59 1x5l s LEU 29 N -0.42 2.06 -0.23 3.45 1.43 -0.38 -3.01 118.68 121.58 1x5l s LEU 29 Ca 0.17 -0.45 -0.00 0.00 -1.03 0.00 0.00 54.13 52.82 1x5l s LEU 29 Cb -0.13 -1.22 0.06 0.00 0.03 0.00 0.00 46.19 44.93 1x5l s LEU 29 CO 0.06 0.28 -0.02 -0.22 0.23 0.00 0.00 176.35 176.68 1x5l s LEU 30 N -0.64 2.20 0.05 1.79 2.96 0.76 -3.32 118.68 122.48 1x5l s LEU 30 Ca 0.09 -1.11 0.09 0.00 -0.22 0.00 0.00 54.13 52.98 1x5l s LEU 30 Cb -0.09 -1.01 -0.03 0.00 0.50 0.00 0.00 46.19 45.56 1x5l s LEU 30 CO -0.01 -0.26 -0.25 -1.66 -1.32 0.00 0.00 176.35 172.85 1x5l s TRP 31 N 1.52 2.19 0.37 5.38 -2.14 -1.22 0.24 118.94 125.29 1x5l s TRP 31 Ca -0.04 -0.40 0.01 0.00 2.66 0.00 0.00 56.10 58.33 1x5l s TRP 31 Cb -0.18 -1.30 -0.02 0.00 -3.10 0.00 0.00 33.47 28.86 1x5l s TRP 31 CO -0.07 0.13 0.57 -0.65 -2.66 0.00 0.00 176.95 174.27 1x5l s GLN 32 N -1.26 3.33 0.95 3.25 -0.21 -0.99 -4.78 119.66 119.94 1x5l s GLN 32 Ca 0.11 -0.45 -0.11 0.00 0.02 0.00 0.00 55.36 54.93 1x5l s GLN 32 Cb -0.10 -2.65 0.12 0.00 1.00 0.00 0.00 33.01 31.39 1x5l s GLN 32 CO 0.02 0.02 0.91 0.39 -2.12 0.00 0.00 175.29 174.52 1x5l n GLU 33 N -1.85 -0.54 -2.16 2.91 1.02 -1.26 -4.65 120.64 114.11 1x5l n GLU 33 Ca -0.03 -0.10 -0.42 0.00 -0.02 0.00 0.00 57.16 56.59 1x5l n GLU 33 Cb 0.57 -2.21 -0.03 0.00 -0.02 0.00 0.00 31.44 29.75 1x5l n GLU 33 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1x5l s PRO 34 N -4.32 4.23 0.29 3.49 0.04 -1.26 -4.86 135.00 132.60 1x5l s PRO 34 Ca 0.64 2.02 0.21 0.00 0.04 0.00 0.00 61.00 63.91 1x5l s PRO 34 Cb -0.22 -3.77 0.96 0.00 0.04 0.00 0.00 34.50 31.50 1x5l s PRO 34 CO 0.61 -0.72 0.99 0.39 0.04 0.00 0.00 177.00 178.32 1x5l n GLU 35 N 6.32 -0.02 -3.38 4.56 1.02 -1.26 -3.21 120.64 124.66 1x5l n GLU 35 Ca 0.15 0.79 -0.14 0.00 -0.02 0.00 0.00 57.16 57.94 1x5l n GLU 35 Cb 0.43 -1.57 -0.09 0.00 -0.02 0.00 0.00 31.44 30.19 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 -4.62 0.33 0.24 3.49 -0.21 -1.26 -5.02 119.66 112.62 1x5l s GLN 36 Ca -0.05 0.04 0.01 0.00 0.02 0.00 0.00 55.36 55.39 1x5l s GLN 36 Cb 0.20 -0.60 0.28 0.00 1.00 0.00 0.00 33.01 33.88 1x5l s GLN 36 CO 0.52 -0.95 1.61 -1.00 -2.12 0.00 0.00 175.29 173.36 1x5l h PRO 37 N 8.23 0.43 -4.89 2.91 0.13 -1.90 1.03 132.00 137.95 1x5l h PRO 37 Ca -0.13 -0.23 -0.40 0.00 -0.87 0.00 0.00 66.00 64.37 1x5l h PRO 37 Cb 1.10 0.01 0.02 0.00 0.13 0.00 0.00 31.00 32.26 1x5l h PRO 37 CO 0.31 0.80 -0.60 0.09 -0.23 0.00 0.00 178.00 178.36 1x5l n ASN 38 N -4.00 -5.40 0.00 1.44 3.02 -1.26 -3.36 115.26 105.70 1x5l n ASN 38 Ca -0.02 -0.34 0.00 0.00 -0.03 0.00 0.00 54.58 54.19 1x5l n ASN 38 Cb 0.53 -4.37 0.00 0.00 -0.61 0.00 0.00 39.78 35.32 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 -1.45 0.22 3.85 7.41 0.00 -1.26 -4.42 105.19 109.53 1x5l n GLY 39 Ca -0.07 -1.40 -0.36 0.00 0.00 0.00 0.00 46.02 44.20 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 -3.37 5.26 -0.15 -0.61 1.09 -1.26 -5.10 121.20 117.06 1x5l s ILE 40 Ca 0.00 0.01 -0.04 0.00 -1.10 0.00 0.00 60.65 59.52 1x5l s ILE 40 Cb 0.00 -3.33 -0.03 0.00 -1.06 0.00 0.00 42.46 38.04 1x5l s ILE 40 CO 0.00 0.53 -0.01 -0.63 -0.10 0.00 0.00 174.94 174.73 1x5l s ILE 41 N -1.09 4.12 -0.10 2.92 1.01 -1.26 -4.00 121.20 122.80 1x5l s ILE 41 Ca 0.18 -0.28 -0.01 0.00 0.00 0.00 0.00 60.65 60.54 1x5l s ILE 41 Cb -0.12 -2.80 -0.00 0.00 0.01 0.00 0.00 42.46 39.55 1x5l s ILE 41 CO 0.08 0.51 -0.02 -0.07 0.00 0.00 0.00 174.94 175.44 1x5l h LEU 42 N 6.38 0.00 -7.93 2.97 3.38 -1.89 -3.50 115.31 114.73 1x5l h LEU 42 Ca -0.36 0.00 0.09 0.00 0.09 0.00 0.00 57.88 57.70 1x5l h LEU 42 Cb 1.19 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.88 1x5l h LEU 42 CO 0.63 0.53 0.29 -1.83 0.09 0.00 0.00 178.44 178.14 1x5l s GLU 43 N -1.63 1.69 0.08 1.13 -1.05 -1.26 -4.95 118.70 112.71 1x5l s GLU 43 Ca -0.02 -0.95 0.05 0.00 -0.15 0.00 0.00 54.97 53.90 1x5l s GLU 43 Cb 0.00 0.57 -0.04 0.00 -0.44 0.00 0.00 34.13 34.22 1x5l s GLU 43 CO 0.03 -0.78 -0.02 0.71 0.95 0.00 0.00 175.26 176.15 1x5l s TYR 44 N -3.70 2.95 0.04 4.83 1.51 -0.04 -3.13 117.35 119.80 1x5l s TYR 44 Ca 0.12 -0.04 0.09 0.00 -1.01 0.00 0.00 57.07 56.23 1x5l s TYR 44 Cb -0.05 -1.54 -0.03 0.00 -0.11 0.00 0.00 41.96 40.23 1x5l s TYR 44 CO 0.06 0.46 -0.25 -1.21 -1.11 0.00 0.00 175.55 173.50 1x5l s GLU 45 N -2.17 1.86 -0.15 -0.62 2.02 -1.04 -1.31 118.70 117.30 1x5l s GLU 45 Ca 0.24 -1.08 0.00 0.00 0.02 0.00 0.00 54.97 54.15 1x5l s GLU 45 Cb -0.12 -2.02 0.03 0.00 0.10 0.00 0.00 34.13 32.13 1x5l s GLU 45 CO 0.16 0.52 -0.10 0.42 0.02 0.00 0.00 175.26 176.28 1x5l s ILE 46 N -0.81 1.36 -0.27 -1.63 1.01 -0.36 -2.66 121.20 117.83 1x5l s ILE 46 Ca 0.12 -0.61 -0.09 0.00 0.00 0.00 0.00 60.65 60.07 1x5l s ILE 46 Cb -0.10 -1.37 -0.03 0.00 0.01 0.00 0.00 42.46 40.96 1x5l s ILE 46 CO 0.02 0.32 0.13 -0.75 0.00 0.00 0.00 174.94 174.67 1x5l s LYS 47 N 1.56 3.71 -0.07 2.79 2.20 -0.61 0.12 119.74 129.44 1x5l s LYS 47 Ca 0.03 -0.46 0.04 0.00 -0.36 0.00 0.00 55.97 55.22 1x5l s LYS 47 Cb -0.14 -3.50 0.00 0.00 -1.51 0.00 0.00 37.83 32.69 1x5l s LYS 47 CO -0.09 -0.23 -0.18 1.52 -0.36 0.00 0.00 175.35 176.01 1x5l s TYR 48 N 1.67 1.93 0.20 4.03 -0.85 -1.17 -1.82 117.35 121.34 1x5l s TYR 48 Ca 0.06 -0.68 -0.11 0.00 -0.52 0.00 0.00 57.07 55.82 1x5l s TYR 48 Cb -0.16 -1.32 -0.01 0.00 0.38 0.00 0.00 41.96 40.86 1x5l s TYR 48 CO 0.07 -0.28 0.36 1.52 -1.52 0.00 0.00 175.55 175.70 1x5l s TYR 49 N 0.32 0.38 -0.55 -3.49 -0.85 -1.13 -3.77 117.35 108.26 1x5l s TYR 49 Ca -0.12 -0.73 -0.27 0.00 -0.52 0.00 0.00 57.07 55.43 1x5l s TYR 49 Cb -0.15 0.04 -0.02 0.00 0.38 0.00 0.00 41.96 42.21 1x5l s TYR 49 CO 0.05 -0.83 1.83 -1.21 -1.52 0.00 0.00 175.55 173.87 1x5l s GLU 50 N -3.99 2.80 0.52 -3.49 2.02 -1.26 -1.59 118.70 113.71 1x5l s GLU 50 Ca 0.20 0.77 0.36 0.00 0.02 0.00 0.00 54.97 56.32 1x5l s GLU 50 Cb 0.02 -4.34 1.52 0.00 0.10 0.00 0.00 34.13 31.43 1x5l s GLU 50 CO 0.03 -2.52 1.74 1.57 0.02 0.00 0.00 175.26 176.11 1x5l h LYS 51 N 14.39 0.06 -0.02 1.61 5.09 -1.89 0.59 116.57 136.39 1x5l h LYS 51 Ca -0.27 -0.00 -0.05 0.00 0.09 0.00 0.00 60.65 60.41 1x5l h LYS 51 Cb 1.16 -0.01 0.00 0.00 0.10 0.00 0.00 32.23 33.48 1x5l h LYS 51 CO 1.18 0.04 -0.18 0.22 -2.09 0.00 0.00 179.45 178.62 1x5l h ASP 52 N 0.06 0.19 0.11 7.07 3.58 -1.88 -3.38 116.42 122.16 1x5l h ASP 52 Ca 0.66 -0.71 -0.01 0.00 0.42 0.00 0.00 57.03 57.39 1x5l h ASP 52 Cb 2.47 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 43.47 1x5l h ASP 52 CO -0.08 0.87 -0.05 0.11 -2.88 0.00 0.00 179.24 177.21 1x5l h LYS 53 N -0.48 -0.14 -5.96 0.28 1.79 -0.93 -3.48 116.57 107.66 1x5l h LYS 53 Ca -0.02 0.01 -0.40 0.00 -2.18 0.00 0.00 60.65 58.07 1x5l h LYS 53 Cb 0.88 0.03 0.09 0.00 -1.58 0.00 0.00 32.23 31.65 1x5l h LYS 53 CO 0.04 -0.10 -0.79 -1.91 -1.08 0.00 0.00 179.45 175.61 1x5l n GLU 54 N -3.18 -5.78 -2.26 3.15 2.13 0.17 -4.99 120.64 109.89 1x5l n GLU 54 Ca -0.02 0.71 -0.26 0.00 0.66 0.00 0.00 57.16 58.25 1x5l n GLU 54 Cb 0.06 -5.49 0.10 0.00 0.27 0.00 0.00 31.44 26.39 1x5l n GLU 54 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1x5l s MET 55 N -5.89 1.71 0.15 5.31 0.23 -1.26 -4.99 119.30 114.56 1x5l s MET 55 Ca 0.13 -0.54 -0.16 0.00 -1.03 0.00 0.00 55.69 54.09 1x5l s MET 55 Cb -0.06 -2.15 0.06 0.00 -1.53 0.00 0.00 34.83 31.15 1x5l s MET 55 CO 0.78 -1.55 1.74 1.96 -2.03 0.00 0.00 175.02 175.92 1x5l h GLN 56 N -0.80 0.21 -5.92 3.16 4.20 -2.04 -3.38 115.11 110.55 1x5l h GLN 56 Ca -0.42 -0.01 -0.52 0.00 0.06 0.00 0.00 58.65 57.75 1x5l h GLN 56 Cb 1.28 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 29.00 1x5l h GLN 56 CO 0.49 0.14 1.46 0.45 -0.67 0.00 0.00 178.83 180.71 1x5l s SER 57 N -5.33 5.14 0.10 1.46 0.15 -1.26 -4.95 113.70 109.02 1x5l s SER 57 Ca -0.13 1.12 0.09 0.00 0.70 0.00 0.00 55.95 57.73 1x5l s SER 57 Cb 0.12 -2.51 -0.04 0.00 -1.71 0.00 0.00 66.02 61.88 1x5l s SER 57 CO 0.71 -2.33 -0.23 -0.72 1.20 0.00 0.00 173.24 171.87 1x5l s TYR 58 N 9.56 1.96 0.18 3.44 -0.85 -1.26 -5.01 117.35 125.37 1x5l s TYR 58 Ca 0.87 -0.40 -0.01 0.00 -0.52 0.00 0.00 57.07 57.01 1x5l s TYR 58 Cb -0.20 -1.08 -0.04 0.00 0.38 0.00 0.00 41.96 41.01 1x5l s TYR 58 CO 0.28 0.23 0.37 0.45 -1.52 0.00 0.00 175.55 175.37 1x5l s SER 59 N -1.87 6.40 0.03 -0.18 0.15 -1.25 -5.05 113.70 111.93 1x5l s SER 59 Ca 0.09 0.41 0.03 0.00 0.70 0.00 0.00 55.95 57.18 1x5l s SER 59 Cb -0.10 -2.01 -0.02 0.00 -1.71 0.00 0.00 66.02 62.18 1x5l s SER 59 CO 0.04 -0.01 -0.10 -0.89 1.20 0.00 0.00 173.24 173.49 1x5l s THR 60 N -1.80 0.76 0.19 6.45 2.01 -1.26 -3.02 115.64 118.97 1x5l s THR 60 Ca 0.38 -0.87 0.10 0.00 0.31 0.00 0.00 61.69 61.62 1x5l s THR 60 Cb -0.11 -0.73 -0.04 0.00 0.01 0.00 0.00 72.50 71.62 1x5l s THR 60 CO 0.28 -0.11 -0.21 -0.22 -0.69 0.00 0.00 174.62 173.67 1x5l s LEU 61 N -1.09 2.45 -0.07 4.42 2.96 0.12 -4.95 118.68 122.52 1x5l s LEU 61 Ca -0.02 -0.88 0.05 0.00 -0.22 0.00 0.00 54.13 53.06 1x5l s LEU 61 Cb -0.07 -0.99 -0.01 0.00 0.50 0.00 0.00 46.19 45.61 1x5l s LEU 61 CO 0.01 0.04 -0.25 -0.54 -1.32 0.00 0.00 176.35 174.29 1x5l s LYS 62 N -2.81 2.67 -0.06 1.98 -0.14 -1.26 -1.23 119.74 118.89 1x5l s LYS 62 Ca 0.19 -0.89 -0.03 0.00 -1.36 0.00 0.00 55.97 53.88 1x5l s LYS 62 Cb -0.07 -2.18 0.03 0.00 -1.68 0.00 0.00 37.83 33.93 1x5l s LYS 62 CO 0.09 0.32 0.15 0.00 -0.76 0.00 0.00 175.35 175.14 1x5l s ALA 63 N -0.02 -0.30 -0.00 5.17 0.00 -0.43 -5.00 121.76 121.18 1x5l s ALA 63 Ca -0.08 0.60 0.08 0.00 0.00 0.00 0.00 51.96 52.56 1x5l s ALA 63 Cb -0.15 -0.39 -0.23 0.00 0.00 0.00 0.00 23.12 22.34 1x5l s ALA 63 CO 0.05 -0.13 0.82 -0.39 0.00 0.00 0.00 175.76 176.11 1x5l h VAL 64 N 5.72 1.08 -2.00 0.00 -1.51 -1.92 -0.08 116.25 117.54 1x5l h VAL 64 Ca -0.37 -2.86 -0.44 0.00 -1.23 0.00 0.00 66.70 61.79 1x5l h VAL 64 Cb 1.16 2.58 0.02 0.00 -2.13 0.00 0.00 31.29 32.91 1x5l h VAL 64 CO 0.42 0.68 -0.24 0.28 -1.23 0.00 0.00 177.57 177.48 1x5l s THR 65 N -2.62 3.65 -1.17 7.19 -1.32 -1.26 -4.75 115.64 115.36 1x5l s THR 65 Ca -0.05 -0.86 0.01 0.00 -1.21 0.00 0.00 61.69 59.58 1x5l s THR 65 Cb 0.08 -3.28 0.04 0.00 -1.51 0.00 0.00 72.50 67.83 1x5l s THR 65 CO 0.82 -0.14 0.66 0.35 -2.21 0.00 0.00 174.62 174.10 1x5l n THR 66 N -1.86 0.12 -3.85 5.08 -2.24 -1.26 -4.68 114.28 105.59 1x5l n THR 66 Ca 0.03 -0.07 -0.21 0.00 -2.27 0.00 0.00 64.05 61.54 1x5l n THR 66 Cb 0.58 -0.38 -0.17 0.00 -2.10 0.00 0.00 70.33 68.26 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 -1.26 0.45 -0.00 -0.78 0.52 -1.26 -3.39 118.95 113.23 1x5l s ARG 67 Ca 0.03 0.11 -0.16 0.00 -0.52 0.00 0.00 55.73 55.19 1x5l s ARG 67 Cb 0.02 -0.75 0.03 0.00 0.52 0.00 0.00 34.95 34.76 1x5l s ARG 67 CO 0.01 -0.23 0.35 0.00 0.02 0.00 0.00 175.30 175.44 1x5l s ALA 68 N 1.61 -0.86 -0.28 2.13 0.00 -1.21 -4.95 121.76 118.21 1x5l s ALA 68 Ca -0.01 0.34 0.02 0.00 0.00 0.00 0.00 51.96 52.31 1x5l s ALA 68 Cb -0.13 0.14 0.08 0.00 0.00 0.00 0.00 23.12 23.21 1x5l s ALA 68 CO -0.03 -0.31 -0.01 0.99 0.00 0.00 0.00 175.76 176.40 1x5l s THR 69 N -1.63 1.70 -0.32 0.00 2.01 -1.26 -1.25 115.64 114.89 1x5l s THR 69 Ca -0.11 -1.59 -0.28 0.00 0.31 0.00 0.00 61.69 60.01 1x5l s THR 69 Cb -0.04 -2.07 -0.03 0.00 0.01 0.00 0.00 72.50 70.38 1x5l s THR 69 CO 0.03 -0.32 1.98 -0.69 -0.69 0.00 0.00 174.62 174.94 1x5l s VAL 70 N 1.27 3.28 0.19 3.82 1.01 0.81 -4.79 120.40 125.98 1x5l s VAL 70 Ca 0.01 0.28 0.08 0.00 0.00 0.00 0.00 61.98 62.34 1x5l s VAL 70 Cb -0.19 -3.41 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 1x5l s VAL 70 CO -0.10 -0.28 0.00 -0.55 0.00 0.00 0.00 175.10 174.18 1x5l s SER 71 N 7.34 4.74 0.00 3.32 0.15 -1.26 -1.17 113.70 126.82 1x5l s SER 71 Ca 0.87 -0.43 0.00 0.00 0.70 0.00 0.00 55.95 57.09 1x5l s SER 71 Cb -0.25 -0.99 0.00 0.00 -1.71 0.00 0.00 66.02 63.07 1x5l s SER 71 CO 0.33 0.08 0.00 0.61 1.20 0.00 0.00 173.24 175.45 1x5l n GLY 72 N -0.24 0.98 3.70 9.45 0.00 -0.84 -5.01 105.19 113.23 1x5l n GLY 72 Ca -0.09 -0.24 -0.23 0.00 0.00 0.00 0.00 46.02 45.46 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 -0.36 3.18 0.13 0.99 1.43 0.01 -5.06 118.68 119.01 1x5l s LEU 73 Ca 0.00 -0.83 -0.18 0.00 -1.03 0.00 0.00 54.13 52.09 1x5l s LEU 73 Cb 0.00 -1.63 -0.07 0.00 0.03 0.00 0.00 46.19 44.52 1x5l s LEU 73 CO 0.00 -0.27 0.62 -0.54 0.23 0.00 0.00 176.35 176.39 1x5l s LYS 74 N -3.80 4.18 0.54 1.70 1.02 -1.26 -4.39 119.74 117.73 1x5l s LYS 74 Ca 0.36 0.73 -0.19 0.00 0.02 0.00 0.00 55.97 56.89 1x5l s LYS 74 Cb -0.02 -3.07 -0.06 0.00 -0.52 0.00 0.00 37.83 34.16 1x5l s LYS 74 CO 0.22 0.53 1.13 -1.25 -0.92 0.00 0.00 175.35 175.06 1x5l s PRO 75 N -1.55 3.35 -1.42 -1.68 0.04 -1.25 -3.63 135.00 128.87 1x5l s PRO 75 Ca 0.35 1.61 -0.07 0.00 0.04 0.00 0.00 61.00 62.93 1x5l s PRO 75 Cb -0.18 -2.01 0.04 0.00 0.04 0.00 0.00 34.50 32.40 1x5l s PRO 75 CO 0.20 -0.85 0.83 0.41 0.04 0.00 0.00 177.00 177.63 1x5l n GLY 76 N 0.15 -0.39 2.76 0.56 0.00 -0.94 -4.76 105.19 102.57 1x5l n GLY 76 Ca 0.12 0.16 -0.18 0.00 0.00 0.00 0.00 46.02 46.12 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 -3.51 -0.36 0.52 2.61 2.01 -1.24 -4.98 115.64 110.70 1x5l s THR 77 Ca 0.32 -0.21 -0.21 0.00 0.31 0.00 0.00 61.69 61.89 1x5l s THR 77 Cb -0.16 -0.77 -0.07 0.00 0.01 0.00 0.00 72.50 71.51 1x5l s THR 77 CO 0.82 -0.27 1.03 0.54 -0.69 0.00 0.00 174.62 176.05 1x5l n ARG 78 N 5.32 1.22 -3.78 4.92 1.74 -1.26 -4.12 116.66 120.69 1x5l n ARG 78 Ca -0.05 0.45 -0.15 0.00 -0.77 0.00 0.00 57.85 57.33 1x5l n ARG 78 Cb 0.49 -2.17 -0.16 0.00 -1.02 0.00 0.00 32.46 29.60 1x5l n ARG 78 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1x5l s TYR 79 N -1.39 0.04 -0.27 -1.55 2.02 -0.17 -3.36 117.35 112.67 1x5l s TYR 79 Ca 0.69 0.12 -0.20 0.00 -0.37 0.00 0.00 57.07 57.32 1x5l s TYR 79 Cb -0.47 -0.24 -0.02 0.00 -0.40 0.00 0.00 41.96 40.83 1x5l s TYR 79 CO 0.52 -0.09 0.61 0.08 -1.57 0.00 0.00 175.55 175.10 1x5l s VAL 80 N 1.06 4.99 0.10 0.71 1.01 -0.62 -3.30 120.40 124.35 1x5l s VAL 80 Ca -0.09 1.03 0.02 0.00 0.00 0.00 0.00 61.98 62.94 1x5l s VAL 80 Cb -0.13 -3.93 -0.04 0.00 0.00 0.00 0.00 36.38 32.29 1x5l s VAL 80 CO -0.03 0.01 0.19 -0.36 0.00 0.00 0.00 175.10 174.91 1x5l s PHE 81 N 2.49 3.39 -0.21 5.22 0.08 -1.15 -2.83 117.98 124.96 1x5l s PHE 81 Ca 0.25 0.15 -0.05 0.00 0.12 0.00 0.00 56.93 57.40 1x5l s PHE 81 Cb -0.15 -1.67 0.11 0.00 -0.57 0.00 0.00 43.02 40.73 1x5l s PHE 81 CO 0.09 0.55 0.37 -0.65 -0.10 0.00 0.00 175.22 175.48 1x5l s GLN 82 N -2.74 0.30 -0.02 0.44 -0.21 -0.75 -1.84 119.66 114.84 1x5l s GLN 82 Ca 0.33 0.73 -0.00 0.00 0.02 0.00 0.00 55.36 56.44 1x5l s GLN 82 Cb -0.12 -0.15 -0.04 0.00 1.00 0.00 0.00 33.01 33.70 1x5l s GLN 82 CO 0.26 -0.45 0.03 0.08 -2.12 0.00 0.00 175.29 173.09 1x5l s VAL 83 N 2.54 4.42 0.02 1.09 1.01 -1.26 -1.57 120.40 126.66 1x5l s VAL 83 Ca 0.06 -0.44 -0.19 0.00 0.00 0.00 0.00 61.98 61.41 1x5l s VAL 83 Cb -0.14 -2.96 0.04 0.00 0.00 0.00 0.00 36.38 33.32 1x5l s VAL 83 CO -0.13 0.43 0.42 0.00 0.00 0.00 0.00 175.10 175.82 1x5l s ARG 84 N -1.45 0.89 -0.15 2.72 1.70 -1.09 -2.57 118.95 119.00 1x5l s ARG 84 Ca 0.19 -0.26 -0.07 0.00 -0.47 0.00 0.00 55.73 55.12 1x5l s ARG 84 Cb -0.12 0.40 -0.04 0.00 -0.57 0.00 0.00 34.95 34.62 1x5l s ARG 84 CO 0.09 -0.29 0.10 0.00 -1.08 0.00 0.00 175.30 174.12 1x5l s ALA 85 N -2.11 3.66 -0.26 7.88 0.00 -1.26 -2.49 121.76 127.17 1x5l s ALA 85 Ca -0.08 -0.70 0.01 0.00 0.00 0.00 0.00 51.96 51.20 1x5l s ALA 85 Cb -0.02 -1.94 0.05 0.00 0.00 0.00 0.00 23.12 21.21 1x5l s ALA 85 CO 0.00 0.42 -0.09 0.50 0.00 0.00 0.00 175.76 176.59 1x5l s ARG 86 N -0.39 2.45 -0.07 0.00 3.52 -1.18 -2.25 118.95 121.03 1x5l s ARG 86 Ca 0.11 -1.22 -0.04 0.00 -0.13 0.00 0.00 55.73 54.45 1x5l s ARG 86 Cb -0.12 -2.92 -0.04 0.00 -1.56 0.00 0.00 34.95 30.31 1x5l s ARG 86 CO 0.02 -0.51 0.10 0.95 -0.81 0.00 0.00 175.30 175.05 1x5l s THR 87 N 1.19 5.09 0.24 4.11 -4.23 -0.37 -2.65 115.64 119.01 1x5l s THR 87 Ca -0.05 -0.06 0.09 0.00 -1.18 0.00 0.00 61.69 60.48 1x5l s THR 87 Cb -0.19 -3.25 0.27 0.00 1.34 0.00 0.00 72.50 70.67 1x5l s THR 87 CO -0.05 0.52 1.09 -0.24 -0.54 0.00 0.00 174.62 175.40 1x5l n SER 88 N 1.71 0.10 0.20 3.99 2.88 -1.26 0.04 113.62 121.28 1x5l n SER 88 Ca -0.17 1.16 -0.10 0.00 -1.33 0.00 0.00 58.87 58.43 1x5l n SER 88 Cb 0.54 -0.50 -0.05 0.00 -0.75 0.00 0.00 64.21 63.44 1x5l n SER 88 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1x5l h ALA 89 N 1.39 -1.04 -2.95 -1.46 0.00 -1.88 -3.47 119.26 109.84 1x5l h ALA 89 Ca 0.51 -0.12 -0.23 0.00 0.00 0.00 0.00 54.91 55.07 1x5l h ALA 89 Cb 1.25 0.44 -0.06 0.00 0.00 0.00 0.00 17.79 19.42 1x5l h ALA 89 CO -0.59 -1.04 -0.09 0.20 0.00 0.00 0.00 179.25 177.74 1x5l s GLY 90 N -1.58 1.31 -0.14 0.00 0.00 0.11 -5.02 107.32 102.00 1x5l s GLY 90 Ca -0.10 -1.39 -0.03 0.00 0.00 0.00 0.00 44.72 43.20 1x5l s GLY 90 CO 0.32 -0.87 -0.04 0.00 0.00 0.00 0.00 173.10 172.52 1x5l s GLY 92 N 0.10 1.61 0.15 0.00 0.00 -0.95 -5.01 107.32 103.21 1x5l s GLY 92 Ca -0.01 -0.70 -0.15 0.00 0.00 0.00 0.00 44.72 43.87 1x5l s GLY 92 CO 0.03 -0.12 0.56 0.50 0.00 0.00 0.00 173.10 174.07 1x5l s ARG 93 N -5.50 3.99 0.21 2.90 0.52 -1.26 -4.84 118.95 114.97 1x5l s ARG 93 Ca 0.65 0.51 -0.32 0.00 -0.52 0.00 0.00 55.73 56.05 1x5l s ARG 93 Cb -0.11 -2.93 -0.13 0.00 0.52 0.00 0.00 34.95 32.30 1x5l s ARG 93 CO 0.52 0.47 1.61 1.19 0.02 0.00 0.00 175.30 179.11 1x5l n PHE 94 N 0.80 2.51 -0.37 -0.53 3.72 -1.26 -4.73 117.46 117.59 1x5l n PHE 94 Ca -0.05 0.21 -0.29 0.00 -0.05 0.00 0.00 57.45 57.27 1x5l n PHE 94 Cb 0.52 -2.58 0.26 0.00 -0.94 0.00 0.00 39.48 36.73 1x5l n PHE 94 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1x5l n SER 95 N 3.25 -3.15 -4.58 4.37 2.88 -1.06 -4.88 113.62 110.44 1x5l n SER 95 Ca 0.15 -0.54 -0.40 0.00 -1.33 0.00 0.00 58.87 56.74 1x5l n SER 95 Cb 0.32 -1.06 0.02 0.00 -0.75 0.00 0.00 64.21 62.75 1x5l n SER 95 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1x5l n GLN 96 N -4.84 1.11 -1.60 -1.46 6.02 -1.26 -4.79 117.38 110.55 1x5l n GLN 96 Ca 0.08 0.41 -0.42 0.00 -0.01 0.00 0.00 57.00 57.05 1x5l n GLN 96 Cb 0.56 -1.99 -0.03 0.00 1.02 0.00 0.00 30.24 29.80 1x5l n GLN 96 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1x5l s ALA 97 N -1.38 2.63 0.38 -1.58 0.00 -1.26 -4.81 121.76 115.73 1x5l s ALA 97 Ca 0.66 0.72 -0.24 0.00 0.00 0.00 0.00 51.96 53.10 1x5l s ALA 97 Cb -0.52 -4.10 -0.10 0.00 0.00 0.00 0.00 23.12 18.40 1x5l s ALA 97 CO 0.55 -2.95 0.97 1.41 0.00 0.00 0.00 175.76 175.74 1x5l s MET 98 N 6.53 4.36 -0.12 0.00 1.75 -0.76 -4.95 119.30 126.11 1x5l s MET 98 Ca 1.01 1.28 0.02 0.00 -1.25 0.00 0.00 55.69 56.74 1x5l s MET 98 Cb -0.32 -2.51 0.02 0.00 2.84 0.00 0.00 34.83 34.86 1x5l s MET 98 CO 0.34 0.08 -0.16 -1.21 -0.65 0.00 0.00 175.02 173.42 1x5l s GLU 99 N -2.57 2.38 -0.20 4.11 2.02 -1.26 -2.95 118.70 120.23 1x5l s GLU 99 Ca 0.56 -0.61 -0.20 0.00 0.02 0.00 0.00 54.97 54.74 1x5l s GLU 99 Cb -0.16 -2.03 0.05 0.00 0.10 0.00 0.00 34.13 32.10 1x5l s GLU 99 CO 0.20 -0.09 0.55 0.08 0.02 0.00 0.00 175.26 176.03 1x5l s VAL 100 N 1.06 0.00 0.06 2.63 1.01 -1.21 -5.04 120.40 118.91 1x5l s VAL 100 Ca -0.04 -0.01 0.04 0.00 0.00 0.00 0.00 61.98 61.97 1x5l s VAL 100 Cb -0.15 -0.78 -0.04 0.00 0.00 0.00 0.00 36.38 35.42 1x5l s VAL 100 CO -0.04 -0.01 -0.02 -0.70 0.00 0.00 0.00 175.10 174.34 1x5l s GLU 101 N 0.22 2.57 0.63 2.72 2.12 -1.26 -1.00 118.70 124.70 1x5l s GLU 101 Ca -0.01 -0.79 -0.01 0.00 0.36 0.00 0.00 54.97 54.53 1x5l s GLU 101 Cb -0.04 -2.55 0.07 0.00 0.26 0.00 0.00 34.13 31.88 1x5l s GLU 101 CO 0.01 0.56 0.89 0.95 -0.54 0.00 0.00 175.26 177.13 1x5l s THR 102 N -1.22 2.42 0.08 -1.70 -4.23 -1.26 -4.96 115.64 104.77 1x5l s THR 102 Ca 0.23 -0.58 -0.31 0.00 -1.18 0.00 0.00 61.69 59.85 1x5l s THR 102 Cb -0.12 -2.84 -0.07 0.00 1.34 0.00 0.00 72.50 70.81 1x5l s THR 102 CO 0.15 0.00 1.45 -0.83 -0.54 0.00 0.00 174.62 174.85 1x5l s GLY 103 N -4.55 1.84 0.57 3.99 0.00 0.16 -3.98 107.32 105.35 1x5l s GLY 103 Ca 0.61 1.08 -0.20 0.00 0.00 0.00 0.00 44.72 46.22 1x5l s GLY 103 CO 0.41 2.50 1.20 0.54 0.00 0.00 0.00 173.10 177.76 1x5l s LYS 104 N 1.73 3.13 0.00 2.90 -0.14 -1.26 -2.22 119.74 123.87 1x5l s LYS 104 Ca 0.66 1.82 0.12 0.00 -1.36 0.00 0.00 55.97 57.21 1x5l s LYS 104 Cb -0.36 -2.02 0.69 0.00 -1.68 0.00 0.00 37.83 34.46 1x5l s LYS 104 CO 0.30 -1.08 1.12 -0.35 -0.76 0.00 0.00 175.35 174.58 1x5l n PRO 105 N -1.38 0.49 -0.25 -1.68 -0.04 -1.26 -3.85 135.00 127.03 1x5l n PRO 105 Ca 0.12 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 1x5l n PRO 105 Cb 0.49 -1.37 0.07 0.00 -0.04 0.00 0.00 33.50 32.65 1x5l n PRO 105 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1x5l h SER 106 N 0.00 -0.77 -4.91 3.54 4.64 -1.98 -3.44 113.55 110.63 1x5l h SER 106 Ca 0.00 0.22 -0.01 0.00 -0.47 0.00 0.00 61.79 61.53 1x5l h SER 106 Cb 0.00 0.48 -0.15 0.00 -0.31 0.00 0.00 62.40 62.42 1x5l h SER 106 CO 0.00 -0.25 0.26 -0.83 -0.87 0.00 0.00 176.83 175.14 1x5l s GLY 107 N -3.61 -0.57 0.19 -0.77 0.00 -1.25 -5.02 107.32 96.29 1x5l s GLY 107 Ca -0.14 0.86 0.21 0.00 0.00 0.00 0.00 44.72 45.64 1x5l s GLY 107 CO 0.74 0.44 1.64 -1.55 0.00 0.00 0.00 173.10 174.37 1x5l n PRO 108 N 0.04 0.14 -4.37 2.90 -0.04 -1.26 -4.75 135.00 127.65 1x5l n PRO 108 Ca -0.16 0.38 -0.20 0.00 -0.04 0.00 0.00 63.50 63.49 1x5l n PRO 108 Cb 0.62 -1.78 -0.10 0.00 -0.04 0.00 0.00 33.50 32.20 1x5l n PRO 108 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1x5l s SER 109 N -3.92 2.74 0.17 3.54 0.01 -1.26 -5.05 113.70 109.93 1x5l s SER 109 Ca 0.05 -1.04 -0.24 0.00 1.31 0.00 0.00 55.95 56.03 1x5l s SER 109 Cb 0.09 -0.16 0.03 0.00 0.21 0.00 0.00 66.02 66.19 1x5l s SER 109 CO 0.36 -0.16 1.38 -0.24 0.41 0.00 0.00 173.24 174.98 1x5l n SER 110 N -0.44 -0.82 -0.65 2.44 2.88 -1.26 -5.07 113.62 110.70 1x5l n SER 110 Ca -0.07 1.58 0.08 0.00 -1.33 0.00 0.00 58.87 59.13 1x5l n SER 110 Cb 0.61 -0.26 0.07 0.00 -0.75 0.00 0.00 64.21 63.88 1x5l n SER 110 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42