#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 6.97 -0.09 1.61 1.04 -1.26 -5.03 113.70 116.94 1v5m s SER 2 Ca 0.00 1.17 -0.32 0.00 0.48 0.00 0.00 55.95 57.27 1v5m s SER 2 Cb 0.00 -2.40 0.12 0.00 0.10 0.00 0.00 66.02 63.84 1v5m s SER 2 CO 0.00 -0.07 1.14 -0.55 0.98 0.00 0.00 173.24 174.74 1v5m s SER 3 N 0.61 -0.17 0.91 7.02 0.15 -1.26 -5.16 113.70 115.80 1v5m s SER 3 Ca 0.36 -0.06 0.00 0.00 0.70 0.00 0.00 55.95 56.95 1v5m s SER 3 Cb -0.18 0.22 0.00 0.00 -1.71 0.00 0.00 66.02 64.35 1v5m s SER 3 CO 0.18 -0.37 0.00 0.61 1.20 0.00 0.00 173.24 174.85 1v5m n GLY 4 N -0.23 -0.33 3.75 9.45 0.00 -1.26 -4.80 105.19 111.77 1v5m n GLY 4 Ca -0.04 -0.97 -0.30 0.00 0.00 0.00 0.00 46.02 44.71 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 -4.00 3.95 0.05 1.61 0.15 -1.26 -5.08 113.70 109.12 1v5m s SER 5 Ca 0.00 1.49 -0.09 0.00 0.70 0.00 0.00 55.95 58.06 1v5m s SER 5 Cb 0.00 -2.20 0.00 0.00 -1.71 0.00 0.00 66.02 62.11 1v5m s SER 5 CO 0.00 -2.34 0.18 -0.94 1.20 0.00 0.00 173.24 171.34 1v5m s SER 6 N -3.55 0.07 0.00 5.45 1.04 -1.26 -5.15 113.70 110.30 1v5m s SER 6 Ca 0.62 -0.44 0.00 0.00 0.48 0.00 0.00 55.95 56.61 1v5m s SER 6 Cb -0.17 0.29 0.00 0.00 0.10 0.00 0.00 66.02 66.24 1v5m s SER 6 CO 0.56 -0.58 0.00 0.61 0.98 0.00 0.00 173.24 174.81 1v5m n GLY 7 N 0.58 1.63 3.99 7.32 0.00 -1.26 -5.17 105.19 112.28 1v5m n GLY 7 Ca -0.18 0.07 -0.22 0.00 0.00 0.00 0.00 46.02 45.68 1v5m n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1v5m s ASN 8 N 2.00 4.67 0.36 1.61 2.20 -1.26 -5.13 114.94 119.38 1v5m s ASN 8 Ca 0.00 -0.36 0.00 0.00 -0.94 0.00 0.00 52.86 51.56 1v5m s ASN 8 Cb 0.00 -0.16 0.00 0.00 -2.00 0.00 0.00 41.25 39.09 1v5m s ASN 8 CO 0.00 -1.62 0.45 0.00 -2.94 0.00 0.00 177.10 172.99 1v5m n LEU 9 N -2.63 0.00 -4.62 3.54 -0.00 -1.26 -5.17 117.00 106.86 1v5m n LEU 9 Ca 0.14 -3.00 -0.29 0.00 -0.00 0.00 0.00 56.01 52.85 1v5m n LEU 9 Cb 0.60 2.41 -0.09 0.00 -0.00 0.00 0.00 43.42 46.35 1v5m n LEU 9 CO 0.42 -0.64 -0.39 0.00 -0.00 0.00 0.00 177.39 176.78 1v5m s ALA 10 N -2.94 3.07 -1.28 1.47 0.00 -1.26 -5.04 121.76 115.78 1v5m s ALA 10 Ca 0.32 -1.24 -0.19 0.00 0.00 0.00 0.00 51.96 50.86 1v5m s ALA 10 Cb -0.00 -0.98 0.05 0.00 0.00 0.00 0.00 23.12 22.19 1v5m s ALA 10 CO 0.23 0.63 1.76 0.00 0.00 0.00 0.00 175.76 178.38 1v5m s ALA 11 N -1.32 3.13 0.03 0.00 0.00 -1.26 -4.94 121.76 117.40 1v5m s ALA 11 Ca 0.23 -2.82 0.07 0.00 0.00 0.00 0.00 51.96 49.44 1v5m s ALA 11 Cb -0.11 -4.65 -0.03 0.00 0.00 0.00 0.00 23.12 18.33 1v5m s ALA 11 CO 0.16 -3.54 -0.17 0.21 0.00 0.00 0.00 175.76 172.42 1v5m s LYS 12 N 4.50 2.13 -0.01 0.00 2.47 -1.26 -5.13 119.74 122.45 1v5m s LYS 12 Ca 0.56 -0.94 -0.05 0.00 -1.56 0.00 0.00 55.97 53.97 1v5m s LYS 12 Cb 0.03 -2.22 -0.04 0.00 -1.46 0.00 0.00 37.83 34.15 1v5m s LYS 12 CO 0.08 0.55 0.22 0.54 0.16 0.00 0.00 175.35 176.90 1v5m s VAL 13 N -0.90 5.38 0.08 4.02 0.11 -1.26 -5.04 120.40 122.78 1v5m s VAL 13 Ca 0.14 0.03 -0.31 0.00 -2.93 0.00 0.00 61.98 58.92 1v5m s VAL 13 Cb -0.11 -3.54 -0.09 0.00 -1.53 0.00 0.00 36.38 31.11 1v5m s VAL 13 CO 0.05 0.37 1.85 -0.70 -3.33 0.00 0.00 175.10 173.34 1v5m s GLU 14 N -1.78 4.15 0.30 1.54 2.12 -1.26 -4.97 118.70 118.80 1v5m s GLU 14 Ca 0.26 2.56 0.06 0.00 0.36 0.00 0.00 54.97 58.21 1v5m s GLU 14 Cb -0.13 -3.81 -0.02 0.00 0.26 0.00 0.00 34.13 30.43 1v5m s GLU 14 CO 0.16 -0.87 0.21 1.28 -0.54 0.00 0.00 175.26 175.50 1v5m n LEU 15 N 6.39 0.00 -4.91 2.70 4.77 -1.26 -5.16 117.00 119.53 1v5m n LEU 15 Ca 0.18 -2.65 -0.32 0.00 -0.03 0.00 0.00 56.01 53.19 1v5m n LEU 15 Cb 0.40 1.27 -0.05 0.00 -2.33 0.00 0.00 43.42 42.71 1v5m n LEU 15 CO 0.66 -0.43 -0.14 0.54 -1.33 0.00 0.00 177.39 176.69 1v5m s VAL 16 N -3.06 5.39 0.11 4.08 0.11 -1.26 -5.02 120.40 120.75 1v5m s VAL 16 Ca 0.29 -0.21 -0.24 0.00 -2.93 0.00 0.00 61.98 58.90 1v5m s VAL 16 Cb 0.01 -3.58 -0.08 0.00 -1.53 0.00 0.00 36.38 31.21 1v5m s VAL 16 CO 0.21 0.24 1.67 0.44 -3.33 0.00 0.00 175.10 174.33 1v5m h ASP 17 N 3.50 -0.44 -3.70 3.54 5.19 -1.98 -3.42 116.42 119.10 1v5m h ASP 17 Ca -0.47 0.06 -0.53 0.00 -0.62 0.00 0.00 57.03 55.47 1v5m h ASP 17 Cb 1.18 0.18 0.07 0.00 0.18 0.00 0.00 39.33 40.94 1v5m h ASP 17 CO 0.72 -0.22 0.71 -0.63 -3.12 0.00 0.00 179.24 176.70 1v5m s ILE 18 N -6.13 2.55 -0.16 0.35 1.01 -1.26 -3.27 121.20 114.29 1v5m s ILE 18 Ca -0.15 0.52 0.00 0.00 0.00 0.00 0.00 60.65 61.02 1v5m s ILE 18 Cb 0.08 -3.33 -0.23 0.00 0.01 0.00 0.00 42.46 38.99 1v5m s ILE 18 CO 0.66 0.11 0.19 0.00 0.00 0.00 0.00 174.94 175.90 1v5m n GLN 19 N 1.30 0.71 -3.64 2.79 1.13 0.03 -4.99 117.38 114.71 1v5m n GLN 19 Ca 0.03 0.21 -0.04 0.00 -1.94 0.00 0.00 57.00 55.25 1v5m n GLN 19 Cb 0.41 -1.64 -0.07 0.00 0.11 0.00 0.00 30.24 29.04 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 -2.55 0.32 -0.02 -1.09 3.52 -1.25 -5.02 118.95 112.86 1v5m s ARG 20 Ca -0.23 0.45 0.01 0.00 -0.13 0.00 0.00 55.73 55.82 1v5m s ARG 20 Cb 0.07 0.12 0.02 0.00 -1.56 0.00 0.00 34.95 33.60 1v5m s ARG 20 CO 0.73 -0.05 -0.02 -2.00 -0.81 0.00 0.00 175.30 173.15 1v5m s GLU 21 N 0.65 0.37 0.22 5.12 2.12 -1.26 -1.98 118.70 123.93 1v5m s GLU 21 Ca -0.01 -0.02 -0.18 0.00 0.36 0.00 0.00 54.97 55.13 1v5m s GLU 21 Cb -0.04 -0.46 0.02 0.00 0.26 0.00 0.00 34.13 33.91 1v5m s GLU 21 CO -0.11 -0.06 0.55 0.20 -0.54 0.00 0.00 175.26 175.30 1v5m s GLY 22 N 0.64 -0.02 -0.50 -1.50 0.00 -0.50 -5.01 107.32 100.43 1v5m s GLY 22 Ca -0.07 -0.31 -0.12 0.00 0.00 0.00 0.00 44.72 44.22 1v5m s GLY 22 CO -0.01 -0.27 0.41 0.00 0.00 0.00 0.00 173.10 173.23 1v5m s ALA 23 N -3.90 3.51 0.34 3.20 0.00 -1.26 -0.39 121.76 123.26 1v5m s ALA 23 Ca 0.11 -2.52 0.03 0.00 0.00 0.00 0.00 51.96 49.58 1v5m s ALA 23 Cb -0.02 -3.02 -0.04 0.00 0.00 0.00 0.00 23.12 20.04 1v5m s ALA 23 CO 0.00 -1.95 0.10 -0.48 0.00 0.00 0.00 175.76 173.44 1v5m s LEU 24 N 1.47 1.96 0.09 0.00 2.34 0.17 -4.93 118.68 119.79 1v5m s LEU 24 Ca 0.04 -1.51 0.00 0.00 0.06 0.00 0.00 54.13 52.73 1v5m s LEU 24 Cb -0.28 -0.15 -0.04 0.00 -0.56 0.00 0.00 46.19 45.17 1v5m s LEU 24 CO 0.01 -0.78 0.24 -0.13 -1.06 0.00 0.00 176.35 174.63 1v5m s ARG 25 N -3.84 3.45 0.05 1.48 0.52 -1.24 -0.73 118.95 118.64 1v5m s ARG 25 Ca 0.32 -0.46 -0.02 0.00 -0.52 0.00 0.00 55.73 55.05 1v5m s ARG 25 Cb 0.06 -3.00 -0.03 0.00 0.52 0.00 0.00 34.95 32.49 1v5m s ARG 25 CO 0.15 0.57 0.00 -0.59 0.02 0.00 0.00 175.30 175.45 1v5m s PHE 26 N -1.59 0.44 0.15 -0.53 -0.71 -0.85 -1.13 117.98 113.75 1v5m s PHE 26 Ca 0.35 -0.94 -0.14 0.00 -1.04 0.00 0.00 56.93 55.16 1v5m s PHE 26 Cb -0.12 -0.32 0.02 0.00 -1.21 0.00 0.00 43.02 41.38 1v5m s PHE 26 CO 0.28 -0.38 0.38 0.00 -1.34 0.00 0.00 175.22 174.16 1v5m s MET 27 N -3.65 1.14 -0.09 1.99 0.23 -0.31 -2.44 119.30 116.17 1v5m s MET 27 Ca 0.04 -0.86 0.04 0.00 -1.03 0.00 0.00 55.69 53.88 1v5m s MET 27 Cb 0.06 0.45 -0.01 0.00 -1.53 0.00 0.00 34.83 33.80 1v5m s MET 27 CO -0.09 -0.44 -0.20 0.08 -2.03 0.00 0.00 175.02 172.33 1v5m s VAL 28 N -3.86 2.43 -0.51 5.16 1.01 -1.26 0.17 120.40 123.54 1v5m s VAL 28 Ca 0.07 -0.91 -0.27 0.00 0.00 0.00 0.00 61.98 60.87 1v5m s VAL 28 Cb 0.02 -1.94 -0.01 0.00 0.00 0.00 0.00 36.38 34.44 1v5m s VAL 28 CO -0.07 0.56 1.76 0.00 0.00 0.00 0.00 175.10 177.34 1v5m s ALA 29 N 0.02 2.50 0.02 5.51 0.00 -1.08 -4.93 121.76 123.80 1v5m s ALA 29 Ca -0.08 -0.36 -0.20 0.00 0.00 0.00 0.00 51.96 51.32 1v5m s ALA 29 Cb -0.15 -4.17 0.04 0.00 0.00 0.00 0.00 23.12 18.84 1v5m s ALA 29 CO 0.05 -3.32 0.46 0.16 0.00 0.00 0.00 175.76 173.11 1v5m s ASP 30 N 6.81 -0.36 -0.41 0.00 -4.77 -1.26 -4.78 116.67 111.90 1v5m s ASP 30 Ca 0.69 0.17 -0.17 0.00 -3.30 0.00 0.00 52.55 49.94 1v5m s ASP 30 Cb -0.15 0.44 0.02 0.00 -1.09 0.00 0.00 42.92 42.13 1v5m s ASP 30 CO 0.26 -0.63 0.42 -1.81 0.70 0.00 0.00 175.17 174.11 1v5m s ASP 31 N -1.74 6.19 -0.09 2.11 1.01 -1.26 -5.02 116.67 117.86 1v5m s ASP 31 Ca -0.08 -0.66 -0.37 0.00 0.71 0.00 0.00 52.55 52.15 1v5m s ASP 31 Cb -0.02 -2.22 -0.15 0.00 1.01 0.00 0.00 42.92 41.55 1v5m s ASP 31 CO 0.01 -0.55 1.65 0.00 0.21 0.00 0.00 175.17 176.49 1v5m n ALA 32 N 5.55 0.05 -0.11 5.23 0.00 -1.26 -4.88 120.51 125.08 1v5m n ALA 32 Ca -0.08 0.40 -0.23 0.00 0.00 0.00 0.00 53.44 53.53 1v5m n ALA 32 Cb 0.47 -2.27 -0.11 0.00 0.00 0.00 0.00 19.45 17.54 1v5m n ALA 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1v5m n ALA 33 N 4.71 1.17 -0.04 0.00 0.00 -1.26 -4.54 120.51 120.55 1v5m n ALA 33 Ca 0.22 -0.93 -0.12 0.00 0.00 0.00 0.00 53.44 52.61 1v5m n ALA 33 Cb 0.20 -0.17 -0.06 0.00 0.00 0.00 0.00 19.45 19.42 1v5m n ALA 33 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1v5m h SER 34 N -0.51 -1.37 -0.04 0.00 0.02 -2.06 -3.47 113.55 106.12 1v5m h SER 34 Ca -0.57 0.19 0.00 0.00 -0.84 0.00 0.00 61.79 60.57 1v5m h SER 34 Cb 1.73 0.57 0.00 0.00 0.14 0.00 0.00 62.40 64.84 1v5m h SER 34 CO -0.20 -0.41 0.00 0.61 -1.14 0.00 0.00 176.83 175.69 1v5m n GLY 35 N -1.43 0.70 3.59 -3.77 0.00 -1.26 -5.17 105.19 97.85 1v5m n GLY 35 Ca -0.03 -0.72 -0.30 0.00 0.00 0.00 0.00 46.02 44.97 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 -0.57 -1.30 0.08 1.61 0.04 -1.26 -4.81 135.00 128.80 1v5m s PRO 36 Ca 0.00 -0.09 0.00 0.00 0.04 0.00 0.00 61.00 60.95 1v5m s PRO 36 Cb 0.00 -1.59 0.00 0.00 0.04 0.00 0.00 34.50 32.95 1v5m s PRO 36 CO 0.00 -3.76 0.00 0.41 0.04 0.00 0.00 177.00 173.69 1v5m n GLY 37 N -0.95 -0.49 1.36 0.56 0.00 -1.26 -5.05 105.19 99.36 1v5m n GLY 37 Ca 0.13 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.22 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 1.02 2.46 3.73 -0.02 0.00 -1.26 -5.01 105.19 106.12 1v5m n GLY 38 Ca 0.00 -0.51 -0.32 0.00 0.00 0.00 0.00 46.02 45.19 1v5m n GLY 38 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1v5m s THR 39 N 0.00 2.73 -0.16 2.61 -1.32 -1.26 -4.94 115.64 113.30 1v5m s THR 39 Ca 0.00 0.26 -0.29 0.00 -1.21 0.00 0.00 61.69 60.45 1v5m s THR 39 Cb 0.00 -2.59 -0.02 0.00 -1.51 0.00 0.00 72.50 68.39 1v5m s THR 39 CO 0.00 -0.29 1.28 0.00 -2.21 0.00 0.00 174.62 173.40 1v5m s ALA 40 N -2.65 3.66 0.46 11.08 0.00 -1.26 -4.89 121.76 128.15 1v5m s ALA 40 Ca 0.65 0.48 0.26 0.00 0.00 0.00 0.00 51.96 53.35 1v5m s ALA 40 Cb -0.21 -3.62 1.28 0.00 0.00 0.00 0.00 23.12 20.57 1v5m s ALA 40 CO 0.54 -1.17 1.79 1.96 0.00 0.00 0.00 175.76 178.88 1v5m h GLN 41 N 8.23 0.22 -4.72 0.00 1.08 -1.97 -3.42 115.11 114.53 1v5m h GLN 41 Ca -0.27 -0.01 -0.69 0.00 -1.45 0.00 0.00 58.65 56.22 1v5m h GLN 41 Cb 1.11 -0.05 0.01 0.00 -0.05 0.00 0.00 27.48 28.50 1v5m h GLN 41 CO 0.97 0.15 0.52 0.91 -0.95 0.00 0.00 178.83 180.43 1v5m n TRP 42 N -4.46 1.35 -4.99 2.96 7.02 -1.26 -4.85 117.44 113.21 1v5m n TRP 42 Ca 0.25 0.90 -0.31 0.00 -1.02 0.00 0.00 57.50 57.32 1v5m n TRP 42 Cb 1.01 -1.75 -0.17 0.00 -2.42 0.00 0.00 31.31 27.98 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 2.26 2.80 0.18 -0.99 -1.52 -1.02 -4.92 119.66 116.45 1v5m s GLN 43 Ca 0.82 -0.79 -0.33 0.00 -1.95 0.00 0.00 55.36 53.11 1v5m s GLN 43 Cb -1.17 -2.17 -0.13 0.00 -0.22 0.00 0.00 33.01 29.32 1v5m s GLN 43 CO 0.64 0.11 1.64 1.63 -0.25 0.00 0.00 175.29 179.06 1v5m n LYS 44 N 3.69 2.42 -3.80 2.91 5.02 -1.26 -2.01 118.16 125.13 1v5m n LYS 44 Ca -0.20 0.87 -0.09 0.00 -2.02 0.00 0.00 58.31 56.87 1v5m n LYS 44 Cb 0.52 -2.67 -0.04 0.00 -0.02 0.00 0.00 35.03 32.82 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 -3.90 2.51 -0.19 0.00 3.52 -0.41 -0.65 118.95 119.83 1v5m s ARG 46 Ca 0.12 -1.18 -0.25 0.00 -0.13 0.00 0.00 55.73 54.28 1v5m s ARG 46 Cb -0.01 -2.92 -0.01 0.00 -1.56 0.00 0.00 34.95 30.46 1v5m s ARG 46 CO -0.01 -0.49 0.84 -1.17 -0.81 0.00 0.00 175.30 173.67 1v5m s LEU 47 N 1.20 4.15 -0.22 -0.88 2.96 0.47 -2.42 118.68 123.95 1v5m s LEU 47 Ca -0.04 1.15 0.00 0.00 -0.22 0.00 0.00 54.13 55.02 1v5m s LEU 47 Cb -0.18 -3.24 0.05 0.00 0.50 0.00 0.00 46.19 43.32 1v5m s LEU 47 CO -0.05 -0.45 -0.06 -0.22 -1.32 0.00 0.00 176.35 174.25 1v5m s LEU 48 N 2.39 2.33 -0.65 -0.68 2.96 -1.16 -1.41 118.68 122.46 1v5m s LEU 48 Ca 0.38 -1.03 -0.18 0.00 -0.22 0.00 0.00 54.13 53.08 1v5m s LEU 48 Cb -0.16 -1.14 0.12 0.00 0.50 0.00 0.00 46.19 45.52 1v5m s LEU 48 CO 0.11 -0.21 0.74 -0.22 -1.32 0.00 0.00 176.35 175.44 1v5m s LEU 49 N 1.44 5.60 0.23 -0.68 0.20 -0.84 -2.81 118.68 121.82 1v5m s LEU 49 Ca -0.04 -1.68 0.05 0.00 0.69 0.00 0.00 54.13 53.15 1v5m s LEU 49 Cb -0.18 -2.29 -0.03 0.00 -0.43 0.00 0.00 46.19 43.26 1v5m s LEU 49 CO -0.07 -1.02 0.34 -0.60 -0.29 0.00 0.00 176.35 174.71 1v5m s ARG 50 N 2.28 3.43 0.11 1.98 3.52 -1.13 -0.79 118.95 128.35 1v5m s ARG 50 Ca 0.14 -0.74 -0.19 0.00 -0.13 0.00 0.00 55.73 54.80 1v5m s ARG 50 Cb -0.21 -2.89 -0.07 0.00 -1.56 0.00 0.00 34.95 30.22 1v5m s ARG 50 CO 0.02 0.44 0.60 0.50 -0.81 0.00 0.00 175.30 176.06 1v5m s ARG 51 N -3.86 4.20 0.36 5.12 3.52 -1.20 -2.63 118.95 124.46 1v5m s ARG 51 Ca 0.34 0.75 0.07 0.00 -0.13 0.00 0.00 55.73 56.75 1v5m s ARG 51 Cb -0.09 -3.14 -0.00 0.00 -1.56 0.00 0.00 34.95 30.15 1v5m s ARG 51 CO 0.29 0.57 0.51 0.00 -0.81 0.00 0.00 175.30 175.86 1v5m s ALA 52 N -1.23 4.29 0.77 6.12 0.00 -1.22 -4.84 121.76 125.65 1v5m s ALA 52 Ca 0.33 -1.49 -0.11 0.00 0.00 0.00 0.00 51.96 50.68 1v5m s ALA 52 Cb -0.19 -1.69 0.05 0.00 0.00 0.00 0.00 23.12 21.29 1v5m s ALA 52 CO 0.20 -0.12 1.09 0.14 0.00 0.00 0.00 175.76 177.07 1v5m s VAL 53 N -2.24 3.35 0.26 0.00 -7.23 -1.25 -4.81 120.40 108.47 1v5m s VAL 53 Ca 0.48 0.44 0.18 0.00 -1.81 0.00 0.00 61.98 61.26 1v5m s VAL 53 Cb -0.10 -3.20 0.28 0.00 0.56 0.00 0.00 36.38 33.93 1v5m s VAL 53 CO 0.32 -0.57 0.95 0.00 -0.31 0.00 0.00 175.10 175.49 1v5m n ALA 54 N -3.33 0.77 -0.02 1.32 0.00 -1.26 -0.43 120.51 117.56 1v5m n ALA 54 Ca 0.07 0.55 -0.06 0.00 0.00 0.00 0.00 53.44 54.01 1v5m n ALA 54 Cb 0.56 -0.64 -0.04 0.00 0.00 0.00 0.00 19.45 19.33 1v5m n ALA 54 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1v5m h GLY 55 N 0.00 -1.45 -3.23 0.00 0.00 -2.04 -3.43 103.07 92.92 1v5m h GLY 55 Ca 0.53 0.71 -0.57 0.00 0.00 0.00 0.00 47.33 48.00 1v5m h GLY 55 CO -0.34 -0.46 -0.62 1.85 0.00 0.00 0.00 176.54 176.97 1v5m s GLU 56 N -4.03 2.52 0.04 4.80 2.56 0.43 -5.06 118.70 119.95 1v5m s GLU 56 Ca -0.06 -1.15 -0.32 0.00 0.00 0.00 0.00 54.97 53.44 1v5m s GLU 56 Cb 0.03 -2.37 -0.18 0.00 2.00 0.00 0.00 34.13 33.61 1v5m s GLU 56 CO 0.24 0.43 1.33 0.07 -0.56 0.00 0.00 175.26 176.76 1v5m h ARG 57 N 2.27 -1.08 0.00 4.30 0.11 -1.83 -3.34 114.38 114.80 1v5m h ARG 57 Ca -0.47 0.07 -0.10 0.00 0.10 0.00 0.00 59.98 59.58 1v5m h ARG 57 Cb 1.22 0.25 -0.02 0.00 1.11 0.00 0.00 29.97 32.52 1v5m h ARG 57 CO 0.60 -0.72 -0.01 1.19 0.10 0.00 0.00 179.97 181.13 1v5m n PHE 58 N -5.52 -1.20 -3.71 4.08 3.01 -1.26 -3.39 117.46 109.46 1v5m n PHE 58 Ca -0.14 -1.14 -0.11 0.00 1.01 0.00 0.00 57.45 57.07 1v5m n PHE 58 Cb 0.45 0.35 -0.11 0.00 -0.01 0.00 0.00 39.48 40.16 1v5m n PHE 58 CO 0.00 0.00 0.00 0.50 1.01 0.00 0.00 176.76 178.27 1v5m s ARG 59 N -2.30 0.38 -0.13 -1.08 3.52 -1.08 -3.13 118.95 115.15 1v5m s ARG 59 Ca 0.13 0.69 -0.03 0.00 -0.13 0.00 0.00 55.73 56.39 1v5m s ARG 59 Cb -0.01 0.03 -0.03 0.00 -1.56 0.00 0.00 34.95 33.37 1v5m s ARG 59 CO 0.09 -0.13 -0.01 -1.17 -0.81 0.00 0.00 175.30 173.27 1v5m s LEU 60 N 1.08 3.46 0.12 -0.88 1.98 -0.31 -2.83 118.68 121.30 1v5m s LEU 60 Ca -0.07 0.02 0.10 0.00 -2.89 0.00 0.00 54.13 51.29 1v5m s LEU 60 Cb -0.07 -1.82 -0.04 0.00 0.66 0.00 0.00 46.19 44.92 1v5m s LEU 60 CO -0.09 0.27 -0.26 -1.61 -1.89 0.00 0.00 176.35 172.77 1v5m s GLU 61 N -0.22 1.42 -0.42 1.98 2.02 -1.12 0.15 118.70 122.51 1v5m s GLU 61 Ca 0.05 -1.30 0.02 0.00 0.02 0.00 0.00 54.97 53.76 1v5m s GLU 61 Cb -0.13 -1.85 0.13 0.00 0.10 0.00 0.00 34.13 32.39 1v5m s GLU 61 CO 0.02 0.44 0.22 -0.06 0.02 0.00 0.00 175.26 175.90 1v5m s PHE 62 N -1.04 1.88 -0.09 1.61 0.40 -1.22 -2.99 117.98 116.52 1v5m s PHE 62 Ca 0.13 -2.31 -0.30 0.00 -0.60 0.00 0.00 56.93 53.86 1v5m s PHE 62 Cb -0.10 -1.81 -0.03 0.00 0.51 0.00 0.00 43.02 41.59 1v5m s PHE 62 CO 0.05 -0.80 1.33 -0.06 0.70 0.00 0.00 175.22 176.45 1v5m s PHE 63 N 0.54 2.79 -0.20 0.36 0.08 -1.01 -1.07 117.98 119.46 1v5m s PHE 63 Ca 0.17 0.89 -0.04 0.00 0.12 0.00 0.00 56.93 58.07 1v5m s PHE 63 Cb -0.24 -3.58 0.08 0.00 -0.57 0.00 0.00 43.02 38.72 1v5m s PHE 63 CO -0.02 -2.08 0.16 0.08 -0.10 0.00 0.00 175.22 173.26 1v5m s VAL 64 N 3.10 -0.20 1.02 -0.44 1.01 -1.26 -1.28 120.40 122.34 1v5m s VAL 64 Ca 0.59 -0.23 -0.13 0.00 0.00 0.00 0.00 61.98 62.22 1v5m s VAL 64 Cb -0.26 -0.68 0.20 0.00 0.00 0.00 0.00 36.38 35.64 1v5m s VAL 64 CO 0.21 -0.31 1.09 -2.16 0.00 0.00 0.00 175.10 173.93 1v5m s PRO 65 N 2.23 0.25 0.00 2.72 0.04 -1.26 -4.63 135.00 134.34 1v5m s PRO 65 Ca 0.05 0.46 0.14 0.00 0.04 0.00 0.00 61.00 61.69 1v5m s PRO 65 Cb -0.16 -1.72 0.83 0.00 0.04 0.00 0.00 34.50 33.49 1v5m s PRO 65 CO -0.15 -2.84 1.25 -0.35 0.04 0.00 0.00 177.00 174.95 1v5m n PRO 66 N -4.24 0.49 0.00 0.56 -0.04 -1.12 -1.88 135.00 128.77 1v5m n PRO 66 Ca 0.05 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.62 1v5m n PRO 66 Cb 0.58 -1.44 -0.07 0.00 -0.04 0.00 0.00 33.50 32.52 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 -0.94 0.01 -2.42 0.54 4.01 -1.26 -4.75 118.16 113.34 1v5m n LYS 67 Ca 0.10 -0.00 -0.35 0.00 -0.51 0.00 0.00 58.31 57.55 1v5m n LYS 67 Cb 0.05 -1.50 -0.02 0.00 -0.51 0.00 0.00 35.03 33.04 1v5m n LYS 67 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1v5m s ALA 68 N -3.01 2.91 0.16 7.82 0.00 -0.79 -4.95 121.76 123.90 1v5m s ALA 68 Ca 0.08 0.75 0.11 0.00 0.00 0.00 0.00 51.96 52.90 1v5m s ALA 68 Cb 0.16 -3.31 0.16 0.00 0.00 0.00 0.00 23.12 20.13 1v5m s ALA 68 CO 0.85 -0.46 1.49 1.03 0.00 0.00 0.00 175.76 178.66 1v5m h SER 69 N 1.81 0.00 -3.70 0.00 0.87 -1.92 -3.45 113.55 107.16 1v5m h SER 69 Ca -0.49 0.00 -0.67 0.00 -1.23 0.00 0.00 61.79 59.39 1v5m h SER 69 Cb 1.23 0.00 -0.18 0.00 -0.44 0.00 0.00 62.40 63.01 1v5m h SER 69 CO 0.60 0.72 -0.74 -0.13 -0.53 0.00 0.00 176.83 176.74 1v5m s ARG 70 N -3.21 2.28 0.26 2.24 0.52 -1.26 -5.10 118.95 114.67 1v5m s ARG 70 Ca 0.00 -0.89 -0.30 0.00 -0.52 0.00 0.00 55.73 54.03 1v5m s ARG 70 Cb 0.11 -2.35 -0.09 0.00 0.52 0.00 0.00 34.95 33.14 1v5m s ARG 70 CO 0.77 0.55 1.26 -1.25 0.02 0.00 0.00 175.30 176.66 1v5m s PRO 71 N -1.66 4.43 -0.07 3.54 0.04 -1.26 -4.59 135.00 135.42 1v5m s PRO 71 Ca 0.18 2.05 -0.20 0.00 0.04 0.00 0.00 61.00 63.07 1v5m s PRO 71 Cb -0.11 -3.15 -0.29 0.00 0.04 0.00 0.00 34.50 30.98 1v5m s PRO 71 CO 0.09 -0.13 0.75 -0.22 0.04 0.00 0.00 177.00 177.53 1v5m h LYS 72 N 4.38 0.26 -2.20 4.56 3.64 -1.36 -3.40 116.57 122.46 1v5m h LYS 72 Ca -0.47 -0.45 -0.59 0.00 -1.27 0.00 0.00 60.65 57.88 1v5m h LYS 72 Cb 1.22 0.17 -0.42 0.00 -0.41 0.00 0.00 32.23 32.79 1v5m h LYS 72 CO 0.71 1.21 -0.66 0.28 -2.27 0.00 0.00 179.45 178.72 1v5m n VAL 73 N -4.08 2.30 -2.03 2.00 0.31 -0.74 -5.01 118.33 111.07 1v5m n VAL 73 Ca -0.18 -5.23 -0.42 0.00 -0.01 0.00 0.00 64.34 58.49 1v5m n VAL 73 Cb 0.83 -1.81 -0.03 0.00 -0.91 0.00 0.00 33.84 31.93 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 -2.70 6.55 -0.26 4.52 1.04 -1.26 -3.44 113.70 118.15 1v5m s SER 74 Ca 0.42 2.04 0.03 0.00 0.48 0.00 0.00 55.95 58.92 1v5m s SER 74 Cb 0.20 -2.53 0.06 0.00 0.10 0.00 0.00 66.02 63.84 1v5m s SER 74 CO -0.06 -1.05 -0.11 -0.63 0.98 0.00 0.00 173.24 172.37 1v5m s ILE 75 N 4.49 2.21 0.23 -1.02 1.01 0.12 -4.96 121.20 123.28 1v5m s ILE 75 Ca 0.73 -1.58 -0.30 0.00 0.00 0.00 0.00 60.65 59.51 1v5m s ILE 75 Cb -0.31 -2.28 -0.09 0.00 0.01 0.00 0.00 42.46 39.80 1v5m s ILE 75 CO 0.29 0.00 1.28 -2.16 0.00 0.00 0.00 174.94 174.36 1v5m s PRO 76 N 1.12 4.41 0.56 2.79 0.04 -1.26 -1.16 135.00 141.51 1v5m s PRO 76 Ca -0.08 2.05 0.31 0.00 0.04 0.00 0.00 61.00 63.32 1v5m s PRO 76 Cb -0.20 -3.18 1.47 0.00 0.04 0.00 0.00 34.50 32.64 1v5m s PRO 76 CO -0.05 -0.19 1.86 -0.07 0.04 0.00 0.00 177.00 178.59 1v5m h LEU 77 N 4.89 0.00 -1.75 -3.56 -0.00 -1.86 0.49 115.31 113.53 1v5m h LEU 77 Ca -0.46 0.00 -0.03 0.00 -0.00 0.00 0.00 57.88 57.40 1v5m h LEU 77 Cb 1.22 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.87 1v5m h LEU 77 CO 0.74 0.00 -0.13 -1.28 -0.00 0.00 0.00 178.44 177.77 1v5m h SER 78 N 0.00 0.00 0.45 -0.43 0.87 -1.91 -2.25 113.55 110.28 1v5m h SER 78 Ca 0.38 0.00 -0.23 0.00 -1.23 0.00 0.00 61.79 60.71 1v5m h SER 78 Cb 1.67 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.63 1v5m h SER 78 CO -0.00 0.13 -1.01 0.00 -0.53 0.00 0.00 176.83 175.41 1v5m h ALA 79 N 1.87 0.32 -2.85 6.23 0.00 -0.37 -3.45 119.26 121.00 1v5m h ALA 79 Ca -0.00 -0.76 -0.53 0.00 0.00 0.00 0.00 54.91 53.62 1v5m h ALA 79 Cb 0.23 -0.02 0.07 0.00 0.00 0.00 0.00 17.79 18.07 1v5m h ALA 79 CO 0.02 0.87 0.72 0.42 0.00 0.00 0.00 179.25 181.28 1v5m s ILE 80 N -3.10 2.49 0.00 0.00 -1.09 -0.85 0.90 121.20 119.55 1v5m s ILE 80 Ca -0.05 0.46 0.00 0.00 -2.23 0.00 0.00 60.65 58.83 1v5m s ILE 80 Cb 0.09 -3.29 0.00 0.00 -1.58 0.00 0.00 42.46 37.67 1v5m s ILE 80 CO 0.87 0.10 0.00 2.30 -1.23 0.00 0.00 174.94 176.97 1v5m n ILE 81 N 1.25 0.00 -3.75 2.92 -5.35 -0.89 -4.83 119.36 108.71 1v5m n ILE 81 Ca 0.03 0.00 -0.13 0.00 -0.27 0.00 0.00 62.75 62.37 1v5m n ILE 81 Cb 0.40 -0.28 -0.14 0.00 -1.74 0.00 0.00 39.64 37.89 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 -1.37 0.10 -0.30 6.28 2.12 -1.10 -5.06 118.70 119.38 1v5m s GLU 82 Ca 0.00 0.36 0.02 0.00 0.36 0.00 0.00 54.97 55.71 1v5m s GLU 82 Cb 0.00 -0.15 0.08 0.00 0.26 0.00 0.00 34.13 34.32 1v5m s GLU 82 CO 0.00 -0.15 0.01 0.54 -0.54 0.00 0.00 175.26 175.12 1v5m s VAL 83 N 1.08 1.77 0.76 3.70 0.11 -1.26 -0.23 120.40 126.33 1v5m s VAL 83 Ca -0.08 -1.76 -0.11 0.00 -2.93 0.00 0.00 61.98 57.10 1v5m s VAL 83 Cb -0.11 -2.18 0.05 0.00 -1.53 0.00 0.00 36.38 32.61 1v5m s VAL 83 CO -0.06 -0.41 1.08 -0.13 -3.33 0.00 0.00 175.10 172.25 1v5m s ARG 84 N 1.21 2.36 0.00 1.54 0.52 -0.81 -4.86 118.95 118.90 1v5m s ARG 84 Ca 0.04 0.84 0.00 0.00 -0.52 0.00 0.00 55.73 56.09 1v5m s ARG 84 Cb -0.19 -1.93 0.00 0.00 0.52 0.00 0.00 34.95 33.35 1v5m s ARG 84 CO -0.11 -1.48 0.00 0.25 0.02 0.00 0.00 175.30 173.98 1v5m n THR 85 N -3.37 0.00 -3.69 0.02 -2.24 -1.26 -1.67 114.28 102.07 1v5m n THR 85 Ca 0.07 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.47 1v5m n THR 85 Cb 0.55 0.02 -0.12 0.00 -2.10 0.00 0.00 70.33 68.68 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 -1.50 4.24 0.57 4.28 2.01 -1.26 -4.51 115.64 119.47 1v5m s THR 86 Ca 0.00 -0.73 -0.07 0.00 0.31 0.00 0.00 61.69 61.20 1v5m s THR 86 Cb 0.00 -3.26 -0.01 0.00 0.01 0.00 0.00 72.50 69.25 1v5m s THR 86 CO 0.00 -0.04 0.90 -0.04 -0.69 0.00 0.00 174.62 174.75 1v5m s MET 87 N 1.53 3.13 0.00 4.92 1.00 -1.26 -5.02 119.30 123.60 1v5m s MET 87 Ca 0.02 0.15 0.00 0.00 0.00 0.00 0.00 55.69 55.86 1v5m s MET 87 Cb -0.18 -2.26 0.00 0.00 0.00 0.00 0.00 34.83 32.39 1v5m s MET 87 CO 0.04 -0.59 0.00 -0.35 0.00 0.00 0.00 175.02 174.12 1v5m n PRO 88 N -2.55 0.29 -1.03 2.03 -0.04 -1.26 -4.78 135.00 127.65 1v5m n PRO 88 Ca 0.04 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.16 1v5m n PRO 88 Cb 0.57 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.99 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 4.95 -0.19 1.53 7.99 -1.26 -3.94 117.00 126.08 1v5m n LEU 89 Ca 0.00 -3.08 0.01 0.00 -0.01 0.00 0.00 56.01 52.93 1v5m n LEU 89 Cb 0.00 -1.18 0.02 0.00 -0.11 0.00 0.00 43.42 42.15 1v5m n LEU 89 CO 0.00 0.32 0.32 1.21 -1.51 0.00 0.00 177.39 177.73 1v5m n GLU 90 N 5.55 0.54 -3.53 3.23 2.13 -1.26 -5.09 120.64 122.21 1v5m n GLU 90 Ca 0.49 -1.06 -0.10 0.00 0.66 0.00 0.00 57.16 57.14 1v5m n GLU 90 Cb 0.28 -0.68 -0.04 0.00 0.27 0.00 0.00 31.44 31.27 1v5m n GLU 90 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1v5m s MET 91 N -0.48 0.79 0.00 5.31 0.23 -1.25 -5.01 119.30 118.89 1v5m s MET 91 Ca 0.04 -0.08 0.00 0.00 -1.03 0.00 0.00 55.69 54.61 1v5m s MET 91 Cb 0.03 0.37 0.00 0.00 -1.53 0.00 0.00 34.83 33.70 1v5m s MET 91 CO 0.00 -0.30 0.41 -0.35 -2.03 0.00 0.00 175.02 172.75 1v5m n PRO 92 N 0.23 0.49 -2.87 3.16 -0.04 -1.26 -4.79 135.00 129.92 1v5m n PRO 92 Ca -0.11 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.24 1v5m n PRO 92 Cb 0.60 -1.08 0.06 0.00 -0.04 0.00 0.00 33.50 33.03 1v5m n PRO 92 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1v5m n GLU 93 N -0.25 -3.13 0.00 0.54 1.02 -1.26 -4.89 120.64 112.67 1v5m n GLU 93 Ca 0.00 0.60 0.01 0.00 -0.02 0.00 0.00 57.16 57.76 1v5m n GLU 93 Cb 0.04 -4.71 0.07 0.00 -0.02 0.00 0.00 31.44 26.82 1v5m n GLU 93 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1v5m n LYS 94 N -2.96 0.98 -4.38 3.49 4.76 -1.26 -4.86 118.16 113.92 1v5m n LYS 94 Ca -0.13 0.00 -0.40 0.00 -2.87 0.00 0.00 58.31 54.91 1v5m n LYS 94 Cb 0.60 -1.04 -0.08 0.00 -1.84 0.00 0.00 35.03 32.68 1v5m n LYS 94 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1v5m n ASP 95 N -0.54 -1.59 -2.28 4.39 8.00 -1.26 -4.06 116.55 119.20 1v5m n ASP 95 Ca 0.02 -1.19 -0.05 0.00 0.71 0.00 0.00 54.79 54.28 1v5m n ASP 95 Cb 0.01 -1.52 0.05 0.00 -0.02 0.00 0.00 41.12 39.64 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 -2.32 2.36 -3.95 -2.24 6.94 -1.26 -3.84 115.26 110.95 1v5m n ASN 96 Ca 0.09 -2.59 -0.09 0.00 -0.02 0.00 0.00 54.58 51.97 1v5m n ASN 96 Cb 0.44 -0.42 -0.08 0.00 -2.36 0.00 0.00 39.78 37.36 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 -3.43 0.15 -0.26 5.53 -4.23 -1.26 -1.48 115.64 110.66 1v5m s THR 97 Ca 0.35 -1.42 -0.21 0.00 -1.18 0.00 0.00 61.69 59.23 1v5m s THR 97 Cb 0.36 -1.51 0.07 0.00 1.34 0.00 0.00 72.50 72.76 1v5m s THR 97 CO -0.04 -0.67 0.67 0.72 -0.54 0.00 0.00 174.62 174.76 1v5m s PHE 98 N -3.91 -0.81 0.02 3.99 -0.12 -0.97 -4.63 117.98 111.55 1v5m s PHE 98 Ca 0.09 1.86 -0.07 0.00 -0.05 0.00 0.00 56.93 58.76 1v5m s PHE 98 Cb 0.06 0.34 -0.05 0.00 -0.63 0.00 0.00 43.02 42.74 1v5m s PHE 98 CO -0.08 -0.39 0.28 0.08 -0.05 0.00 0.00 175.22 175.05 1v5m s VAL 99 N 0.68 5.29 -0.41 -2.49 1.01 -0.67 -1.75 120.40 122.07 1v5m s VAL 99 Ca -0.03 0.17 -0.06 0.00 0.00 0.00 0.00 61.98 62.06 1v5m s VAL 99 Cb -0.05 -3.58 0.09 0.00 0.00 0.00 0.00 36.38 32.85 1v5m s VAL 99 CO -0.04 0.34 0.22 -0.76 0.00 0.00 0.00 175.10 174.86 1v5m s LEU 100 N -1.82 5.08 -0.62 3.92 1.43 -0.27 -1.92 118.68 124.48 1v5m s LEU 100 Ca 0.28 -1.70 -0.22 0.00 -1.03 0.00 0.00 54.13 51.46 1v5m s LEU 100 Cb -0.13 -1.90 0.07 0.00 0.03 0.00 0.00 46.19 44.26 1v5m s LEU 100 CO 0.17 -0.52 0.90 -0.75 0.23 0.00 0.00 176.35 176.37 1v5m s LYS 101 N 1.30 3.14 0.58 1.70 2.36 0.68 -2.15 119.74 127.35 1v5m s LYS 101 Ca 0.04 -0.81 -0.09 0.00 -2.55 0.00 0.00 55.97 52.56 1v5m s LYS 101 Cb -0.23 -4.19 -0.03 0.00 -1.05 0.00 0.00 37.83 32.33 1v5m s LYS 101 CO -0.01 -1.68 0.95 0.14 1.55 0.00 0.00 175.35 176.30 1v5m s VAL 102 N 3.74 4.59 0.54 4.02 -7.23 -0.89 -2.09 120.40 123.09 1v5m s VAL 102 Ca 0.21 0.56 0.21 0.00 -1.81 0.00 0.00 61.98 61.15 1v5m s VAL 102 Cb -0.17 -3.80 0.30 0.00 0.56 0.00 0.00 36.38 33.26 1v5m s VAL 102 CO 0.11 -0.96 2.18 1.05 -0.31 0.00 0.00 175.10 177.18 1v5m h GLU 103 N -0.16 0.00 0.00 4.82 4.11 0.19 -0.93 114.58 122.61 1v5m h GLU 103 Ca -0.45 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 58.92 1v5m h GLU 103 Cb 1.21 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 1v5m h GLU 103 CO 0.62 0.01 -0.27 -0.97 0.07 0.00 0.00 179.01 178.47 1v5m h ASN 104 N 0.00 0.00 0.00 3.06 -0.73 -1.93 -3.46 115.58 112.52 1v5m h ASN 104 Ca -0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 1v5m h ASN 104 Cb 0.02 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.61 1v5m h ASN 104 CO 0.00 0.27 0.00 0.61 -0.37 0.00 0.00 177.43 177.94 1v5m n GLY 105 N -0.73 1.28 3.81 1.57 0.00 -0.35 -5.11 105.19 105.66 1v5m n GLY 105 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.00 3.77 -0.07 4.61 0.00 -1.26 -4.90 121.76 121.91 1v5m s ALA 106 Ca 0.00 -0.60 -0.02 0.00 0.00 0.00 0.00 51.96 51.34 1v5m s ALA 106 Cb 0.00 -2.12 -0.03 0.00 0.00 0.00 0.00 23.12 20.97 1v5m s ALA 106 CO 0.00 0.40 0.01 -1.21 0.00 0.00 0.00 175.76 174.96 1v5m s GLU 107 N -0.41 2.98 -0.25 0.00 8.01 -1.25 -2.08 118.70 125.69 1v5m s GLU 107 Ca 0.14 -0.42 0.01 0.00 0.01 0.00 0.00 54.97 54.70 1v5m s GLU 107 Cb -0.12 -2.80 0.07 0.00 -4.31 0.00 0.00 34.13 26.97 1v5m s GLU 107 CO 0.03 0.69 -0.02 0.71 0.01 0.00 0.00 175.26 176.68 1v5m s TYR 108 N -0.94 2.39 -0.46 1.61 1.51 -0.91 -2.63 117.35 117.91 1v5m s TYR 108 Ca 0.15 -1.85 -0.24 0.00 -1.01 0.00 0.00 57.07 54.12 1v5m s TYR 108 Cb -0.11 -1.72 0.03 0.00 -0.11 0.00 0.00 41.96 40.05 1v5m s TYR 108 CO 0.04 -0.80 0.87 0.42 -1.11 0.00 0.00 175.55 174.97 1v5m s ILE 109 N 1.39 4.54 -0.05 2.71 1.01 0.13 -1.11 121.20 129.81 1v5m s ILE 109 Ca -0.02 0.57 -0.01 0.00 0.00 0.00 0.00 60.65 61.19 1v5m s ILE 109 Cb -0.19 -4.40 -0.04 0.00 0.01 0.00 0.00 42.46 37.85 1v5m s ILE 109 CO -0.09 -0.81 0.04 -0.76 0.00 0.00 0.00 174.94 173.32 1v5m s LEU 110 N 3.58 3.75 0.03 2.97 1.02 -0.71 -1.16 118.68 128.16 1v5m s LEU 110 Ca 0.34 0.15 0.04 0.00 0.02 0.00 0.00 54.13 54.68 1v5m s LEU 110 Cb -0.11 -2.03 -0.03 0.00 0.02 0.00 0.00 46.19 44.04 1v5m s LEU 110 CO 0.24 0.33 -0.09 -0.70 0.02 0.00 0.00 176.35 176.15 1v5m s GLU 111 N -1.30 2.41 0.15 1.70 -6.30 -0.28 -2.30 118.70 112.77 1v5m s GLU 111 Ca 0.18 -0.81 0.08 0.00 -2.50 0.00 0.00 54.97 51.91 1v5m s GLU 111 Cb -0.12 -2.42 -0.04 0.00 0.00 0.00 0.00 34.13 31.55 1v5m s GLU 111 CO 0.08 0.58 -0.18 0.95 0.02 0.00 0.00 175.26 176.71 1v5m s THR 112 N -1.02 1.72 0.07 -1.70 -4.23 -0.55 -3.72 115.64 106.20 1v5m s THR 112 Ca 0.17 -1.86 -0.13 0.00 -1.18 0.00 0.00 61.69 58.69 1v5m s THR 112 Cb -0.11 -1.77 -0.03 0.00 1.34 0.00 0.00 72.50 71.93 1v5m s THR 112 CO 0.08 -0.33 0.90 -0.38 -0.54 0.00 0.00 174.62 174.36 1v5m n ILE 113 N 0.37 -0.29 -4.03 2.99 5.41 -1.26 -4.75 119.36 117.80 1v5m n ILE 113 Ca -0.14 1.40 -0.13 0.00 1.00 0.00 0.00 62.75 64.88 1v5m n ILE 113 Cb 0.57 -1.76 -0.03 0.00 -0.71 0.00 0.00 39.64 37.70 1v5m n ILE 113 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 1v5m n ASP 114 N -4.04 -0.93 0.10 4.38 5.68 -1.26 -5.02 116.55 115.46 1v5m n ASP 114 Ca 0.01 -2.55 0.12 0.00 -0.50 0.00 0.00 54.79 51.87 1v5m n ASP 114 Cb 0.11 1.81 0.62 0.00 -1.14 0.00 0.00 41.12 42.52 1v5m n ASP 114 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 1v5m h SER 115 N 1.57 0.10 -0.72 -1.12 4.64 -1.71 -1.25 113.55 115.06 1v5m h SER 115 Ca -0.21 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.10 1v5m h SER 115 Cb 0.94 -0.02 -0.03 0.00 -0.31 0.00 0.00 62.40 62.97 1v5m h SER 115 CO 0.28 0.06 0.39 0.17 -0.87 0.00 0.00 176.83 176.86 1v5m h LEU 116 N 0.11 0.90 -0.10 5.97 8.10 -1.94 -1.84 115.31 126.52 1v5m h LEU 116 Ca 0.13 -0.10 -0.18 0.00 0.11 0.00 0.00 57.88 57.84 1v5m h LEU 116 Cb 0.39 -0.23 0.01 0.00 -0.44 0.00 0.00 40.66 40.39 1v5m h LEU 116 CO -0.02 0.75 -0.64 1.56 -4.11 0.00 0.00 178.44 175.98 1v5m h GLN 117 N 0.99 0.61 0.03 0.17 4.20 -1.64 -3.10 115.11 116.38 1v5m h GLN 117 Ca 0.25 -0.52 -0.00 0.00 0.06 0.00 0.00 58.65 58.44 1v5m h GLN 117 Cb 0.05 0.12 -0.00 0.00 0.30 0.00 0.00 27.48 27.95 1v5m h GLN 117 CO -0.04 1.14 -0.03 -0.22 -0.67 0.00 0.00 178.83 179.01 1v5m h LYS 118 N 0.24 -0.06 -0.97 1.46 3.64 -1.16 -1.74 116.57 117.99 1v5m h LYS 118 Ca -0.05 0.00 0.32 0.00 -1.27 0.00 0.00 60.65 59.65 1v5m h LYS 118 Cb 1.29 0.01 -0.16 0.00 -0.41 0.00 0.00 32.23 32.96 1v5m h LYS 118 CO 0.13 -0.04 0.35 1.25 -2.27 0.00 0.00 179.45 178.87 1v5m h HIS 119 N -0.06 0.52 0.17 1.91 2.76 -1.49 0.16 115.15 119.12 1v5m h HIS 119 Ca -0.00 0.05 0.01 0.00 -2.20 0.00 0.00 60.37 58.23 1v5m h HIS 119 Cb 0.06 -0.07 -0.03 0.00 1.55 0.00 0.00 27.41 28.92 1v5m h HIS 119 CO -0.05 -0.34 -0.28 0.77 -1.30 0.00 0.00 177.93 176.73 1v5m h SER 120 N 0.12 -0.79 0.34 3.26 0.02 -1.39 -2.58 113.55 112.53 1v5m h SER 120 Ca 0.69 0.09 -0.01 0.00 -0.84 0.00 0.00 61.79 61.72 1v5m h SER 120 Cb 1.60 0.29 -0.03 0.00 0.14 0.00 0.00 62.40 64.41 1v5m h SER 120 CO -0.75 -0.38 -0.45 -0.50 -1.14 0.00 0.00 176.83 173.61 1v5m h TRP 121 N -0.53 -1.28 -1.56 3.45 4.06 0.21 -1.36 115.95 118.94 1v5m h TRP 121 Ca 0.02 0.02 0.51 0.00 2.06 0.00 0.00 58.89 61.49 1v5m h TRP 121 Cb 0.53 0.51 -0.12 0.00 -1.00 0.00 0.00 29.16 29.08 1v5m h TRP 121 CO -0.23 -0.57 1.05 0.28 -3.56 0.00 0.00 178.44 175.40 1v5m n VAL 122 N -5.13 -0.18 0.26 1.49 0.31 -0.83 -0.08 118.33 114.18 1v5m n VAL 122 Ca -0.10 1.73 -0.13 0.00 -0.01 0.00 0.00 64.34 65.83 1v5m n VAL 122 Cb 0.39 -2.84 -0.07 0.00 -0.91 0.00 0.00 33.84 30.41 1v5m n VAL 122 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1v5m h ALA 123 N 1.43 -0.70 -0.11 3.52 0.00 -0.84 -0.65 119.26 121.91 1v5m h ALA 123 Ca 0.90 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 55.65 1v5m h ALA 123 Cb 3.13 0.27 -0.03 0.00 0.00 0.00 0.00 17.79 21.16 1v5m h ALA 123 CO -0.34 -0.72 -0.08 0.38 0.00 0.00 0.00 179.25 178.50 1v5m h ASP 124 N -1.06 -0.24 0.42 0.00 2.03 -0.18 0.45 116.42 117.85 1v5m h ASP 124 Ca -0.07 0.05 -0.02 0.00 -0.73 0.00 0.00 57.03 56.26 1v5m h ASP 124 Cb 0.61 0.13 -0.01 0.00 -0.83 0.00 0.00 39.33 39.23 1v5m h ASP 124 CO 0.12 -0.10 -0.30 0.40 -1.03 0.00 0.00 179.24 178.33 1v5m h ILE 125 N -0.08 0.00 -0.03 4.15 2.04 -1.13 -2.71 117.51 119.75 1v5m h ILE 125 Ca 0.07 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.96 1v5m h ILE 125 Cb 0.18 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 36.21 1v5m h ILE 125 CO -0.16 0.00 -0.28 1.56 0.00 0.00 0.00 178.15 179.27 1v5m h GLN 126 N -0.69 -0.39 0.00 2.37 4.20 -1.08 0.50 115.11 120.02 1v5m h GLN 126 Ca -0.06 0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.68 1v5m h GLN 126 Cb 0.56 0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.43 1v5m h GLN 126 CO 0.03 -0.26 0.66 0.78 -0.67 0.00 0.00 178.83 179.38 1v5m h GLY 127 N -0.41 0.00 0.00 3.46 0.00 -0.07 0.18 103.07 106.23 1v5m h GLY 127 Ca 0.07 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.26 1v5m h GLY 127 CO -0.26 0.00 -1.21 0.00 0.00 0.00 0.00 176.54 175.07 1v5m h VAL 129 N -1.00 0.89 0.19 0.00 3.04 -0.10 -1.87 116.25 117.40 1v5m h VAL 129 Ca -0.21 -0.24 -0.01 0.00 -1.01 0.00 0.00 66.70 65.23 1v5m h VAL 129 Cb 1.03 0.12 0.00 0.00 -2.01 0.00 0.00 31.29 30.44 1v5m h VAL 129 CO -0.13 0.13 -0.09 0.44 -1.01 0.00 0.00 177.57 176.91 1v5m h ASP 130 N 0.70 -0.22 0.00 3.17 3.32 -0.92 -3.45 116.42 119.03 1v5m h ASP 130 Ca 0.40 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.46 1v5m h ASP 130 Cb 0.59 0.06 -0.00 0.00 0.22 0.00 0.00 39.33 40.19 1v5m h ASP 130 CO -0.17 -0.15 -0.13 -1.20 -1.72 0.00 0.00 179.24 175.88 1v5m n SER 131 N -2.72 1.04 0.00 6.45 7.64 -1.14 -5.11 113.62 119.78 1v5m n SER 131 Ca -0.03 0.13 0.00 0.00 1.01 0.00 0.00 58.87 59.98 1v5m n SER 131 Cb 0.10 -0.32 0.00 0.00 -1.01 0.00 0.00 64.21 62.98 1v5m n SER 131 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1v5m n GLY 132 N 3.39 1.77 0.24 0.23 0.00 -0.72 -4.85 105.19 105.25 1v5m n GLY 132 Ca -0.01 -0.41 0.11 0.00 0.00 0.00 0.00 46.02 45.72 1v5m n GLY 132 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1v5m h PRO 133 N 0.00 0.00 -6.44 1.61 0.13 -1.88 -3.41 132.00 122.01 1v5m h PRO 133 Ca 0.00 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.52 1v5m h PRO 133 Cb 0.00 0.00 0.11 0.00 0.13 0.00 0.00 31.00 31.24 1v5m h PRO 133 CO 0.00 0.18 0.09 0.45 -0.23 0.00 0.00 178.00 178.49 1v5m n SER 134 N -3.41 1.15 -3.64 1.44 2.88 -1.26 -4.98 113.62 105.79 1v5m n SER 134 Ca -0.00 1.18 -0.03 0.00 -1.33 0.00 0.00 58.87 58.69 1v5m n SER 134 Cb 0.37 -1.27 -0.07 0.00 -0.75 0.00 0.00 64.21 62.50 1v5m n SER 134 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1v5m s SER 135 N -0.57 -0.36 0.00 -3.46 0.15 -1.26 -4.74 113.70 103.46 1v5m s SER 135 Ca 0.59 0.60 0.00 0.00 0.70 0.00 0.00 55.95 57.85 1v5m s SER 135 Cb -0.72 1.00 0.00 0.00 -1.71 0.00 0.00 66.02 64.59 1v5m s SER 135 CO 0.60 -0.10 0.35 0.61 1.20 0.00 0.00 173.24 175.90