#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5l n SER 2 N 0.00 -1.51 -4.79 1.61 2.88 -1.26 -5.03 113.62 105.52 1x5l n SER 2 Ca 0.00 -0.09 -0.23 0.00 -1.33 0.00 0.00 58.87 57.22 1x5l n SER 2 Cb 0.00 -1.28 -0.05 0.00 -0.75 0.00 0.00 64.21 62.13 1x5l n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1x5l s SER 3 N -2.40 5.34 0.00 -3.46 0.01 -1.26 -5.09 113.70 106.84 1x5l s SER 3 Ca 0.68 -0.30 0.00 0.00 1.31 0.00 0.00 55.95 57.64 1x5l s SER 3 Cb -0.25 -1.31 0.00 0.00 0.21 0.00 0.00 66.02 64.68 1x5l s SER 3 CO 0.64 -0.01 0.00 0.61 0.41 0.00 0.00 173.24 174.89 1x5l n GLY 4 N -0.96 3.24 3.32 3.44 0.00 -1.26 -5.01 105.19 107.96 1x5l n GLY 4 Ca -0.08 -0.07 -0.20 0.00 0.00 0.00 0.00 46.02 45.67 1x5l n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1x5l n SER 5 N 0.00 -5.30 -4.90 1.61 2.88 -1.26 -5.00 113.62 101.65 1x5l n SER 5 Ca 0.00 -0.49 -0.30 0.00 -1.33 0.00 0.00 58.87 56.75 1x5l n SER 5 Cb 0.00 -4.52 -0.04 0.00 -0.75 0.00 0.00 64.21 58.90 1x5l n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1x5l s SER 6 N -3.42 6.48 0.53 -3.46 0.15 -1.26 -5.11 113.70 107.61 1x5l s SER 6 Ca 0.44 0.66 0.08 0.00 0.70 0.00 0.00 55.95 57.83 1x5l s SER 6 Cb -0.19 -2.12 0.05 0.00 -1.71 0.00 0.00 66.02 62.05 1x5l s SER 6 CO 0.64 -0.07 0.62 -0.83 1.20 0.00 0.00 173.24 174.80 1x5l s GLY 7 N -2.79 1.96 0.57 9.45 0.00 -1.26 -5.12 107.32 110.13 1x5l s GLY 7 Ca 0.43 -1.84 -0.09 0.00 0.00 0.00 0.00 44.72 43.22 1x5l s GLY 7 CO 0.26 -1.72 0.94 1.20 0.00 0.00 0.00 173.10 173.79 1x5l s GLN 8 N -4.47 3.55 -0.04 2.90 1.11 -1.26 -5.08 119.66 116.38 1x5l s GLN 8 Ca 0.53 0.53 -0.03 0.00 0.01 0.00 0.00 55.36 56.40 1x5l s GLN 8 Cb -0.05 -2.19 -0.04 0.00 -1.01 0.00 0.00 33.01 29.72 1x5l s GLN 8 CO 0.33 -0.44 0.12 0.00 0.01 0.00 0.00 175.29 175.31 1x5l s ALA 9 N -3.02 3.76 0.48 6.09 0.00 -1.26 -4.92 121.76 122.89 1x5l s ALA 9 Ca 0.52 -0.78 -0.22 0.00 0.00 0.00 0.00 51.96 51.49 1x5l s ALA 9 Cb -0.11 -1.77 -0.09 0.00 0.00 0.00 0.00 23.12 21.16 1x5l s ALA 9 CO 0.50 0.69 0.91 0.00 0.00 0.00 0.00 175.76 177.86 1x5l n ALA 10 N 1.35 -0.08 -1.87 0.00 0.00 -1.26 -4.83 120.51 113.82 1x5l n ALA 10 Ca -0.14 0.14 -0.41 0.00 0.00 0.00 0.00 53.44 53.03 1x5l n ALA 10 Cb 0.53 -2.04 -0.03 0.00 0.00 0.00 0.00 19.45 17.91 1x5l n ALA 10 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1x5l s PRO 11 N -2.16 4.44 0.92 0.00 0.04 -1.26 -4.81 135.00 132.16 1x5l s PRO 11 Ca 0.67 2.05 -0.10 0.00 0.04 0.00 0.00 61.00 63.65 1x5l s PRO 11 Cb -0.51 -3.15 0.14 0.00 0.04 0.00 0.00 34.50 31.01 1x5l s PRO 11 CO 0.54 -0.12 1.10 0.43 0.04 0.00 0.00 177.00 179.00 1x5l n SER 12 N 1.66 0.22 -4.82 6.66 7.64 -1.12 -3.92 113.62 119.93 1x5l n SER 12 Ca 0.02 0.42 -0.34 0.00 1.01 0.00 0.00 58.87 59.99 1x5l n SER 12 Cb 0.43 -1.46 -0.06 0.00 -1.01 0.00 0.00 64.21 62.10 1x5l n SER 12 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 1x5l s GLN 13 N -4.55 4.22 -0.23 1.43 0.74 -1.26 -4.63 119.66 115.38 1x5l s GLN 13 Ca 0.67 0.97 -0.16 0.00 0.05 0.00 0.00 55.36 56.88 1x5l s GLN 13 Cb -0.23 -2.49 -0.04 0.00 1.10 0.00 0.00 33.01 31.35 1x5l s GLN 13 CO 0.58 0.16 0.43 0.08 -0.55 0.00 0.00 175.29 175.98 1x5l s VAL 14 N -1.91 5.16 -0.54 1.34 1.01 -1.26 -4.75 120.40 119.46 1x5l s VAL 14 Ca 0.54 0.73 0.11 0.00 0.00 0.00 0.00 61.98 63.37 1x5l s VAL 14 Cb -0.12 -3.75 0.33 0.00 0.00 0.00 0.00 36.38 32.83 1x5l s VAL 14 CO 0.18 0.20 1.26 1.33 0.00 0.00 0.00 175.10 178.06 1x5l n VAL 15 N 4.66 1.42 -4.01 2.92 0.24 -1.26 -3.52 118.33 118.78 1x5l n VAL 15 Ca -0.07 -1.33 -0.32 0.00 -2.04 0.00 0.00 64.34 60.58 1x5l n VAL 15 Cb 0.51 0.24 -0.15 0.00 -1.47 0.00 0.00 33.84 32.97 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 -1.63 2.39 -0.05 3.34 1.01 -1.26 -4.94 120.40 119.26 1x5l s VAL 16 Ca 0.26 -1.91 -0.02 0.00 0.00 0.00 0.00 61.98 60.31 1x5l s VAL 16 Cb 0.18 -2.56 0.03 0.00 0.00 0.00 0.00 36.38 34.03 1x5l s VAL 16 CO 0.11 -0.30 0.10 -0.63 0.00 0.00 0.00 175.10 174.38 1x5l s ILE 17 N 1.04 -0.04 0.10 2.22 1.01 -1.26 -3.24 121.20 121.03 1x5l s ILE 17 Ca 0.00 0.15 0.05 0.00 0.00 0.00 0.00 60.65 60.86 1x5l s ILE 17 Cb -0.20 -0.17 -0.03 0.00 0.01 0.00 0.00 42.46 42.07 1x5l s ILE 17 CO -0.06 0.06 -0.14 -0.13 0.00 0.00 0.00 174.94 174.68 1x5l s ARG 18 N 0.91 0.91 -0.40 2.79 0.52 0.20 -4.96 118.95 118.93 1x5l s ARG 18 Ca -0.07 -1.11 -0.17 0.00 -0.52 0.00 0.00 55.73 53.86 1x5l s ARG 18 Cb -0.10 -0.82 0.01 0.00 0.52 0.00 0.00 34.95 34.57 1x5l s ARG 18 CO -0.04 0.16 0.44 -1.14 0.02 0.00 0.00 175.30 174.74 1x5l s GLN 19 N -2.30 3.24 -0.07 3.54 0.74 -1.26 -0.73 119.66 122.82 1x5l s GLN 19 Ca 0.04 -0.63 -0.07 0.00 0.05 0.00 0.00 55.36 54.75 1x5l s GLN 19 Cb -0.07 -3.92 -0.04 0.00 1.10 0.00 0.00 33.01 30.08 1x5l s GLN 19 CO 0.02 -0.78 0.28 0.93 -0.55 0.00 0.00 175.29 175.19 1x5l h GLU 20 N 8.66 -0.21 -2.21 1.67 4.39 -1.69 -3.47 114.58 121.73 1x5l h GLU 20 Ca -0.27 0.01 0.01 0.00 0.34 0.00 0.00 59.36 59.45 1x5l h GLU 20 Cb 1.12 0.05 -0.23 0.00 -0.10 0.00 0.00 28.75 29.59 1x5l h GLU 20 CO 0.78 -0.11 -0.22 1.03 -1.16 0.00 0.00 179.01 179.33 1x5l s ARG 21 N -2.29 0.48 -0.50 2.33 0.52 -1.22 -4.99 118.95 113.28 1x5l s ARG 21 Ca -0.04 1.28 -0.14 0.00 -0.52 0.00 0.00 55.73 56.31 1x5l s ARG 21 Cb 0.00 0.63 0.11 0.00 0.52 0.00 0.00 34.95 36.21 1x5l s ARG 21 CO 0.12 -0.22 0.42 0.00 0.02 0.00 0.00 175.30 175.64 1x5l s ALA 22 N 2.72 3.55 1.16 2.13 0.00 -1.26 0.48 121.76 130.53 1x5l s ALA 22 Ca -0.05 -2.37 -0.16 0.00 0.00 0.00 0.00 51.96 49.39 1x5l s ALA 22 Cb -0.12 -3.08 0.23 0.00 0.00 0.00 0.00 23.12 20.15 1x5l s ALA 22 CO -0.17 -1.88 0.90 0.41 0.00 0.00 0.00 175.76 175.03 1x5l n GLY 23 N 5.15 -2.45 0.15 0.00 0.00 0.81 -3.96 105.19 104.89 1x5l n GLY 23 Ca -0.12 -1.53 -0.14 0.00 0.00 0.00 0.00 46.02 44.23 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 -0.29 -0.18 1.61 4.15 -1.92 0.69 115.11 119.17 1x5l h GLN 24 Ca -0.33 0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.11 1x5l h GLN 24 Cb 0.98 0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.73 1x5l h GLN 24 CO 0.22 -0.04 0.00 0.25 -1.93 0.00 0.00 178.83 177.33 1x5l n THR 25 N -5.13 1.67 -3.96 2.39 -2.24 -1.26 -3.12 114.28 102.63 1x5l n THR 25 Ca -0.09 -1.61 -0.09 0.00 -2.27 0.00 0.00 64.05 59.98 1x5l n THR 25 Cb 0.21 0.06 -0.04 0.00 -2.10 0.00 0.00 70.33 68.46 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 -1.77 0.01 -0.04 3.42 1.04 -1.24 -0.66 113.70 114.46 1x5l s SER 26 Ca 0.28 -0.96 -0.29 0.00 0.48 0.00 0.00 55.95 55.46 1x5l s SER 26 Cb 0.22 0.65 0.09 0.00 0.10 0.00 0.00 66.02 67.08 1x5l s SER 26 CO 0.08 -1.26 0.77 0.54 0.98 0.00 0.00 173.24 174.35 1x5l s VAL 27 N -3.70 0.00 0.02 5.02 0.11 0.24 0.28 120.40 122.37 1x5l s VAL 27 Ca 0.21 0.00 0.07 0.00 -2.93 0.00 0.00 61.98 59.33 1x5l s VAL 27 Cb -0.02 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.80 1x5l s VAL 27 CO 0.10 0.00 -0.20 -0.55 -3.33 0.00 0.00 175.10 171.12 1x5l s SER 28 N -1.60 3.58 0.43 3.54 0.15 0.18 0.26 113.70 120.24 1x5l s SER 28 Ca -0.05 -0.43 0.06 0.00 0.70 0.00 0.00 55.95 56.23 1x5l s SER 28 Cb -0.00 -0.54 -0.07 0.00 -1.71 0.00 0.00 66.02 63.70 1x5l s SER 28 CO 0.02 0.28 0.01 -0.76 1.20 0.00 0.00 173.24 173.99 1x5l s LEU 29 N -1.14 2.74 -0.27 3.45 1.43 -1.07 -1.98 118.68 121.84 1x5l s LEU 29 Ca 0.13 -1.43 -0.01 0.00 -1.03 0.00 0.00 54.13 51.79 1x5l s LEU 29 Cb -0.10 -0.84 0.16 0.00 0.03 0.00 0.00 46.19 45.43 1x5l s LEU 29 CO 0.03 -0.53 0.45 -0.22 0.23 0.00 0.00 176.35 176.30 1x5l s LEU 30 N -3.73 -0.91 0.11 1.79 2.96 0.09 -4.07 118.68 114.92 1x5l s LEU 30 Ca 0.30 0.26 0.09 0.00 -0.22 0.00 0.00 54.13 54.55 1x5l s LEU 30 Cb 0.08 1.43 -0.04 0.00 0.50 0.00 0.00 46.19 48.17 1x5l s LEU 30 CO 0.15 -0.30 -0.23 -1.66 -1.32 0.00 0.00 176.35 172.99 1x5l s TRP 31 N 2.64 1.95 0.24 5.38 -2.14 -1.22 -0.62 118.94 125.17 1x5l s TRP 31 Ca 0.14 -0.40 0.03 0.00 2.66 0.00 0.00 56.10 58.52 1x5l s TRP 31 Cb -0.14 -1.07 -0.03 0.00 -3.10 0.00 0.00 33.47 29.12 1x5l s TRP 31 CO -0.21 0.24 0.39 1.14 -2.66 0.00 0.00 176.95 175.85 1x5l s GLN 32 N -1.91 3.46 0.51 3.25 -2.07 -1.20 -4.80 119.66 116.90 1x5l s GLN 32 Ca 0.09 -0.57 -0.21 0.00 -1.82 0.00 0.00 55.36 52.85 1x5l s GLN 32 Cb -0.10 -2.85 -0.08 0.00 -1.09 0.00 0.00 33.01 28.88 1x5l s GLN 32 CO 0.05 0.39 0.88 0.39 -1.32 0.00 0.00 175.29 175.67 1x5l n GLU 33 N -1.17 1.00 -2.26 9.60 1.02 -1.26 -4.79 120.64 122.78 1x5l n GLU 33 Ca -0.07 0.37 -0.41 0.00 -0.02 0.00 0.00 57.16 57.04 1x5l n GLU 33 Cb 0.56 -1.99 -0.03 0.00 -0.02 0.00 0.00 31.44 29.96 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 -2.24 4.47 0.34 3.49 0.04 -1.26 -4.86 135.00 134.97 1x5l s PRO 34 Ca 0.68 2.05 0.26 0.00 0.04 0.00 0.00 61.00 64.04 1x5l s PRO 34 Cb -0.49 -3.12 1.13 0.00 0.04 0.00 0.00 34.50 32.06 1x5l s PRO 34 CO 0.53 -0.04 1.14 0.39 0.04 0.00 0.00 177.00 179.07 1x5l n GLU 35 N 1.01 -0.02 -3.33 4.56 1.02 -1.26 -3.35 120.64 119.27 1x5l n GLU 35 Ca -0.00 0.89 -0.10 0.00 -0.02 0.00 0.00 57.16 57.93 1x5l n GLU 35 Cb 0.43 -1.81 -0.07 0.00 -0.02 0.00 0.00 31.44 29.97 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 -4.71 0.38 0.00 3.49 -0.21 -1.26 -5.00 119.66 112.35 1x5l s GLN 36 Ca -0.05 0.16 0.14 0.00 0.02 0.00 0.00 55.36 55.64 1x5l s GLN 36 Cb 0.22 -0.40 0.65 0.00 1.00 0.00 0.00 33.01 34.48 1x5l s GLN 36 CO 0.61 -0.96 1.44 -0.35 -2.12 0.00 0.00 175.29 173.91 1x5l n PRO 37 N 5.35 0.07 -3.77 2.91 -0.04 -1.21 -2.80 135.00 135.51 1x5l n PRO 37 Ca -0.01 0.22 -0.29 0.00 -0.04 0.00 0.00 63.50 63.39 1x5l n PRO 37 Cb 0.49 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.47 1x5l n PRO 37 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1x5l n ASN 38 N -1.43 -4.76 0.00 3.54 4.13 -1.26 -4.51 115.26 110.97 1x5l n ASN 38 Ca 0.05 -0.68 0.00 0.00 1.68 0.00 0.00 54.58 55.62 1x5l n ASN 38 Cb 0.15 -3.82 0.00 0.00 -1.54 0.00 0.00 39.78 34.57 1x5l n ASN 38 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1x5l n GLY 39 N -1.59 0.42 3.71 7.41 0.00 -1.26 -4.59 105.19 109.28 1x5l n GLY 39 Ca 0.02 -2.27 -0.42 0.00 0.00 0.00 0.00 46.02 43.36 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 -0.16 4.90 -0.21 -0.61 1.09 -1.26 -5.03 121.20 119.91 1x5l s ILE 40 Ca 0.00 1.90 -0.14 0.00 -1.10 0.00 0.00 60.65 61.31 1x5l s ILE 40 Cb 0.00 -4.25 -0.04 0.00 -1.06 0.00 0.00 42.46 37.11 1x5l s ILE 40 CO 0.00 0.15 0.32 -0.63 -0.10 0.00 0.00 174.94 174.68 1x5l s ILE 41 N 1.16 5.26 -0.00 2.92 1.01 -1.26 -4.45 121.20 125.84 1x5l s ILE 41 Ca 0.47 0.54 -0.25 0.00 0.00 0.00 0.00 60.65 61.42 1x5l s ILE 41 Cb -0.20 -3.65 -0.17 0.00 0.01 0.00 0.00 42.46 38.45 1x5l s ILE 41 CO 0.24 0.29 1.22 -0.07 0.00 0.00 0.00 174.94 176.62 1x5l h LEU 42 N 7.49 -0.23 -7.43 2.97 3.38 -1.75 -3.49 115.31 116.25 1x5l h LEU 42 Ca -0.37 -0.26 0.15 0.00 0.09 0.00 0.00 57.88 57.49 1x5l h LEU 42 Cb 1.16 0.06 -0.10 0.00 0.09 0.00 0.00 40.66 41.87 1x5l h LEU 42 CO 0.70 0.17 0.47 -1.83 0.09 0.00 0.00 178.44 178.05 1x5l s GLU 43 N -4.47 1.09 -0.09 1.13 -1.05 -1.24 -4.81 118.70 109.26 1x5l s GLU 43 Ca -0.14 -0.54 -0.02 0.00 -0.15 0.00 0.00 54.97 54.11 1x5l s GLU 43 Cb 0.02 0.41 -0.03 0.00 -0.44 0.00 0.00 34.13 34.08 1x5l s GLU 43 CO 0.57 -0.49 0.02 0.71 0.95 0.00 0.00 175.26 177.01 1x5l s TYR 44 N -3.26 3.21 -0.14 4.83 1.51 0.63 -2.42 117.35 121.71 1x5l s TYR 44 Ca 0.09 0.23 -0.06 0.00 -1.01 0.00 0.00 57.07 56.33 1x5l s TYR 44 Cb -0.01 -1.80 -0.04 0.00 -0.11 0.00 0.00 41.96 40.00 1x5l s TYR 44 CO -0.02 0.50 0.07 -1.21 -1.11 0.00 0.00 175.55 173.78 1x5l s GLU 45 N -0.91 3.59 -0.29 -0.62 8.01 -0.57 -1.64 118.70 126.27 1x5l s GLU 45 Ca 0.14 -0.30 0.02 0.00 0.01 0.00 0.00 54.97 54.83 1x5l s GLU 45 Cb -0.11 -3.10 0.07 0.00 -4.31 0.00 0.00 34.13 26.67 1x5l s GLU 45 CO 0.03 0.51 -0.05 0.42 0.01 0.00 0.00 175.26 176.18 1x5l s ILE 46 N -0.31 2.35 -0.23 -1.63 1.01 0.09 -1.31 121.20 121.17 1x5l s ILE 46 Ca 0.09 -1.77 -0.09 0.00 0.00 0.00 0.00 60.65 58.88 1x5l s ILE 46 Cb -0.12 -2.47 -0.04 0.00 0.01 0.00 0.00 42.46 39.84 1x5l s ILE 46 CO 0.02 -0.19 0.10 -0.75 0.00 0.00 0.00 174.94 174.12 1x5l s LYS 47 N 1.08 3.89 -0.03 2.79 2.20 -1.00 0.26 119.74 128.92 1x5l s LYS 47 Ca -0.04 -0.37 0.02 0.00 -0.36 0.00 0.00 55.97 55.22 1x5l s LYS 47 Cb -0.20 -3.39 0.01 0.00 -1.51 0.00 0.00 37.83 32.75 1x5l s LYS 47 CO -0.05 0.01 -0.06 1.52 -0.36 0.00 0.00 175.35 176.41 1x5l s TYR 48 N 1.13 0.82 0.29 4.03 1.13 -0.89 -2.11 117.35 121.74 1x5l s TYR 48 Ca 0.05 -0.22 0.02 0.00 -1.41 0.00 0.00 57.07 55.52 1x5l s TYR 48 Cb -0.14 -0.65 -0.05 0.00 -1.10 0.00 0.00 41.96 40.02 1x5l s TYR 48 CO 0.04 -0.14 0.09 1.52 -2.51 0.00 0.00 175.55 174.55 1x5l s TYR 49 N 0.54 1.66 -0.48 -3.49 -0.85 -1.17 -1.32 117.35 112.24 1x5l s TYR 49 Ca -0.08 -1.15 -0.27 0.00 -0.52 0.00 0.00 57.07 55.05 1x5l s TYR 49 Cb -0.11 -1.00 -0.04 0.00 0.38 0.00 0.00 41.96 41.18 1x5l s TYR 49 CO 0.01 -0.27 2.11 -1.21 -1.52 0.00 0.00 175.55 174.67 1x5l s GLU 50 N -3.96 2.57 0.25 -3.49 2.02 -1.19 -1.96 118.70 112.93 1x5l s GLU 50 Ca 0.37 1.21 -0.00 0.00 0.02 0.00 0.00 54.97 56.56 1x5l s GLU 50 Cb 0.08 -4.44 0.58 0.00 0.10 0.00 0.00 34.13 30.44 1x5l s GLU 50 CO 0.15 -2.76 1.30 1.17 0.02 0.00 0.00 175.26 175.13 1x5l n LYS 51 N 8.96 -0.07 -0.05 1.61 3.00 -1.13 0.12 118.16 130.60 1x5l n LYS 51 Ca 0.28 1.26 -0.15 0.00 -0.00 0.00 0.00 58.31 59.71 1x5l n LYS 51 Cb 0.52 -1.97 -0.07 0.00 0.00 0.00 0.00 35.03 33.51 1x5l n LYS 51 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.40 177.78 1x5l h ASP 52 N 0.00 0.62 -3.35 3.14 2.03 -1.88 -3.41 116.42 113.57 1x5l h ASP 52 Ca 0.48 -0.56 -0.73 0.00 -0.73 0.00 0.00 57.03 55.48 1x5l h ASP 52 Cb 0.94 -0.18 -0.22 0.00 -0.83 0.00 0.00 39.33 39.04 1x5l h ASP 52 CO -0.80 1.06 -0.35 -0.54 -1.03 0.00 0.00 179.24 177.58 1x5l s LYS 53 N -4.00 2.98 0.09 4.15 -0.14 0.33 -5.07 119.74 118.09 1x5l s LYS 53 Ca -0.13 -1.27 -0.12 0.00 -1.36 0.00 0.00 55.97 53.09 1x5l s LYS 53 Cb 0.06 -4.09 -0.06 0.00 -1.68 0.00 0.00 37.83 32.06 1x5l s LYS 53 CO 0.81 -0.96 0.46 -2.00 -0.76 0.00 0.00 175.35 172.90 1x5l s GLU 54 N 1.65 3.87 -1.29 1.68 2.12 -1.23 -3.27 118.70 122.23 1x5l s GLU 54 Ca 0.04 0.33 -0.03 0.00 0.36 0.00 0.00 54.97 55.68 1x5l s GLU 54 Cb -0.23 -3.01 0.02 0.00 0.26 0.00 0.00 34.13 31.17 1x5l s GLU 54 CO 0.07 0.55 0.22 -1.33 -0.54 0.00 0.00 175.26 174.24 1x5l n MET 55 N 1.02 -2.89 -0.02 4.30 2.81 -1.26 -4.80 117.12 116.27 1x5l n MET 55 Ca -0.08 0.68 -0.03 0.00 -1.81 0.00 0.00 57.70 56.46 1x5l n MET 55 Cb 0.52 -5.36 -0.03 0.00 -0.71 0.00 0.00 33.22 27.65 1x5l n MET 55 CO 0.00 0.00 0.00 0.94 1.51 0.00 0.00 175.97 178.42 1x5l n GLN 56 N -3.26 0.87 -3.19 0.03 7.27 -1.26 -5.00 117.38 112.84 1x5l n GLN 56 Ca -0.12 0.02 0.01 0.00 0.07 0.00 0.00 57.00 56.97 1x5l n GLN 56 Cb 0.61 -1.10 -0.02 0.00 2.41 0.00 0.00 30.24 32.13 1x5l n GLN 56 CO 0.00 0.00 0.00 -1.12 0.07 0.00 0.00 177.06 176.01 1x5l s SER 57 N -4.26 -1.05 -0.02 1.69 0.01 -1.26 -5.08 113.70 103.73 1x5l s SER 57 Ca -0.06 0.23 0.07 0.00 1.31 0.00 0.00 55.95 57.49 1x5l s SER 57 Cb 0.02 1.82 -0.02 0.00 0.21 0.00 0.00 66.02 68.05 1x5l s SER 57 CO 0.13 -0.30 -0.22 -0.72 0.41 0.00 0.00 173.24 172.54 1x5l s TYR 58 N 2.76 1.98 -0.12 2.43 1.13 -1.26 -3.18 117.35 121.09 1x5l s TYR 58 Ca 0.12 -0.39 0.01 0.00 -1.41 0.00 0.00 57.07 55.41 1x5l s TYR 58 Cb -0.12 -1.28 0.02 0.00 -1.10 0.00 0.00 41.96 39.48 1x5l s TYR 58 CO -0.25 -0.04 -0.14 -1.12 -2.51 0.00 0.00 175.55 171.48 1x5l s SER 59 N -0.49 2.45 -0.19 -0.18 0.01 -0.43 -4.94 113.70 109.93 1x5l s SER 59 Ca 0.08 -0.43 -0.14 0.00 1.31 0.00 0.00 55.95 56.77 1x5l s SER 59 Cb -0.09 -1.08 -0.04 0.00 0.21 0.00 0.00 66.02 65.02 1x5l s SER 59 CO -0.01 -0.01 0.31 -0.89 0.41 0.00 0.00 173.24 173.05 1x5l s THR 60 N 1.17 5.28 -0.05 1.44 2.01 -1.25 -2.09 115.64 122.13 1x5l s THR 60 Ca -0.03 0.55 -0.00 0.00 0.31 0.00 0.00 61.69 62.52 1x5l s THR 60 Cb -0.14 -3.65 -0.03 0.00 0.01 0.00 0.00 72.50 68.69 1x5l s THR 60 CO -0.04 0.33 -0.01 -0.22 -0.69 0.00 0.00 174.62 173.99 1x5l s LEU 61 N 0.87 3.51 -0.27 4.42 2.96 0.14 -4.88 118.68 125.43 1x5l s LEU 61 Ca 0.16 0.07 -0.07 0.00 -0.22 0.00 0.00 54.13 54.06 1x5l s LEU 61 Cb -0.14 -1.89 -0.02 0.00 0.50 0.00 0.00 46.19 44.65 1x5l s LEU 61 CO 0.05 0.34 0.08 -0.54 -1.32 0.00 0.00 176.35 174.96 1x5l s LYS 62 N -1.15 3.48 -0.07 1.98 -0.14 -1.26 -0.73 119.74 121.84 1x5l s LYS 62 Ca 0.16 -0.60 0.02 0.00 -1.36 0.00 0.00 55.97 54.19 1x5l s LYS 62 Cb -0.11 -3.36 0.01 0.00 -1.68 0.00 0.00 37.83 32.69 1x5l s LYS 62 CO 0.05 -0.28 -0.12 0.00 -0.76 0.00 0.00 175.35 174.25 1x5l s ALA 63 N 1.59 1.29 0.08 5.17 0.00 -0.65 -5.00 121.76 124.24 1x5l s ALA 63 Ca 0.05 -0.45 -0.06 0.00 0.00 0.00 0.00 51.96 51.51 1x5l s ALA 63 Cb -0.16 -0.63 -0.26 0.00 0.00 0.00 0.00 23.12 22.08 1x5l s ALA 63 CO 0.03 0.03 1.15 -0.39 0.00 0.00 0.00 175.76 176.59 1x5l h VAL 64 N 6.00 1.46 -1.67 0.00 -1.51 -1.87 0.18 116.25 118.83 1x5l h VAL 64 Ca -0.31 -2.91 -0.44 0.00 -1.23 0.00 0.00 66.70 61.81 1x5l h VAL 64 Cb 1.18 2.86 0.04 0.00 -2.13 0.00 0.00 31.29 33.24 1x5l h VAL 64 CO 0.47 0.85 -0.13 0.28 -1.23 0.00 0.00 177.57 177.81 1x5l s THR 65 N -2.76 2.64 -2.00 7.19 -1.32 -1.26 -4.70 115.64 113.43 1x5l s THR 65 Ca -0.05 -0.87 0.06 0.00 -1.21 0.00 0.00 61.69 59.63 1x5l s THR 65 Cb 0.07 -2.78 0.18 0.00 -1.51 0.00 0.00 72.50 68.46 1x5l s THR 65 CO 0.89 0.00 1.09 0.35 -2.21 0.00 0.00 174.62 174.74 1x5l n THR 66 N -2.17 0.00 -4.82 5.08 -2.24 -1.26 -4.68 114.28 104.19 1x5l n THR 66 Ca 0.10 0.00 -0.26 0.00 -2.27 0.00 0.00 64.05 61.62 1x5l n THR 66 Cb 0.60 -0.20 -0.16 0.00 -2.10 0.00 0.00 70.33 68.46 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 1.94 0.13 -0.78 0.52 -1.26 -3.40 118.95 114.10 1x5l s ARG 67 Ca 0.09 -0.59 -0.08 0.00 -0.52 0.00 0.00 55.73 54.63 1x5l s ARG 67 Cb 0.04 -1.61 -0.01 0.00 0.52 0.00 0.00 34.95 33.89 1x5l s ARG 67 CO 0.07 0.17 0.23 0.00 0.02 0.00 0.00 175.30 175.79 1x5l s ALA 68 N 0.26 -0.00 -0.29 2.13 0.00 -1.26 -4.85 121.76 117.75 1x5l s ALA 68 Ca -0.09 -0.84 0.01 0.00 0.00 0.00 0.00 51.96 51.03 1x5l s ALA 68 Cb -0.14 0.72 0.09 0.00 0.00 0.00 0.00 23.12 23.79 1x5l s ALA 68 CO 0.04 -0.58 0.04 0.99 0.00 0.00 0.00 175.76 176.25 1x5l s THR 69 N -3.94 1.38 -0.48 0.00 2.01 -1.26 -2.59 115.64 110.77 1x5l s THR 69 Ca 0.13 -1.54 -0.27 0.00 0.31 0.00 0.00 61.69 60.32 1x5l s THR 69 Cb 0.04 -1.92 -0.03 0.00 0.01 0.00 0.00 72.50 70.60 1x5l s THR 69 CO -0.04 -0.48 1.94 -0.69 -0.69 0.00 0.00 174.62 174.67 1x5l s VAL 70 N 1.39 3.32 0.23 3.82 1.01 0.73 -4.82 120.40 126.09 1x5l s VAL 70 Ca 0.05 0.26 0.09 0.00 0.00 0.00 0.00 61.98 62.38 1x5l s VAL 70 Cb -0.18 -3.65 -0.04 0.00 0.00 0.00 0.00 36.38 32.51 1x5l s VAL 70 CO -0.15 -0.55 -0.02 -0.55 0.00 0.00 0.00 175.10 173.83 1x5l s SER 71 N 8.08 4.54 0.00 3.32 0.15 -1.26 0.82 113.70 129.35 1x5l s SER 71 Ca 0.78 -0.59 0.00 0.00 0.70 0.00 0.00 55.95 56.84 1x5l s SER 71 Cb -0.18 -0.86 0.00 0.00 -1.71 0.00 0.00 66.02 63.28 1x5l s SER 71 CO 0.27 0.03 0.00 0.61 1.20 0.00 0.00 173.24 175.35 1x5l n GLY 72 N -0.60 0.75 3.57 9.45 0.00 -0.95 -4.98 105.19 112.42 1x5l n GLY 72 Ca -0.08 -0.39 -0.27 0.00 0.00 0.00 0.00 46.02 45.28 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 -2.01 2.07 -0.09 0.99 1.43 0.16 -5.03 118.68 116.20 1x5l s LEU 73 Ca 0.00 -1.66 -0.04 0.00 -1.03 0.00 0.00 54.13 51.40 1x5l s LEU 73 Cb 0.00 -0.25 -0.04 0.00 0.03 0.00 0.00 46.19 45.93 1x5l s LEU 73 CO 0.00 -0.90 0.06 -0.54 0.23 0.00 0.00 176.35 175.20 1x5l s LYS 74 N -3.75 3.17 0.29 1.70 1.02 -1.26 -4.63 119.74 116.28 1x5l s LYS 74 Ca 0.20 -0.30 -0.29 0.00 0.02 0.00 0.00 55.97 55.60 1x5l s LYS 74 Cb 0.03 -2.96 -0.10 0.00 -0.52 0.00 0.00 37.83 34.28 1x5l s LYS 74 CO 0.12 0.73 1.24 -1.25 -0.92 0.00 0.00 175.35 175.27 1x5l s PRO 75 N -1.02 4.45 -1.18 -1.68 0.04 -1.25 -3.59 135.00 130.77 1x5l s PRO 75 Ca 0.15 2.05 -0.00 0.00 0.04 0.00 0.00 61.00 63.24 1x5l s PRO 75 Cb -0.12 -3.13 0.00 0.00 0.04 0.00 0.00 34.50 31.29 1x5l s PRO 75 CO 0.04 -0.08 0.99 0.41 0.04 0.00 0.00 177.00 178.40 1x5l n GLY 76 N 1.26 -0.35 2.82 0.56 0.00 -1.25 -4.82 105.19 103.41 1x5l n GLY 76 Ca 0.01 0.09 -0.15 0.00 0.00 0.00 0.00 46.02 45.97 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 -3.35 -0.41 0.58 2.61 2.01 -1.24 -5.03 115.64 110.82 1x5l s THR 77 Ca 0.01 -0.07 -0.18 0.00 0.31 0.00 0.00 61.69 61.76 1x5l s THR 77 Cb -0.00 -0.69 -0.07 0.00 0.01 0.00 0.00 72.50 71.75 1x5l s THR 77 CO 0.72 -0.15 0.78 0.54 -0.69 0.00 0.00 174.62 175.82 1x5l n ARG 78 N 5.33 0.74 -3.74 4.92 1.74 -1.26 -4.05 116.66 120.34 1x5l n ARG 78 Ca -0.05 0.29 -0.12 0.00 -0.77 0.00 0.00 57.85 57.19 1x5l n ARG 78 Cb 0.50 -1.96 -0.13 0.00 -1.02 0.00 0.00 32.46 29.85 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 -1.59 -0.32 -0.48 -1.55 2.02 -0.81 -2.85 117.35 111.77 1x5l s TYR 79 Ca 0.72 0.77 -0.19 0.00 -0.37 0.00 0.00 57.07 58.01 1x5l s TYR 79 Cb -0.44 0.07 0.05 0.00 -0.40 0.00 0.00 41.96 41.24 1x5l s TYR 79 CO 0.50 -0.21 0.56 0.08 -1.57 0.00 0.00 175.55 174.92 1x5l s VAL 80 N 0.93 4.95 0.30 0.71 1.01 -0.83 -2.24 120.40 125.23 1x5l s VAL 80 Ca -0.07 -0.46 -0.07 0.00 0.00 0.00 0.00 61.98 61.39 1x5l s VAL 80 Cb -0.08 -4.22 -0.06 0.00 0.00 0.00 0.00 36.38 32.03 1x5l s VAL 80 CO -0.06 -0.68 0.58 -0.36 0.00 0.00 0.00 175.10 174.58 1x5l s PHE 81 N 2.44 3.47 -0.28 5.22 0.08 -0.51 -3.06 117.98 125.34 1x5l s PHE 81 Ca 0.14 0.74 -0.02 0.00 0.12 0.00 0.00 56.93 57.92 1x5l s PHE 81 Cb -0.19 -2.18 0.17 0.00 -0.57 0.00 0.00 43.02 40.25 1x5l s PHE 81 CO 0.12 0.15 0.53 -0.65 -0.10 0.00 0.00 175.22 175.27 1x5l s GLN 82 N -3.46 0.50 0.14 0.44 -0.21 -0.90 -1.85 119.66 114.31 1x5l s GLN 82 Ca 0.46 0.86 -0.17 0.00 0.02 0.00 0.00 55.36 56.53 1x5l s GLN 82 Cb -0.11 0.22 -0.07 0.00 1.00 0.00 0.00 33.01 34.06 1x5l s GLN 82 CO 0.29 -0.62 0.59 0.08 -2.12 0.00 0.00 175.29 173.51 1x5l s VAL 83 N 2.76 4.76 0.07 1.09 1.01 -1.26 -2.37 120.40 126.45 1x5l s VAL 83 Ca 0.18 1.05 -0.04 0.00 0.00 0.00 0.00 61.98 63.17 1x5l s VAL 83 Cb -0.15 -3.81 -0.03 0.00 0.00 0.00 0.00 36.38 32.39 1x5l s VAL 83 CO -0.19 0.34 0.06 0.00 0.00 0.00 0.00 175.10 175.31 1x5l s ARG 84 N -1.69 0.73 -0.03 2.72 1.70 -0.43 0.10 118.95 122.06 1x5l s ARG 84 Ca 0.36 -1.14 0.00 0.00 -0.47 0.00 0.00 55.73 54.48 1x5l s ARG 84 Cb -0.17 0.26 -0.03 0.00 -0.57 0.00 0.00 34.95 34.44 1x5l s ARG 84 CO 0.20 -0.18 0.00 0.00 -1.08 0.00 0.00 175.30 174.23 1x5l s ALA 85 N -3.91 3.29 -0.06 7.88 0.00 -1.26 -1.50 121.76 126.19 1x5l s ALA 85 Ca 0.08 -0.91 0.03 0.00 0.00 0.00 0.00 51.96 51.16 1x5l s ALA 85 Cb 0.07 -1.39 0.01 0.00 0.00 0.00 0.00 23.12 21.81 1x5l s ALA 85 CO -0.09 0.63 -0.13 0.50 0.00 0.00 0.00 175.76 176.66 1x5l s ARG 86 N -1.36 1.75 0.11 0.00 3.52 -1.02 -3.02 118.95 118.93 1x5l s ARG 86 Ca 0.18 -0.46 0.09 0.00 -0.13 0.00 0.00 55.73 55.41 1x5l s ARG 86 Cb -0.11 -1.45 -0.04 0.00 -1.56 0.00 0.00 34.95 31.79 1x5l s ARG 86 CO 0.08 0.07 -0.23 0.95 -0.81 0.00 0.00 175.30 175.36 1x5l s THR 87 N 0.54 1.90 0.27 4.11 -4.23 -0.40 -1.87 115.64 115.98 1x5l s THR 87 Ca -0.13 -1.59 0.01 0.00 -1.18 0.00 0.00 61.69 58.80 1x5l s THR 87 Cb -0.15 -1.70 0.38 0.00 1.34 0.00 0.00 72.50 72.37 1x5l s THR 87 CO 0.04 0.01 1.40 -0.24 -0.54 0.00 0.00 174.62 175.30 1x5l n SER 88 N 1.09 -0.13 0.13 3.99 2.88 -1.26 -0.80 113.62 119.51 1x5l n SER 88 Ca -0.19 1.53 -0.09 0.00 -1.33 0.00 0.00 58.87 58.79 1x5l n SER 88 Cb 0.53 -0.54 -0.05 0.00 -0.75 0.00 0.00 64.21 63.40 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 1.79 -0.92 -3.00 -1.46 0.00 -1.94 -3.48 119.26 110.24 1x5l h ALA 89 Ca 0.53 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.35 1x5l h ALA 89 Cb 1.06 0.51 0.00 0.00 0.00 0.00 0.00 17.79 19.36 1x5l h ALA 89 CO -0.85 -0.94 0.00 0.41 0.00 0.00 0.00 179.25 177.86 1x5l n GLY 90 N -1.27 3.77 3.24 0.00 0.00 0.02 -5.06 105.19 105.89 1x5l n GLY 90 Ca -0.06 -0.21 -0.14 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.11 0.45 3.16 0.00 0.00 -1.17 -4.39 105.19 103.14 1x5l n GLY 92 Ca -0.11 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.78 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 3.13 0.81 0.10 1.61 0.52 -1.26 -4.96 118.95 118.91 1x5l s ARG 93 Ca 0.00 -1.17 -0.30 0.00 -0.52 0.00 0.00 55.73 53.73 1x5l s ARG 93 Cb 0.00 -0.41 -0.06 0.00 0.52 0.00 0.00 34.95 35.00 1x5l s ARG 93 CO 0.00 0.05 1.15 -0.06 0.02 0.00 0.00 175.30 176.45 1x5l s PHE 94 N -2.70 3.51 1.11 -0.53 0.08 -1.26 -4.47 117.98 113.72 1x5l s PHE 94 Ca 0.06 1.44 -0.16 0.00 0.12 0.00 0.00 56.93 58.39 1x5l s PHE 94 Cb -0.01 -3.35 0.22 0.00 -0.57 0.00 0.00 43.02 39.31 1x5l s PHE 94 CO -0.01 -0.94 0.45 -1.13 -0.10 0.00 0.00 175.22 173.49 1x5l n SER 95 N 3.30 -3.21 -4.74 1.36 3.41 0.11 -4.86 113.62 109.00 1x5l n SER 95 Ca 0.06 -0.48 -0.38 0.00 -0.26 0.00 0.00 58.87 57.82 1x5l n SER 95 Cb 0.47 -0.83 0.06 0.00 -0.26 0.00 0.00 64.21 63.64 1x5l n SER 95 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1x5l s GLN 96 N -3.83 2.82 -0.36 4.33 -2.07 -1.23 -4.76 119.66 114.57 1x5l s GLN 96 Ca 0.44 2.14 -0.27 0.00 -1.82 0.00 0.00 55.36 55.84 1x5l s GLN 96 Cb -0.08 -2.03 -0.05 0.00 -1.09 0.00 0.00 33.01 29.77 1x5l s GLN 96 CO 0.40 -1.41 2.16 0.00 -1.32 0.00 0.00 175.29 175.12 1x5l s ALA 97 N -1.36 2.38 0.01 2.60 0.00 -1.26 -4.73 121.76 119.41 1x5l s ALA 97 Ca 0.78 0.33 -0.10 0.00 0.00 0.00 0.00 51.96 52.96 1x5l s ALA 97 Cb -0.39 -4.16 -0.05 0.00 0.00 0.00 0.00 23.12 18.52 1x5l s ALA 97 CO 0.43 -3.35 0.34 1.41 0.00 0.00 0.00 175.76 174.59 1x5l s MET 98 N 6.83 3.73 -0.14 0.00 1.75 -0.77 -4.98 119.30 125.71 1x5l s MET 98 Ca 0.93 0.16 0.02 0.00 -1.25 0.00 0.00 55.69 55.55 1x5l s MET 98 Cb -0.24 -3.11 0.01 0.00 2.84 0.00 0.00 34.83 34.32 1x5l s MET 98 CO 0.31 0.65 -0.21 -1.21 -0.65 0.00 0.00 175.02 173.91 1x5l s GLU 99 N -1.49 2.94 -0.08 4.11 2.02 -1.26 -1.42 118.70 123.51 1x5l s GLU 99 Ca 0.26 -0.82 -0.04 0.00 0.02 0.00 0.00 54.97 54.39 1x5l s GLU 99 Cb -0.14 -2.41 0.04 0.00 0.10 0.00 0.00 34.13 31.72 1x5l s GLU 99 CO 0.14 -0.06 0.19 0.08 0.02 0.00 0.00 175.26 175.64 1x5l s VAL 100 N 0.93 -0.04 -0.27 2.63 1.01 -0.95 -5.02 120.40 118.69 1x5l s VAL 100 Ca -0.05 0.14 -0.11 0.00 0.00 0.00 0.00 61.98 61.97 1x5l s VAL 100 Cb -0.15 -0.30 -0.05 0.00 0.00 0.00 0.00 36.38 35.88 1x5l s VAL 100 CO -0.04 0.06 0.17 -0.70 0.00 0.00 0.00 175.10 174.59 1x5l s GLU 101 N 1.05 3.92 1.11 2.72 2.12 -1.26 -1.92 118.70 126.45 1x5l s GLU 101 Ca -0.08 -0.33 -0.15 0.00 0.36 0.00 0.00 54.97 54.76 1x5l s GLU 101 Cb -0.10 -3.61 0.24 0.00 0.26 0.00 0.00 34.13 30.93 1x5l s GLU 101 CO -0.06 -0.16 0.54 0.25 -0.54 0.00 0.00 175.26 175.29 1x5l n THR 102 N 4.97 0.00 -2.55 -1.70 -2.24 -1.26 -4.83 114.28 106.69 1x5l n THR 102 Ca -0.14 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.21 1x5l n THR 102 Cb 0.52 -0.62 -0.02 0.00 -2.10 0.00 0.00 70.33 68.11 1x5l n THR 102 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1x5l s GLY 103 N -2.30 1.19 0.63 3.38 0.00 0.24 -4.49 107.32 105.98 1x5l s GLY 103 Ca 0.42 -0.54 -0.18 0.00 0.00 0.00 0.00 44.72 44.42 1x5l s GLY 103 CO 0.35 2.52 0.92 0.28 0.00 0.00 0.00 173.10 177.17 1x5l n LYS 104 N 8.11 0.76 -2.05 2.90 5.02 -1.26 -3.94 118.16 127.70 1x5l n LYS 104 Ca 0.12 0.31 -0.27 0.00 -2.02 0.00 0.00 58.31 56.44 1x5l n LYS 104 Cb 0.49 -2.14 -0.05 0.00 -0.02 0.00 0.00 35.03 33.30 1x5l n LYS 104 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1x5l s PRO 105 N -2.85 2.56 0.14 1.97 0.04 -1.26 -4.86 135.00 130.74 1x5l s PRO 105 Ca 0.75 -0.33 -0.03 0.00 0.04 0.00 0.00 61.00 61.44 1x5l s PRO 105 Cb -0.40 -5.07 -0.03 0.00 0.04 0.00 0.00 34.50 29.04 1x5l s PRO 105 CO 0.48 -3.40 0.11 -1.12 0.04 0.00 0.00 177.00 173.11 1x5l s SER 106 N 7.97 0.25 0.35 6.66 0.01 -1.26 -5.12 113.70 122.56 1x5l s SER 106 Ca 0.70 -1.16 0.06 0.00 1.31 0.00 0.00 55.95 56.87 1x5l s SER 106 Cb -0.06 0.33 -0.07 0.00 0.21 0.00 0.00 66.02 66.43 1x5l s SER 106 CO -0.00 -0.77 -0.00 -0.83 0.41 0.00 0.00 173.24 172.04 1x5l s GLY 107 N -3.04 2.21 0.00 3.44 0.00 -1.26 -5.01 107.32 103.66 1x5l s GLY 107 Ca 0.24 -2.13 0.09 0.00 0.00 0.00 0.00 44.72 42.92 1x5l s GLY 107 CO 0.02 -1.96 0.99 -1.55 0.00 0.00 0.00 173.10 170.60 1x5l n PRO 108 N -0.79 0.49 -0.24 2.90 -0.04 -1.26 -4.07 135.00 131.99 1x5l n PRO 108 Ca -0.04 0.00 0.19 0.00 -0.04 0.00 0.00 63.50 63.60 1x5l n PRO 108 Cb 0.66 -1.29 0.35 0.00 -0.04 0.00 0.00 33.50 33.17 1x5l n PRO 108 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1x5l n SER 109 N -0.79 0.14 -4.33 3.54 2.88 -1.26 -3.84 113.62 109.95 1x5l n SER 109 Ca 0.07 1.20 -0.33 0.00 -1.33 0.00 0.00 58.87 58.47 1x5l n SER 109 Cb 0.03 -0.53 -0.15 0.00 -0.75 0.00 0.00 64.21 62.81 1x5l n SER 109 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1x5l s SER 110 N -4.78 3.91 0.00 -3.46 0.15 -1.26 -5.34 113.70 102.92 1x5l s SER 110 Ca -0.07 -0.38 0.00 0.00 0.70 0.00 0.00 55.95 56.20 1x5l s SER 110 Cb 0.23 -1.60 0.00 0.00 -1.71 0.00 0.00 66.02 62.94 1x5l s SER 110 CO 0.56 0.13 0.00 0.61 1.20 0.00 0.00 173.24 175.73