#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 -0.02 -0.13 1.61 1.04 -1.26 -5.13 113.70 109.82 1v5m s SER 2 Ca 0.00 -0.62 -0.30 0.00 0.48 0.00 0.00 55.95 55.51 1v5m s SER 2 Cb 0.00 0.49 0.10 0.00 0.10 0.00 0.00 66.02 66.70 1v5m s SER 2 CO 0.00 -0.96 0.83 -0.55 0.98 0.00 0.00 173.24 173.54 1v5m s SER 3 N -3.33 -0.54 0.00 7.02 0.15 -1.26 -5.17 113.70 110.56 1v5m s SER 3 Ca 0.20 0.67 0.00 0.00 0.70 0.00 0.00 55.95 57.52 1v5m s SER 3 Cb -0.02 0.55 0.00 0.00 -1.71 0.00 0.00 66.02 64.84 1v5m s SER 3 CO 0.05 -0.45 0.00 0.61 1.20 0.00 0.00 173.24 174.65 1v5m n GLY 4 N 1.08 3.00 3.52 9.45 0.00 -1.26 -5.18 105.19 115.79 1v5m n GLY 4 Ca -0.15 -0.29 -0.11 0.00 0.00 0.00 0.00 46.02 45.47 1v5m n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1v5m s SER 5 N 1.00 -0.45 -0.04 1.61 0.15 -1.26 -5.16 113.70 109.55 1v5m s SER 5 Ca 0.00 0.25 -0.02 0.00 0.70 0.00 0.00 55.95 56.88 1v5m s SER 5 Cb 0.00 0.42 0.03 0.00 -1.71 0.00 0.00 66.02 64.76 1v5m s SER 5 CO 0.00 -0.58 0.06 -0.44 1.20 0.00 0.00 173.24 173.48 1v5m s SER 6 N -1.87 1.00 0.19 5.45 0.01 -1.26 -5.15 113.70 112.07 1v5m s SER 6 Ca -0.00 0.09 0.02 0.00 1.31 0.00 0.00 55.95 57.37 1v5m s SER 6 Cb -0.01 -0.11 -0.05 0.00 0.21 0.00 0.00 66.02 66.07 1v5m s SER 6 CO -0.03 -0.24 -0.00 -0.83 0.41 0.00 0.00 173.24 172.55 1v5m s GLY 7 N 2.05 1.32 -1.05 3.44 0.00 -1.26 -5.06 107.32 106.76 1v5m s GLY 7 Ca 0.03 -1.64 -0.24 0.00 0.00 0.00 0.00 44.72 42.88 1v5m s GLY 7 CO -0.03 -1.57 1.94 -1.31 0.00 0.00 0.00 173.10 172.12 1v5m s ASN 8 N -3.21 5.10 -0.21 1.64 0.01 -1.26 -4.85 114.94 112.16 1v5m s ASN 8 Ca 0.25 -1.20 -0.20 0.00 -0.71 0.00 0.00 52.86 51.00 1v5m s ASN 8 Cb 0.06 -2.58 0.06 0.00 0.41 0.00 0.00 41.25 39.20 1v5m s ASN 8 CO 0.05 -2.91 0.57 -1.48 -1.51 0.00 0.00 177.10 171.83 1v5m s LEU 9 N 10.52 -0.20 0.05 0.60 0.05 -1.26 -5.07 118.68 123.37 1v5m s LEU 9 Ca 0.69 1.13 -0.29 0.00 0.05 0.00 0.00 54.13 55.71 1v5m s LEU 9 Cb -0.04 1.98 -0.17 0.00 -2.05 0.00 0.00 46.19 45.91 1v5m s LEU 9 CO 0.06 -0.22 1.46 0.00 -0.55 0.00 0.00 176.35 177.10 1v5m h ALA 10 N 5.14 -0.69 -5.42 1.48 0.00 -2.08 -3.47 119.26 114.22 1v5m h ALA 10 Ca -0.28 -0.18 -0.37 0.00 0.00 0.00 0.00 54.91 54.08 1v5m h ALA 10 Cb 1.17 0.27 0.13 0.00 0.00 0.00 0.00 17.79 19.35 1v5m h ALA 10 CO 0.15 -0.82 -0.62 0.00 0.00 0.00 0.00 179.25 177.96 1v5m n ALA 11 N -2.47 -1.20 -2.70 0.00 0.00 -1.26 -4.93 120.51 107.95 1v5m n ALA 11 Ca -0.12 0.37 -0.33 0.00 0.00 0.00 0.00 53.44 53.36 1v5m n ALA 11 Cb 0.31 -5.10 -0.01 0.00 0.00 0.00 0.00 19.45 14.66 1v5m n ALA 11 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1v5m n LYS 12 N -4.63 4.05 -0.71 0.00 2.85 -1.26 -5.06 118.16 113.40 1v5m n LYS 12 Ca 0.01 -4.65 -0.32 0.00 -1.05 0.00 0.00 58.31 52.30 1v5m n LYS 12 Cb 0.56 -2.33 0.16 0.00 -0.65 0.00 0.00 35.03 32.77 1v5m n LYS 12 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 177.40 178.68 1v5m n VAL 13 N -0.23 0.00 -3.80 0.58 0.24 -1.26 -4.99 118.33 108.87 1v5m n VAL 13 Ca 0.40 -0.20 -0.30 0.00 -2.04 0.00 0.00 64.34 62.20 1v5m n VAL 13 Cb 0.36 -0.75 -0.13 0.00 -1.47 0.00 0.00 33.84 31.85 1v5m n VAL 13 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 1v5m s GLU 14 N -3.91 1.58 0.12 7.34 2.12 -1.26 -5.09 118.70 119.60 1v5m s GLU 14 Ca 0.60 -2.28 -0.09 0.00 0.36 0.00 0.00 54.97 53.56 1v5m s GLU 14 Cb -0.20 -2.73 -0.00 0.00 0.26 0.00 0.00 34.13 31.45 1v5m s GLU 14 CO 0.65 -1.15 0.23 -0.51 -0.54 0.00 0.00 175.26 173.94 1v5m s LEU 15 N 0.05 1.21 0.13 2.70 1.43 -1.26 -5.13 118.68 117.81 1v5m s LEU 15 Ca 0.18 -0.71 -0.31 0.00 -1.03 0.00 0.00 54.13 52.26 1v5m s LEU 15 Cb -0.24 1.13 -0.10 0.00 0.03 0.00 0.00 46.19 47.01 1v5m s LEU 15 CO -0.01 -0.79 1.74 0.54 0.23 0.00 0.00 176.35 178.06 1v5m s VAL 16 N -3.90 2.61 0.06 -1.59 0.11 -1.26 -4.90 120.40 111.54 1v5m s VAL 16 Ca 0.09 0.21 -0.12 0.00 -2.93 0.00 0.00 61.98 59.23 1v5m s VAL 16 Cb 0.04 -3.13 -0.03 0.00 -1.53 0.00 0.00 36.38 31.73 1v5m s VAL 16 CO -0.07 0.00 0.98 0.47 -3.33 0.00 0.00 175.10 173.15 1v5m n ASP 17 N 5.22 -0.41 -4.64 3.54 9.92 -1.26 -4.32 116.55 124.60 1v5m n ASP 17 Ca 0.16 1.07 -0.50 0.00 -0.53 0.00 0.00 54.79 54.99 1v5m n ASP 17 Cb 0.38 -0.28 -0.05 0.00 -0.64 0.00 0.00 41.12 40.53 1v5m n ASP 17 CO 0.00 0.00 0.00 -0.38 0.13 0.00 0.00 177.20 176.95 1v5m n ILE 18 N -3.87 0.08 -0.08 0.53 -0.00 -1.26 -4.30 119.36 110.45 1v5m n ILE 18 Ca 0.01 -0.01 -0.10 0.00 -0.00 0.00 0.00 62.75 62.65 1v5m n ILE 18 Cb 0.10 -1.22 -0.04 0.00 -0.00 0.00 0.00 39.64 38.48 1v5m n ILE 18 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1v5m n GLN 19 N 3.48 0.49 -3.71 0.38 1.13 -0.14 -5.01 117.38 114.01 1v5m n GLN 19 Ca 0.19 0.46 -0.14 0.00 -1.94 0.00 0.00 57.00 55.57 1v5m n GLN 19 Cb 0.23 -1.64 -0.09 0.00 0.11 0.00 0.00 30.24 28.85 1v5m n GLN 19 CO 0.00 0.00 0.00 0.50 -1.44 0.00 0.00 177.06 176.12 1v5m s ARG 20 N -2.41 0.63 -0.13 -1.09 6.06 -1.25 -5.03 118.95 115.73 1v5m s ARG 20 Ca -0.21 0.32 -0.05 0.00 -2.50 0.00 0.00 55.73 53.29 1v5m s ARG 20 Cb 0.04 0.30 0.06 0.00 0.06 0.00 0.00 34.95 35.41 1v5m s ARG 20 CO 0.33 -0.13 0.26 -2.00 -2.50 0.00 0.00 175.30 171.26 1v5m s GLU 21 N -0.43 0.15 0.27 5.12 2.12 -1.26 -1.64 118.70 123.03 1v5m s GLU 21 Ca -0.06 0.72 -0.15 0.00 0.36 0.00 0.00 54.97 55.85 1v5m s GLU 21 Cb -0.03 -0.05 0.01 0.00 0.26 0.00 0.00 34.13 34.31 1v5m s GLU 21 CO 0.03 -0.28 0.57 0.20 -0.54 0.00 0.00 175.26 175.24 1v5m s GLY 22 N 2.32 0.38 -0.45 -1.50 0.00 -0.74 -5.01 107.32 102.32 1v5m s GLY 22 Ca 0.00 -0.72 -0.08 0.00 0.00 0.00 0.00 44.72 43.92 1v5m s GLY 22 CO -0.08 -0.46 0.30 0.00 0.00 0.00 0.00 173.10 172.86 1v5m s ALA 23 N -3.86 3.33 0.36 3.20 0.00 -1.26 -0.49 121.76 123.05 1v5m s ALA 23 Ca 0.19 -2.46 0.03 0.00 0.00 0.00 0.00 51.96 49.73 1v5m s ALA 23 Cb -0.03 -2.72 -0.04 0.00 0.00 0.00 0.00 23.12 20.33 1v5m s ALA 23 CO 0.09 -1.83 0.09 -0.48 0.00 0.00 0.00 175.76 173.63 1v5m s LEU 24 N 1.34 2.06 -0.08 0.00 2.34 0.04 -4.93 118.68 119.45 1v5m s LEU 24 Ca 0.05 -1.51 -0.08 0.00 0.06 0.00 0.00 54.13 52.66 1v5m s LEU 24 Cb -0.25 -0.24 -0.04 0.00 -0.56 0.00 0.00 46.19 45.10 1v5m s LEU 24 CO -0.01 -0.76 0.20 -0.13 -1.06 0.00 0.00 176.35 174.59 1v5m s ARG 25 N -3.83 3.52 0.20 1.48 0.52 -1.18 -1.04 118.95 118.63 1v5m s ARG 25 Ca 0.30 -0.07 0.05 0.00 -0.52 0.00 0.00 55.73 55.49 1v5m s ARG 25 Cb 0.06 -3.17 -0.05 0.00 0.52 0.00 0.00 34.95 32.31 1v5m s ARG 25 CO 0.15 0.74 -0.06 -0.59 0.02 0.00 0.00 175.30 175.56 1v5m s PHE 26 N -1.10 1.49 0.19 -0.53 -0.71 -0.66 -0.14 117.98 116.52 1v5m s PHE 26 Ca 0.19 -0.81 -0.17 0.00 -1.04 0.00 0.00 56.93 55.10 1v5m s PHE 26 Cb -0.13 -0.81 0.02 0.00 -1.21 0.00 0.00 43.02 40.89 1v5m s PHE 26 CO 0.08 0.07 0.50 0.00 -1.34 0.00 0.00 175.22 174.53 1v5m s MET 27 N -3.79 1.35 -0.13 1.99 0.23 -0.21 -2.26 119.30 116.49 1v5m s MET 27 Ca 0.24 -0.89 0.02 0.00 -1.03 0.00 0.00 55.69 54.03 1v5m s MET 27 Cb 0.04 0.51 0.01 0.00 -1.53 0.00 0.00 34.83 33.86 1v5m s MET 27 CO 0.06 -0.57 -0.19 0.08 -2.03 0.00 0.00 175.02 172.37 1v5m s VAL 28 N -3.88 1.79 -0.47 5.16 1.01 -1.26 -0.52 120.40 122.23 1v5m s VAL 28 Ca 0.10 -0.81 -0.27 0.00 0.00 0.00 0.00 61.98 61.00 1v5m s VAL 28 Cb -0.00 -1.60 -0.04 0.00 0.00 0.00 0.00 36.38 34.73 1v5m s VAL 28 CO -0.03 0.50 2.13 0.00 0.00 0.00 0.00 175.10 177.70 1v5m s ALA 29 N 0.91 2.12 -0.03 5.51 0.00 -1.14 -4.87 121.76 124.26 1v5m s ALA 29 Ca -0.06 -0.04 -0.30 0.00 0.00 0.00 0.00 51.96 51.56 1v5m s ALA 29 Cb -0.15 -4.25 0.11 0.00 0.00 0.00 0.00 23.12 18.83 1v5m s ALA 29 CO -0.02 -3.80 0.97 0.34 0.00 0.00 0.00 175.76 173.24 1v5m s ASP 30 N 9.56 -0.30 -0.58 0.00 2.15 -1.26 -4.79 116.67 121.46 1v5m s ASP 30 Ca 0.86 -0.03 -0.21 0.00 0.43 0.00 0.00 52.55 53.60 1v5m s ASP 30 Cb -0.19 0.34 0.06 0.00 -0.30 0.00 0.00 42.92 42.83 1v5m s ASP 30 CO 0.27 -0.55 0.83 -1.81 -0.17 0.00 0.00 175.17 173.73 1v5m s ASP 31 N -2.46 6.23 0.11 -0.34 1.11 -1.26 -5.02 116.67 115.04 1v5m s ASP 31 Ca 0.07 -0.86 0.07 0.00 0.18 0.00 0.00 52.55 52.00 1v5m s ASP 31 Cb -0.01 -2.37 -0.04 0.00 1.07 0.00 0.00 42.92 41.58 1v5m s ASP 31 CO -0.07 -1.18 -0.17 0.00 1.18 0.00 0.00 175.17 174.93 1v5m s ALA 32 N 3.43 1.58 0.69 5.23 0.00 -1.26 -5.14 121.76 126.30 1v5m s ALA 32 Ca 0.21 -1.24 -0.14 0.00 0.00 0.00 0.00 51.96 50.78 1v5m s ALA 32 Cb -0.17 -0.14 0.02 0.00 0.00 0.00 0.00 23.12 22.82 1v5m s ALA 32 CO 0.12 0.21 1.13 0.00 0.00 0.00 0.00 175.76 177.23 1v5m s ALA 33 N -1.65 2.33 0.05 0.00 0.00 -1.26 -5.04 121.76 116.19 1v5m s ALA 33 Ca 0.07 0.61 0.02 0.00 0.00 0.00 0.00 51.96 52.65 1v5m s ALA 33 Cb -0.08 -3.36 -0.04 0.00 0.00 0.00 0.00 23.12 19.65 1v5m s ALA 33 CO 0.04 -1.51 0.09 0.45 0.00 0.00 0.00 175.76 174.82 1v5m s SER 34 N -2.51 5.62 0.00 0.00 0.15 -1.26 -5.13 113.70 110.58 1v5m s SER 34 Ca 0.68 0.06 0.00 0.00 0.70 0.00 0.00 55.95 57.39 1v5m s SER 34 Cb -0.22 -1.56 0.00 0.00 -1.71 0.00 0.00 66.02 62.53 1v5m s SER 34 CO 0.44 0.21 0.00 0.61 1.20 0.00 0.00 173.24 175.70 1v5m n GLY 35 N 0.70 2.87 3.74 9.45 0.00 -1.26 -5.11 105.19 115.58 1v5m n GLY 35 Ca -0.10 -2.07 -0.30 0.00 0.00 0.00 0.00 46.02 43.55 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 1.40 1.73 0.00 1.61 0.04 -1.26 -4.91 135.00 133.61 1v5m s PRO 36 Ca 0.00 0.98 0.00 0.00 0.04 0.00 0.00 61.00 62.02 1v5m s PRO 36 Cb 0.00 -1.85 0.00 0.00 0.04 0.00 0.00 34.50 32.69 1v5m s PRO 36 CO 0.00 -1.96 0.00 0.41 0.04 0.00 0.00 177.00 175.49 1v5m n GLY 37 N -1.17 -0.92 2.56 0.56 0.00 -1.26 -4.78 105.19 100.18 1v5m n GLY 37 Ca 0.08 -1.63 -0.29 0.00 0.00 0.00 0.00 46.02 44.18 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 -0.81 5.93 3.88 -0.02 0.00 -1.26 -5.04 105.19 107.87 1v5m n GLY 38 Ca 0.00 -2.72 -0.26 0.00 0.00 0.00 0.00 46.02 43.04 1v5m n GLY 38 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1v5m s THR 39 N -5.44 4.96 0.56 2.61 2.01 -1.26 -5.10 115.64 113.99 1v5m s THR 39 Ca 0.49 -0.88 -0.18 0.00 0.31 0.00 0.00 61.69 61.42 1v5m s THR 39 Cb 0.40 -3.56 -0.05 0.00 0.01 0.00 0.00 72.50 69.30 1v5m s THR 39 CO -0.22 -0.12 1.10 0.00 -0.69 0.00 0.00 174.62 174.68 1v5m s ALA 40 N -1.77 2.69 0.38 7.40 0.00 -1.26 -4.91 121.76 124.29 1v5m s ALA 40 Ca 0.33 0.67 0.17 0.00 0.00 0.00 0.00 51.96 53.12 1v5m s ALA 40 Cb -0.10 -3.31 1.06 0.00 0.00 0.00 0.00 23.12 20.76 1v5m s ALA 40 CO 0.26 -0.78 1.76 1.96 0.00 0.00 0.00 175.76 178.96 1v5m h GLN 41 N 0.95 0.42 -4.30 0.00 4.20 -1.99 -3.43 115.11 110.97 1v5m h GLN 41 Ca -0.49 -0.03 -0.52 0.00 0.06 0.00 0.00 58.65 57.68 1v5m h GLN 41 Cb 1.24 -0.09 0.06 0.00 0.30 0.00 0.00 27.48 28.99 1v5m h GLN 41 CO 0.57 0.28 -0.18 0.91 -0.67 0.00 0.00 178.83 179.74 1v5m n TRP 42 N -4.69 0.03 -4.92 2.96 7.02 -1.26 -4.94 117.44 111.64 1v5m n TRP 42 Ca 0.26 0.73 -0.28 0.00 -1.02 0.00 0.00 57.50 57.18 1v5m n TRP 42 Cb 0.86 -1.45 -0.17 0.00 -2.42 0.00 0.00 31.31 28.14 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 -0.38 2.40 0.23 -0.99 -1.52 -0.96 -4.94 119.66 113.51 1v5m s GLN 43 Ca 0.55 -0.66 -0.32 0.00 -1.95 0.00 0.00 55.36 52.99 1v5m s GLN 43 Cb -0.78 -1.87 -0.12 0.00 -0.22 0.00 0.00 33.01 30.02 1v5m s GLN 43 CO 0.40 0.11 1.65 1.63 -0.25 0.00 0.00 175.29 178.83 1v5m n LYS 44 N 3.66 2.64 -3.78 2.91 5.02 -1.26 -1.65 118.16 125.70 1v5m n LYS 44 Ca -0.21 0.95 -0.09 0.00 -2.02 0.00 0.00 58.31 56.94 1v5m n LYS 44 Cb 0.52 -2.75 -0.03 0.00 -0.02 0.00 0.00 35.03 32.75 1v5m n LYS 44 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1v5m s ARG 46 N -3.89 2.22 -0.16 0.00 3.52 -0.70 -0.78 118.95 119.15 1v5m s ARG 46 Ca 0.10 -0.90 -0.26 0.00 -0.13 0.00 0.00 55.73 54.54 1v5m s ARG 46 Cb -0.03 -2.50 -0.01 0.00 -1.56 0.00 0.00 34.95 30.85 1v5m s ARG 46 CO 0.02 -0.41 0.84 -1.17 -0.81 0.00 0.00 175.30 173.77 1v5m s LEU 47 N 1.34 4.18 -0.21 -0.88 2.96 0.36 -2.78 118.68 123.66 1v5m s LEU 47 Ca -0.01 1.20 -0.00 0.00 -0.22 0.00 0.00 54.13 55.10 1v5m s LEU 47 Cb -0.16 -3.25 0.05 0.00 0.50 0.00 0.00 46.19 43.33 1v5m s LEU 47 CO -0.09 -0.40 -0.04 -0.22 -1.32 0.00 0.00 176.35 174.29 1v5m s LEU 48 N 2.12 2.08 -0.46 -0.68 2.96 -1.14 -1.78 118.68 121.79 1v5m s LEU 48 Ca 0.39 -0.98 -0.12 0.00 -0.22 0.00 0.00 54.13 53.20 1v5m s LEU 48 Cb -0.17 -1.02 0.09 0.00 0.50 0.00 0.00 46.19 45.60 1v5m s LEU 48 CO 0.13 -0.23 0.35 -0.22 -1.32 0.00 0.00 176.35 175.06 1v5m s LEU 49 N 1.53 5.53 0.42 -0.68 0.20 -0.65 -3.08 118.68 121.95 1v5m s LEU 49 Ca -0.03 -1.54 0.06 0.00 0.69 0.00 0.00 54.13 53.31 1v5m s LEU 49 Cb -0.18 -2.09 -0.07 0.00 -0.43 0.00 0.00 46.19 43.43 1v5m s LEU 49 CO -0.07 -0.64 0.01 -0.60 -0.29 0.00 0.00 176.35 174.76 1v5m s ARG 50 N 1.51 1.97 0.57 1.98 3.52 -1.24 -0.96 118.95 126.31 1v5m s ARG 50 Ca 0.04 -2.14 -0.14 0.00 -0.13 0.00 0.00 55.73 53.36 1v5m s ARG 50 Cb -0.25 -1.59 -0.05 0.00 -1.56 0.00 0.00 34.95 31.50 1v5m s ARG 50 CO 0.03 -0.10 1.02 1.03 -0.81 0.00 0.00 175.30 176.47 1v5m s ARG 51 N -3.74 3.66 0.34 5.12 0.52 -1.26 -3.44 118.95 120.16 1v5m s ARG 51 Ca 0.32 0.92 0.08 0.00 -0.52 0.00 0.00 55.73 56.53 1v5m s ARG 51 Cb 0.09 -2.09 -0.04 0.00 0.52 0.00 0.00 34.95 33.43 1v5m s ARG 51 CO 0.16 -0.51 0.19 0.00 0.02 0.00 0.00 175.30 175.15 1v5m s ALA 52 N -2.82 3.60 0.66 2.13 0.00 -1.23 -4.76 121.76 119.34 1v5m s ALA 52 Ca 0.58 -1.79 -0.11 0.00 0.00 0.00 0.00 51.96 50.65 1v5m s ALA 52 Cb -0.11 -0.85 -0.02 0.00 0.00 0.00 0.00 23.12 22.14 1v5m s ALA 52 CO 0.41 0.02 1.05 0.14 0.00 0.00 0.00 175.76 177.38 1v5m s VAL 53 N -2.40 4.32 0.04 0.00 -7.23 -1.26 -4.89 120.40 108.98 1v5m s VAL 53 Ca 0.39 0.75 -0.25 0.00 -1.81 0.00 0.00 61.98 61.06 1v5m s VAL 53 Cb -0.03 -3.68 -0.13 0.00 0.56 0.00 0.00 36.38 33.10 1v5m s VAL 53 CO 0.24 -0.99 0.63 0.00 -0.31 0.00 0.00 175.10 174.67 1v5m n ALA 54 N -2.90 -2.55 0.00 1.32 0.00 -1.26 -2.33 120.51 112.78 1v5m n ALA 54 Ca 0.07 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.89 1v5m n ALA 54 Cb 0.54 -1.17 0.00 0.00 0.00 0.00 0.00 19.45 18.82 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 1.11 2.48 3.79 0.00 0.00 -1.26 -5.03 105.19 106.28 1v5m n GLY 55 Ca 0.13 -0.73 -0.38 0.00 0.00 0.00 0.00 46.02 45.03 1v5m n GLY 55 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1v5m s GLU 56 N 0.00 4.18 0.00 1.61 2.56 -0.99 -5.02 118.70 121.04 1v5m s GLU 56 Ca 0.00 0.59 0.00 0.00 0.00 0.00 0.00 54.97 55.56 1v5m s GLU 56 Cb 0.00 -3.30 0.00 0.00 2.00 0.00 0.00 34.13 32.83 1v5m s GLU 56 CO 0.00 0.49 0.84 0.54 -0.56 0.00 0.00 175.26 176.56 1v5m n ARG 57 N 2.39 0.00 -4.22 4.30 5.12 -1.26 -4.36 116.66 118.63 1v5m n ARG 57 Ca -0.10 0.50 -0.13 0.00 -1.93 0.00 0.00 57.85 56.19 1v5m n ARG 57 Cb 0.51 -1.42 -0.10 0.00 -1.16 0.00 0.00 32.46 30.30 1v5m n ARG 57 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 1v5m s PHE 58 N -2.67 1.17 -0.02 -1.55 0.40 -1.26 -3.48 117.98 110.57 1v5m s PHE 58 Ca 0.00 -1.24 0.00 0.00 -0.60 0.00 0.00 56.93 55.09 1v5m s PHE 58 Cb 0.00 -0.63 0.03 0.00 0.51 0.00 0.00 43.02 42.93 1v5m s PHE 58 CO 0.00 -0.47 0.02 0.50 0.70 0.00 0.00 175.22 175.97 1v5m s ARG 59 N -4.06 0.07 -0.11 0.44 3.52 -1.22 -1.56 118.95 116.02 1v5m s ARG 59 Ca 0.32 0.16 -0.04 0.00 -0.13 0.00 0.00 55.73 56.04 1v5m s ARG 59 Cb 0.07 -0.33 -0.04 0.00 -1.56 0.00 0.00 34.95 33.09 1v5m s ARG 59 CO 0.08 -0.16 0.03 -1.17 -0.81 0.00 0.00 175.30 173.27 1v5m s LEU 60 N 1.10 3.74 -0.02 -0.88 1.98 0.49 -3.68 118.68 121.41 1v5m s LEU 60 Ca -0.09 0.18 0.06 0.00 -2.89 0.00 0.00 54.13 51.39 1v5m s LEU 60 Cb -0.13 -1.88 -0.01 0.00 0.66 0.00 0.00 46.19 44.82 1v5m s LEU 60 CO -0.03 0.34 -0.20 -1.61 -1.89 0.00 0.00 176.35 172.97 1v5m s GLU 61 N -0.67 1.68 -0.48 1.98 2.02 -1.18 -0.13 118.70 121.92 1v5m s GLU 61 Ca 0.11 -0.71 0.03 0.00 0.02 0.00 0.00 54.97 54.42 1v5m s GLU 61 Cb -0.12 -1.59 0.13 0.00 0.10 0.00 0.00 34.13 32.65 1v5m s GLU 61 CO 0.02 0.41 0.24 -0.06 0.02 0.00 0.00 175.26 175.90 1v5m s PHE 62 N -0.41 2.80 -0.45 1.61 0.40 -1.24 -2.87 117.98 117.82 1v5m s PHE 62 Ca 0.06 -2.91 -0.28 0.00 -0.60 0.00 0.00 56.93 53.20 1v5m s PHE 62 Cb -0.08 -2.51 0.00 0.00 0.51 0.00 0.00 43.02 40.93 1v5m s PHE 62 CO -0.00 -0.76 1.56 -0.06 0.70 0.00 0.00 175.22 176.65 1v5m s PHE 63 N -0.02 2.14 -0.25 0.36 0.08 -1.12 -1.51 117.98 117.67 1v5m s PHE 63 Ca 0.17 0.62 0.00 0.00 0.12 0.00 0.00 56.93 57.84 1v5m s PHE 63 Cb -0.25 -4.26 0.07 0.00 -0.57 0.00 0.00 43.02 38.00 1v5m s PHE 63 CO -0.00 -2.26 -0.01 0.08 -0.10 0.00 0.00 175.22 172.93 1v5m s VAL 64 N 6.35 1.36 1.03 -0.44 1.01 -1.26 -0.77 120.40 127.68 1v5m s VAL 64 Ca 0.64 -1.24 -0.13 0.00 0.00 0.00 0.00 61.98 61.25 1v5m s VAL 64 Cb -0.15 -1.74 0.21 0.00 0.00 0.00 0.00 36.38 34.69 1v5m s VAL 64 CO 0.30 -0.23 1.10 -2.16 0.00 0.00 0.00 175.10 174.10 1v5m s PRO 65 N 1.45 0.15 0.00 2.72 0.04 -1.26 -4.67 135.00 133.43 1v5m s PRO 65 Ca -0.02 0.42 0.00 0.00 0.04 0.00 0.00 61.00 61.44 1v5m s PRO 65 Cb -0.18 -1.71 0.00 0.00 0.04 0.00 0.00 34.50 32.64 1v5m s PRO 65 CO -0.09 -2.90 0.40 -0.35 0.04 0.00 0.00 177.00 174.10 1v5m n PRO 66 N -4.27 0.49 -0.02 0.56 -0.04 0.05 -2.05 135.00 129.71 1v5m n PRO 66 Ca 0.06 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.52 1v5m n PRO 66 Cb 0.58 -1.09 -0.07 0.00 -0.04 0.00 0.00 33.50 32.87 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 -0.22 1.32 -1.59 0.54 4.76 -1.26 -4.75 118.16 116.96 1v5m n LYS 67 Ca 0.00 -0.05 -0.39 0.00 -2.87 0.00 0.00 58.31 55.00 1v5m n LYS 67 Cb 0.05 -1.23 0.04 0.00 -1.84 0.00 0.00 35.03 32.04 1v5m n LYS 67 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1v5m n ALA 68 N -2.06 -0.03 -0.12 7.82 0.00 -0.87 -4.91 120.51 120.34 1v5m n ALA 68 Ca -0.08 0.07 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 1v5m n ALA 68 Cb 0.50 -2.06 -0.02 0.00 0.00 0.00 0.00 19.45 17.87 1v5m n ALA 68 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1v5m h SER 69 N 0.79 1.00 -3.17 0.00 0.02 -1.96 -3.45 113.55 106.79 1v5m h SER 69 Ca -0.47 -0.46 -0.63 0.00 -0.84 0.00 0.00 61.79 59.39 1v5m h SER 69 Cb 1.36 -0.28 -0.12 0.00 0.14 0.00 0.00 62.40 63.51 1v5m h SER 69 CO 0.52 1.25 -0.66 0.00 -1.14 0.00 0.00 176.83 176.80 1v5m s ARG 70 N -4.42 2.50 0.22 3.45 1.70 -1.26 -5.10 118.95 116.05 1v5m s ARG 70 Ca -0.11 -0.94 -0.30 0.00 -0.47 0.00 0.00 55.73 53.91 1v5m s ARG 70 Cb 0.11 -2.48 -0.09 0.00 -0.57 0.00 0.00 34.95 31.93 1v5m s ARG 70 CO 0.88 0.51 1.29 -1.25 -1.08 0.00 0.00 175.30 175.64 1v5m s PRO 71 N -2.56 4.41 -0.07 3.89 0.04 -1.26 -4.68 135.00 134.76 1v5m s PRO 71 Ca 0.26 2.05 -0.25 0.00 0.04 0.00 0.00 61.00 63.10 1v5m s PRO 71 Cb -0.11 -3.18 -0.26 0.00 0.04 0.00 0.00 34.50 30.99 1v5m s PRO 71 CO 0.18 -0.20 0.94 -0.22 0.04 0.00 0.00 177.00 177.74 1v5m h LYS 72 N 5.00 0.17 -2.25 4.56 3.64 -1.54 -3.38 116.57 122.77 1v5m h LYS 72 Ca -0.45 -0.23 -0.59 0.00 -1.27 0.00 0.00 60.65 58.11 1v5m h LYS 72 Cb 1.22 0.08 -0.42 0.00 -0.41 0.00 0.00 32.23 32.69 1v5m h LYS 72 CO 0.75 1.02 -0.66 0.28 -2.27 0.00 0.00 179.45 178.57 1v5m n VAL 73 N -4.43 2.72 -1.96 2.00 0.31 -1.05 -5.01 118.33 110.91 1v5m n VAL 73 Ca -0.11 -5.44 -0.42 0.00 -0.01 0.00 0.00 64.34 58.36 1v5m n VAL 73 Cb 0.58 -1.50 -0.03 0.00 -0.91 0.00 0.00 33.84 31.99 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 -3.19 5.66 -0.20 4.52 1.04 -1.26 -3.72 113.70 116.55 1v5m s SER 74 Ca 0.46 1.14 -0.03 0.00 0.48 0.00 0.00 55.95 58.00 1v5m s SER 74 Cb 0.25 -2.52 -0.01 0.00 0.10 0.00 0.00 66.02 63.84 1v5m s SER 74 CO -0.11 -1.92 -0.06 -0.63 0.98 0.00 0.00 173.24 171.50 1v5m s ILE 75 N 7.71 3.33 0.09 -1.02 1.01 0.82 -4.96 121.20 128.17 1v5m s ILE 75 Ca 0.80 -0.52 -0.31 0.00 0.00 0.00 0.00 60.65 60.62 1v5m s ILE 75 Cb -0.21 -2.49 -0.07 0.00 0.01 0.00 0.00 42.46 39.70 1v5m s ILE 75 CO 0.31 0.44 1.38 -2.16 0.00 0.00 0.00 174.94 174.91 1v5m s PRO 76 N 1.26 4.32 0.37 2.79 0.04 -1.26 -0.38 135.00 142.15 1v5m s PRO 76 Ca 0.03 2.03 0.19 0.00 0.04 0.00 0.00 61.00 63.30 1v5m s PRO 76 Cb -0.14 -3.32 1.23 0.00 0.04 0.00 0.00 34.50 32.32 1v5m s PRO 76 CO -0.02 -0.45 1.63 1.25 0.04 0.00 0.00 177.00 179.45 1v5m h LEU 77 N 7.08 0.40 -1.00 -3.56 7.12 -1.58 0.77 115.31 124.54 1v5m h LEU 77 Ca -0.41 0.20 0.18 0.00 0.13 0.00 0.00 57.88 57.97 1v5m h LEU 77 Cb 1.20 0.18 -0.10 0.00 -0.53 0.00 0.00 40.66 41.41 1v5m h LEU 77 CO 0.87 -0.24 0.61 0.28 -0.13 0.00 0.00 178.44 179.82 1v5m h SER 78 N 0.18 0.80 -0.98 1.25 0.02 -1.91 0.45 113.55 113.35 1v5m h SER 78 Ca 0.78 0.09 0.03 0.00 -0.84 0.00 0.00 61.79 61.85 1v5m h SER 78 Cb 2.02 -0.06 -0.06 0.00 0.14 0.00 0.00 62.40 64.45 1v5m h SER 78 CO -0.62 0.31 0.65 0.00 -1.14 0.00 0.00 176.83 176.02 1v5m h ALA 79 N 1.63 1.29 -2.72 3.77 0.00 0.20 -3.43 119.26 119.99 1v5m h ALA 79 Ca 0.56 -0.05 -0.53 0.00 0.00 0.00 0.00 54.91 54.89 1v5m h ALA 79 Cb 0.82 -0.36 0.08 0.00 0.00 0.00 0.00 17.79 18.33 1v5m h ALA 79 CO -0.36 0.56 0.91 -0.89 0.00 0.00 0.00 179.25 179.47 1v5m n ILE 80 N -4.44 0.71 0.00 0.00 2.08 0.15 0.44 119.36 118.29 1v5m n ILE 80 Ca 0.13 -0.18 0.00 0.00 0.56 0.00 0.00 62.75 63.26 1v5m n ILE 80 Cb 0.07 -1.95 0.00 0.00 -0.75 0.00 0.00 39.64 37.01 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 2.68 0.00 -3.78 1.39 -5.35 -0.56 -4.84 119.36 108.90 1v5m n ILE 81 Ca 0.11 0.00 -0.13 0.00 -0.27 0.00 0.00 62.75 62.46 1v5m n ILE 81 Cb 0.36 -0.53 -0.12 0.00 -1.74 0.00 0.00 39.64 37.61 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 -1.66 0.26 -0.37 6.28 2.56 -0.94 -5.06 118.70 119.78 1v5m s GLU 82 Ca 0.00 0.36 0.02 0.00 0.00 0.00 0.00 54.97 55.35 1v5m s GLU 82 Cb 0.00 0.09 0.11 0.00 2.00 0.00 0.00 34.13 36.33 1v5m s GLU 82 CO 0.00 -0.05 0.12 0.54 -0.56 0.00 0.00 175.26 175.30 1v5m s VAL 83 N 0.32 1.75 -0.83 3.70 0.11 -1.26 0.36 120.40 124.54 1v5m s VAL 83 Ca -0.02 -2.19 -0.25 0.00 -2.93 0.00 0.00 61.98 56.59 1v5m s VAL 83 Cb -0.03 -2.28 -0.06 0.00 -1.53 0.00 0.00 36.38 32.48 1v5m s VAL 83 CO -0.01 -0.69 2.04 -0.13 -3.33 0.00 0.00 175.10 172.98 1v5m s ARG 84 N 0.91 2.36 -0.09 1.54 0.52 -0.76 -4.80 118.95 118.64 1v5m s ARG 84 Ca 0.12 0.03 -0.00 0.00 -0.52 0.00 0.00 55.73 55.37 1v5m s ARG 84 Cb -0.20 -4.91 0.07 0.00 0.52 0.00 0.00 34.95 30.43 1v5m s ARG 84 CO -0.11 -3.50 1.80 0.25 0.02 0.00 0.00 175.30 173.76 1v5m n THR 85 N 7.97 2.01 -3.64 0.02 -2.24 -1.26 -1.94 114.28 115.20 1v5m n THR 85 Ca 0.39 -0.71 -0.01 0.00 -2.27 0.00 0.00 64.05 61.45 1v5m n THR 85 Cb 0.47 -1.33 -0.04 0.00 -2.10 0.00 0.00 70.33 67.33 1v5m n THR 85 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1v5m s THR 86 N -0.63 -0.93 0.31 4.28 2.01 -1.26 -4.98 115.64 114.45 1v5m s THR 86 Ca 0.09 0.00 0.04 0.00 0.31 0.00 0.00 61.69 62.13 1v5m s THR 86 Cb 0.07 -1.00 -0.02 0.00 0.01 0.00 0.00 72.50 71.56 1v5m s THR 86 CO 0.00 0.00 0.46 -0.04 -0.69 0.00 0.00 174.62 174.36 1v5m s MET 87 N 2.81 3.29 0.00 4.92 1.00 -1.26 -5.00 119.30 125.06 1v5m s MET 87 Ca -0.06 -0.76 0.00 0.00 0.00 0.00 0.00 55.69 54.87 1v5m s MET 87 Cb -0.11 -2.79 0.00 0.00 0.00 0.00 0.00 34.83 31.92 1v5m s MET 87 CO -0.19 0.17 0.00 -0.35 0.00 0.00 0.00 175.02 174.65 1v5m n PRO 88 N -1.63 -0.32 -0.74 2.03 -0.04 -1.26 -4.80 135.00 128.24 1v5m n PRO 88 Ca -0.04 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.34 1v5m n PRO 88 Cb 0.57 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.91 1v5m n PRO 88 CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 1v5m n LEU 89 N 0.00 4.13 -0.09 1.53 -0.00 -1.26 -3.76 117.00 117.55 1v5m n LEU 89 Ca 0.00 -2.53 -0.11 0.00 -0.00 0.00 0.00 56.01 53.37 1v5m n LEU 89 Cb 0.00 -1.09 -0.09 0.00 -0.00 0.00 0.00 43.42 42.24 1v5m n LEU 89 CO 0.00 1.18 -1.06 1.21 -0.00 0.00 0.00 177.39 178.72 1v5m n GLU 90 N 2.50 0.78 -3.44 1.47 4.07 -1.26 -4.94 120.64 119.82 1v5m n GLU 90 Ca 0.30 0.08 -0.38 0.00 -0.06 0.00 0.00 57.16 57.09 1v5m n GLU 90 Cb 0.69 -1.37 -0.09 0.00 -0.06 0.00 0.00 31.44 30.61 1v5m n GLU 90 CO 0.00 0.00 0.00 -1.64 -0.06 0.00 0.00 177.13 175.43 1v5m s MET 91 N -2.36 4.06 -0.02 5.31 -1.94 -1.25 -5.00 119.30 118.11 1v5m s MET 91 Ca -0.20 0.01 -0.21 0.00 -1.71 0.00 0.00 55.69 53.58 1v5m s MET 91 Cb 0.06 -3.61 -0.13 0.00 2.01 0.00 0.00 34.83 33.16 1v5m s MET 91 CO 0.47 -0.16 0.92 -1.00 -0.01 0.00 0.00 175.02 175.24 1v5m h PRO 92 N 7.89 -0.51 0.00 2.03 0.13 -1.93 -3.40 132.00 136.21 1v5m h PRO 92 Ca -0.34 0.03 -0.13 0.00 -0.87 0.00 0.00 66.00 64.69 1v5m h PRO 92 Cb 1.17 0.11 -0.29 0.00 0.13 0.00 0.00 31.00 32.13 1v5m h PRO 92 CO 0.66 -0.21 -0.89 -0.85 -0.23 0.00 0.00 178.00 176.47 1v5m n GLU 93 N -5.14 0.40 -3.34 0.86 0.28 -1.26 -4.98 120.64 107.46 1v5m n GLU 93 Ca -0.09 -2.31 -0.45 0.00 -0.16 0.00 0.00 57.16 54.15 1v5m n GLU 93 Cb 0.27 -0.41 -0.00 0.00 1.43 0.00 0.00 31.44 32.72 1v5m n GLU 93 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 1v5m s LYS 94 N -0.81 4.12 -0.49 3.44 1.02 -1.26 -4.84 119.74 120.92 1v5m s LYS 94 Ca 0.34 -3.12 0.02 0.00 0.02 0.00 0.00 55.97 53.23 1v5m s LYS 94 Cb 0.38 -4.54 0.56 0.00 -0.52 0.00 0.00 37.83 33.71 1v5m s LYS 94 CO -0.14 -1.25 1.92 -0.25 -0.92 0.00 0.00 175.35 174.71 1v5m n ASP 95 N 2.88 4.99 -2.39 2.83 8.00 -1.26 -4.39 116.55 127.20 1v5m n ASP 95 Ca 0.22 -3.58 -0.17 0.00 0.71 0.00 0.00 54.79 51.97 1v5m n ASP 95 Cb 0.40 -0.88 0.03 0.00 -0.02 0.00 0.00 41.12 40.65 1v5m n ASP 95 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1v5m n ASN 96 N -0.97 3.62 -3.99 -2.24 6.94 -1.26 -4.02 115.26 113.33 1v5m n ASN 96 Ca 0.58 -3.18 -0.14 0.00 -0.02 0.00 0.00 54.58 51.81 1v5m n ASN 96 Cb 1.30 -0.42 -0.13 0.00 -2.36 0.00 0.00 39.78 38.16 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 -4.41 0.42 -0.02 5.53 -4.23 -1.26 -0.66 115.64 111.02 1v5m s THR 97 Ca 0.41 -0.52 -0.01 0.00 -1.18 0.00 0.00 61.69 60.39 1v5m s THR 97 Cb 0.39 -0.42 0.01 0.00 1.34 0.00 0.00 72.50 73.82 1v5m s THR 97 CO -0.03 -0.07 0.04 0.72 -0.54 0.00 0.00 174.62 174.74 1v5m s PHE 98 N -0.58 -0.04 -0.10 3.99 -0.12 -1.01 -4.62 117.98 115.50 1v5m s PHE 98 Ca -0.03 0.12 -0.14 0.00 -0.05 0.00 0.00 56.93 56.83 1v5m s PHE 98 Cb -0.05 -0.01 -0.05 0.00 -0.63 0.00 0.00 43.02 42.28 1v5m s PHE 98 CO -0.00 -0.03 0.32 0.08 -0.05 0.00 0.00 175.22 175.54 1v5m s VAL 99 N 0.17 5.24 -0.42 -2.49 1.01 -0.82 -2.40 120.40 120.69 1v5m s VAL 99 Ca -0.01 0.63 -0.09 0.00 0.00 0.00 0.00 61.98 62.50 1v5m s VAL 99 Cb -0.02 -3.64 0.08 0.00 0.00 0.00 0.00 36.38 32.80 1v5m s VAL 99 CO -0.00 0.48 0.27 -0.76 0.00 0.00 0.00 175.10 175.08 1v5m s LEU 100 N -0.21 5.19 -0.50 3.92 1.43 -0.78 -1.83 118.68 125.90 1v5m s LEU 100 Ca 0.19 -1.52 -0.20 0.00 -1.03 0.00 0.00 54.13 51.57 1v5m s LEU 100 Cb -0.14 -1.99 0.05 0.00 0.03 0.00 0.00 46.19 44.13 1v5m s LEU 100 CO 0.07 -0.55 0.68 -0.75 0.23 0.00 0.00 176.35 176.04 1v5m s LYS 101 N 1.42 3.19 0.79 1.70 2.36 0.16 -2.04 119.74 127.32 1v5m s LYS 101 Ca 0.03 -0.68 -0.09 0.00 -2.55 0.00 0.00 55.97 52.68 1v5m s LYS 101 Cb -0.23 -4.06 0.10 0.00 -1.05 0.00 0.00 37.83 32.59 1v5m s LYS 101 CO 0.02 -1.22 1.12 0.14 1.55 0.00 0.00 175.35 176.96 1v5m s VAL 102 N 2.89 2.13 0.02 4.02 -7.23 -0.97 -1.50 120.40 119.76 1v5m s VAL 102 Ca 0.19 -0.18 -0.18 0.00 -1.81 0.00 0.00 61.98 60.01 1v5m s VAL 102 Cb -0.17 -2.95 -0.28 0.00 0.56 0.00 0.00 36.38 33.54 1v5m s VAL 102 CO 0.15 0.00 1.06 1.05 -0.31 0.00 0.00 175.10 177.05 1v5m h GLU 103 N -0.94 0.51 -0.71 4.82 -0.00 -0.34 -3.26 114.58 114.66 1v5m h GLU 103 Ca -0.44 -0.67 0.14 0.00 -0.00 0.00 0.00 59.36 58.38 1v5m h GLU 103 Cb 1.30 0.22 -0.04 0.00 -0.00 0.00 0.00 28.75 30.22 1v5m h GLU 103 CO 0.54 1.29 0.47 -0.97 -0.00 0.00 0.00 179.01 180.34 1v5m h ASN 104 N 0.05 0.36 0.00 3.06 -1.24 -1.96 -3.46 115.58 112.40 1v5m h ASN 104 Ca -0.15 0.02 0.00 0.00 0.71 0.00 0.00 56.30 56.88 1v5m h ASN 104 Cb 1.71 -0.06 0.00 0.00 0.73 0.00 0.00 38.32 40.70 1v5m h ASN 104 CO 0.19 0.20 0.00 0.61 -1.29 0.00 0.00 177.43 177.14 1v5m n GLY 105 N -1.53 0.77 3.64 1.57 0.00 -1.23 -5.17 105.19 103.25 1v5m n GLY 105 Ca 0.13 -0.63 -0.05 0.00 0.00 0.00 0.00 46.02 45.47 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 -0.24 -2.17 -0.10 4.61 0.00 -1.26 -5.00 121.76 117.59 1v5m s ALA 106 Ca 0.00 2.08 -0.04 0.00 0.00 0.00 0.00 51.96 54.00 1v5m s ALA 106 Cb 0.00 -1.62 -0.04 0.00 0.00 0.00 0.00 23.12 21.46 1v5m s ALA 106 CO 0.00 -0.30 0.05 -1.21 0.00 0.00 0.00 175.76 174.30 1v5m s GLU 107 N 0.94 3.21 -0.28 0.00 8.01 -1.25 -2.28 118.70 127.04 1v5m s GLU 107 Ca -0.05 -0.32 0.02 0.00 0.01 0.00 0.00 54.97 54.63 1v5m s GLU 107 Cb -0.04 -2.95 0.08 0.00 -4.31 0.00 0.00 34.13 26.91 1v5m s GLU 107 CO -0.12 0.69 -0.00 0.71 0.01 0.00 0.00 175.26 176.54 1v5m s TYR 108 N -0.81 2.80 -0.46 1.61 1.51 -0.86 -2.87 117.35 118.26 1v5m s TYR 108 Ca 0.13 -2.20 -0.25 0.00 -1.01 0.00 0.00 57.07 53.74 1v5m s TYR 108 Cb -0.12 -2.05 0.03 0.00 -0.11 0.00 0.00 41.96 39.71 1v5m s TYR 108 CO 0.03 -0.86 0.89 0.42 -1.11 0.00 0.00 175.55 174.91 1v5m s ILE 109 N 1.25 4.52 -0.09 2.71 1.01 0.32 -1.86 121.20 129.05 1v5m s ILE 109 Ca 0.01 0.62 -0.02 0.00 0.00 0.00 0.00 60.65 61.27 1v5m s ILE 109 Cb -0.19 -4.41 -0.03 0.00 0.01 0.00 0.00 42.46 37.84 1v5m s ILE 109 CO -0.10 -0.82 -0.01 -0.76 0.00 0.00 0.00 174.94 173.25 1v5m s LEU 110 N 3.63 3.53 -0.20 2.97 1.02 -1.01 -1.04 118.68 127.58 1v5m s LEU 110 Ca 0.35 0.11 -0.02 0.00 0.02 0.00 0.00 54.13 54.58 1v5m s LEU 110 Cb -0.11 -1.81 -0.00 0.00 0.02 0.00 0.00 46.19 44.29 1v5m s LEU 110 CO 0.25 0.36 -0.09 -0.70 0.02 0.00 0.00 176.35 176.19 1v5m s GLU 111 N -0.78 3.30 0.54 1.70 2.12 0.80 -2.42 118.70 123.96 1v5m s GLU 111 Ca 0.12 -0.68 0.04 0.00 0.36 0.00 0.00 54.97 54.81 1v5m s GLU 111 Cb -0.11 -2.87 0.05 0.00 0.26 0.00 0.00 34.13 31.46 1v5m s GLU 111 CO 0.02 -0.15 0.75 0.95 -0.54 0.00 0.00 175.26 176.30 1v5m s THR 112 N 1.29 2.62 0.10 -1.70 -4.23 0.17 -3.08 115.64 110.80 1v5m s THR 112 Ca 0.03 -0.78 -0.32 0.00 -1.18 0.00 0.00 61.69 59.44 1v5m s THR 112 Cb -0.14 -2.84 -0.13 0.00 1.34 0.00 0.00 72.50 70.73 1v5m s THR 112 CO -0.04 0.00 1.51 0.40 -0.54 0.00 0.00 174.62 175.95 1v5m h ILE 113 N 0.15 0.00 -3.89 2.99 2.04 -1.91 -3.46 117.51 113.43 1v5m h ILE 113 Ca -0.39 0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.36 1v5m h ILE 113 Cb 1.29 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 37.24 1v5m h ILE 113 CO 0.47 0.00 -0.33 1.51 0.00 0.00 0.00 178.15 179.80 1v5m s ASP 114 N -4.56 0.05 0.55 1.72 1.47 -1.26 -5.01 116.67 109.64 1v5m s ASP 114 Ca -0.15 -0.85 0.38 0.00 1.18 0.00 0.00 52.55 53.11 1v5m s ASP 114 Cb 0.06 0.42 1.54 0.00 -0.34 0.00 0.00 42.92 44.60 1v5m s ASP 114 CO 0.56 -0.87 1.75 -1.28 0.68 0.00 0.00 175.17 176.01 1v5m h SER 115 N 2.57 0.00 -0.59 2.11 0.87 -1.89 0.55 113.55 117.18 1v5m h SER 115 Ca -0.32 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.19 1v5m h SER 115 Cb 1.22 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.16 1v5m h SER 115 CO 0.49 0.00 0.19 -0.07 -0.53 0.00 0.00 176.83 176.91 1v5m h LEU 116 N 0.00 0.86 -0.12 2.23 3.38 -1.95 -1.36 115.31 118.34 1v5m h LEU 116 Ca 0.59 -0.21 -0.10 0.00 0.09 0.00 0.00 57.88 58.26 1v5m h LEU 116 Cb 2.45 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 42.96 1v5m h LEU 116 CO -0.01 0.83 -0.46 1.56 0.09 0.00 0.00 178.44 180.46 1v5m h GLN 117 N 0.83 0.00 0.43 1.13 1.08 -0.35 -3.28 115.11 114.95 1v5m h GLN 117 Ca 0.19 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.37 1v5m h GLN 117 Cb 0.28 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.72 1v5m h GLN 117 CO -0.01 0.46 -0.21 -0.22 -0.95 0.00 0.00 178.83 177.91 1v5m h LYS 118 N 0.00 -0.55 -1.03 1.46 3.64 -0.91 -2.99 116.57 116.18 1v5m h LYS 118 Ca -0.00 0.04 0.30 0.00 -1.27 0.00 0.00 60.65 59.71 1v5m h LYS 118 Cb 1.30 0.13 -0.13 0.00 -0.41 0.00 0.00 32.23 33.12 1v5m h LYS 118 CO 0.06 -0.29 0.62 1.12 -2.27 0.00 0.00 179.45 178.68 1v5m h HIS 119 N -1.08 0.89 -0.12 1.91 2.07 -1.38 0.16 115.15 117.59 1v5m h HIS 119 Ca -0.06 0.03 -0.00 0.00 -2.85 0.00 0.00 60.37 57.49 1v5m h HIS 119 Cb 0.52 -0.25 -0.01 0.00 2.57 0.00 0.00 27.41 30.24 1v5m h HIS 119 CO 0.02 -0.06 0.08 1.03 -3.07 0.00 0.00 177.93 175.92 1v5m h SER 120 N 0.41 0.15 0.57 3.10 0.87 -1.61 -2.50 113.55 114.54 1v5m h SER 120 Ca 0.69 -0.04 -0.02 0.00 -1.23 0.00 0.00 61.79 61.19 1v5m h SER 120 Cb 1.56 -0.04 -0.00 0.00 -0.44 0.00 0.00 62.40 63.49 1v5m h SER 120 CO -0.50 0.14 -0.32 -0.50 -0.53 0.00 0.00 176.83 175.12 1v5m h TRP 121 N 0.14 -0.83 -0.98 2.24 4.06 -0.56 -1.19 115.95 118.83 1v5m h TRP 121 Ca 0.04 -0.01 0.30 0.00 2.06 0.00 0.00 58.89 61.28 1v5m h TRP 121 Cb 0.02 0.29 -0.15 0.00 -1.00 0.00 0.00 29.16 28.32 1v5m h TRP 121 CO -0.06 -0.49 0.52 0.28 -3.56 0.00 0.00 178.44 175.12 1v5m h VAL 122 N -0.83 0.32 0.10 1.49 2.07 -1.28 0.26 116.25 118.39 1v5m h VAL 122 Ca -0.07 -0.11 -0.00 0.00 0.82 0.00 0.00 66.70 67.33 1v5m h VAL 122 Cb 0.66 -0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.39 1v5m h VAL 122 CO 0.10 0.06 -0.05 0.00 0.02 0.00 0.00 177.57 177.70 1v5m h ALA 123 N 1.83 -0.13 -1.00 1.67 0.00 -1.05 0.29 119.26 120.87 1v5m h ALA 123 Ca 0.70 -0.21 0.09 0.00 0.00 0.00 0.00 54.91 55.48 1v5m h ALA 123 Cb 1.54 0.05 -0.07 0.00 0.00 0.00 0.00 17.79 19.31 1v5m h ALA 123 CO -0.60 -0.35 0.64 -0.44 0.00 0.00 0.00 179.25 178.49 1v5m h ASP 124 N -0.58 0.99 0.21 0.00 5.19 0.25 0.47 116.42 122.95 1v5m h ASP 124 Ca -0.01 0.02 -0.01 0.00 -0.62 0.00 0.00 57.03 56.41 1v5m h ASP 124 Cb 0.47 -0.18 0.00 0.00 0.18 0.00 0.00 39.33 39.80 1v5m h ASP 124 CO 0.02 0.59 -0.10 0.40 -3.12 0.00 0.00 179.24 177.03 1v5m h ILE 125 N 1.10 0.09 -0.88 0.35 2.04 -0.57 -3.16 117.51 116.47 1v5m h ILE 125 Ca 0.45 -0.84 0.17 0.00 1.00 0.00 0.00 64.86 65.65 1v5m h ILE 125 Cb 0.28 0.15 -0.07 0.00 -0.74 0.00 0.00 36.82 36.45 1v5m h ILE 125 CO -0.21 0.03 0.58 1.56 0.00 0.00 0.00 178.15 180.10 1v5m h GLN 126 N -1.07 0.54 0.00 2.37 1.08 -0.34 0.22 115.11 117.91 1v5m h GLN 126 Ca -0.03 -0.03 -0.03 0.00 -1.45 0.00 0.00 58.65 57.11 1v5m h GLN 126 Cb 0.26 -0.12 -0.00 0.00 -0.05 0.00 0.00 27.48 27.57 1v5m h GLN 126 CO 0.05 0.35 -0.14 0.78 -0.95 0.00 0.00 178.83 178.92 1v5m h GLY 127 N 0.55 0.00 0.00 3.46 0.00 -0.14 -3.09 103.07 103.86 1v5m h GLY 127 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.78 1v5m h GLY 127 CO -0.20 0.00 -0.15 0.00 0.00 0.00 0.00 176.54 176.19 1v5m n VAL 129 N -4.17 -0.21 -3.65 0.00 3.14 -0.81 -4.41 118.33 108.22 1v5m n VAL 129 Ca -0.02 1.51 -0.00 0.00 -2.96 0.00 0.00 64.34 62.86 1v5m n VAL 129 Cb 0.08 -2.47 -0.06 0.00 -1.06 0.00 0.00 33.84 30.33 1v5m n VAL 129 CO 0.00 0.00 0.00 1.51 -6.46 0.00 0.00 176.83 171.88 1v5m s ASP 130 N -4.33 -0.20 -0.61 6.55 1.47 -1.17 -5.06 116.67 113.33 1v5m s ASP 130 Ca -0.06 0.33 -0.17 0.00 1.18 0.00 0.00 52.55 53.83 1v5m s ASP 130 Cb 0.26 0.95 -0.14 0.00 -0.34 0.00 0.00 42.92 43.64 1v5m s ASP 130 CO 0.68 -0.05 1.60 -0.24 0.68 0.00 0.00 175.17 177.84 1v5m n SER 131 N 3.01 0.03 0.00 2.11 2.88 -1.25 -4.43 113.62 115.96 1v5m n SER 131 Ca -0.16 0.05 0.00 0.00 -1.33 0.00 0.00 58.87 57.43 1v5m n SER 131 Cb 0.57 -0.53 0.00 0.00 -0.75 0.00 0.00 64.21 63.50 1v5m n SER 131 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1v5m n GLY 132 N 3.87 5.31 3.61 0.46 0.00 -1.26 -5.03 105.19 112.15 1v5m n GLY 132 Ca 0.40 -1.43 -0.43 0.00 0.00 0.00 0.00 46.02 44.56 1v5m n GLY 132 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1v5m s PRO 133 N 3.66 3.58 0.01 1.61 0.04 -1.26 -4.89 135.00 137.74 1v5m s PRO 133 Ca 0.00 1.47 0.01 0.00 0.04 0.00 0.00 61.00 62.52 1v5m s PRO 133 Cb 0.00 -4.10 -0.04 0.00 0.04 0.00 0.00 34.50 30.40 1v5m s PRO 133 CO 0.00 -1.56 0.02 -1.54 0.04 0.00 0.00 177.00 173.96 1v5m s SER 134 N 4.93 5.24 0.18 6.66 1.04 -1.26 -4.51 113.70 125.97 1v5m s SER 134 Ca 0.73 0.01 0.10 0.00 0.48 0.00 0.00 55.95 57.28 1v5m s SER 134 Cb -0.22 -1.39 -0.04 0.00 0.10 0.00 0.00 66.02 64.46 1v5m s SER 134 CO 0.32 0.27 -0.18 -0.55 0.98 0.00 0.00 173.24 174.07 1v5m s SER 135 N -1.67 3.77 0.00 7.02 0.15 -1.26 -5.16 113.70 116.54 1v5m s SER 135 Ca 0.21 -0.74 0.00 0.00 0.70 0.00 0.00 55.95 56.12 1v5m s SER 135 Cb -0.12 -0.45 0.00 0.00 -1.71 0.00 0.00 66.02 63.74 1v5m s SER 135 CO 0.12 0.12 0.00 0.61 1.20 0.00 0.00 173.24 175.29