#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5l s SER 2 N 0.00 1.12 0.32 1.61 0.01 -1.26 -5.16 113.70 110.35 1x5l s SER 2 Ca 0.00 -0.17 0.10 0.00 1.31 0.00 0.00 55.95 57.19 1x5l s SER 2 Cb 0.00 -0.14 -0.06 0.00 0.21 0.00 0.00 66.02 66.03 1x5l s SER 2 CO 0.00 0.11 -0.08 -0.44 0.41 0.00 0.00 173.24 173.24 1x5l s SER 3 N -0.18 3.92 0.00 2.44 0.01 -1.26 -5.09 113.70 113.54 1x5l s SER 3 Ca 0.03 -1.04 0.00 0.00 1.31 0.00 0.00 55.95 56.25 1x5l s SER 3 Cb -0.04 -0.44 0.00 0.00 0.21 0.00 0.00 66.02 65.75 1x5l s SER 3 CO -0.00 -0.14 0.00 0.61 0.41 0.00 0.00 173.24 174.12 1x5l n GLY 4 N -0.81 -1.92 0.38 3.44 0.00 -1.26 -5.05 105.19 99.98 1x5l n GLY 4 Ca -0.05 0.89 -0.05 0.00 0.00 0.00 0.00 46.02 46.81 1x5l n GLY 4 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1x5l h SER 5 N 0.00 -1.50 -4.01 1.61 4.64 -2.09 -3.40 113.55 108.81 1x5l h SER 5 Ca 0.00 0.28 -0.54 0.00 -0.47 0.00 0.00 61.79 61.06 1x5l h SER 5 Cb 0.00 0.73 0.11 0.00 -0.31 0.00 0.00 62.40 62.93 1x5l h SER 5 CO 0.00 -0.30 0.60 -0.55 -0.87 0.00 0.00 176.83 175.71 1x5l s SER 6 N -5.29 5.72 0.00 4.97 0.15 -1.26 -4.97 113.70 113.02 1x5l s SER 6 Ca -0.14 2.68 0.00 0.00 0.70 0.00 0.00 55.95 59.19 1x5l s SER 6 Cb 0.16 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 61.84 1x5l s SER 6 CO 0.68 -1.26 0.00 0.61 1.20 0.00 0.00 173.24 174.48 1x5l n GLY 7 N 0.63 2.24 2.93 9.45 0.00 -1.26 -5.17 105.19 114.01 1x5l n GLY 7 Ca 0.08 -0.52 -0.15 0.00 0.00 0.00 0.00 46.02 45.42 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 1.53 0.34 0.86 1.61 -1.52 -1.26 -5.15 119.66 116.07 1x5l s GLN 8 Ca 0.00 -0.13 -0.11 0.00 -1.95 0.00 0.00 55.36 53.17 1x5l s GLN 8 Cb 0.00 -0.34 0.11 0.00 -0.22 0.00 0.00 33.01 32.55 1x5l s GLN 8 CO 0.00 0.07 1.10 0.00 -0.25 0.00 0.00 175.29 176.20 1x5l s ALA 9 N 0.01 1.75 0.40 6.09 0.00 -1.26 -4.83 121.76 123.92 1x5l s ALA 9 Ca 0.00 0.18 -0.22 0.00 0.00 0.00 0.00 51.96 51.91 1x5l s ALA 9 Cb -0.03 -3.27 -0.11 0.00 0.00 0.00 0.00 23.12 19.72 1x5l s ALA 9 CO -0.00 -2.23 0.95 0.00 0.00 0.00 0.00 175.76 174.47 1x5l s ALA 10 N -2.86 3.09 0.99 0.00 0.00 -1.26 -4.85 121.76 116.87 1x5l s ALA 10 Ca 0.63 0.43 -0.12 0.00 0.00 0.00 0.00 51.96 52.90 1x5l s ALA 10 Cb -0.19 -3.16 0.18 0.00 0.00 0.00 0.00 23.12 19.96 1x5l s ALA 10 CO 0.57 0.14 1.09 -1.25 0.00 0.00 0.00 175.76 176.32 1x5l s PRO 11 N -2.86 0.51 1.18 0.00 0.04 -1.26 -4.84 135.00 127.78 1x5l s PRO 11 Ca 0.59 0.56 -0.19 0.00 0.04 0.00 0.00 61.00 62.00 1x5l s PRO 11 Cb -0.12 -1.74 0.28 0.00 0.04 0.00 0.00 34.50 32.96 1x5l s PRO 11 CO 0.16 -2.69 1.13 0.45 0.04 0.00 0.00 177.00 176.09 1x5l s SER 12 N -3.44 1.13 -0.26 6.66 0.15 -0.46 -4.75 113.70 112.72 1x5l s SER 12 Ca 0.65 0.61 -0.05 0.00 0.70 0.00 0.00 55.95 57.86 1x5l s SER 12 Cb -0.19 -0.85 -0.00 0.00 -1.71 0.00 0.00 66.02 63.27 1x5l s SER 12 CO 0.58 -3.99 0.02 -1.58 1.20 0.00 0.00 173.24 169.47 1x5l s GLN 13 N -5.44 3.28 -0.16 5.44 0.74 -1.26 -4.73 119.66 117.53 1x5l s GLN 13 Ca 0.71 -0.71 -0.29 0.00 0.05 0.00 0.00 55.36 55.12 1x5l s GLN 13 Cb -0.09 -3.21 -0.05 0.00 1.10 0.00 0.00 33.01 30.76 1x5l s GLN 13 CO 0.56 -0.31 2.04 0.08 -0.55 0.00 0.00 175.29 177.11 1x5l s VAL 14 N 1.50 3.15 -0.41 1.34 1.01 -1.26 -4.83 120.40 120.90 1x5l s VAL 14 Ca 0.04 0.16 0.15 0.00 0.00 0.00 0.00 61.98 62.33 1x5l s VAL 14 Cb -0.16 -3.16 0.47 0.00 0.00 0.00 0.00 36.38 33.53 1x5l s VAL 14 CO 0.00 -0.08 1.38 1.33 0.00 0.00 0.00 175.10 177.73 1x5l n VAL 15 N 6.96 1.92 -4.03 2.92 0.24 -1.26 -4.31 118.33 120.76 1x5l n VAL 15 Ca 0.25 -1.61 -0.31 0.00 -2.04 0.00 0.00 64.34 60.63 1x5l n VAL 15 Cb 0.44 -0.03 -0.15 0.00 -1.47 0.00 0.00 33.84 32.63 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 -2.28 2.15 -0.03 3.34 1.01 -1.26 -4.98 120.40 118.35 1x5l s VAL 16 Ca 0.37 -1.93 -0.01 0.00 0.00 0.00 0.00 61.98 60.40 1x5l s VAL 16 Cb 0.28 -2.42 0.02 0.00 0.00 0.00 0.00 36.38 34.26 1x5l s VAL 16 CO 0.11 -0.31 0.06 -0.63 0.00 0.00 0.00 175.10 174.32 1x5l s ILE 17 N 1.04 -0.04 0.02 2.22 1.01 -1.25 -3.66 121.20 120.55 1x5l s ILE 17 Ca 0.01 0.15 -0.02 0.00 0.00 0.00 0.00 60.65 60.78 1x5l s ILE 17 Cb -0.19 -0.11 -0.02 0.00 0.01 0.00 0.00 42.46 42.15 1x5l s ILE 17 CO -0.07 0.06 0.01 -0.13 0.00 0.00 0.00 174.94 174.81 1x5l s ARG 18 N 0.78 0.41 -0.29 2.79 0.52 0.25 -4.93 118.95 118.49 1x5l s ARG 18 Ca -0.06 -0.67 -0.11 0.00 -0.52 0.00 0.00 55.73 54.37 1x5l s ARG 18 Cb -0.09 0.15 -0.04 0.00 0.52 0.00 0.00 34.95 35.49 1x5l s ARG 18 CO -0.03 -0.08 0.19 -1.14 0.02 0.00 0.00 175.30 174.26 1x5l s GLN 19 N -1.90 3.85 -0.08 3.54 -0.44 -1.26 0.19 119.66 123.55 1x5l s GLN 19 Ca -0.12 -0.39 -0.18 0.00 -2.50 0.00 0.00 55.36 52.18 1x5l s GLN 19 Cb -0.06 -3.66 -0.14 0.00 -1.64 0.00 0.00 33.01 27.51 1x5l s GLN 19 CO -0.02 -0.23 0.64 0.93 0.50 0.00 0.00 175.29 177.11 1x5l h GLU 20 N 8.38 -0.12 -2.86 1.67 4.39 -1.87 -3.48 114.58 120.69 1x5l h GLU 20 Ca -0.35 0.01 -0.14 0.00 0.34 0.00 0.00 59.36 59.22 1x5l h GLU 20 Cb 1.18 0.03 -0.25 0.00 -0.10 0.00 0.00 28.75 29.61 1x5l h GLU 20 CO 0.57 0.33 -0.32 1.03 -1.16 0.00 0.00 179.01 179.46 1x5l s ARG 21 N -2.70 0.39 -0.43 2.33 0.52 -1.26 -5.02 118.95 112.77 1x5l s ARG 21 Ca -0.11 0.54 -0.07 0.00 -0.52 0.00 0.00 55.73 55.57 1x5l s ARG 21 Cb -0.00 0.13 0.10 0.00 0.52 0.00 0.00 34.95 35.69 1x5l s ARG 21 CO 0.41 -0.08 0.26 0.00 0.02 0.00 0.00 175.30 175.91 1x5l s ALA 22 N 0.51 3.26 1.00 2.13 0.00 -1.26 -1.14 121.76 126.26 1x5l s ALA 22 Ca -0.03 -2.37 -0.03 0.00 0.00 0.00 0.00 51.96 49.53 1x5l s ALA 22 Cb -0.04 -2.61 0.04 0.00 0.00 0.00 0.00 23.12 20.51 1x5l s ALA 22 CO -0.03 -1.76 0.25 0.41 0.00 0.00 0.00 175.76 174.63 1x5l n GLY 23 N 4.81 -1.22 0.22 0.00 0.00 0.35 -4.49 105.19 104.85 1x5l n GLY 23 Ca -0.07 -1.67 -0.12 0.00 0.00 0.00 0.00 46.02 44.16 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 -0.45 -0.07 1.61 4.15 -1.94 -2.82 115.11 115.59 1x5l h GLN 24 Ca -0.08 0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.37 1x5l h GLN 24 Cb 0.22 0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.02 1x5l h GLN 24 CO 0.06 -0.14 0.00 0.25 -1.93 0.00 0.00 178.83 177.07 1x5l n THR 25 N -5.12 1.60 -3.86 2.39 -2.24 -1.26 -3.73 114.28 102.06 1x5l n THR 25 Ca -0.09 -1.72 -0.11 0.00 -2.27 0.00 0.00 64.05 59.86 1x5l n THR 25 Cb 0.27 0.05 -0.10 0.00 -2.10 0.00 0.00 70.33 68.45 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 -2.00 0.01 -0.01 3.42 1.04 -1.26 -1.42 113.70 113.48 1x5l s SER 26 Ca 0.23 -0.19 -0.04 0.00 0.48 0.00 0.00 55.95 56.43 1x5l s SER 26 Cb 0.19 0.22 -0.00 0.00 0.10 0.00 0.00 66.02 66.53 1x5l s SER 26 CO 0.04 -0.39 0.08 -0.69 0.98 0.00 0.00 173.24 173.27 1x5l s VAL 27 N -1.42 0.06 0.18 5.02 1.01 -0.64 0.13 120.40 124.74 1x5l s VAL 27 Ca -0.14 -0.47 0.04 0.00 0.00 0.00 0.00 61.98 61.41 1x5l s VAL 27 Cb -0.07 -0.28 -0.04 0.00 0.00 0.00 0.00 36.38 35.99 1x5l s VAL 27 CO 0.02 -0.26 0.21 -0.55 0.00 0.00 0.00 175.10 174.52 1x5l s SER 28 N -0.83 5.85 0.06 3.32 0.15 -0.29 -0.46 113.70 121.50 1x5l s SER 28 Ca -0.09 -0.03 0.02 0.00 0.70 0.00 0.00 55.95 56.55 1x5l s SER 28 Cb -0.05 -1.62 -0.03 0.00 -1.71 0.00 0.00 66.02 62.61 1x5l s SER 28 CO 0.00 0.04 -0.08 -0.76 1.20 0.00 0.00 173.24 173.64 1x5l s LEU 29 N -3.31 2.35 -0.06 3.45 1.43 -0.49 -3.55 118.68 118.50 1x5l s LEU 29 Ca 0.33 -0.72 -0.02 0.00 -1.03 0.00 0.00 54.13 52.69 1x5l s LEU 29 Cb -0.10 -0.16 0.03 0.00 0.03 0.00 0.00 46.19 45.99 1x5l s LEU 29 CO 0.26 -0.29 0.03 -0.76 0.23 0.00 0.00 176.35 175.82 1x5l s LEU 30 N -2.11 0.43 -0.06 1.79 1.43 0.49 -3.68 118.68 116.97 1x5l s LEU 30 Ca -0.02 -0.01 -0.07 0.00 -1.03 0.00 0.00 54.13 53.00 1x5l s LEU 30 Cb -0.05 -0.31 0.02 0.00 0.03 0.00 0.00 46.19 45.88 1x5l s LEU 30 CO -0.01 -0.21 0.19 -1.66 0.23 0.00 0.00 176.35 174.88 1x5l s TRP 31 N 2.01 -0.19 0.64 0.29 -2.14 -1.20 0.84 118.94 119.19 1x5l s TRP 31 Ca 0.04 0.46 0.00 0.00 2.66 0.00 0.00 56.10 59.26 1x5l s TRP 31 Cb -0.12 0.06 0.08 0.00 -3.10 0.00 0.00 33.47 30.39 1x5l s TRP 31 CO -0.04 -0.12 0.89 1.14 -2.66 0.00 0.00 176.95 176.16 1x5l s GLN 32 N -0.04 2.12 0.53 3.25 -2.07 -1.24 -4.74 119.66 117.47 1x5l s GLN 32 Ca -0.01 -0.93 -0.21 0.00 -1.82 0.00 0.00 55.36 52.39 1x5l s GLN 32 Cb -0.02 -2.40 -0.05 0.00 -1.09 0.00 0.00 33.01 29.44 1x5l s GLN 32 CO 0.00 -1.08 1.20 -1.21 -1.32 0.00 0.00 175.29 172.89 1x5l s GLU 33 N -4.96 3.33 0.36 9.60 2.02 -1.26 -4.88 118.70 122.92 1x5l s GLU 33 Ca 0.62 1.83 -0.27 0.00 0.02 0.00 0.00 54.97 57.17 1x5l s GLU 33 Cb -0.08 -2.15 -0.09 0.00 0.10 0.00 0.00 34.13 31.91 1x5l s GLU 33 CO 0.41 -0.92 1.21 -1.25 0.02 0.00 0.00 175.26 174.74 1x5l s PRO 34 N -3.05 4.24 0.06 0.39 0.04 -1.26 -4.94 135.00 130.48 1x5l s PRO 34 Ca 0.71 1.97 -0.11 0.00 0.04 0.00 0.00 61.00 63.61 1x5l s PRO 34 Cb -0.30 -2.89 -0.03 0.00 0.04 0.00 0.00 34.50 31.32 1x5l s PRO 34 CO 0.35 -0.20 1.01 0.39 0.04 0.00 0.00 177.00 178.59 1x5l n GLU 35 N 0.49 -0.16 -3.83 4.56 1.02 -1.26 -3.90 120.64 117.56 1x5l n GLU 35 Ca 0.02 1.00 -0.30 0.00 -0.02 0.00 0.00 57.16 57.86 1x5l n GLU 35 Cb 0.44 -1.48 -0.15 0.00 -0.02 0.00 0.00 31.44 30.23 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 -4.06 1.03 0.52 3.49 -0.21 -1.26 -4.98 119.66 114.20 1x5l s GLN 36 Ca -0.04 -1.19 0.31 0.00 0.02 0.00 0.00 55.36 54.45 1x5l s GLN 36 Cb 0.04 -2.37 1.27 0.00 1.00 0.00 0.00 33.01 32.95 1x5l s GLN 36 CO 0.22 -0.88 1.96 -1.00 -2.12 0.00 0.00 175.29 173.46 1x5l h PRO 37 N 7.97 0.00 -6.03 2.91 0.13 -1.95 -1.23 132.00 133.81 1x5l h PRO 37 Ca -0.12 0.00 -0.43 0.00 -0.87 0.00 0.00 66.00 64.58 1x5l h PRO 37 Cb 1.03 0.00 0.07 0.00 0.13 0.00 0.00 31.00 32.23 1x5l h PRO 37 CO 0.46 0.08 -0.72 0.09 -0.23 0.00 0.00 178.00 177.68 1x5l n ASN 38 N -3.23 -5.48 0.00 1.44 3.02 -1.26 -4.01 115.26 105.74 1x5l n ASN 38 Ca 0.00 -0.65 0.00 0.00 -0.03 0.00 0.00 54.58 53.91 1x5l n ASN 38 Cb 0.33 -4.56 0.00 0.00 -0.61 0.00 0.00 39.78 34.94 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 -1.85 0.64 3.57 7.41 0.00 -1.26 -4.80 105.19 108.90 1x5l n GLY 39 Ca 0.00 -1.50 -0.32 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 -4.00 3.53 -0.26 -0.61 -1.09 -1.26 -5.11 121.20 112.40 1x5l s ILE 40 Ca 0.00 -0.75 -0.07 0.00 -2.23 0.00 0.00 60.65 57.60 1x5l s ILE 40 Cb 0.00 -2.50 -0.02 0.00 -1.58 0.00 0.00 42.46 38.36 1x5l s ILE 40 CO 0.00 0.45 0.06 -0.63 -1.23 0.00 0.00 174.94 173.59 1x5l s ILE 41 N -0.93 4.16 0.01 2.92 1.01 -1.26 -4.39 121.20 122.71 1x5l s ILE 41 Ca 0.15 -0.31 -0.25 0.00 0.00 0.00 0.00 60.65 60.25 1x5l s ILE 41 Cb -0.11 -2.98 -0.19 0.00 0.01 0.00 0.00 42.46 39.19 1x5l s ILE 41 CO 0.06 0.29 1.40 -0.07 0.00 0.00 0.00 174.94 176.62 1x5l h LEU 42 N 8.23 -0.01 -7.00 2.97 3.38 -1.85 -3.47 115.31 117.55 1x5l h LEU 42 Ca -0.37 -0.34 0.01 0.00 0.09 0.00 0.00 57.88 57.27 1x5l h LEU 42 Cb 1.16 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.75 1x5l h LEU 42 CO 0.59 0.33 0.31 -1.83 0.09 0.00 0.00 178.44 177.93 1x5l s GLU 43 N -4.82 1.01 -0.40 1.13 -1.05 -1.26 -4.86 118.70 108.45 1x5l s GLU 43 Ca -0.15 -0.10 -0.17 0.00 -0.15 0.00 0.00 54.97 54.40 1x5l s GLU 43 Cb 0.03 0.47 0.01 0.00 -0.44 0.00 0.00 34.13 34.20 1x5l s GLU 43 CO 0.67 -0.39 0.44 0.71 0.95 0.00 0.00 175.26 177.64 1x5l s TYR 44 N -2.36 3.17 0.06 4.83 2.02 0.85 -3.12 117.35 122.81 1x5l s TYR 44 Ca -0.03 -0.24 -0.30 0.00 -0.37 0.00 0.00 57.07 56.13 1x5l s TYR 44 Cb -0.01 -2.87 -0.05 0.00 -0.40 0.00 0.00 41.96 38.63 1x5l s TYR 44 CO -0.02 -0.64 1.08 -1.21 -1.57 0.00 0.00 175.55 173.18 1x5l s GLU 45 N 2.17 4.54 -0.16 -0.62 8.01 -0.32 -1.81 118.70 130.50 1x5l s GLU 45 Ca 0.13 1.60 0.01 0.00 0.01 0.00 0.00 54.97 56.71 1x5l s GLU 45 Cb -0.17 -3.38 0.00 0.00 -4.31 0.00 0.00 34.13 26.28 1x5l s GLU 45 CO 0.13 -0.07 -0.16 0.42 0.01 0.00 0.00 175.26 175.59 1x5l s ILE 46 N 0.70 2.54 -0.30 -1.63 1.01 0.71 -1.05 121.20 123.19 1x5l s ILE 46 Ca 0.53 -0.81 -0.11 0.00 0.00 0.00 0.00 60.65 60.27 1x5l s ILE 46 Cb -0.26 -2.07 -0.03 0.00 0.01 0.00 0.00 42.46 40.11 1x5l s ILE 46 CO 0.30 0.52 0.18 -0.75 0.00 0.00 0.00 174.94 175.19 1x5l s LYS 47 N 0.88 3.72 -0.11 2.79 2.20 0.63 -0.71 119.74 129.13 1x5l s LYS 47 Ca -0.04 -0.48 0.00 0.00 -0.36 0.00 0.00 55.97 55.10 1x5l s LYS 47 Cb -0.15 -3.64 0.02 0.00 -1.51 0.00 0.00 37.83 32.55 1x5l s LYS 47 CO -0.01 -0.28 -0.11 1.52 -0.36 0.00 0.00 175.35 176.11 1x5l s TYR 48 N 1.71 1.67 0.07 4.03 1.13 -0.76 -0.35 117.35 124.86 1x5l s TYR 48 Ca 0.06 -0.82 0.01 0.00 -1.41 0.00 0.00 57.07 54.91 1x5l s TYR 48 Cb -0.16 -1.30 -0.04 0.00 -1.10 0.00 0.00 41.96 39.36 1x5l s TYR 48 CO 0.09 -0.50 -0.06 1.52 -2.51 0.00 0.00 175.55 174.10 1x5l s TYR 49 N 1.41 0.73 -0.50 -3.49 -0.85 -1.00 -2.42 117.35 111.23 1x5l s TYR 49 Ca 0.00 -0.89 -0.28 0.00 -0.52 0.00 0.00 57.07 55.39 1x5l s TYR 49 Cb -0.13 -0.45 -0.01 0.00 0.38 0.00 0.00 41.96 41.75 1x5l s TYR 49 CO -0.06 -0.21 1.70 -1.21 -1.52 0.00 0.00 175.55 174.25 1x5l s GLU 50 N -3.46 3.07 0.22 -3.49 2.02 -1.26 -1.12 118.70 114.68 1x5l s GLU 50 Ca 0.06 0.83 0.07 0.00 0.02 0.00 0.00 54.97 55.96 1x5l s GLU 50 Cb 0.03 -4.24 0.67 0.00 0.10 0.00 0.00 34.13 30.70 1x5l s GLU 50 CO -0.05 -2.19 1.02 1.17 0.02 0.00 0.00 175.26 175.23 1x5l n LYS 51 N 8.75 -0.05 -0.00 1.61 3.00 -0.32 0.25 118.16 131.41 1x5l n LYS 51 Ca 0.19 0.94 -0.17 0.00 -0.00 0.00 0.00 58.31 59.26 1x5l n LYS 51 Cb 0.49 -1.57 -0.10 0.00 0.00 0.00 0.00 35.03 33.85 1x5l n LYS 51 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.40 177.62 1x5l h ASP 52 N 0.00 0.65 -0.37 3.14 1.82 -1.89 -3.17 116.42 116.59 1x5l h ASP 52 Ca 0.47 -0.71 0.00 0.00 -0.39 0.00 0.00 57.03 56.40 1x5l h ASP 52 Cb 1.11 -0.20 0.00 0.00 0.68 0.00 0.00 39.33 40.93 1x5l h ASP 52 CO -0.56 1.26 0.00 0.29 -1.61 0.00 0.00 179.24 178.62 1x5l n LYS 53 N -4.15 3.12 -0.33 0.28 4.76 0.71 -4.51 118.16 118.04 1x5l n LYS 53 Ca -0.09 -1.87 0.15 0.00 -2.87 0.00 0.00 58.31 53.62 1x5l n LYS 53 Cb 0.69 -1.85 0.30 0.00 -1.84 0.00 0.00 35.03 32.33 1x5l n LYS 53 CO 0.00 0.00 0.00 1.49 -1.37 0.00 0.00 177.40 177.52 1x5l h GLU 54 N 2.49 0.04 0.00 1.97 4.81 0.33 1.84 114.58 126.07 1x5l h GLU 54 Ca 0.00 -0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.16 1x5l h GLU 54 Cb 1.25 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.61 1x5l h GLU 54 CO 0.24 0.03 -0.34 0.00 -0.73 0.00 0.00 179.01 178.20 1x5l h MET 55 N 0.04 0.00 0.21 1.92 -0.00 -1.84 -3.33 114.93 111.92 1x5l h MET 55 Ca 0.59 0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 60.28 1x5l h MET 55 Cb 1.24 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 32.83 1x5l h MET 55 CO -0.86 0.34 -0.15 0.37 -0.00 0.00 0.00 176.91 176.62 1x5l h GLN 56 N 0.00 -0.33 -2.32 -0.10 5.75 0.26 -3.47 115.11 114.89 1x5l h GLN 56 Ca -0.00 0.02 0.10 0.00 -0.15 0.00 0.00 58.65 58.61 1x5l h GLN 56 Cb 1.00 0.07 -0.15 0.00 1.07 0.00 0.00 27.48 29.48 1x5l h GLN 56 CO 0.04 -0.22 0.47 0.45 -2.65 0.00 0.00 178.83 176.92 1x5l s SER 57 N -2.77 -0.39 -0.03 -0.69 0.15 -1.03 -5.15 113.70 103.79 1x5l s SER 57 Ca -0.06 0.02 0.05 0.00 0.70 0.00 0.00 55.95 56.66 1x5l s SER 57 Cb 0.01 0.40 -0.01 0.00 -1.71 0.00 0.00 66.02 64.72 1x5l s SER 57 CO 0.18 -0.64 -0.18 -0.72 1.20 0.00 0.00 173.24 173.07 1x5l s TYR 58 N -3.11 1.72 0.11 3.44 -0.85 -1.26 -4.49 117.35 112.90 1x5l s TYR 58 Ca 0.04 -0.43 0.03 0.00 -0.52 0.00 0.00 57.07 56.19 1x5l s TYR 58 Cb -0.01 -1.14 -0.04 0.00 0.38 0.00 0.00 41.96 41.15 1x5l s TYR 58 CO -0.09 -0.11 0.14 -1.12 -1.52 0.00 0.00 175.55 172.85 1x5l s SER 59 N -0.15 5.78 0.07 -0.18 0.01 -1.02 -5.00 113.70 113.22 1x5l s SER 59 Ca 0.00 0.03 0.09 0.00 1.31 0.00 0.00 55.95 57.39 1x5l s SER 59 Cb -0.10 -1.61 -0.03 0.00 0.21 0.00 0.00 66.02 64.49 1x5l s SER 59 CO 0.01 0.13 -0.25 -0.89 0.41 0.00 0.00 173.24 172.65 1x5l s THR 60 N -1.56 2.01 0.04 1.44 2.01 -1.26 -1.83 115.64 116.49 1x5l s THR 60 Ca 0.31 -1.44 0.02 0.00 0.31 0.00 0.00 61.69 60.89 1x5l s THR 60 Cb -0.12 -1.75 -0.02 0.00 0.01 0.00 0.00 72.50 70.62 1x5l s THR 60 CO 0.24 0.22 -0.07 -0.22 -0.69 0.00 0.00 174.62 174.11 1x5l s LEU 61 N -1.47 2.26 -0.12 4.42 2.96 0.11 -4.96 118.68 121.88 1x5l s LEU 61 Ca 0.11 -0.56 -0.02 0.00 -0.22 0.00 0.00 54.13 53.44 1x5l s LEU 61 Cb -0.10 -0.12 -0.03 0.00 0.50 0.00 0.00 46.19 46.44 1x5l s LEU 61 CO 0.03 -0.23 -0.06 -0.54 -1.32 0.00 0.00 176.35 174.24 1x5l s LYS 62 N -1.63 3.34 -0.04 1.98 3.01 -1.26 -0.20 119.74 124.93 1x5l s LYS 62 Ca -0.10 -0.55 0.03 0.00 -1.01 0.00 0.00 55.97 54.34 1x5l s LYS 62 Cb -0.10 -2.77 0.01 0.00 -1.01 0.00 0.00 37.83 33.96 1x5l s LYS 62 CO 0.00 0.38 -0.11 0.00 0.51 0.00 0.00 175.35 176.13 1x5l s ALA 63 N -0.03 1.05 -0.09 5.17 0.00 -0.75 -4.97 121.76 122.15 1x5l s ALA 63 Ca 0.00 -0.39 0.09 0.00 0.00 0.00 0.00 51.96 51.66 1x5l s ALA 63 Cb -0.13 -0.42 -0.24 0.00 0.00 0.00 0.00 23.12 22.33 1x5l s ALA 63 CO 0.03 0.15 0.48 1.33 0.00 0.00 0.00 175.76 177.74 1x5l n VAL 64 N 3.45 1.61 -3.05 0.00 0.24 -1.26 -0.10 118.33 119.22 1x5l n VAL 64 Ca -0.20 -0.77 -0.18 0.00 -2.04 0.00 0.00 64.34 61.16 1x5l n VAL 64 Cb 0.53 -1.12 0.02 0.00 -1.47 0.00 0.00 33.84 31.80 1x5l n VAL 64 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 1x5l s THR 65 N -2.57 2.76 -1.64 3.34 -1.32 -1.26 -4.86 115.64 110.09 1x5l s THR 65 Ca -0.11 -1.02 0.00 0.00 -1.21 0.00 0.00 61.69 59.36 1x5l s THR 65 Cb 0.07 -2.78 0.01 0.00 -1.51 0.00 0.00 72.50 68.30 1x5l s THR 65 CO 0.80 0.00 0.84 0.35 -2.21 0.00 0.00 174.62 174.40 1x5l n THR 66 N -1.93 0.03 -3.64 5.08 -2.24 -1.26 -4.63 114.28 105.68 1x5l n THR 66 Ca 0.10 -0.02 -0.18 0.00 -2.27 0.00 0.00 64.05 61.68 1x5l n THR 66 Cb 0.60 -0.17 -0.16 0.00 -2.10 0.00 0.00 70.33 68.50 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 -1.65 0.04 0.11 -0.78 0.52 -1.26 -3.21 118.95 112.72 1x5l s ARG 67 Ca 0.01 0.46 0.03 0.00 -0.52 0.00 0.00 55.73 55.71 1x5l s ARG 67 Cb 0.01 -0.52 -0.04 0.00 0.52 0.00 0.00 34.95 34.92 1x5l s ARG 67 CO 0.00 -0.38 -0.09 0.00 0.02 0.00 0.00 175.30 174.86 1x5l s ALA 68 N 2.27 1.18 -0.27 2.13 0.00 -1.24 -4.95 121.76 120.88 1x5l s ALA 68 Ca 0.04 -1.34 -0.00 0.00 0.00 0.00 0.00 51.96 50.66 1x5l s ALA 68 Cb -0.13 0.08 0.08 0.00 0.00 0.00 0.00 23.12 23.15 1x5l s ALA 68 CO -0.06 -0.12 0.04 0.99 0.00 0.00 0.00 175.76 176.60 1x5l s THR 69 N -3.12 1.19 -0.01 0.00 2.01 -1.26 -1.40 115.64 113.06 1x5l s THR 69 Ca 0.11 -1.34 -0.30 0.00 0.31 0.00 0.00 61.69 60.48 1x5l s THR 69 Cb 0.02 -1.73 -0.07 0.00 0.01 0.00 0.00 72.50 70.72 1x5l s THR 69 CO -0.01 -0.42 1.77 -0.69 -0.69 0.00 0.00 174.62 174.57 1x5l s VAL 70 N 1.50 3.31 0.26 3.82 1.01 0.39 -4.81 120.40 125.88 1x5l s VAL 70 Ca 0.04 0.43 0.10 0.00 0.00 0.00 0.00 61.98 62.54 1x5l s VAL 70 Cb -0.18 -3.28 -0.04 0.00 0.00 0.00 0.00 36.38 32.88 1x5l s VAL 70 CO -0.15 -0.03 -0.04 -0.94 0.00 0.00 0.00 175.10 173.94 1x5l s SER 71 N 3.62 4.40 0.00 3.32 1.04 -1.26 -1.62 113.70 123.20 1x5l s SER 71 Ca 0.79 -0.68 0.00 0.00 0.48 0.00 0.00 55.95 56.54 1x5l s SER 71 Cb -0.37 -0.77 0.00 0.00 0.10 0.00 0.00 66.02 64.98 1x5l s SER 71 CO 0.34 0.02 0.00 0.61 0.98 0.00 0.00 173.24 175.19 1x5l n GLY 72 N -0.74 0.75 3.80 7.32 0.00 -1.10 -5.02 105.19 110.21 1x5l n GLY 72 Ca -0.07 -0.40 -0.26 0.00 0.00 0.00 0.00 46.02 45.29 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 -0.97 2.91 -0.03 0.99 1.43 -0.50 -5.07 118.68 117.44 1x5l s LEU 73 Ca 0.00 -1.18 0.01 0.00 -1.03 0.00 0.00 54.13 51.93 1x5l s LEU 73 Cb 0.00 -1.32 -0.03 0.00 0.03 0.00 0.00 46.19 44.87 1x5l s LEU 73 CO 0.00 -0.76 -0.02 -0.54 0.23 0.00 0.00 176.35 175.27 1x5l s LYS 74 N -4.03 2.80 0.81 1.70 1.02 -1.26 -4.56 119.74 116.22 1x5l s LYS 74 Ca 0.35 -0.57 -0.11 0.00 0.02 0.00 0.00 55.97 55.66 1x5l s LYS 74 Cb 0.01 -2.66 0.08 0.00 -0.52 0.00 0.00 37.83 34.74 1x5l s LYS 74 CO 0.20 0.65 1.09 -1.25 -0.92 0.00 0.00 175.35 175.12 1x5l s PRO 75 N -1.27 1.95 -1.38 -1.68 0.04 -1.24 -3.93 135.00 127.49 1x5l s PRO 75 Ca 0.17 1.07 -0.10 0.00 0.04 0.00 0.00 61.00 62.18 1x5l s PRO 75 Cb -0.11 -1.87 0.01 0.00 0.04 0.00 0.00 34.50 32.57 1x5l s PRO 75 CO 0.07 -1.83 0.39 0.41 0.04 0.00 0.00 177.00 176.08 1x5l n GLY 76 N -1.17 -0.42 3.41 0.56 0.00 -1.19 -4.76 105.19 101.62 1x5l n GLY 76 Ca 0.08 0.24 -0.06 0.00 0.00 0.00 0.00 46.02 46.28 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 -3.94 -0.76 0.46 2.61 2.01 -1.25 -4.99 115.64 109.77 1x5l s THR 77 Ca 0.16 0.10 -0.25 0.00 0.31 0.00 0.00 61.69 62.01 1x5l s THR 77 Cb -0.08 -0.79 -0.08 0.00 0.01 0.00 0.00 72.50 71.56 1x5l s THR 77 CO 0.93 0.04 1.44 -0.13 -0.69 0.00 0.00 174.62 176.22 1x5l s ARG 78 N 2.68 3.64 0.00 4.92 0.52 -1.26 -3.91 118.95 125.54 1x5l s ARG 78 Ca -0.04 2.45 0.02 0.00 -0.52 0.00 0.00 55.73 57.65 1x5l s ARG 78 Cb -0.12 -2.64 -0.01 0.00 0.52 0.00 0.00 34.95 32.70 1x5l s ARG 78 CO -0.15 -0.86 -0.08 0.71 0.02 0.00 0.00 175.30 174.94 1x5l s TYR 79 N -1.20 0.69 -0.28 -0.53 2.02 0.09 -1.17 117.35 116.97 1x5l s TYR 79 Ca 0.62 -0.17 -0.05 0.00 -0.37 0.00 0.00 57.07 57.10 1x5l s TYR 79 Cb -0.44 -0.44 0.02 0.00 -0.40 0.00 0.00 41.96 40.70 1x5l s TYR 79 CO 0.57 -0.01 0.03 0.08 -1.57 0.00 0.00 175.55 174.64 1x5l s VAL 80 N -0.31 3.52 0.10 0.71 1.01 -0.27 -1.70 120.40 123.46 1x5l s VAL 80 Ca 0.02 -0.85 0.00 0.00 0.00 0.00 0.00 61.98 61.14 1x5l s VAL 80 Cb -0.04 -2.82 -0.04 0.00 0.00 0.00 0.00 36.38 33.48 1x5l s VAL 80 CO -0.00 0.11 0.26 -0.36 0.00 0.00 0.00 175.10 175.10 1x5l s PHE 81 N 1.42 3.50 -0.27 5.22 0.40 -1.20 -2.36 117.98 124.70 1x5l s PHE 81 Ca 0.01 0.25 -0.01 0.00 -0.60 0.00 0.00 56.93 56.59 1x5l s PHE 81 Cb -0.17 -1.77 0.15 0.00 0.51 0.00 0.00 43.02 41.74 1x5l s PHE 81 CO -0.00 0.54 0.41 -0.65 0.70 0.00 0.00 175.22 176.23 1x5l s GLN 82 N -2.75 0.40 0.24 0.44 -0.21 0.53 -2.84 119.66 115.47 1x5l s GLN 82 Ca 0.36 0.42 -0.12 0.00 0.02 0.00 0.00 55.36 56.04 1x5l s GLN 82 Cb -0.12 -0.31 -0.08 0.00 1.00 0.00 0.00 33.01 33.51 1x5l s GLN 82 CO 0.28 -0.80 0.60 0.08 -2.12 0.00 0.00 175.29 173.33 1x5l s VAL 83 N 2.58 4.85 0.05 1.09 1.01 -1.26 -0.27 120.40 128.45 1x5l s VAL 83 Ca 0.12 0.66 -0.22 0.00 0.00 0.00 0.00 61.98 62.54 1x5l s VAL 83 Cb -0.14 -3.64 0.05 0.00 0.00 0.00 0.00 36.38 32.65 1x5l s VAL 83 CO -0.22 -0.05 0.51 0.00 0.00 0.00 0.00 175.10 175.35 1x5l s ARG 84 N -2.72 1.04 -0.06 2.72 1.70 -0.21 -2.76 118.95 118.65 1x5l s ARG 84 Ca 0.48 -0.26 -0.06 0.00 -0.47 0.00 0.00 55.73 55.42 1x5l s ARG 84 Cb -0.12 0.47 -0.04 0.00 -0.57 0.00 0.00 34.95 34.69 1x5l s ARG 84 CO 0.20 -0.38 0.18 0.00 -1.08 0.00 0.00 175.30 174.23 1x5l s ALA 85 N -2.51 3.89 -0.04 7.88 0.00 -1.26 -1.18 121.76 128.55 1x5l s ALA 85 Ca -0.05 -0.65 0.04 0.00 0.00 0.00 0.00 51.96 51.31 1x5l s ALA 85 Cb -0.01 -1.98 -0.00 0.00 0.00 0.00 0.00 23.12 21.13 1x5l s ALA 85 CO -0.02 0.65 -0.17 0.50 0.00 0.00 0.00 175.76 176.73 1x5l s ARG 86 N -1.40 1.67 0.10 0.00 6.06 -1.18 -2.48 118.95 121.72 1x5l s ARG 86 Ca 0.21 -0.59 0.07 0.00 -2.50 0.00 0.00 55.73 52.91 1x5l s ARG 86 Cb -0.13 -1.48 -0.03 0.00 0.06 0.00 0.00 34.95 33.37 1x5l s ARG 86 CO 0.10 0.25 -0.17 0.95 -2.50 0.00 0.00 175.30 173.94 1x5l s THR 87 N -0.01 1.41 0.42 4.11 -4.23 -0.22 -2.32 115.64 114.79 1x5l s THR 87 Ca -0.02 -1.51 0.26 0.00 -1.18 0.00 0.00 61.69 59.24 1x5l s THR 87 Cb -0.11 -1.38 0.44 0.00 1.34 0.00 0.00 72.50 72.80 1x5l s THR 87 CO 0.02 -0.21 1.64 0.77 -0.54 0.00 0.00 174.62 176.30 1x5l h SER 88 N 4.00 0.30 0.55 3.99 4.64 -2.00 -0.68 113.55 124.37 1x5l h SER 88 Ca -0.43 0.15 -0.03 0.00 -0.47 0.00 0.00 61.79 61.01 1x5l h SER 88 Cb 1.19 0.13 0.01 0.00 -0.31 0.00 0.00 62.40 63.41 1x5l h SER 88 CO 0.43 -0.17 -0.27 0.00 -0.87 0.00 0.00 176.83 175.95 1x5l h ALA 89 N 1.67 -1.01 -2.84 5.18 0.00 -1.93 -3.49 119.26 116.84 1x5l h ALA 89 Ca 0.79 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.53 1x5l h ALA 89 Cb 2.32 0.29 0.00 0.00 0.00 0.00 0.00 17.79 20.40 1x5l h ALA 89 CO -0.46 -0.96 0.00 0.41 0.00 0.00 0.00 179.25 178.25 1x5l n GLY 90 N -0.83 3.19 3.28 0.00 0.00 -0.26 -5.03 105.19 105.54 1x5l n GLY 90 Ca -0.09 -0.92 -0.28 0.00 0.00 0.00 0.00 46.02 44.72 1x5l n GLY 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x5l s GLY 92 N -0.86 1.50 0.56 0.00 0.00 -1.04 -4.88 107.32 102.61 1x5l s GLY 92 Ca 0.09 -0.86 -0.20 0.00 0.00 0.00 0.00 44.72 43.75 1x5l s GLY 92 CO 0.00 -0.71 1.23 0.50 0.00 0.00 0.00 173.10 174.13 1x5l s ARG 93 N -4.59 3.16 1.09 2.90 1.81 -1.26 -4.74 118.95 117.32 1x5l s ARG 93 Ca 0.47 1.90 -0.13 0.00 -1.72 0.00 0.00 55.73 56.24 1x5l s ARG 93 Cb -0.10 -2.09 0.24 0.00 -0.45 0.00 0.00 34.95 32.55 1x5l s ARG 93 CO 0.40 -1.08 1.07 -0.06 -0.68 0.00 0.00 175.30 174.95 1x5l s PHE 94 N -1.52 1.66 0.63 -0.53 0.08 -1.26 -4.61 117.98 112.43 1x5l s PHE 94 Ca 0.74 0.96 0.03 0.00 0.12 0.00 0.00 56.93 58.77 1x5l s PHE 94 Cb -0.32 -3.23 0.09 0.00 -0.57 0.00 0.00 43.02 38.99 1x5l s PHE 94 CO 0.36 -3.37 0.87 0.45 -0.10 0.00 0.00 175.22 173.43 1x5l s SER 95 N -3.23 4.82 0.31 1.36 0.15 -1.11 -4.86 113.70 111.14 1x5l s SER 95 Ca 0.67 -0.42 -0.29 0.00 0.70 0.00 0.00 55.95 56.61 1x5l s SER 95 Cb -0.20 -0.16 -0.13 0.00 -1.71 0.00 0.00 66.02 63.83 1x5l s SER 95 CO 0.60 -1.51 1.23 0.00 1.20 0.00 0.00 173.24 174.75 1x5l n GLN 96 N -2.51 1.87 -1.94 5.44 6.02 -1.26 -4.83 117.38 120.16 1x5l n GLN 96 Ca 0.13 0.66 -0.40 0.00 -0.01 0.00 0.00 57.00 57.38 1x5l n GLN 96 Cb 0.61 -2.19 -0.03 0.00 1.02 0.00 0.00 30.24 29.65 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 -0.90 2.39 0.49 -1.58 0.00 -1.26 -4.79 121.76 116.11 1x5l s ALA 97 Ca 0.59 -0.14 -0.12 0.00 0.00 0.00 0.00 51.96 52.29 1x5l s ALA 97 Cb -0.63 -4.19 -0.06 0.00 0.00 0.00 0.00 23.12 18.25 1x5l s ALA 97 CO 0.59 -3.43 0.89 1.41 0.00 0.00 0.00 175.76 175.22 1x5l s MET 98 N 6.64 3.77 -0.12 0.00 1.75 -1.13 -4.97 119.30 125.24 1x5l s MET 98 Ca 0.78 0.65 0.01 0.00 -1.25 0.00 0.00 55.69 55.88 1x5l s MET 98 Cb -0.18 -2.25 0.02 0.00 2.84 0.00 0.00 34.83 35.26 1x5l s MET 98 CO 0.27 -0.24 -0.16 -1.21 -0.65 0.00 0.00 175.02 173.04 1x5l s GLU 99 N -4.30 2.32 -0.09 4.11 2.02 -1.26 -3.27 118.70 118.23 1x5l s GLU 99 Ca 0.54 -0.59 -0.05 0.00 0.02 0.00 0.00 54.97 54.89 1x5l s GLU 99 Cb -0.10 -2.00 0.04 0.00 0.10 0.00 0.00 34.13 32.16 1x5l s GLU 99 CO 0.37 -0.10 0.22 0.08 0.02 0.00 0.00 175.26 175.85 1x5l s VAL 100 N 1.10 -0.03 0.02 2.63 1.01 -0.69 -5.00 120.40 119.44 1x5l s VAL 100 Ca -0.04 0.13 0.01 0.00 0.00 0.00 0.00 61.98 62.08 1x5l s VAL 100 Cb -0.14 -0.34 -0.04 0.00 0.00 0.00 0.00 36.38 35.86 1x5l s VAL 100 CO -0.04 0.05 0.08 -0.70 0.00 0.00 0.00 175.10 174.49 1x5l s GLU 101 N 1.04 3.02 0.73 2.72 2.12 -1.26 -0.73 118.70 126.33 1x5l s GLU 101 Ca -0.08 -0.55 -0.01 0.00 0.36 0.00 0.00 54.97 54.70 1x5l s GLU 101 Cb -0.09 -2.82 0.13 0.00 0.26 0.00 0.00 34.13 31.61 1x5l s GLU 101 CO -0.06 0.62 1.00 0.95 -0.54 0.00 0.00 175.26 177.23 1x5l s THR 102 N -1.26 2.12 -0.20 -1.70 -4.23 -1.25 -4.92 115.64 104.19 1x5l s THR 102 Ca 0.25 -0.59 -0.29 0.00 -1.18 0.00 0.00 61.69 59.88 1x5l s THR 102 Cb -0.12 -2.53 -0.01 0.00 1.34 0.00 0.00 72.50 71.18 1x5l s THR 102 CO 0.17 0.00 1.33 -0.83 -0.54 0.00 0.00 174.62 174.75 1x5l s GLY 103 N -4.75 1.53 0.53 3.99 0.00 -1.06 -4.04 107.32 103.52 1x5l s GLY 103 Ca 0.67 0.39 -0.20 0.00 0.00 0.00 0.00 44.72 45.58 1x5l s GLY 103 CO 0.45 2.60 0.82 0.28 0.00 0.00 0.00 173.10 177.25 1x5l n LYS 104 N 6.93 0.89 0.24 2.90 5.02 -1.26 -3.20 118.16 129.68 1x5l n LYS 104 Ca 0.15 0.33 0.12 0.00 -2.02 0.00 0.00 58.31 56.89 1x5l n LYS 104 Cb 0.45 -1.96 0.56 0.00 -0.02 0.00 0.00 35.03 34.06 1x5l n LYS 104 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 1x5l h PRO 105 N 0.72 0.00 0.40 1.97 0.13 -1.94 -3.28 132.00 130.01 1x5l h PRO 105 Ca -0.46 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.66 1x5l h PRO 105 Cb 1.37 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.48 1x5l h PRO 105 CO 0.51 0.17 -0.39 0.77 -0.23 0.00 0.00 178.00 178.83 1x5l h SER 106 N 0.00 -1.07 -4.61 1.44 0.02 -2.00 -3.49 113.55 103.83 1x5l h SER 106 Ca -0.00 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 1x5l h SER 106 Cb 0.62 0.35 0.00 0.00 0.14 0.00 0.00 62.40 63.51 1x5l h SER 106 CO 0.02 -0.52 0.00 0.61 -1.14 0.00 0.00 176.83 175.80 1x5l n GLY 107 N -1.44 0.75 3.56 -3.77 0.00 -1.24 -4.97 105.19 98.09 1x5l n GLY 107 Ca -0.09 -2.17 -0.27 0.00 0.00 0.00 0.00 46.02 43.49 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 -0.90 2.55 0.82 1.61 0.04 -1.26 -4.96 135.00 132.91 1x5l s PRO 108 Ca 0.00 -0.38 -0.09 0.00 0.04 0.00 0.00 61.00 60.58 1x5l s PRO 108 Cb 0.00 -5.08 0.14 0.00 0.04 0.00 0.00 34.50 29.60 1x5l s PRO 108 CO 0.00 -3.44 1.14 -1.12 0.04 0.00 0.00 177.00 173.63 1x5l s SER 109 N 7.88 3.93 0.45 6.66 0.01 -1.26 -5.11 113.70 126.25 1x5l s SER 109 Ca 0.70 0.11 0.05 0.00 1.31 0.00 0.00 55.95 58.12 1x5l s SER 109 Cb -0.06 -0.40 -0.05 0.00 0.21 0.00 0.00 66.02 65.72 1x5l s SER 109 CO 0.01 -2.18 0.09 -0.55 0.41 0.00 0.00 173.24 171.02 1x5l s SER 110 N -4.75 4.16 0.00 2.44 0.15 -1.26 -5.29 113.70 109.14 1x5l s SER 110 Ca 0.68 -1.35 0.00 0.00 0.70 0.00 0.00 55.95 55.98 1x5l s SER 110 Cb -0.06 -0.12 0.00 0.00 -1.71 0.00 0.00 66.02 64.13 1x5l s SER 110 CO 0.48 -0.63 0.00 0.61 1.20 0.00 0.00 173.24 174.90