#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v5m s SER 2 N 0.00 1.94 0.15 1.61 0.01 -1.26 -5.15 113.70 111.00 1v5m s SER 2 Ca 0.00 -0.49 -0.04 0.00 1.31 0.00 0.00 55.95 56.73 1v5m s SER 2 Cb 0.00 -0.13 -0.03 0.00 0.21 0.00 0.00 66.02 66.07 1v5m s SER 2 CO 0.00 0.07 0.15 -0.55 0.41 0.00 0.00 173.24 173.32 1v5m s SER 3 N -1.20 0.20 0.33 2.44 0.15 -1.26 -5.18 113.70 109.18 1v5m s SER 3 Ca 0.03 -1.09 -0.12 0.00 0.70 0.00 0.00 55.95 55.48 1v5m s SER 3 Cb -0.08 0.35 0.02 0.00 -1.71 0.00 0.00 66.02 64.61 1v5m s SER 3 CO 0.02 -0.80 0.63 -0.83 1.20 0.00 0.00 173.24 173.46 1v5m s GLY 4 N -3.02 0.68 0.06 9.45 0.00 -1.26 -5.18 107.32 108.04 1v5m s GLY 4 Ca 0.22 -0.95 -0.00 0.00 0.00 0.00 0.00 44.72 43.99 1v5m s GLY 4 CO 0.02 -0.55 -0.04 -0.56 0.00 0.00 0.00 173.10 171.97 1v5m s SER 5 N -3.09 0.63 0.32 1.64 0.01 -1.26 -5.17 113.70 106.77 1v5m s SER 5 Ca 0.21 -1.00 0.09 0.00 1.31 0.00 0.00 55.95 56.56 1v5m s SER 5 Cb -0.03 0.18 -0.05 0.00 0.21 0.00 0.00 66.02 66.33 1v5m s SER 5 CO 0.13 -0.57 0.01 -0.55 0.41 0.00 0.00 173.24 172.66 1v5m s SER 6 N -2.95 4.25 0.00 2.44 0.15 -1.26 -5.14 113.70 111.19 1v5m s SER 6 Ca 0.08 -0.91 0.00 0.00 0.70 0.00 0.00 55.95 55.82 1v5m s SER 6 Cb 0.07 -0.59 0.00 0.00 -1.71 0.00 0.00 66.02 63.79 1v5m s SER 6 CO -0.09 -0.18 0.00 0.61 1.20 0.00 0.00 173.24 174.78 1v5m n GLY 7 N -0.94 -1.87 2.72 9.45 0.00 -1.26 -5.05 105.19 108.25 1v5m n GLY 7 Ca -0.04 -1.07 -0.21 0.00 0.00 0.00 0.00 46.02 44.70 1v5m n GLY 7 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1v5m s ASN 8 N -1.63 1.50 -0.76 1.61 -0.87 -1.26 -5.09 114.94 108.43 1v5m s ASN 8 Ca 0.00 -0.17 -0.26 0.00 -1.57 0.00 0.00 52.86 50.86 1v5m s ASN 8 Cb 0.00 0.10 -0.00 0.00 -0.02 0.00 0.00 41.25 41.33 1v5m s ASN 8 CO 0.00 -0.30 1.64 -0.22 -2.57 0.00 0.00 177.10 175.65 1v5m s LEU 9 N 2.24 3.26 0.36 0.60 1.98 -1.26 -4.98 118.68 120.88 1v5m s LEU 9 Ca 0.04 -0.33 -0.00 0.00 -2.89 0.00 0.00 54.13 50.95 1v5m s LEU 9 Cb -0.14 -2.55 -0.03 0.00 0.66 0.00 0.00 46.19 44.12 1v5m s LEU 9 CO -0.09 -2.16 0.57 0.00 -1.89 0.00 0.00 176.35 172.79 1v5m s ALA 10 N 7.68 3.66 -0.16 5.97 0.00 -1.26 -5.06 121.76 132.60 1v5m s ALA 10 Ca 0.55 -0.85 -0.29 0.00 0.00 0.00 0.00 51.96 51.37 1v5m s ALA 10 Cb -0.08 -2.17 -0.00 0.00 0.00 0.00 0.00 23.12 20.86 1v5m s ALA 10 CO 0.11 -0.05 1.01 0.00 0.00 0.00 0.00 175.76 176.84 1v5m s ALA 11 N -2.35 3.52 0.12 0.00 0.00 -1.26 -5.04 121.76 116.75 1v5m s ALA 11 Ca 0.41 0.28 0.10 0.00 0.00 0.00 0.00 51.96 52.75 1v5m s ALA 11 Cb -0.10 -3.47 -0.04 0.00 0.00 0.00 0.00 23.12 19.51 1v5m s ALA 11 CO 0.37 -0.78 -0.24 0.21 0.00 0.00 0.00 175.76 175.31 1v5m s LYS 12 N 2.49 1.27 0.14 0.00 2.47 -1.26 -5.09 119.74 119.76 1v5m s LYS 12 Ca 0.46 -1.26 -0.20 0.00 -1.56 0.00 0.00 55.97 53.41 1v5m s LYS 12 Cb -0.17 -1.66 -0.12 0.00 -1.46 0.00 0.00 37.83 34.42 1v5m s LYS 12 CO 0.13 0.39 0.36 1.55 0.16 0.00 0.00 175.35 177.94 1v5m n VAL 13 N 0.99 1.39 -2.84 4.02 3.14 -1.26 -4.79 118.33 118.98 1v5m n VAL 13 Ca -0.19 -0.35 -0.43 0.00 -2.96 0.00 0.00 64.34 60.41 1v5m n VAL 13 Cb 0.53 0.00 -0.03 0.00 -1.06 0.00 0.00 33.84 33.28 1v5m n VAL 13 CO 0.00 0.00 0.00 -0.70 -6.46 0.00 0.00 176.83 169.67 1v5m s GLU 14 N -0.70 3.41 0.28 1.45 2.12 -1.26 -5.01 118.70 118.99 1v5m s GLU 14 Ca 0.45 -1.30 0.06 0.00 0.36 0.00 0.00 54.97 54.54 1v5m s GLU 14 Cb -0.65 -4.72 -0.02 0.00 0.26 0.00 0.00 34.13 29.00 1v5m s GLU 14 CO 0.39 -1.86 0.36 -0.48 -0.54 0.00 0.00 175.26 173.13 1v5m s LEU 15 N 3.60 4.09 -0.75 2.70 -0.00 -1.26 -4.98 118.68 122.08 1v5m s LEU 15 Ca 0.31 -0.09 -0.26 0.00 -0.00 0.00 0.00 54.13 54.09 1v5m s LEU 15 Cb -0.08 -2.70 -0.15 0.00 -0.00 0.00 0.00 46.19 43.25 1v5m s LEU 15 CO -0.02 -0.19 2.49 0.55 -0.00 0.00 0.00 176.35 179.18 1v5m n VAL 16 N -1.44 -0.04 -0.13 1.48 3.14 -1.26 -4.80 118.33 115.28 1v5m n VAL 16 Ca -0.06 -0.47 -0.04 0.00 -2.96 0.00 0.00 64.34 60.82 1v5m n VAL 16 Cb 0.58 -1.67 -0.03 0.00 -1.06 0.00 0.00 33.84 31.65 1v5m n VAL 16 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 1v5m n ASP 17 N 13.51 -0.34 -4.54 6.55 8.00 -1.26 -3.77 116.55 134.71 1v5m n ASP 17 Ca 0.51 0.79 -0.35 0.00 0.71 0.00 0.00 54.79 56.46 1v5m n ASP 17 Cb 0.32 -0.18 -0.07 0.00 -0.02 0.00 0.00 41.12 41.17 1v5m n ASP 17 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1v5m n ILE 18 N -3.80 -0.06 -0.13 0.53 -0.00 -1.26 -4.40 119.36 110.24 1v5m n ILE 18 Ca 0.01 -0.57 -0.09 0.00 -0.00 0.00 0.00 62.75 62.10 1v5m n ILE 18 Cb 0.08 -2.07 -0.07 0.00 -0.00 0.00 0.00 39.64 37.59 1v5m n ILE 18 CO 0.00 0.00 0.00 1.56 -0.00 0.00 0.00 176.55 178.11 1v5m h GLN 19 N 16.84 -0.21 -3.53 0.38 1.08 -1.30 -3.45 115.11 124.90 1v5m h GLN 19 Ca -0.16 0.01 -0.05 0.00 -1.45 0.00 0.00 58.65 57.00 1v5m h GLN 19 Cb 1.25 0.05 -0.10 0.00 -0.05 0.00 0.00 27.48 28.62 1v5m h GLN 19 CO 1.22 -0.14 -0.10 1.03 -0.95 0.00 0.00 178.83 179.89 1v5m s ARG 20 N -4.77 1.36 -0.16 1.46 0.52 -1.25 -5.06 118.95 111.04 1v5m s ARG 20 Ca -0.09 -1.04 -0.18 0.00 -0.52 0.00 0.00 55.73 53.90 1v5m s ARG 20 Cb 0.06 0.47 0.05 0.00 0.52 0.00 0.00 34.95 36.05 1v5m s ARG 20 CO 0.42 -0.56 0.50 -2.00 0.02 0.00 0.00 175.30 173.68 1v5m s GLU 21 N -3.93 0.62 0.14 3.54 2.12 -1.26 -2.10 118.70 117.83 1v5m s GLU 21 Ca 0.14 0.59 -0.25 0.00 0.36 0.00 0.00 54.97 55.82 1v5m s GLU 21 Cb 0.00 0.30 0.07 0.00 0.26 0.00 0.00 34.13 34.76 1v5m s GLU 21 CO 0.01 -0.10 0.78 0.20 -0.54 0.00 0.00 175.26 175.61 1v5m s GLY 22 N 0.04 -0.38 -0.39 -1.50 0.00 -0.81 -5.04 107.32 99.24 1v5m s GLY 22 Ca -0.02 0.38 -0.06 0.00 0.00 0.00 0.00 44.72 45.02 1v5m s GLY 22 CO 0.02 0.12 0.18 0.00 0.00 0.00 0.00 173.10 173.42 1v5m s ALA 23 N -3.52 3.15 0.28 3.20 0.00 -1.26 -0.65 121.76 122.95 1v5m s ALA 23 Ca 0.07 -2.13 0.02 0.00 0.00 0.00 0.00 51.96 49.92 1v5m s ALA 23 Cb -0.02 -2.43 -0.04 0.00 0.00 0.00 0.00 23.12 20.63 1v5m s ALA 23 CO -0.04 -1.59 0.16 -0.48 0.00 0.00 0.00 175.76 173.81 1v5m s LEU 24 N 1.33 1.55 0.13 0.00 2.34 -0.69 -4.94 118.68 118.39 1v5m s LEU 24 Ca 0.02 -1.52 -0.13 0.00 0.06 0.00 0.00 54.13 52.56 1v5m s LEU 24 Cb -0.22 0.27 -0.07 0.00 -0.56 0.00 0.00 46.19 45.61 1v5m s LEU 24 CO 0.00 -0.88 0.52 -0.13 -1.06 0.00 0.00 176.35 174.80 1v5m s ARG 25 N -3.88 3.93 0.17 1.48 3.00 -1.22 -2.03 118.95 120.40 1v5m s ARG 25 Ca 0.37 0.43 0.06 0.00 0.00 0.00 0.00 55.73 56.59 1v5m s ARG 25 Cb 0.05 -2.95 -0.04 0.00 0.00 0.00 0.00 34.95 32.01 1v5m s ARG 25 CO 0.17 0.50 -0.13 -0.59 0.00 0.00 0.00 175.30 175.25 1v5m s PHE 26 N -1.45 1.49 0.19 -0.53 -0.71 -0.62 -1.07 117.98 115.28 1v5m s PHE 26 Ca 0.37 -0.64 -0.23 0.00 -1.04 0.00 0.00 56.93 55.39 1v5m s PHE 26 Cb -0.15 -0.73 0.06 0.00 -1.21 0.00 0.00 43.02 40.99 1v5m s PHE 26 CO 0.19 0.22 0.65 0.00 -1.34 0.00 0.00 175.22 174.94 1v5m s MET 27 N -3.48 1.42 0.03 1.99 0.23 -0.41 -1.79 119.30 117.28 1v5m s MET 27 Ca 0.18 -0.62 0.08 0.00 -1.03 0.00 0.00 55.69 54.30 1v5m s MET 27 Cb -0.00 0.59 -0.03 0.00 -1.53 0.00 0.00 34.83 33.86 1v5m s MET 27 CO 0.04 -0.63 -0.25 0.08 -2.03 0.00 0.00 175.02 172.23 1v5m s VAL 28 N -3.77 2.00 -0.43 5.16 1.01 -1.26 -0.17 120.40 122.93 1v5m s VAL 28 Ca 0.04 -1.27 -0.25 0.00 0.00 0.00 0.00 61.98 60.50 1v5m s VAL 28 Cb -0.03 -1.70 0.02 0.00 0.00 0.00 0.00 36.38 34.68 1v5m s VAL 28 CO -0.07 0.38 0.90 0.00 0.00 0.00 0.00 175.10 176.31 1v5m s ALA 29 N -0.75 3.29 0.12 5.51 0.00 -1.06 -4.80 121.76 124.07 1v5m s ALA 29 Ca 0.10 -0.73 0.00 0.00 0.00 0.00 0.00 51.96 51.33 1v5m s ALA 29 Cb -0.10 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.45 1v5m s ALA 29 CO 0.01 -1.90 0.00 -3.47 0.00 0.00 0.00 175.76 170.40 1v5m n ASP 30 N 6.97 0.30 -4.49 0.00 2.03 -1.26 -4.76 116.55 115.35 1v5m n ASP 30 Ca 0.06 0.19 -0.43 0.00 0.52 0.00 0.00 54.79 55.12 1v5m n ASP 30 Cb 0.48 0.01 -0.05 0.00 -0.72 0.00 0.00 41.12 40.84 1v5m n ASP 30 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 1v5m s ASP 31 N -5.32 6.29 -0.06 1.67 1.01 -1.26 -4.93 116.67 114.07 1v5m s ASP 31 Ca 0.00 -0.61 -0.10 0.00 0.71 0.00 0.00 52.55 52.56 1v5m s ASP 31 Cb 0.00 -2.37 -0.05 0.00 1.01 0.00 0.00 42.92 41.51 1v5m s ASP 31 CO 0.00 -1.06 0.40 0.00 0.21 0.00 0.00 175.17 174.73 1v5m h ALA 32 N 9.15 -0.35 0.08 5.23 0.00 -2.01 -3.41 119.26 127.96 1v5m h ALA 32 Ca -0.27 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.56 1v5m h ALA 32 Cb 1.08 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1v5m h ALA 32 CO 1.02 -0.33 -0.04 0.00 0.00 0.00 0.00 179.25 179.91 1v5m h ALA 33 N -1.12 -0.69 -2.41 0.00 0.00 -2.06 -3.49 119.26 109.50 1v5m h ALA 33 Ca -0.04 -0.02 0.12 0.00 0.00 0.00 0.00 54.91 54.97 1v5m h ALA 33 Cb 0.27 0.04 -0.12 0.00 0.00 0.00 0.00 17.79 17.98 1v5m h ALA 33 CO 0.06 -0.68 0.45 -1.12 0.00 0.00 0.00 179.25 177.96 1v5m s SER 34 N -2.62 -0.32 0.00 0.00 0.01 -1.26 -5.19 113.70 104.32 1v5m s SER 34 Ca -0.02 -0.16 0.00 0.00 1.31 0.00 0.00 55.95 57.08 1v5m s SER 34 Cb 0.00 0.46 0.00 0.00 0.21 0.00 0.00 66.02 66.69 1v5m s SER 34 CO 0.05 -0.78 0.00 0.61 0.41 0.00 0.00 173.24 173.53 1v5m n GLY 35 N -0.34 4.83 3.68 3.44 0.00 -1.26 -4.90 105.19 110.64 1v5m n GLY 35 Ca -0.09 -1.44 -0.42 0.00 0.00 0.00 0.00 46.02 44.08 1v5m n GLY 35 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1v5m s PRO 36 N 0.38 4.25 1.30 1.61 0.04 -1.26 -4.81 135.00 136.52 1v5m s PRO 36 Ca 0.00 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.06 1v5m s PRO 36 Cb 0.00 -3.64 0.00 0.00 0.04 0.00 0.00 34.50 30.90 1v5m s PRO 36 CO 0.00 -0.64 0.00 0.41 0.04 0.00 0.00 177.00 176.81 1v5m n GLY 37 N 3.75 -1.71 2.36 0.56 0.00 -1.26 -4.75 105.19 104.14 1v5m n GLY 37 Ca 0.14 -1.28 -0.15 0.00 0.00 0.00 0.00 46.02 44.73 1v5m n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1v5m n GLY 38 N -0.08 2.71 3.74 -0.02 0.00 -1.26 -5.12 105.19 105.16 1v5m n GLY 38 Ca 0.00 -1.22 -0.24 0.00 0.00 0.00 0.00 46.02 44.55 1v5m n GLY 38 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1v5m s THR 39 N -1.77 2.43 -0.70 2.61 -4.23 -1.26 -5.07 115.64 107.63 1v5m s THR 39 Ca 0.35 -1.68 -0.24 0.00 -1.18 0.00 0.00 61.69 58.93 1v5m s THR 39 Cb 0.34 -2.99 0.06 0.00 1.34 0.00 0.00 72.50 71.25 1v5m s THR 39 CO -0.07 -0.03 1.10 0.00 -0.54 0.00 0.00 174.62 175.08 1v5m s ALA 40 N -2.57 2.98 0.54 3.99 0.00 -1.26 -4.87 121.76 120.57 1v5m s ALA 40 Ca 0.41 -1.70 0.40 0.00 0.00 0.00 0.00 51.96 51.07 1v5m s ALA 40 Cb 0.02 -4.03 1.38 0.00 0.00 0.00 0.00 23.12 20.50 1v5m s ALA 40 CO 0.23 -2.99 1.38 1.04 0.00 0.00 0.00 175.76 175.42 1v5m n GLN 41 N 8.33 0.00 -1.42 0.00 6.02 -1.26 -4.56 117.38 124.49 1v5m n GLN 41 Ca 0.00 0.99 -0.55 0.00 -0.01 0.00 0.00 57.00 57.43 1v5m n GLN 41 Cb 0.47 -2.35 -0.08 0.00 1.02 0.00 0.00 30.24 29.30 1v5m n GLN 41 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 177.06 176.96 1v5m n TRP 42 N -3.58 1.40 -5.04 1.08 7.02 -1.26 -4.81 117.44 112.25 1v5m n TRP 42 Ca 0.36 0.94 -0.29 0.00 -1.02 0.00 0.00 57.50 57.48 1v5m n TRP 42 Cb 1.75 -1.82 -0.16 0.00 -2.42 0.00 0.00 31.31 28.66 1v5m n TRP 42 CO 0.00 0.00 0.00 -0.65 -2.02 0.00 0.00 177.69 175.02 1v5m s GLN 43 N 2.35 2.25 0.16 -0.99 -1.52 -0.74 -4.91 119.66 116.26 1v5m s GLN 43 Ca 0.85 -0.75 -0.32 0.00 -1.95 0.00 0.00 55.36 53.20 1v5m s GLN 43 Cb -1.22 -1.88 -0.12 0.00 -0.22 0.00 0.00 33.01 29.57 1v5m s GLN 43 CO 0.66 0.28 1.77 1.63 -0.25 0.00 0.00 175.29 179.38 1v5m n LYS 44 N 3.16 2.73 -3.81 2.91 4.01 -1.26 -1.60 118.16 124.30 1v5m n LYS 44 Ca -0.18 0.99 -0.08 0.00 -0.51 0.00 0.00 58.31 58.52 1v5m n LYS 44 Cb 0.52 -2.85 -0.03 0.00 -0.51 0.00 0.00 35.03 32.16 1v5m n LYS 44 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1v5m s ARG 46 N -3.91 3.13 -0.36 0.00 3.52 -0.72 -1.71 118.95 118.89 1v5m s ARG 46 Ca 0.12 -0.76 -0.21 0.00 -0.13 0.00 0.00 55.73 54.74 1v5m s ARG 46 Cb -0.04 -2.70 0.00 0.00 -1.56 0.00 0.00 34.95 30.66 1v5m s ARG 46 CO 0.03 -0.18 0.66 -1.17 -0.81 0.00 0.00 175.30 173.83 1v5m s LEU 47 N 1.29 4.24 -0.11 -0.88 2.96 0.18 -2.85 118.68 123.50 1v5m s LEU 47 Ca 0.04 0.18 0.02 0.00 -0.22 0.00 0.00 54.13 54.14 1v5m s LEU 47 Cb -0.14 -2.83 -0.01 0.00 0.50 0.00 0.00 46.19 43.71 1v5m s LEU 47 CO -0.09 -0.62 -0.17 -0.22 -1.32 0.00 0.00 176.35 173.93 1v5m s LEU 48 N 2.78 2.48 -0.33 -0.68 2.96 -1.18 -1.93 118.68 122.78 1v5m s LEU 48 Ca 0.26 -0.40 0.01 0.00 -0.22 0.00 0.00 54.13 53.77 1v5m s LEU 48 Cb -0.14 -1.53 0.08 0.00 0.50 0.00 0.00 46.19 45.10 1v5m s LEU 48 CO 0.15 0.18 0.04 -0.22 -1.32 0.00 0.00 176.35 175.18 1v5m s LEU 49 N 0.24 4.39 0.03 -0.68 0.20 -0.89 -3.06 118.68 118.92 1v5m s LEU 49 Ca -0.12 -1.76 0.04 0.00 0.69 0.00 0.00 54.13 52.99 1v5m s LEU 49 Cb -0.16 -1.68 -0.02 0.00 -0.43 0.00 0.00 46.19 43.90 1v5m s LEU 49 CO 0.06 -0.35 -0.11 0.00 -0.29 0.00 0.00 176.35 175.66 1v5m s ARG 50 N 1.08 0.76 0.35 1.98 3.03 -1.26 -1.34 118.95 123.55 1v5m s ARG 50 Ca 0.02 -0.68 -0.28 0.00 2.03 0.00 0.00 55.73 56.83 1v5m s ARG 50 Cb -0.20 -0.70 -0.10 0.00 -1.03 0.00 0.00 34.95 32.92 1v5m s ARG 50 CO -0.05 0.17 1.28 -0.98 -1.13 0.00 0.00 175.30 174.59 1v5m s ARG 51 N -1.11 4.26 -0.22 3.89 1.70 -1.26 -2.47 118.95 123.73 1v5m s ARG 51 Ca -0.01 2.14 -0.27 0.00 -0.47 0.00 0.00 55.73 57.11 1v5m s ARG 51 Cb -0.08 -2.97 0.00 0.00 -0.57 0.00 0.00 34.95 31.34 1v5m s ARG 51 CO 0.01 -0.24 0.93 0.00 -1.08 0.00 0.00 175.30 174.92 1v5m s ALA 52 N -1.20 3.64 0.11 7.88 0.00 0.12 -4.85 121.76 127.47 1v5m s ALA 52 Ca 0.51 0.05 -0.22 0.00 0.00 0.00 0.00 51.96 52.31 1v5m s ALA 52 Cb -0.38 -3.41 -0.07 0.00 0.00 0.00 0.00 23.12 19.26 1v5m s ALA 52 CO 0.50 -0.94 0.66 0.14 0.00 0.00 0.00 175.76 176.12 1v5m s VAL 53 N 2.89 4.58 -1.47 0.00 -7.23 -1.26 -4.03 120.40 113.87 1v5m s VAL 53 Ca 0.40 1.43 -0.10 0.00 -1.81 0.00 0.00 61.98 61.89 1v5m s VAL 53 Cb -0.15 -4.00 0.06 0.00 0.56 0.00 0.00 36.38 32.85 1v5m s VAL 53 CO 0.08 0.54 0.92 0.00 -0.31 0.00 0.00 175.10 176.32 1v5m n ALA 54 N 1.65 -1.47 -2.41 1.32 0.00 -1.26 -4.81 120.51 113.53 1v5m n ALA 54 Ca -0.08 0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1v5m n ALA 54 Cb 0.50 -3.88 0.00 0.00 0.00 0.00 0.00 19.45 16.07 1v5m n ALA 54 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1v5m n GLY 55 N -1.68 1.26 2.08 0.00 0.00 -1.26 -5.16 105.19 100.43 1v5m n GLY 55 Ca -0.05 0.15 -0.20 0.00 0.00 0.00 0.00 46.02 45.93 1v5m n GLY 55 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1v5m n GLU 56 N 0.00 -3.55 -0.02 1.61 0.28 -1.26 -4.97 120.64 112.72 1v5m n GLU 56 Ca 0.00 -0.98 -0.11 0.00 -0.16 0.00 0.00 57.16 55.92 1v5m n GLU 56 Cb 0.00 -1.18 -0.09 0.00 1.43 0.00 0.00 31.44 31.60 1v5m n GLU 56 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1v5m h ARG 57 N 0.00 -0.07 -4.64 3.44 2.47 -1.94 -3.34 114.38 110.30 1v5m h ARG 57 Ca -0.26 0.00 -0.37 0.00 -1.26 0.00 0.00 59.98 58.10 1v5m h ARG 57 Cb 0.84 0.02 -0.12 0.00 -1.65 0.00 0.00 29.97 29.06 1v5m h ARG 57 CO 0.16 0.52 -0.44 -0.06 0.56 0.00 0.00 179.97 180.70 1v5m s PHE 58 N -2.73 1.45 -0.27 3.04 0.40 -1.26 0.16 117.98 118.76 1v5m s PHE 58 Ca -0.13 -1.50 -0.11 0.00 -0.60 0.00 0.00 56.93 54.58 1v5m s PHE 58 Cb -0.01 -0.52 0.11 0.00 0.51 0.00 0.00 43.02 43.10 1v5m s PHE 58 CO 0.50 -0.89 0.62 0.50 0.70 0.00 0.00 175.22 176.65 1v5m s ARG 59 N -3.52 0.57 -0.14 0.44 3.52 -1.03 -1.82 118.95 116.97 1v5m s ARG 59 Ca 0.38 1.30 -0.23 0.00 -0.13 0.00 0.00 55.73 57.05 1v5m s ARG 59 Cb 0.03 0.56 -0.03 0.00 -1.56 0.00 0.00 34.95 33.95 1v5m s ARG 59 CO 0.23 -0.19 0.70 -0.51 -0.81 0.00 0.00 175.30 174.71 1v5m s LEU 60 N 2.44 4.22 -0.20 -0.88 2.01 0.38 -4.03 118.68 122.61 1v5m s LEU 60 Ca -0.07 1.04 -0.02 0.00 0.01 0.00 0.00 54.13 55.09 1v5m s LEU 60 Cb -0.10 -3.03 -0.00 0.00 0.01 0.00 0.00 46.19 43.06 1v5m s LEU 60 CO -0.18 -0.23 -0.08 -1.61 1.01 0.00 0.00 176.35 175.25 1v5m s GLU 61 N 1.51 3.31 -0.70 1.70 2.02 -1.17 -0.53 118.70 124.85 1v5m s GLU 61 Ca 0.34 -0.67 -0.12 0.00 0.02 0.00 0.00 54.97 54.55 1v5m s GLU 61 Cb -0.17 -2.88 0.18 0.00 0.10 0.00 0.00 34.13 31.37 1v5m s GLU 61 CO 0.14 -0.14 0.61 -0.06 0.02 0.00 0.00 175.26 175.83 1v5m s PHE 62 N 1.27 3.57 -0.33 1.61 0.40 -1.23 -3.12 117.98 120.15 1v5m s PHE 62 Ca 0.03 -2.00 -0.29 0.00 -0.60 0.00 0.00 56.93 54.07 1v5m s PHE 62 Cb -0.14 -3.66 0.01 0.00 0.51 0.00 0.00 43.02 39.74 1v5m s PHE 62 CO -0.04 -0.97 1.26 -0.06 0.70 0.00 0.00 175.22 176.12 1v5m s PHE 63 N 0.51 2.74 -0.22 0.36 0.08 -1.13 -0.76 117.98 119.56 1v5m s PHE 63 Ca 0.14 0.89 -0.02 0.00 0.12 0.00 0.00 56.93 58.05 1v5m s PHE 63 Cb -0.17 -3.97 0.07 0.00 -0.57 0.00 0.00 43.02 38.38 1v5m s PHE 63 CO -0.05 -1.54 0.05 0.08 -0.10 0.00 0.00 175.22 173.65 1v5m s VAL 64 N 4.38 0.61 1.02 -0.44 1.01 -1.26 -1.73 120.40 123.99 1v5m s VAL 64 Ca 0.54 -0.76 -0.13 0.00 0.00 0.00 0.00 61.98 61.64 1v5m s VAL 64 Cb -0.15 -1.18 0.20 0.00 0.00 0.00 0.00 36.38 35.25 1v5m s VAL 64 CO 0.24 -0.31 1.09 -2.16 0.00 0.00 0.00 175.10 173.95 1v5m s PRO 65 N 1.80 0.27 0.00 2.72 0.04 -1.26 -4.67 135.00 133.90 1v5m s PRO 65 Ca 0.01 0.47 0.12 0.00 0.04 0.00 0.00 61.00 61.64 1v5m s PRO 65 Cb -0.17 -1.72 0.70 0.00 0.04 0.00 0.00 34.50 33.35 1v5m s PRO 65 CO -0.12 -2.83 1.13 -0.35 0.04 0.00 0.00 177.00 174.87 1v5m n PRO 66 N -4.24 0.49 -0.01 0.56 -0.04 -0.70 -2.00 135.00 129.06 1v5m n PRO 66 Ca 0.05 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.61 1v5m n PRO 66 Cb 0.57 -1.37 -0.16 0.00 -0.04 0.00 0.00 33.50 32.50 1v5m n PRO 66 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1v5m n LYS 67 N -0.87 0.66 -1.85 0.54 4.76 -1.26 -4.74 118.16 115.39 1v5m n LYS 67 Ca 0.09 -0.18 -0.40 0.00 -2.87 0.00 0.00 58.31 54.95 1v5m n LYS 67 Cb 0.04 -1.54 0.01 0.00 -1.84 0.00 0.00 35.03 31.71 1v5m n LYS 67 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1v5m s ALA 68 N -3.48 3.26 0.24 7.82 0.00 -0.85 -4.92 121.76 123.84 1v5m s ALA 68 Ca -0.08 1.43 0.00 0.00 0.00 0.00 0.00 51.96 53.31 1v5m s ALA 68 Cb 0.14 -3.57 0.28 0.00 0.00 0.00 0.00 23.12 19.97 1v5m s ALA 68 CO 0.90 -1.11 1.63 0.77 0.00 0.00 0.00 175.76 177.95 1v5m h SER 69 N 2.43 0.53 -3.31 0.00 0.02 -1.93 -3.44 113.55 107.85 1v5m h SER 69 Ca -0.51 -0.22 -0.67 0.00 -0.84 0.00 0.00 61.79 59.56 1v5m h SER 69 Cb 1.26 -0.15 -0.13 0.00 0.14 0.00 0.00 62.40 63.52 1v5m h SER 69 CO 0.62 0.86 -0.63 -0.13 -1.14 0.00 0.00 176.83 176.40 1v5m s ARG 70 N -4.29 2.87 0.34 3.45 1.81 -1.26 -5.10 118.95 116.78 1v5m s ARG 70 Ca -0.07 -0.55 -0.28 0.00 -1.72 0.00 0.00 55.73 53.11 1v5m s ARG 70 Cb 0.13 -2.73 -0.10 0.00 -0.45 0.00 0.00 34.95 31.81 1v5m s ARG 70 CO 0.81 0.64 1.21 -1.25 -0.68 0.00 0.00 175.30 176.04 1v5m s PRO 71 N -1.46 4.34 -0.05 3.54 0.04 -1.26 -4.65 135.00 135.50 1v5m s PRO 71 Ca 0.19 2.00 -0.23 0.00 0.04 0.00 0.00 61.00 63.00 1v5m s PRO 71 Cb -0.12 -2.99 -0.28 0.00 0.04 0.00 0.00 34.50 31.16 1v5m s PRO 71 CO 0.09 -0.13 0.95 -0.22 0.04 0.00 0.00 177.00 177.73 1v5m h LYS 72 N 3.28 0.26 -2.19 4.56 3.64 -1.21 -3.39 116.57 121.51 1v5m h LYS 72 Ca -0.48 -0.37 -0.58 0.00 -1.27 0.00 0.00 60.65 57.95 1v5m h LYS 72 Cb 1.23 0.13 -0.41 0.00 -0.41 0.00 0.00 32.23 32.76 1v5m h LYS 72 CO 0.65 1.12 -0.74 0.28 -2.27 0.00 0.00 179.45 178.49 1v5m n VAL 73 N -4.28 2.06 -2.19 2.00 0.31 -0.98 -5.01 118.33 110.24 1v5m n VAL 73 Ca -0.12 -5.18 -0.41 0.00 -0.01 0.00 0.00 64.34 58.62 1v5m n VAL 73 Cb 0.69 -1.57 -0.03 0.00 -0.91 0.00 0.00 33.84 32.02 1v5m n VAL 73 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1v5m s SER 74 N -2.77 5.84 -0.09 4.52 1.04 -1.26 -3.57 113.70 117.41 1v5m s SER 74 Ca 0.43 0.59 0.02 0.00 0.48 0.00 0.00 55.95 57.47 1v5m s SER 74 Cb 0.23 -2.54 -0.02 0.00 0.10 0.00 0.00 66.02 63.79 1v5m s SER 74 CO -0.08 -1.88 -0.13 -0.63 0.98 0.00 0.00 173.24 171.50 1v5m s ILE 75 N 7.09 3.14 0.40 -1.02 1.01 0.31 -4.99 121.20 127.15 1v5m s ILE 75 Ca 0.64 -0.66 -0.25 0.00 0.00 0.00 0.00 60.65 60.37 1v5m s ILE 75 Cb -0.14 -2.28 -0.08 0.00 0.01 0.00 0.00 42.46 39.97 1v5m s ILE 75 CO 0.26 0.56 1.19 -2.16 0.00 0.00 0.00 174.94 174.79 1v5m s PRO 76 N -0.24 4.02 0.27 2.79 0.04 -1.26 -0.47 135.00 140.15 1v5m s PRO 76 Ca 0.01 1.88 -0.01 0.00 0.04 0.00 0.00 61.00 62.91 1v5m s PRO 76 Cb -0.13 -2.67 0.44 0.00 0.04 0.00 0.00 34.50 32.18 1v5m s PRO 76 CO 0.03 -0.36 1.88 1.25 0.04 0.00 0.00 177.00 179.84 1v5m h LEU 77 N 2.61 1.01 -1.47 -3.56 7.12 -1.68 -1.17 115.31 118.17 1v5m h LEU 77 Ca -0.49 0.01 0.21 0.00 0.13 0.00 0.00 57.88 57.74 1v5m h LEU 77 Cb 1.24 -0.20 -0.07 0.00 -0.53 0.00 0.00 40.66 41.10 1v5m h LEU 77 CO 0.62 0.63 0.60 0.77 -0.13 0.00 0.00 178.44 180.94 1v5m h SER 78 N 1.14 0.43 -0.60 1.25 4.64 -1.92 -0.08 113.55 118.41 1v5m h SER 78 Ca 0.44 0.05 0.05 0.00 -0.47 0.00 0.00 61.79 61.85 1v5m h SER 78 Cb 0.21 -0.03 -0.05 0.00 -0.31 0.00 0.00 62.40 62.22 1v5m h SER 78 CO -0.18 0.17 0.33 0.00 -0.87 0.00 0.00 176.83 176.28 1v5m h ALA 79 N 1.61 0.79 -2.43 5.18 0.00 -1.59 -3.42 119.26 119.41 1v5m h ALA 79 Ca 0.48 0.01 -0.55 0.00 0.00 0.00 0.00 54.91 54.85 1v5m h ALA 79 Cb 1.17 -0.12 0.05 0.00 0.00 0.00 0.00 17.79 18.89 1v5m h ALA 79 CO -0.19 0.01 0.98 -0.89 0.00 0.00 0.00 179.25 179.16 1v5m n ILE 80 N -4.81 0.15 0.00 0.00 2.08 -0.04 0.86 119.36 117.60 1v5m n ILE 80 Ca 0.07 -0.03 0.00 0.00 0.56 0.00 0.00 62.75 63.35 1v5m n ILE 80 Cb 0.14 -1.87 0.00 0.00 -0.75 0.00 0.00 39.64 37.16 1v5m n ILE 80 CO 0.00 0.00 0.00 2.30 0.56 0.00 0.00 176.55 179.41 1v5m n ILE 81 N 4.10 0.00 -3.70 1.39 -5.35 -0.63 -4.86 119.36 110.31 1v5m n ILE 81 Ca 0.17 0.00 -0.11 0.00 -0.27 0.00 0.00 62.75 62.54 1v5m n ILE 81 Cb 0.33 -0.72 -0.12 0.00 -1.74 0.00 0.00 39.64 37.40 1v5m n ILE 81 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 1v5m s GLU 82 N -1.97 0.30 -0.51 6.28 2.12 -1.05 -5.07 118.70 118.80 1v5m s GLU 82 Ca 0.00 0.71 -0.06 0.00 0.36 0.00 0.00 54.97 55.98 1v5m s GLU 82 Cb 0.00 -0.04 0.13 0.00 0.26 0.00 0.00 34.13 34.49 1v5m s GLU 82 CO 0.00 -0.18 0.35 0.54 -0.54 0.00 0.00 175.26 175.44 1v5m s VAL 83 N 1.50 3.90 -0.39 3.70 0.11 -1.26 -0.78 120.40 127.17 1v5m s VAL 83 Ca -0.08 -2.21 -0.29 0.00 -2.93 0.00 0.00 61.98 56.47 1v5m s VAL 83 Cb -0.10 -3.58 0.02 0.00 -1.53 0.00 0.00 36.38 31.20 1v5m s VAL 83 CO -0.11 -0.79 1.10 -0.60 -3.33 0.00 0.00 175.10 171.37 1v5m s ARG 84 N 0.86 3.90 -0.33 1.54 3.52 -0.58 -4.83 118.95 123.04 1v5m s ARG 84 Ca 0.10 0.83 -0.01 0.00 -0.13 0.00 0.00 55.73 56.53 1v5m s ARG 84 Cb -0.23 -3.82 0.25 0.00 -1.56 0.00 0.00 34.95 29.60 1v5m s ARG 84 CO -0.03 -1.13 1.94 0.25 -0.81 0.00 0.00 175.30 175.52 1v5m n THR 85 N 6.32 2.74 -4.33 4.11 -2.24 -1.26 0.49 114.28 120.11 1v5m n THR 85 Ca 0.12 -1.64 -0.19 0.00 -2.27 0.00 0.00 64.05 60.08 1v5m n THR 85 Cb 0.48 -1.24 -0.09 0.00 -2.10 0.00 0.00 70.33 67.38 1v5m n THR 85 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1v5m s THR 86 N -2.37 0.33 0.04 4.28 -4.23 -1.26 -4.88 115.64 107.56 1v5m s THR 86 Ca 0.33 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 58.83 1v5m s THR 86 Cb 0.26 -2.52 -0.03 0.00 1.34 0.00 0.00 72.50 71.55 1v5m s THR 86 CO 0.00 0.00 -0.02 -0.04 -0.54 0.00 0.00 174.62 174.02 1v5m s MET 87 N -3.83 0.55 0.00 3.99 -1.94 -1.26 -4.66 119.30 112.15 1v5m s MET 87 Ca 0.36 -1.07 0.00 0.00 -1.71 0.00 0.00 55.69 53.27 1v5m s MET 87 Cb 0.05 0.19 0.00 0.00 2.01 0.00 0.00 34.83 37.08 1v5m s MET 87 CO 0.17 -0.10 0.00 -0.35 -0.01 0.00 0.00 175.02 174.73 1v5m n PRO 88 N 0.45 0.11 -0.88 2.03 -0.04 -1.26 -4.80 135.00 130.61 1v5m n PRO 88 Ca -0.16 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.15 1v5m n PRO 88 Cb 0.60 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.94 1v5m n PRO 88 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1v5m n LEU 89 N 0.00 4.93 0.01 1.53 7.99 -1.26 -3.52 117.00 126.68 1v5m n LEU 89 Ca 0.00 -2.93 0.00 0.00 -0.01 0.00 0.00 56.01 53.07 1v5m n LEU 89 Cb 0.00 -1.22 0.00 0.00 -0.11 0.00 0.00 43.42 42.09 1v5m n LEU 89 CO 0.00 1.36 -0.12 -0.62 -1.51 0.00 0.00 177.39 176.50 1v5m n GLU 90 N 2.83 0.00 -2.78 3.23 1.02 -1.26 -5.08 120.64 118.60 1v5m n GLU 90 Ca 0.42 0.00 -0.39 0.00 -0.02 0.00 0.00 57.16 57.16 1v5m n GLU 90 Cb 0.65 -0.13 -0.06 0.00 -0.02 0.00 0.00 31.44 31.87 1v5m n GLU 90 CO 0.00 0.00 0.00 1.41 1.18 0.00 0.00 177.13 179.72 1v5m s MET 91 N -2.00 4.76 0.00 3.49 1.75 -1.23 -4.92 119.30 121.15 1v5m s MET 91 Ca 0.00 1.42 0.00 0.00 -1.25 0.00 0.00 55.69 55.86 1v5m s MET 91 Cb 0.00 -3.15 0.00 0.00 2.84 0.00 0.00 34.83 34.52 1v5m s MET 91 CO 0.00 0.46 0.43 -0.35 -0.65 0.00 0.00 175.02 174.91 1v5m n PRO 92 N 1.25 0.49 -2.31 4.11 -0.04 -1.26 -4.76 135.00 132.48 1v5m n PRO 92 Ca -0.01 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.41 1v5m n PRO 92 Cb 0.48 -1.06 0.02 0.00 -0.04 0.00 0.00 33.50 32.90 1v5m n PRO 92 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1v5m n GLU 93 N -0.31 -1.52 -2.32 0.54 2.13 -1.26 -4.98 120.64 112.92 1v5m n GLU 93 Ca 0.00 0.21 -0.42 0.00 0.66 0.00 0.00 57.16 57.61 1v5m n GLU 93 Cb 0.03 -3.25 -0.03 0.00 0.27 0.00 0.00 31.44 28.47 1v5m n GLU 93 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1v5m s LYS 94 N -4.22 4.27 -0.06 5.31 1.02 -1.26 -4.89 119.74 119.90 1v5m s LYS 94 Ca 0.01 1.82 -0.00 0.00 0.02 0.00 0.00 55.97 57.83 1v5m s LYS 94 Cb -0.00 -3.69 0.05 0.00 -0.52 0.00 0.00 37.83 33.66 1v5m s LYS 94 CO 0.18 -0.63 1.73 -0.25 -0.92 0.00 0.00 175.35 175.46 1v5m n ASP 95 N 6.01 4.82 -0.92 2.83 9.92 -1.26 -3.50 116.55 134.45 1v5m n ASP 95 Ca 0.13 -2.43 0.04 0.00 -0.53 0.00 0.00 54.79 52.01 1v5m n ASP 95 Cb 0.45 -0.94 0.05 0.00 -0.64 0.00 0.00 41.12 40.04 1v5m n ASP 95 CO 0.00 0.00 0.00 -0.46 0.13 0.00 0.00 177.20 176.87 1v5m n ASN 96 N 0.99 0.94 -3.44 -2.24 6.94 -1.26 -3.47 115.26 113.71 1v5m n ASN 96 Ca 0.06 -2.40 -0.17 0.00 -0.02 0.00 0.00 54.58 52.05 1v5m n ASN 96 Cb 0.55 -0.32 -0.07 0.00 -2.36 0.00 0.00 39.78 37.57 1v5m n ASN 96 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1v5m s THR 97 N -0.78 0.00 -0.26 5.53 -4.23 -1.23 -0.03 115.64 114.64 1v5m s THR 97 Ca 0.24 -1.91 -0.26 0.00 -1.18 0.00 0.00 61.69 58.58 1v5m s THR 97 Cb 0.26 -2.53 0.14 0.00 1.34 0.00 0.00 72.50 71.72 1v5m s THR 97 CO -0.08 0.00 1.14 0.72 -0.54 0.00 0.00 174.62 175.86 1v5m s PHE 98 N -3.46 -0.33 -0.14 3.99 -0.12 -1.10 -4.86 117.98 111.97 1v5m s PHE 98 Ca 0.38 0.76 -0.09 0.00 -0.05 0.00 0.00 56.93 57.93 1v5m s PHE 98 Cb 0.02 0.41 -0.04 0.00 -0.63 0.00 0.00 43.02 42.78 1v5m s PHE 98 CO 0.24 -0.19 0.17 0.08 -0.05 0.00 0.00 175.22 175.47 1v5m s VAL 99 N -0.15 5.42 -0.41 -2.49 1.01 0.18 -2.46 120.40 121.51 1v5m s VAL 99 Ca 0.04 0.29 -0.06 0.00 0.00 0.00 0.00 61.98 62.24 1v5m s VAL 99 Cb -0.04 -3.47 0.09 0.00 0.00 0.00 0.00 36.38 32.96 1v5m s VAL 99 CO -0.07 0.55 0.22 -0.76 0.00 0.00 0.00 175.10 175.04 1v5m s LEU 100 N -0.51 5.09 -0.58 3.92 1.43 -0.99 -1.52 118.68 125.52 1v5m s LEU 100 Ca 0.14 -1.68 -0.21 0.00 -1.03 0.00 0.00 54.13 51.36 1v5m s LEU 100 Cb -0.12 -1.91 0.07 0.00 0.03 0.00 0.00 46.19 44.26 1v5m s LEU 100 CO 0.03 -0.52 0.78 -0.75 0.23 0.00 0.00 176.35 176.12 1v5m s LYS 101 N 1.31 3.13 0.80 1.70 2.36 0.04 -2.07 119.74 127.01 1v5m s LYS 101 Ca 0.04 -0.89 -0.09 0.00 -2.55 0.00 0.00 55.97 52.47 1v5m s LYS 101 Cb -0.23 -4.17 0.11 0.00 -1.05 0.00 0.00 37.83 32.49 1v5m s LYS 101 CO -0.00 -1.50 1.13 0.14 1.55 0.00 0.00 175.35 176.66 1v5m s VAL 102 N 3.22 2.13 0.17 4.02 -7.23 -0.91 -1.61 120.40 120.20 1v5m s VAL 102 Ca 0.18 -0.19 0.34 0.00 -1.81 0.00 0.00 61.98 60.51 1v5m s VAL 102 Cb -0.19 -2.94 0.39 0.00 0.56 0.00 0.00 36.38 34.20 1v5m s VAL 102 CO 0.11 0.00 2.02 1.05 -0.31 0.00 0.00 175.10 177.97 1v5m h GLU 103 N -0.96 0.00 -1.29 4.82 4.11 0.14 -2.92 114.58 118.48 1v5m h GLU 103 Ca -0.44 0.00 -0.33 0.00 0.07 0.00 0.00 59.36 58.66 1v5m h GLU 103 Cb 1.29 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 30.38 1v5m h GLU 103 CO 0.53 0.01 0.43 0.09 0.07 0.00 0.00 179.01 180.13 1v5m n ASN 104 N -3.11 5.43 -3.97 3.06 3.02 -1.26 -4.88 115.26 113.54 1v5m n ASN 104 Ca 0.00 -3.04 -0.38 0.00 -0.03 0.00 0.00 54.58 51.13 1v5m n ASN 104 Cb 0.28 -0.91 0.01 0.00 -0.61 0.00 0.00 39.78 38.55 1v5m n ASN 104 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1v5m n GLY 105 N -0.01 -0.91 2.82 7.41 0.00 -1.10 -4.95 105.19 108.44 1v5m n GLY 105 Ca 0.33 0.39 -0.17 0.00 0.00 0.00 0.00 46.02 46.57 1v5m n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v5m s ALA 106 N -3.42 -0.10 -0.18 4.61 0.00 -1.26 -4.99 121.76 116.43 1v5m s ALA 106 Ca 0.32 0.50 -0.10 0.00 0.00 0.00 0.00 51.96 52.69 1v5m s ALA 106 Cb -0.18 -0.74 -0.05 0.00 0.00 0.00 0.00 23.12 22.15 1v5m s ALA 106 CO 0.89 -0.51 0.14 -1.21 0.00 0.00 0.00 175.76 175.07 1v5m s GLU 107 N 2.15 4.06 -0.33 0.00 2.02 -1.25 -2.13 118.70 123.22 1v5m s GLU 107 Ca 0.02 -0.19 0.02 0.00 0.02 0.00 0.00 54.97 54.84 1v5m s GLU 107 Cb -0.12 -3.38 0.09 0.00 0.10 0.00 0.00 34.13 30.82 1v5m s GLU 107 CO -0.05 0.38 0.04 0.71 0.02 0.00 0.00 175.26 176.36 1v5m s TYR 108 N 0.12 3.57 -0.40 1.61 1.51 -0.88 -2.57 117.35 120.31 1v5m s TYR 108 Ca 0.10 -2.63 -0.26 0.00 -1.01 0.00 0.00 57.07 53.26 1v5m s TYR 108 Cb -0.11 -2.67 0.02 0.00 -0.11 0.00 0.00 41.96 39.09 1v5m s TYR 108 CO -0.01 -0.92 0.96 0.42 -1.11 0.00 0.00 175.55 174.89 1v5m s ILE 109 N 1.02 4.50 -0.08 2.71 1.01 0.76 -2.34 121.20 128.78 1v5m s ILE 109 Ca 0.04 1.12 0.00 0.00 0.00 0.00 0.00 60.65 61.82 1v5m s ILE 109 Cb -0.20 -4.40 -0.03 0.00 0.01 0.00 0.00 42.46 37.85 1v5m s ILE 109 CO -0.06 -0.67 -0.08 -0.76 0.00 0.00 0.00 174.94 173.37 1v5m s LEU 110 N 3.68 3.07 -0.35 2.97 1.02 -1.03 -1.29 118.68 126.74 1v5m s LEU 110 Ca 0.39 -0.09 -0.08 0.00 0.02 0.00 0.00 54.13 54.37 1v5m s LEU 110 Cb -0.11 -1.67 0.03 0.00 0.02 0.00 0.00 46.19 44.46 1v5m s LEU 110 CO 0.22 0.31 0.14 -0.70 0.02 0.00 0.00 176.35 176.35 1v5m s GLU 111 N -0.51 2.72 0.45 1.70 2.12 -0.23 -2.70 118.70 122.24 1v5m s GLU 111 Ca 0.07 -1.13 -0.05 0.00 0.36 0.00 0.00 54.97 54.22 1v5m s GLU 111 Cb -0.12 -3.57 0.10 0.00 0.26 0.00 0.00 34.13 30.80 1v5m s GLU 111 CO 0.02 -0.67 0.61 0.25 -0.54 0.00 0.00 175.26 174.93 1v5m n THR 112 N 4.89 0.00 0.14 -1.70 -2.24 0.96 -3.41 114.28 112.92 1v5m n THR 112 Ca -0.12 -0.61 -0.06 0.00 -2.27 0.00 0.00 64.05 60.99 1v5m n THR 112 Cb 0.45 -1.52 -0.03 0.00 -2.10 0.00 0.00 70.33 67.14 1v5m n THR 112 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 1v5m h ILE 113 N -1.05 0.00 -3.40 2.28 5.03 -1.92 -3.47 117.51 114.98 1v5m h ILE 113 Ca -0.20 -0.23 -0.23 0.00 -0.12 0.00 0.00 64.86 64.08 1v5m h ILE 113 Cb 0.61 0.00 -0.06 0.00 -3.03 0.00 0.00 36.82 34.33 1v5m h ILE 113 CO 0.16 0.00 -0.21 -0.67 -0.68 0.00 0.00 178.15 176.75 1v5m n ASP 114 N -3.67 -0.42 -0.08 1.72 -0.08 -1.26 -4.99 116.55 107.77 1v5m n ASP 114 Ca -0.05 -2.10 0.08 0.00 -1.51 0.00 0.00 54.79 51.21 1v5m n ASP 114 Cb 0.15 0.93 0.44 0.00 2.34 0.00 0.00 41.12 44.98 1v5m n ASP 114 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 1v5m h SER 115 N 1.05 0.48 0.74 1.67 4.64 -1.92 -1.12 113.55 119.08 1v5m h SER 115 Ca -0.12 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.16 1v5m h SER 115 Cb 0.62 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 1v5m h SER 115 CO 0.18 0.31 -0.40 0.17 -0.87 0.00 0.00 176.83 176.22 1v5m h LEU 116 N 0.54 -0.98 -0.95 5.97 -0.00 -1.96 0.93 115.31 118.86 1v5m h LEU 116 Ca 0.25 0.04 0.06 0.00 -0.00 0.00 0.00 57.88 58.23 1v5m h LEU 116 Cb 0.29 0.27 -0.06 0.00 -0.00 0.00 0.00 40.66 41.15 1v5m h LEU 116 CO -0.07 -0.65 0.61 1.56 -0.00 0.00 0.00 178.44 179.89 1v5m h GLN 117 N -1.05 1.09 0.08 0.17 1.08 -1.91 -1.91 115.11 112.65 1v5m h GLN 117 Ca -0.10 -0.07 -0.00 0.00 -1.45 0.00 0.00 58.65 57.03 1v5m h GLN 117 Cb 0.82 -0.25 0.00 0.00 -0.05 0.00 0.00 27.48 28.01 1v5m h GLN 117 CO 0.14 0.72 -0.04 -0.22 -0.95 0.00 0.00 178.83 178.48 1v5m h LYS 118 N 1.12 -0.10 -0.96 1.46 3.64 -1.06 -1.57 116.57 119.10 1v5m h LYS 118 Ca 0.40 0.01 0.31 0.00 -1.27 0.00 0.00 60.65 60.10 1v5m h LYS 118 Cb 0.13 0.02 -0.16 0.00 -0.41 0.00 0.00 32.23 31.81 1v5m h LYS 118 CO -0.16 -0.07 0.34 1.25 -2.27 0.00 0.00 179.45 178.54 1v5m h HIS 119 N -0.10 0.51 0.40 1.91 2.76 -0.78 0.98 115.15 120.82 1v5m h HIS 119 Ca -0.01 0.05 -0.01 0.00 -2.20 0.00 0.00 60.37 58.20 1v5m h HIS 119 Cb 0.08 -0.07 -0.01 0.00 1.55 0.00 0.00 27.41 28.96 1v5m h HIS 119 CO 0.20 -0.31 -0.31 1.03 -1.30 0.00 0.00 177.93 177.24 1v5m h SER 120 N 0.14 -0.81 -0.20 3.26 0.87 -1.22 -2.58 113.55 113.02 1v5m h SER 120 Ca 0.67 0.06 0.05 0.00 -1.23 0.00 0.00 61.79 61.35 1v5m h SER 120 Cb 1.54 0.26 -0.07 0.00 -0.44 0.00 0.00 62.40 63.68 1v5m h SER 120 CO -0.73 -0.46 -0.39 -0.50 -0.53 0.00 0.00 176.83 174.22 1v5m h TRP 121 N -0.70 -1.12 -0.60 2.24 4.06 0.22 0.27 115.95 120.31 1v5m h TRP 121 Ca -0.03 0.05 0.17 0.00 2.06 0.00 0.00 58.89 61.14 1v5m h TRP 121 Cb 0.61 0.52 -0.02 0.00 -1.00 0.00 0.00 29.16 29.26 1v5m h TRP 121 CO -0.15 -0.45 0.66 0.28 -3.56 0.00 0.00 178.44 175.22 1v5m h VAL 122 N -0.42 0.28 0.09 1.49 2.07 -1.27 -0.18 116.25 118.30 1v5m h VAL 122 Ca 0.10 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.61 1v5m h VAL 122 Cb 0.60 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 1v5m h VAL 122 CO -0.43 0.00 -0.05 0.00 0.02 0.00 0.00 177.57 177.11 1v5m h ALA 123 N 1.26 -0.13 0.11 1.67 0.00 -0.08 -2.67 119.26 119.43 1v5m h ALA 123 Ca 0.29 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1v5m h ALA 123 Cb 1.59 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 19.41 1v5m h ALA 123 CO -0.00 -0.14 -0.21 0.38 0.00 0.00 0.00 179.25 179.28 1v5m h ASP 124 N -0.98 -0.58 0.30 0.00 2.03 -0.37 0.38 116.42 117.20 1v5m h ASP 124 Ca -0.01 0.07 -0.01 0.00 -0.73 0.00 0.00 57.03 56.35 1v5m h ASP 124 Cb 0.41 0.22 -0.01 0.00 -0.83 0.00 0.00 39.33 39.12 1v5m h ASP 124 CO 0.02 -0.29 -0.31 0.40 -1.03 0.00 0.00 179.24 178.03 1v5m h ILE 125 N -0.39 0.00 -0.50 4.15 2.04 -1.25 -0.76 117.51 120.81 1v5m h ILE 125 Ca 0.03 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.98 1v5m h ILE 125 Cb 0.41 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 36.41 1v5m h ILE 125 CO -0.11 0.00 0.01 1.56 0.00 0.00 0.00 178.15 179.61 1v5m h GLN 126 N -0.61 0.13 -0.75 2.37 1.08 -1.44 0.17 115.11 116.06 1v5m h GLN 126 Ca -0.04 -0.01 0.15 0.00 -1.45 0.00 0.00 58.65 57.30 1v5m h GLN 126 Cb 0.53 -0.03 -0.05 0.00 -0.05 0.00 0.00 27.48 27.88 1v5m h GLN 126 CO -0.05 0.08 0.50 0.78 -0.95 0.00 0.00 178.83 179.20 1v5m h GLY 127 N 0.13 0.70 1.13 3.46 0.00 -0.03 -1.31 103.07 107.15 1v5m h GLY 127 Ca 0.25 -0.18 -0.23 0.00 0.00 0.00 0.00 47.33 47.18 1v5m h GLY 127 CO -0.40 0.06 -0.82 0.00 0.00 0.00 0.00 176.54 175.37 1v5m h VAL 129 N 0.41 0.04 0.00 0.00 2.07 -0.16 -3.37 116.25 115.24 1v5m h VAL 129 Ca -0.08 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.44 1v5m h VAL 129 Cb 1.47 0.04 0.00 0.00 -1.52 0.00 0.00 31.29 31.28 1v5m h VAL 129 CO 0.17 0.00 0.00 -0.67 0.02 0.00 0.00 177.57 177.09 1v5m n ASP 130 N -5.59 1.01 -3.64 0.57 2.03 -1.22 -4.99 116.55 104.73 1v5m n ASP 130 Ca 0.14 0.17 -0.05 0.00 0.52 0.00 0.00 54.79 55.57 1v5m n ASP 130 Cb 0.47 -0.27 -0.06 0.00 -0.72 0.00 0.00 41.12 40.53 1v5m n ASP 130 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 1v5m s SER 131 N -5.91 -0.19 -0.29 1.67 0.15 0.67 -5.09 113.70 104.71 1v5m s SER 131 Ca 0.00 0.31 -0.21 0.00 0.70 0.00 0.00 55.95 56.75 1v5m s SER 131 Cb 0.00 0.30 0.13 0.00 -1.71 0.00 0.00 66.02 64.74 1v5m s SER 131 CO 0.00 -0.09 1.01 -0.83 1.20 0.00 0.00 173.24 174.52 1v5m s GLY 132 N -0.28 -0.10 0.46 9.45 0.00 -0.39 -4.54 107.32 111.92 1v5m s GLY 132 Ca 0.05 2.87 -0.23 0.00 0.00 0.00 0.00 44.72 47.42 1v5m s GLY 132 CO -0.10 2.16 1.17 2.56 0.00 0.00 0.00 173.10 178.89 1v5m s PRO 133 N 0.72 3.76 -0.11 2.90 0.04 -1.26 -4.88 135.00 136.16 1v5m s PRO 133 Ca -0.02 1.78 -0.02 0.00 0.04 0.00 0.00 61.00 62.78 1v5m s PRO 133 Cb -0.04 -2.41 -0.03 0.00 0.04 0.00 0.00 34.50 32.06 1v5m s PRO 133 CO -0.10 -0.55 -0.04 -1.12 0.04 0.00 0.00 177.00 175.22 1v5m s SER 134 N -1.36 4.85 -0.43 6.66 0.01 -1.26 -5.04 113.70 117.14 1v5m s SER 134 Ca 0.63 -0.04 -0.14 0.00 1.31 0.00 0.00 55.95 57.72 1v5m s SER 134 Cb -0.29 -1.53 0.05 0.00 0.21 0.00 0.00 66.02 64.46 1v5m s SER 134 CO 0.35 0.27 0.32 -0.94 0.41 0.00 0.00 173.24 173.64 1v5m s SER 135 N -0.25 6.01 0.00 2.44 1.04 -1.26 -5.12 113.70 116.55 1v5m s SER 135 Ca 0.04 -1.14 0.00 0.00 0.48 0.00 0.00 55.95 55.34 1v5m s SER 135 Cb -0.13 -2.13 0.00 0.00 0.10 0.00 0.00 66.02 63.87 1v5m s SER 135 CO 0.02 -0.52 0.07 0.61 0.98 0.00 0.00 173.24 174.40