#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 0.61 0.04 1.61 0.01 -1.26 -5.14 113.70 109.56 1v5m s SER 2 Ca 0.00 -0.08 -0.28 0.00 1.31 0.00 0.00 55.95 56.90 1v5m s SER 2 Cb 0.00 -0.22 0.09 0.00 0.21 0.00 0.00 66.02 66.10 1v5m s SER 2 CO 0.00 -0.02 1.02 -0.55 0.41 0.00 0.00 173.24 174.09 1v5m s SER 3 N 0.53 -0.21 0.00 2.44 0.15 -1.26 -5.08 113.70 110.27 1v5m s SER 3 Ca -0.06 -0.19 0.00 0.00 0.70 0.00 0.00 55.95 56.41 1v5m s SER 3 Cb -0.09 0.36 0.00 0.00 -1.71 0.00 0.00 66.02 64.58 1v5m s SER 3 CO -0.01 -0.64 0.00 0.61 1.20 0.00 0.00 173.24 174.40 1v5m n GLY 4 N -0.36 0.53 3.05 9.45 0.00 -1.26 -5.17 105.19 111.43 1v5m n GLY 4 Ca -0.07 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.81 1v5m n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1v5m s SER 5 N -0.13 0.89 0.07 1.61 1.04 -1.26 -5.16 113.70 110.77 1v5m s SER 5 Ca 0.00 -0.43 -0.19 0.00 0.48 0.00 0.00 55.95 55.81 1v5m s SER 5 Cb 0.00 -0.01 0.04 0.00 0.10 0.00 0.00 66.02 66.16 1v5m s SER 5 CO 0.00 -0.11 0.46 -0.94 0.98 0.00 0.00 173.24 173.63 1v5m s SER 6 N -1.17 -0.34 0.00 7.02 1.04 -1.26 -5.17 113.70 113.81 1v5m s SER 6 Ca -0.06 -0.02 0.00 0.00 0.48 0.00 0.00 55.95 56.36 1v5m s SER 6 Cb -0.08 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.51 1v5m s SER 6 CO 0.00 -0.75 0.00 0.61 0.98 0.00 0.00 173.24 174.08 1v5m n GLY 7 N 0.23 -1.28 2.83 7.32 0.00 -1.26 -5.14 105.19 107.89 1v5m n GLY 7 Ca -0.18 -0.92 -0.24 0.00 0.00 0.00 0.00 46.02 44.68 1v5m n GLY 7 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1v5m s ASN 8 N -3.97 1.76 0.25 1.61 3.84 -1.26 -5.12 114.94 112.05 1v5m s ASN 8 Ca 0.00 -0.17 -0.31 0.00 0.21 0.00 0.00 52.86 52.59 1v5m s ASN 8 Cb 0.00 -0.59 -0.13 0.00 -0.55 0.00 0.00 41.25 39.99 1v5m s ASN 8 CO 0.00 -0.16 1.54 0.00 -2.79 0.00 0.00 177.10 175.69 1v5m n LEU 9 N 4.99 3.68 -4.39 3.21 -0.00 -1.26 -4.92 117.00 118.31 1v5m n LEU 9 Ca -0.10 1.13 -0.45 0.00 -0.00 0.00 0.00 56.01 56.58 1v5m n LEU 9 Cb 0.50 -1.51 -0.02 0.00 -0.00 0.00 0.00 43.42 42.39 1v5m n LEU 9 CO 0.14 -0.14 0.68 0.00 -0.00 0.00 0.00 177.39 178.07 1v5m s ALA 10 N 0.23 3.73 0.21 1.47 0.00 -1.26 -4.91 121.76 121.23 1v5m s ALA 10 Ca 0.69 -3.04 -0.04 0.00 0.00 0.00 0.00 51.96 49.57 1v5m s ALA 10 Cb -0.58 -3.77 0.39 0.00 0.00 0.00 0.00 23.12 19.16 1v5m s ALA 10 CO 0.46 -2.61 1.11 0.00 0.00 0.00 0.00 175.76 174.72 1v5m n ALA 11 N 5.23 0.22 -2.30 0.00 0.00 -1.26 -4.42 120.51 117.98 1v5m n ALA 11 Ca 0.18 0.78 -0.24 0.00 0.00 0.00 0.00 53.44 54.16 1v5m n ALA 11 Cb 0.48 -0.49 -0.00 0.00 0.00 0.00 0.00 19.45 19.43 1v5m n ALA 11 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1v5m s LYS 12 N -5.82 2.33 -0.02 0.00 1.02 -1.26 -5.14 119.74 110.85 1v5m s LYS 12 Ca -0.10 -1.84 0.01 0.00 0.02 0.00 0.00 55.97 54.05 1v5m s LYS 12 Cb 0.20 -2.24 0.01 0.00 -0.52 0.00 0.00 37.83 35.28 1v5m s LYS 12 CO 0.55 -0.53 -0.02 0.54 -0.92 0.00 0.00 175.35 174.98 1v5m s VAL 13 N -2.68 0.23 -0.30 3.17 0.11 -1.26 -5.04 120.40 114.63 1v5m s VAL 13 Ca 0.42 -0.02 0.12 0.00 -2.93 0.00 0.00 61.98 59.57 1v5m s VAL 13 Cb -0.03 -0.26 0.47 0.00 -1.53 0.00 0.00 36.38 35.03 1v5m s VAL 13 CO 0.25 0.12 1.15 1.21 -3.33 0.00 0.00 175.10 174.50 1v5m n GLU 14 N 3.67 2.90 -3.84 1.54 4.07 -1.26 -5.06 120.64 122.66 1v5m n GLU 14 Ca -0.21 -3.96 -0.07 0.00 -0.06 0.00 0.00 57.16 52.86 1v5m n GLU 14 Cb 0.54 -2.02 -0.01 0.00 -0.06 0.00 0.00 31.44 29.89 1v5m n GLU 14 CO 0.00 0.00 0.00 -0.48 -0.06 0.00 0.00 177.13 176.59 1v5m s LEU 15 N -3.63 -0.19 -0.08 4.31 2.34 -1.26 -5.13 118.68 115.03 1v5m s LEU 15 Ca 0.42 -0.71 0.00 0.00 0.06 0.00 0.00 54.13 53.91 1v5m s LEU 15 Cb 0.38 2.70 -0.03 0.00 -0.56 0.00 0.00 46.19 48.69 1v5m s LEU 15 CO -0.01 -1.38 -0.06 -0.69 -1.06 0.00 0.00 176.35 173.15 1v5m s VAL 16 N -3.51 3.73 0.15 1.48 1.01 -1.26 -5.03 120.40 116.97 1v5m s VAL 16 Ca 0.12 -0.46 -0.32 0.00 0.00 0.00 0.00 61.98 61.32 1v5m s VAL 16 Cb -0.05 -2.54 -0.09 0.00 0.00 0.00 0.00 36.38 33.70 1v5m s VAL 16 CO 0.08 0.59 1.54 0.44 0.00 0.00 0.00 175.10 177.74 1v5m h ASP 17 N 5.42 -2.03 -1.51 3.32 5.19 -2.02 -3.38 116.42 121.41 1v5m h ASP 17 Ca -0.47 0.29 -0.66 0.00 -0.62 0.00 0.00 57.03 55.58 1v5m h ASP 17 Cb 1.18 0.87 -0.00 0.00 0.18 0.00 0.00 39.33 41.56 1v5m h ASP 17 CO 0.53 -0.30 1.26 -0.38 -3.12 0.00 0.00 179.24 177.24 1v5m n ILE 18 N -5.29 0.33 -0.01 0.35 -0.00 -1.26 -4.45 119.36 109.04 1v5m n ILE 18 Ca -0.00 -0.21 -0.17 0.00 -0.00 0.00 0.00 62.75 62.37 1v5m n ILE 18 Cb 0.29 -1.75 -0.12 0.00 -0.00 0.00 0.00 39.64 38.07 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 11.04 0.28 -2.38 0.38 1.08 -1.62 -3.49 115.11 120.41 1v5m h GLN 19 Ca -0.37 -0.33 0.05 0.00 -1.45 0.00 0.00 58.65 56.55 1v5m h GLN 19 Cb 1.30 0.10 -0.16 0.00 -0.05 0.00 0.00 27.48 28.67 1v5m h GLN 19 CO 0.99 1.05 0.38 0.50 -0.95 0.00 0.00 178.83 180.79 1v5m s ARG 20 N -3.02 0.96 -0.19 1.46 3.52 -1.26 -5.08 118.95 115.33 1v5m s ARG 20 Ca -0.15 -0.24 -0.17 0.00 -0.13 0.00 0.00 55.73 55.05 1v5m s ARG 20 Cb 0.02 0.44 0.05 0.00 -1.56 0.00 0.00 34.95 33.90 1v5m s ARG 20 CO 0.79 -0.39 0.51 -2.00 -0.81 0.00 0.00 175.30 173.39 1v5m s GLU 21 N -2.86 0.58 0.36 5.12 -6.30 -1.26 -2.62 118.70 111.72 1v5m s GLU 21 Ca 0.01 0.73 -0.17 0.00 -2.50 0.00 0.00 54.97 53.04 1v5m s GLU 21 Cb -0.01 0.26 0.06 0.00 0.00 0.00 0.00 34.13 34.44 1v5m s GLU 21 CO -0.07 -0.08 0.82 0.20 0.02 0.00 0.00 175.26 176.15 1v5m s GLY 22 N 0.40 0.31 -0.29 -1.50 0.00 -0.92 -5.02 107.32 100.31 1v5m s GLY 22 Ca -0.01 -0.67 0.02 0.00 0.00 0.00 0.00 44.72 44.06 1v5m s GLY 22 CO -0.01 0.01 -0.00 0.00 0.00 0.00 0.00 173.10 173.09 1v5m s ALA 23 N -2.40 2.30 0.29 3.20 0.00 -1.26 -0.76 121.76 123.14 1v5m s ALA 23 Ca 0.16 -1.87 0.03 0.00 0.00 0.00 0.00 51.96 50.28 1v5m s ALA 23 Cb -0.05 -1.67 -0.04 0.00 0.00 0.00 0.00 23.12 21.36 1v5m s ALA 23 CO 0.10 -1.43 0.15 -0.48 0.00 0.00 0.00 175.76 174.10 1v5m s LEU 24 N 1.22 1.63 0.16 0.00 2.34 -0.64 -4.95 118.68 118.44 1v5m s LEU 24 Ca 0.02 -1.52 -0.12 0.00 0.06 0.00 0.00 54.13 52.57 1v5m s LEU 24 Cb -0.19 0.18 -0.07 0.00 -0.56 0.00 0.00 46.19 45.56 1v5m s LEU 24 CO -0.10 -0.86 0.51 -0.13 -1.06 0.00 0.00 176.35 174.72 1v5m s ARG 25 N -3.87 3.87 0.05 1.48 3.00 -1.25 -1.67 118.95 120.56 1v5m s ARG 25 Ca 0.36 0.34 0.04 0.00 0.00 0.00 0.00 55.73 56.47 1v5m s ARG 25 Cb 0.06 -2.86 -0.03 0.00 0.00 0.00 0.00 34.95 32.12 1v5m s ARG 25 CO 0.17 0.45 -0.11 -0.59 0.00 0.00 0.00 175.30 175.21 1v5m s PHE 26 N -1.56 0.97 0.15 -0.53 -0.71 -0.40 -1.68 117.98 114.21 1v5m s PHE 26 Ca 0.40 -0.45 -0.07 0.00 -1.04 0.00 0.00 56.93 55.77 1v5m s PHE 26 Cb -0.14 -0.56 -0.02 0.00 -1.21 0.00 0.00 43.02 41.10 1v5m s PHE 26 CO 0.20 -0.00 0.21 0.00 -1.34 0.00 0.00 175.22 174.28 1v5m s MET 27 N -1.54 1.07 -0.10 1.99 0.23 -0.13 -2.88 119.30 117.94 1v5m s MET 27 Ca -0.05 -1.24 0.02 0.00 -1.03 0.00 0.00 55.69 53.40 1v5m s MET 27 Cb -0.09 0.33 0.01 0.00 -1.53 0.00 0.00 34.83 33.55 1v5m s MET 27 CO 0.01 -0.36 -0.17 0.08 -2.03 0.00 0.00 175.02 172.55 1v5m s VAL 28 N -3.98 1.60 -0.55 5.16 1.01 -1.26 -0.34 120.40 122.04 1v5m s VAL 28 Ca 0.18 -0.73 -0.27 0.00 0.00 0.00 0.00 61.98 61.16 1v5m s VAL 28 Cb 0.05 -1.43 -0.02 0.00 0.00 0.00 0.00 36.38 34.97 1v5m s VAL 28 CO -0.00 0.46 1.87 0.00 0.00 0.00 0.00 175.10 177.43 1v5m s ALA 29 N 0.73 2.28 0.00 5.51 0.00 -1.13 -4.93 121.76 124.22 1v5m s ALA 29 Ca -0.12 -0.43 -0.10 0.00 0.00 0.00 0.00 51.96 51.31 1v5m s ALA 29 Cb -0.16 -4.25 0.01 0.00 0.00 0.00 0.00 23.12 18.72 1v5m s ALA 29 CO 0.02 -3.67 0.21 0.34 0.00 0.00 0.00 175.76 172.66 1v5m s ASP 30 N 7.90 -0.05 -0.43 0.00 2.15 -1.26 -4.81 116.67 120.17 1v5m s ASP 30 Ca 0.71 -0.13 -0.07 0.00 0.43 0.00 0.00 52.55 53.50 1v5m s ASP 30 Cb -0.15 0.25 0.11 0.00 -0.30 0.00 0.00 42.92 42.83 1v5m s ASP 30 CO 0.24 -0.42 0.27 -1.81 -0.17 0.00 0.00 175.17 173.27 1v5m s ASP 31 N -1.46 5.52 -0.06 -0.34 1.01 -1.26 -5.05 116.67 115.03 1v5m s ASP 31 Ca -0.13 -1.84 -0.20 0.00 0.71 0.00 0.00 52.55 51.09 1v5m s ASP 31 Cb -0.06 -1.94 0.04 0.00 1.01 0.00 0.00 42.92 41.97 1v5m s ASP 31 CO 0.02 -0.60 0.46 0.00 0.21 0.00 0.00 175.17 175.26 1v5m s ALA 32 N 1.30 -1.16 -0.83 5.23 0.00 -1.26 -5.11 121.76 119.94 1v5m s ALA 32 Ca 0.05 0.85 -0.20 0.00 0.00 0.00 0.00 51.96 52.66 1v5m s ALA 32 Cb -0.24 -0.15 0.11 0.00 0.00 0.00 0.00 23.12 22.84 1v5m s ALA 32 CO -0.01 -0.28 1.06 0.00 0.00 0.00 0.00 175.76 176.52 1v5m s ALA 33 N -0.92 3.28 -0.16 0.00 0.00 -1.26 -4.84 121.76 117.86 1v5m s ALA 33 Ca -0.10 -2.45 -0.14 0.00 0.00 0.00 0.00 51.96 49.27 1v5m s ALA 33 Cb -0.03 -3.97 -0.10 0.00 0.00 0.00 0.00 23.12 19.02 1v5m s ALA 33 CO 0.05 -2.89 0.03 1.03 0.00 0.00 0.00 175.76 173.98 1v5m h SER 34 N 9.09 0.00 -1.44 0.00 0.87 -2.02 -3.51 113.55 116.54 1v5m h SER 34 Ca -0.00 -0.24 0.00 0.00 -1.23 0.00 0.00 61.79 60.32 1v5m h SER 34 Cb 1.04 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.00 1v5m h SER 34 CO 1.13 1.00 0.00 0.61 -0.53 0.00 0.00 176.83 179.04 1v5m n GLY 35 N 1.57 0.70 3.71 5.77 0.00 -1.26 -5.10 105.19 110.59 1v5m n GLY 35 Ca -0.15 -2.10 -0.30 0.00 0.00 0.00 0.00 46.02 43.47 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 -0.96 1.14 0.00 1.61 0.04 -1.26 -5.01 135.00 130.56 1v5m s PRO 36 Ca 0.00 0.78 0.00 0.00 0.04 0.00 0.00 61.00 61.82 1v5m s PRO 36 Cb 0.00 -1.80 0.00 0.00 0.04 0.00 0.00 34.50 32.74 1v5m s PRO 36 CO 0.00 -2.31 0.00 0.41 0.04 0.00 0.00 177.00 175.14 1v5m n GLY 37 N -1.12 -0.60 3.18 0.56 0.00 -1.26 -5.15 105.19 100.80 1v5m n GLY 37 Ca 0.07 -0.63 -0.35 0.00 0.00 0.00 0.00 46.02 45.10 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 0.00 -2.99 0.23 -0.02 0.00 -1.26 -4.89 105.19 96.26 1v5m n GLY 38 Ca 0.00 -0.62 -0.15 0.00 0.00 0.00 0.00 46.02 45.24 1v5m n GLY 38 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1v5m h THR 39 N -1.45 0.61 -3.29 2.61 2.02 -2.01 -3.42 112.91 107.99 1v5m h THR 39 Ca -0.45 -0.07 -0.68 0.00 0.77 0.00 0.00 66.41 65.98 1v5m h THR 39 Cb 1.34 0.65 -0.33 0.00 -1.74 0.00 0.00 68.15 68.07 1v5m h THR 39 CO 0.30 0.01 -0.87 0.00 0.37 0.00 0.00 175.52 175.33 1v5m s ALA 40 N -5.97 2.23 0.38 6.16 0.00 -1.26 -5.00 121.76 118.30 1v5m s ALA 40 Ca -0.16 -1.02 0.27 0.00 0.00 0.00 0.00 51.96 51.06 1v5m s ALA 40 Cb 0.04 -0.91 1.30 0.00 0.00 0.00 0.00 23.12 23.55 1v5m s ALA 40 CO 0.63 0.16 1.38 0.94 0.00 0.00 0.00 175.76 178.87 1v5m n GLN 41 N 3.74 -0.04 -1.06 0.00 -0.06 -1.26 -4.57 117.38 114.13 1v5m n GLN 41 Ca -0.19 1.13 -0.40 0.00 -2.00 0.00 0.00 57.00 55.53 1v5m n GLN 41 Cb 0.52 -2.18 -0.05 0.00 -4.06 0.00 0.00 30.24 24.47 1v5m n GLN 41 CO 0.00 0.00 0.00 0.91 -0.20 0.00 0.00 177.06 177.77 1v5m n TRP 42 N -4.56 0.20 -4.79 3.69 7.02 -1.26 -4.93 117.44 112.81 1v5m n TRP 42 Ca 0.35 0.75 -0.32 0.00 -1.02 0.00 0.00 57.50 57.25 1v5m n TRP 42 Cb 1.34 -1.48 -0.16 0.00 -2.42 0.00 0.00 31.31 28.59 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 -0.23 3.07 0.21 -0.99 -0.21 -1.14 -4.93 119.66 115.44 1v5m s GLN 43 Ca 0.60 -0.84 -0.32 0.00 0.02 0.00 0.00 55.36 54.82 1v5m s GLN 43 Cb -0.84 -2.44 -0.11 0.00 1.00 0.00 0.00 33.01 30.62 1v5m s GLN 43 CO 0.41 0.05 1.65 -1.59 -2.12 0.00 0.00 175.29 173.69 1v5m s LYS 44 N 0.68 4.16 0.30 2.91 0.00 -1.26 -1.27 119.74 125.25 1v5m s LYS 44 Ca -0.10 2.52 -0.18 0.00 0.00 0.00 0.00 55.97 58.21 1v5m s LYS 44 Cb -0.16 -3.09 0.02 0.00 0.00 0.00 0.00 37.83 34.60 1v5m s LYS 44 CO 0.01 -0.68 0.69 0.00 0.00 0.00 0.00 175.35 175.37 1v5m s ARG 46 N -3.56 2.31 -0.33 0.00 3.52 -0.55 -1.62 118.95 118.72 1v5m s ARG 46 Ca 0.14 -0.89 -0.08 0.00 -0.13 0.00 0.00 55.73 54.77 1v5m s ARG 46 Cb -0.05 -2.13 0.02 0.00 -1.56 0.00 0.00 34.95 31.23 1v5m s ARG 46 CO 0.09 0.51 0.12 -1.17 -0.81 0.00 0.00 175.30 174.04 1v5m s LEU 47 N -0.48 4.19 -0.15 -0.88 2.96 0.06 -1.77 118.68 122.62 1v5m s LEU 47 Ca 0.06 -0.86 0.00 0.00 -0.22 0.00 0.00 54.13 53.11 1v5m s LEU 47 Cb -0.11 -1.92 -0.00 0.00 0.50 0.00 0.00 46.19 44.65 1v5m s LEU 47 CO 0.01 -0.27 -0.15 -0.22 -1.32 0.00 0.00 176.35 174.40 1v5m s LEU 48 N 1.50 2.50 -0.30 -0.68 2.96 -1.13 -2.15 118.68 121.37 1v5m s LEU 48 Ca 0.02 -0.45 0.01 0.00 -0.22 0.00 0.00 54.13 53.48 1v5m s LEU 48 Cb -0.18 -1.56 0.07 0.00 0.50 0.00 0.00 46.19 45.01 1v5m s LEU 48 CO 0.04 0.10 -0.01 -0.22 -1.32 0.00 0.00 176.35 174.94 1v5m s LEU 49 N 0.73 4.04 0.13 -0.68 0.20 -1.08 -3.06 118.68 118.96 1v5m s LEU 49 Ca -0.07 -1.54 0.04 0.00 0.69 0.00 0.00 54.13 53.25 1v5m s LEU 49 Cb -0.16 -1.66 -0.04 0.00 -0.43 0.00 0.00 46.19 43.90 1v5m s LEU 49 CO 0.01 -0.29 -0.09 0.00 -0.29 0.00 0.00 176.35 175.70 1v5m s ARG 50 N 1.13 1.00 0.32 1.98 1.70 -1.26 -2.14 118.95 121.68 1v5m s ARG 50 Ca -0.02 -1.42 -0.29 0.00 -0.47 0.00 0.00 55.73 53.52 1v5m s ARG 50 Cb -0.20 -0.50 -0.10 0.00 -0.57 0.00 0.00 34.95 33.57 1v5m s ARG 50 CO -0.04 0.04 1.29 1.03 -1.08 0.00 0.00 175.30 176.55 1v5m s ARG 51 N -3.77 4.38 0.70 3.89 0.52 -1.26 -3.07 118.95 120.33 1v5m s ARG 51 Ca 0.16 2.18 -0.10 0.00 -0.52 0.00 0.00 55.73 57.45 1v5m s ARG 51 Cb 0.03 -3.09 0.03 0.00 0.52 0.00 0.00 34.95 32.45 1v5m s ARG 51 CO -0.01 -0.16 1.06 0.00 0.02 0.00 0.00 175.30 176.20 1v5m s ALA 52 N -1.04 2.98 0.67 2.13 0.00 -0.71 -4.85 121.76 120.93 1v5m s ALA 52 Ca 0.49 -0.55 -0.12 0.00 0.00 0.00 0.00 51.96 51.79 1v5m s ALA 52 Cb -0.39 -2.86 -0.01 0.00 0.00 0.00 0.00 23.12 19.86 1v5m s ALA 52 CO 0.51 -1.18 1.05 0.14 0.00 0.00 0.00 175.76 176.28 1v5m s VAL 53 N -3.30 4.14 -0.39 0.00 -7.23 -1.26 -4.80 120.40 107.56 1v5m s VAL 53 Ca 0.58 0.74 -0.35 0.00 -1.81 0.00 0.00 61.98 61.14 1v5m s VAL 53 Cb -0.11 -3.49 -0.15 0.00 0.56 0.00 0.00 36.38 33.19 1v5m s VAL 53 CO 0.49 -0.87 1.53 0.00 -0.31 0.00 0.00 175.10 175.95 1v5m n ALA 54 N -2.90 -0.19 0.00 1.32 0.00 -1.26 -2.28 120.51 115.19 1v5m n ALA 54 Ca 0.07 0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.73 1v5m n ALA 54 Cb 0.54 -1.58 0.00 0.00 0.00 0.00 0.00 19.45 18.41 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 5.00 4.44 3.59 0.00 0.00 -1.26 -5.12 105.19 111.85 1v5m n GLY 55 Ca 0.37 -0.75 -0.27 0.00 0.00 0.00 0.00 46.02 45.37 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 1.91 -0.03 1.61 2.12 -0.97 -5.10 118.70 118.24 1v5m s GLU 56 Ca 0.00 -2.09 -0.01 0.00 0.36 0.00 0.00 54.97 53.23 1v5m s GLU 56 Cb 0.00 -1.39 -0.00 0.00 0.26 0.00 0.00 34.13 33.00 1v5m s GLU 56 CO 0.00 -0.14 -0.02 0.00 -0.54 0.00 0.00 175.26 174.56 1v5m h ARG 57 N 1.81 0.00 -4.95 4.30 2.47 -1.89 -3.41 114.38 112.71 1v5m h ARG 57 Ca -0.43 0.00 -0.51 0.00 -1.26 0.00 0.00 59.98 57.78 1v5m h ARG 57 Cb 1.25 0.00 -0.13 0.00 -1.65 0.00 0.00 29.97 29.44 1v5m h ARG 57 CO 0.76 0.00 -0.50 -0.06 0.56 0.00 0.00 179.97 180.74 1v5m s PHE 58 N -1.20 1.76 -0.27 3.04 0.40 -1.26 -1.74 117.98 118.71 1v5m s PHE 58 Ca -0.02 -1.51 -0.11 0.00 -0.60 0.00 0.00 56.93 54.69 1v5m s PHE 58 Cb 0.00 -0.90 0.11 0.00 0.51 0.00 0.00 43.02 42.74 1v5m s PHE 58 CO 0.02 -0.64 0.61 0.50 0.70 0.00 0.00 175.22 176.41 1v5m s ARG 59 N -3.56 0.55 0.20 0.44 3.52 -1.18 -2.28 118.95 116.65 1v5m s ARG 59 Ca 0.33 1.30 -0.12 0.00 -0.13 0.00 0.00 55.73 57.11 1v5m s ARG 59 Cb 0.02 0.58 -0.07 0.00 -1.56 0.00 0.00 34.95 33.92 1v5m s ARG 59 CO 0.22 -0.20 0.56 -0.51 -0.81 0.00 0.00 175.30 174.57 1v5m s LEU 60 N 2.50 4.24 -0.02 -0.88 2.01 0.76 -4.00 118.68 123.29 1v5m s LEU 60 Ca -0.06 1.02 0.01 0.00 0.01 0.00 0.00 54.13 55.10 1v5m s LEU 60 Cb -0.10 -3.52 0.02 0.00 0.01 0.00 0.00 46.19 42.59 1v5m s LEU 60 CO -0.18 -0.00 -0.01 -1.61 1.01 0.00 0.00 176.35 175.56 1v5m s GLU 61 N -2.44 0.32 -0.45 1.70 8.01 -1.17 -0.91 118.70 123.77 1v5m s GLU 61 Ca 0.44 -0.00 -0.03 0.00 0.01 0.00 0.00 54.97 55.38 1v5m s GLU 61 Cb -0.13 -0.43 0.12 0.00 -4.31 0.00 0.00 34.13 29.38 1v5m s GLU 61 CO 0.20 -0.06 0.25 -0.06 0.01 0.00 0.00 175.26 175.60 1v5m s PHE 62 N 0.63 3.55 -0.66 1.61 0.40 -1.22 -2.82 117.98 119.47 1v5m s PHE 62 Ca -0.06 -2.42 -0.27 0.00 -0.60 0.00 0.00 56.93 53.58 1v5m s PHE 62 Cb -0.09 -3.25 0.02 0.00 0.51 0.00 0.00 43.02 40.20 1v5m s PHE 62 CO -0.01 -0.96 1.43 -0.06 0.70 0.00 0.00 175.22 176.32 1v5m s PHE 63 N 0.98 2.17 -0.28 0.36 0.08 -0.73 -1.15 117.98 119.41 1v5m s PHE 63 Ca 0.09 0.28 0.03 0.00 0.12 0.00 0.00 56.93 57.45 1v5m s PHE 63 Cb -0.23 -4.45 0.07 0.00 -0.57 0.00 0.00 43.02 37.85 1v5m s PHE 63 CO -0.04 -2.08 -0.04 0.08 -0.10 0.00 0.00 175.22 173.05 1v5m s VAL 64 N 6.47 1.99 1.02 -0.44 1.01 -1.26 0.57 120.40 129.76 1v5m s VAL 64 Ca 0.47 -1.75 -0.13 0.00 0.00 0.00 0.00 61.98 60.57 1v5m s VAL 64 Cb -0.10 -2.26 0.20 0.00 0.00 0.00 0.00 36.38 34.22 1v5m s VAL 64 CO 0.19 -0.26 1.09 -2.16 0.00 0.00 0.00 175.10 173.97 1v5m s PRO 65 N 1.13 0.22 0.00 2.72 0.04 -1.26 -4.61 135.00 133.24 1v5m s PRO 65 Ca -0.01 0.45 0.08 0.00 0.04 0.00 0.00 61.00 61.56 1v5m s PRO 65 Cb -0.19 -1.72 0.48 0.00 0.04 0.00 0.00 34.50 33.11 1v5m s PRO 65 CO -0.07 -2.86 0.93 -0.35 0.04 0.00 0.00 177.00 174.69 1v5m n PRO 66 N -4.25 0.49 -0.00 0.56 -0.04 0.19 -1.84 135.00 130.11 1v5m n PRO 66 Ca 0.05 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.57 1v5m n PRO 66 Cb 0.58 -1.26 -0.08 0.00 -0.04 0.00 0.00 33.50 32.70 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 -0.76 1.77 -1.63 0.54 5.02 -1.26 -4.77 118.16 117.07 1v5m n LYS 67 Ca 0.06 -0.05 -0.38 0.00 -2.02 0.00 0.00 58.31 55.92 1v5m n LYS 67 Cb 0.03 -1.15 0.05 0.00 -0.02 0.00 0.00 35.03 33.94 1v5m n LYS 67 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1v5m n ALA 68 N -1.60 0.29 0.05 7.82 0.00 -0.77 -4.90 120.51 121.41 1v5m n ALA 68 Ca -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 1v5m n ALA 68 Cb 0.24 -2.13 0.21 0.00 0.00 0.00 0.00 19.45 17.76 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 0.49 0.38 -3.85 0.00 0.02 -1.95 -3.44 113.55 105.19 1v5m h SER 69 Ca -0.49 -0.14 -0.55 0.00 -0.84 0.00 0.00 61.79 59.77 1v5m h SER 69 Cb 1.36 -0.10 -0.20 0.00 0.14 0.00 0.00 62.40 63.60 1v5m h SER 69 CO 0.51 0.70 -0.81 0.00 -1.14 0.00 0.00 176.83 176.09 1v5m s ARG 70 N -4.32 1.22 0.35 3.45 3.03 -1.26 -5.13 118.95 116.28 1v5m s ARG 70 Ca -0.06 -1.29 -0.28 0.00 2.03 0.00 0.00 55.73 56.13 1v5m s ARG 70 Cb 0.13 -1.40 -0.09 0.00 -1.03 0.00 0.00 34.95 32.56 1v5m s ARG 70 CO 0.78 0.31 1.21 -1.25 -1.13 0.00 0.00 175.30 175.22 1v5m s PRO 71 N -2.34 4.31 -0.11 3.89 0.04 -1.26 -4.64 135.00 134.88 1v5m s PRO 71 Ca 0.11 1.99 -0.18 0.00 0.04 0.00 0.00 61.00 62.96 1v5m s PRO 71 Cb -0.08 -2.95 -0.27 0.00 0.04 0.00 0.00 34.50 31.24 1v5m s PRO 71 CO 0.06 -0.15 0.58 -0.22 0.04 0.00 0.00 177.00 177.30 1v5m h LYS 72 N 3.21 0.20 -2.27 4.56 3.64 -1.39 -3.40 116.57 121.11 1v5m h LYS 72 Ca -0.48 -0.34 -0.61 0.00 -1.27 0.00 0.00 60.65 57.94 1v5m h LYS 72 Cb 1.23 0.13 -0.41 0.00 -0.41 0.00 0.00 32.23 32.77 1v5m h LYS 72 CO 0.65 1.16 -0.48 0.28 -2.27 0.00 0.00 179.45 178.79 1v5m n VAL 73 N -4.07 3.10 -2.38 2.00 0.31 -1.08 -5.01 118.33 111.19 1v5m n VAL 73 Ca -0.23 -5.50 -0.43 0.00 -0.01 0.00 0.00 64.34 58.17 1v5m n VAL 73 Cb 0.83 -1.67 -0.02 0.00 -0.91 0.00 0.00 33.84 32.06 1v5m n VAL 73 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1v5m s SER 74 N -2.96 6.57 -0.06 4.52 0.15 -1.26 -3.39 113.70 117.27 1v5m s SER 74 Ca 0.45 1.15 0.05 0.00 0.70 0.00 0.00 55.95 58.31 1v5m s SER 74 Cb 0.22 -2.54 -0.01 0.00 -1.71 0.00 0.00 66.02 61.99 1v5m s SER 74 CO -0.09 -1.18 -0.23 -0.63 1.20 0.00 0.00 173.24 172.32 1v5m s ILE 75 N 4.69 1.91 0.56 6.45 1.01 -0.08 -4.98 121.20 130.76 1v5m s ILE 75 Ca 0.59 -0.98 -0.19 0.00 0.00 0.00 0.00 60.65 60.07 1v5m s ILE 75 Cb -0.17 -1.63 -0.05 0.00 0.01 0.00 0.00 42.46 40.63 1v5m s ILE 75 CO 0.26 0.53 1.13 -2.16 0.00 0.00 0.00 174.94 174.70 1v5m s PRO 76 N -0.06 3.27 0.26 2.79 0.04 -1.26 -0.17 135.00 139.88 1v5m s PRO 76 Ca -0.05 1.58 0.01 0.00 0.04 0.00 0.00 61.00 62.58 1v5m s PRO 76 Cb -0.14 -2.00 0.36 0.00 0.04 0.00 0.00 34.50 32.76 1v5m s PRO 76 CO 0.04 -0.91 1.70 1.25 0.04 0.00 0.00 177.00 179.12 1v5m h LEU 77 N 1.03 0.55 -1.54 -3.56 7.12 -1.77 -2.74 115.31 114.40 1v5m h LEU 77 Ca -0.50 -0.19 -0.03 0.00 0.13 0.00 0.00 57.88 57.30 1v5m h LEU 77 Cb 1.26 -0.15 -0.01 0.00 -0.53 0.00 0.00 40.66 41.23 1v5m h LEU 77 CO 0.56 0.79 -0.00 -1.28 -0.13 0.00 0.00 178.44 178.38 1v5m h SER 78 N 0.49 0.26 -0.72 1.25 0.87 -1.93 -2.50 113.55 111.26 1v5m h SER 78 Ca 0.07 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.60 1v5m h SER 78 Cb 0.68 -0.07 -0.04 0.00 -0.44 0.00 0.00 62.40 62.54 1v5m h SER 78 CO 0.05 0.32 0.46 0.00 -0.53 0.00 0.00 176.83 177.12 1v5m h ALA 79 N 1.72 0.92 -2.42 6.23 0.00 -1.87 -3.42 119.26 120.42 1v5m h ALA 79 Ca 0.07 -0.07 -0.54 0.00 0.00 0.00 0.00 54.91 54.36 1v5m h ALA 79 Cb 0.20 -0.29 0.04 0.00 0.00 0.00 0.00 17.79 17.74 1v5m h ALA 79 CO 0.00 0.36 1.08 -0.89 0.00 0.00 0.00 179.25 179.80 1v5m n ILE 80 N -4.55 0.35 -0.02 0.00 2.08 -0.94 -0.36 119.36 115.91 1v5m n ILE 80 Ca 0.06 -0.06 -0.03 0.00 0.56 0.00 0.00 62.75 63.29 1v5m n ILE 80 Cb 0.04 -2.03 -0.03 0.00 -0.75 0.00 0.00 39.64 36.87 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 4.61 0.28 -3.75 1.39 -5.35 -1.01 -4.90 119.36 110.64 1v5m n ILE 81 Ca 0.18 -0.14 -0.15 0.00 -0.27 0.00 0.00 62.75 62.37 1v5m n ILE 81 Cb 0.35 -0.80 -0.15 0.00 -1.74 0.00 0.00 39.64 37.30 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 -2.10 0.02 -0.22 6.28 2.12 -1.20 -5.07 118.70 118.53 1v5m s GLU 82 Ca -0.04 0.31 0.01 0.00 0.36 0.00 0.00 54.97 55.61 1v5m s GLU 82 Cb 0.01 -0.24 0.05 0.00 0.26 0.00 0.00 34.13 34.22 1v5m s GLU 82 CO 0.14 -0.19 -0.08 0.54 -0.54 0.00 0.00 175.26 175.14 1v5m s VAL 83 N 1.27 1.65 0.49 3.70 0.11 -1.26 -1.43 120.40 124.93 1v5m s VAL 83 Ca -0.07 -1.19 -0.02 0.00 -2.93 0.00 0.00 61.98 57.76 1v5m s VAL 83 Cb -0.12 -1.83 -0.00 0.00 -1.53 0.00 0.00 36.38 32.90 1v5m s VAL 83 CO -0.04 0.01 0.75 -0.13 -3.33 0.00 0.00 175.10 172.35 1v5m s ARG 84 N 1.36 3.07 0.00 1.54 0.52 -1.00 -4.87 118.95 119.56 1v5m s ARG 84 Ca -0.05 -0.29 0.00 0.00 -0.52 0.00 0.00 55.73 54.88 1v5m s ARG 84 Cb -0.18 -2.46 0.00 0.00 0.52 0.00 0.00 34.95 32.83 1v5m s ARG 84 CO -0.07 -0.38 0.78 0.25 0.02 0.00 0.00 175.30 175.90 1v5m n THR 85 N -2.24 0.60 -3.61 0.02 -2.24 -1.26 -0.03 114.28 105.52 1v5m n THR 85 Ca 0.02 -0.63 -0.25 0.00 -2.27 0.00 0.00 64.05 60.93 1v5m n THR 85 Cb 0.57 0.73 -0.17 0.00 -2.10 0.00 0.00 70.33 69.37 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 -0.60 -0.11 0.09 4.28 -4.23 -1.26 -4.63 115.64 109.17 1v5m s THR 86 Ca 0.00 -0.10 0.00 0.00 -1.18 0.00 0.00 61.69 60.41 1v5m s THR 86 Cb 0.00 -0.54 -0.04 0.00 1.34 0.00 0.00 72.50 73.26 1v5m s THR 86 CO 0.00 -0.23 0.24 -0.04 -0.54 0.00 0.00 174.62 174.05 1v5m s MET 87 N 2.16 3.45 0.22 3.99 1.00 -1.26 -4.99 119.30 123.87 1v5m s MET 87 Ca 0.03 -0.45 0.22 0.00 0.00 0.00 0.00 55.69 55.49 1v5m s MET 87 Cb -0.16 -3.01 0.92 0.00 0.00 0.00 0.00 34.83 32.59 1v5m s MET 87 CO -0.09 0.58 1.67 -0.35 0.00 0.00 0.00 175.02 176.83 1v5m n PRO 88 N 0.08 0.16 -0.96 2.03 -0.04 -1.26 -4.83 135.00 130.18 1v5m n PRO 88 Ca -0.05 0.40 -0.37 0.00 -0.04 0.00 0.00 63.50 63.44 1v5m n PRO 88 Cb 0.52 -1.81 0.05 0.00 -0.04 0.00 0.00 33.50 32.22 1v5m n PRO 88 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1v5m n LEU 89 N -2.12 -3.93 0.00 1.53 -0.00 -1.26 -4.71 117.00 106.51 1v5m n LEU 89 Ca 0.02 0.08 0.01 0.00 -0.00 0.00 0.00 56.01 56.11 1v5m n LEU 89 Cb 0.22 -0.68 0.04 0.00 -0.00 0.00 0.00 43.42 43.00 1v5m n LEU 89 CO 0.19 -3.94 0.35 -0.62 -0.00 0.00 0.00 177.39 173.36 1v5m n GLU 90 N 1.88 0.65 -0.59 1.96 1.02 -1.26 -4.91 120.64 119.39 1v5m n GLU 90 Ca -0.01 0.00 -0.21 0.00 -0.02 0.00 0.00 57.16 56.91 1v5m n GLU 90 Cb 0.66 -1.03 -0.02 0.00 -0.02 0.00 0.00 31.44 31.03 1v5m n GLU 90 CO 0.00 0.00 0.00 -0.12 1.18 0.00 0.00 177.13 178.19 1v5m n MET 91 N -0.53 0.00 0.00 3.49 1.56 -1.26 -4.67 117.12 115.71 1v5m n MET 91 Ca 0.01 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.44 1v5m n MET 91 Cb 0.00 -0.50 0.02 0.00 2.15 0.00 0.00 33.22 34.90 1v5m n MET 91 CO 0.00 0.00 0.00 -0.35 -0.73 0.00 0.00 175.97 174.89 1v5m n PRO 92 N 0.50 0.49 -2.15 2.12 -0.04 -1.26 -4.79 135.00 129.87 1v5m n PRO 92 Ca 0.08 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.50 1v5m n PRO 92 Cb 0.07 -1.02 0.02 0.00 -0.04 0.00 0.00 33.50 32.53 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 -0.52 -1.11 -0.04 0.54 2.13 -1.26 -5.00 120.64 115.37 1v5m n GLU 93 Ca 0.01 0.21 -0.19 0.00 0.66 0.00 0.00 57.16 57.84 1v5m n GLU 93 Cb 0.00 -2.97 -0.13 0.00 0.27 0.00 0.00 31.44 28.61 1v5m n GLU 93 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1v5m n LYS 94 N -1.86 0.72 -2.37 5.31 4.76 -1.26 -5.03 118.16 118.44 1v5m n LYS 94 Ca -0.05 0.22 -0.04 0.00 -2.87 0.00 0.00 58.31 55.57 1v5m n LYS 94 Cb 0.54 -1.65 0.02 0.00 -1.84 0.00 0.00 35.03 32.10 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 -3.38 -2.04 -1.08 4.39 8.00 -1.26 -4.55 116.55 116.63 1v5m n ASP 95 Ca -0.36 -0.16 0.04 0.00 0.71 0.00 0.00 54.79 55.02 1v5m n ASP 95 Cb 1.03 -1.72 0.06 0.00 -0.02 0.00 0.00 41.12 40.48 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 -1.57 1.06 -4.38 -2.24 2.04 -1.26 -3.90 115.26 105.02 1v5m n ASN 96 Ca -0.07 -2.45 -0.19 0.00 -0.44 0.00 0.00 54.58 51.43 1v5m n ASN 96 Cb 0.54 -0.34 -0.10 0.00 -2.53 0.00 0.00 39.78 37.35 1v5m n ASN 96 CO 0.00 0.00 0.00 0.42 -0.44 0.00 0.00 177.26 177.24 1v5m s THR 97 N -0.82 0.98 -0.28 5.53 -4.23 -1.26 -0.13 115.64 115.44 1v5m s THR 97 Ca 0.29 -2.01 -0.21 0.00 -1.18 0.00 0.00 61.69 58.58 1v5m s THR 97 Cb 0.32 -2.60 0.09 0.00 1.34 0.00 0.00 72.50 71.64 1v5m s THR 97 CO -0.11 -0.11 0.76 0.72 -0.54 0.00 0.00 174.62 175.34 1v5m s PHE 98 N -3.45 -0.85 0.30 3.99 -0.12 -1.02 -4.53 117.98 112.29 1v5m s PHE 98 Ca 0.34 1.87 -0.09 0.00 -0.05 0.00 0.00 56.93 59.00 1v5m s PHE 98 Cb 0.07 0.43 -0.07 0.00 -0.63 0.00 0.00 43.02 42.83 1v5m s PHE 98 CO 0.13 -0.42 0.63 0.08 -0.05 0.00 0.00 175.22 175.59 1v5m s VAL 99 N 0.94 4.89 -0.37 -2.49 1.01 0.95 -2.38 120.40 122.96 1v5m s VAL 99 Ca -0.04 0.46 0.01 0.00 0.00 0.00 0.00 61.98 62.41 1v5m s VAL 99 Cb -0.05 -3.67 0.11 0.00 0.00 0.00 0.00 36.38 32.77 1v5m s VAL 99 CO -0.09 -0.25 0.13 -0.76 0.00 0.00 0.00 175.10 174.13 1v5m s LEU 100 N -3.26 3.10 -0.63 3.92 1.43 -1.12 -2.38 118.68 119.74 1v5m s LEU 100 Ca 0.48 -2.12 -0.22 0.00 -1.03 0.00 0.00 54.13 51.25 1v5m s LEU 100 Cb -0.11 -1.14 0.08 0.00 0.03 0.00 0.00 46.19 45.05 1v5m s LEU 100 CO 0.25 -0.36 0.88 -0.75 0.23 0.00 0.00 176.35 176.61 1v5m s LYS 101 N 0.98 3.10 0.66 1.70 2.20 -0.52 -2.31 119.74 125.55 1v5m s LYS 101 Ca 0.13 -0.95 -0.11 0.00 -0.36 0.00 0.00 55.97 54.67 1v5m s LYS 101 Cb -0.20 -4.23 -0.02 0.00 -1.51 0.00 0.00 37.83 31.87 1v5m s LYS 101 CO -0.13 -1.72 1.05 0.14 -0.36 0.00 0.00 175.35 174.33 1v5m s VAL 102 N 3.65 4.29 0.31 4.02 -7.23 -0.89 -2.39 120.40 122.16 1v5m s VAL 102 Ca 0.19 0.77 0.08 0.00 -1.81 0.00 0.00 61.98 61.21 1v5m s VAL 102 Cb -0.19 -3.58 0.30 0.00 0.56 0.00 0.00 36.38 33.47 1v5m s VAL 102 CO 0.09 -0.94 1.72 1.05 -0.31 0.00 0.00 175.10 176.71 1v5m h GLU 103 N -0.45 0.50 -0.07 4.82 -0.00 -1.04 0.73 114.58 119.06 1v5m h GLU 103 Ca -0.44 -0.03 0.02 0.00 -0.00 0.00 0.00 59.36 58.91 1v5m h GLU 103 Cb 1.20 -0.11 -0.00 0.00 -0.00 0.00 0.00 28.75 29.84 1v5m h GLU 103 CO 0.59 0.33 0.06 -0.97 -0.00 0.00 0.00 179.01 179.02 1v5m h ASN 104 N 0.51 0.00 0.00 3.06 -1.24 -1.92 -3.46 115.58 112.54 1v5m h ASN 104 Ca 0.62 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.63 1v5m h ASN 104 Cb 1.18 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.23 1v5m h ASN 104 CO -0.50 0.00 0.00 0.61 -1.29 0.00 0.00 177.43 176.25 1v5m n GLY 105 N -1.47 0.57 2.91 1.57 0.00 0.25 -5.12 105.19 103.90 1v5m n GLY 105 Ca -0.01 -0.08 -0.25 0.00 0.00 0.00 0.00 46.02 45.68 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 -1.00 1.15 -0.14 4.61 0.00 -1.24 -4.91 121.76 120.23 1v5m s ALA 106 Ca 0.00 -0.40 -0.15 0.00 0.00 0.00 0.00 51.96 51.41 1v5m s ALA 106 Cb 0.00 -0.76 -0.05 0.00 0.00 0.00 0.00 23.12 22.32 1v5m s ALA 106 CO 0.00 -0.26 0.34 -1.21 0.00 0.00 0.00 175.76 174.63 1v5m s GLU 107 N 1.43 4.25 -0.36 0.00 2.02 -1.24 -2.09 118.70 122.70 1v5m s GLU 107 Ca -0.01 0.20 0.04 0.00 0.02 0.00 0.00 54.97 55.21 1v5m s GLU 107 Cb -0.13 -3.41 0.10 0.00 0.10 0.00 0.00 34.13 30.79 1v5m s GLU 107 CO -0.04 0.25 0.08 0.71 0.02 0.00 0.00 175.26 176.27 1v5m s TYR 108 N 0.41 3.70 -0.30 1.61 1.51 -0.98 -2.82 117.35 120.48 1v5m s TYR 108 Ca 0.19 -3.01 -0.29 0.00 -1.01 0.00 0.00 57.07 52.95 1v5m s TYR 108 Cb -0.14 -2.93 0.01 0.00 -0.11 0.00 0.00 41.96 38.79 1v5m s TYR 108 CO 0.06 -0.93 1.22 0.42 -1.11 0.00 0.00 175.55 175.21 1v5m s ILE 109 N 0.77 4.28 -0.06 2.71 1.01 0.54 -2.78 121.20 127.68 1v5m s ILE 109 Ca 0.12 1.46 0.02 0.00 0.00 0.00 0.00 60.65 62.25 1v5m s ILE 109 Cb -0.20 -4.24 -0.03 0.00 0.01 0.00 0.00 42.46 38.00 1v5m s ILE 109 CO -0.07 -0.45 -0.09 -0.76 0.00 0.00 0.00 174.94 173.56 1v5m s LEU 110 N 4.05 3.02 -0.30 2.97 1.02 -1.00 -0.96 118.68 127.48 1v5m s LEU 110 Ca 0.52 -0.09 -0.05 0.00 0.02 0.00 0.00 54.13 54.54 1v5m s LEU 110 Cb -0.15 -1.65 0.03 0.00 0.02 0.00 0.00 46.19 44.44 1v5m s LEU 110 CO 0.20 0.35 0.04 -0.70 0.02 0.00 0.00 176.35 176.26 1v5m s GLU 111 N -0.81 2.78 0.75 1.70 2.12 -0.68 -2.44 118.70 122.11 1v5m s GLU 111 Ca 0.12 -1.05 -0.07 0.00 0.36 0.00 0.00 54.97 54.33 1v5m s GLU 111 Cb -0.11 -3.28 0.09 0.00 0.26 0.00 0.00 34.13 31.09 1v5m s GLU 111 CO 0.01 -0.53 1.06 0.95 -0.54 0.00 0.00 175.26 176.21 1v5m s THR 112 N 1.39 2.21 0.10 -1.70 -4.23 0.82 -3.74 115.64 110.49 1v5m s THR 112 Ca -0.01 -0.28 -0.31 0.00 -1.18 0.00 0.00 61.69 59.92 1v5m s THR 112 Cb -0.18 -2.94 -0.11 0.00 1.34 0.00 0.00 72.50 70.61 1v5m s THR 112 CO 0.00 0.00 1.60 0.40 -0.54 0.00 0.00 174.62 176.09 1v5m h ILE 113 N -0.75 0.22 -4.08 2.99 2.04 -1.92 -3.46 117.51 112.55 1v5m h ILE 113 Ca -0.43 0.00 -0.14 0.00 1.00 0.00 0.00 64.86 65.28 1v5m h ILE 113 Cb 1.30 0.22 -0.12 0.00 -0.74 0.00 0.00 36.82 37.48 1v5m h ILE 113 CO 0.54 0.00 -0.34 -0.62 0.00 0.00 0.00 178.15 177.73 1v5m s ASP 114 N -4.65 0.05 0.63 1.72 2.15 -1.26 -5.01 116.67 110.29 1v5m s ASP 114 Ca -0.17 -1.15 0.28 0.00 0.43 0.00 0.00 52.55 51.94 1v5m s ASP 114 Cb 0.07 0.50 1.47 0.00 -0.30 0.00 0.00 42.92 44.66 1v5m s ASP 114 CO 0.63 -1.01 1.86 0.77 -0.17 0.00 0.00 175.17 177.25 1v5m h SER 115 N 2.41 0.00 0.09 -0.34 4.64 -1.80 -0.53 113.55 118.01 1v5m h SER 115 Ca -0.30 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.01 1v5m h SER 115 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1v5m h SER 115 CO 0.43 0.00 -0.04 -0.07 -0.87 0.00 0.00 176.83 176.28 1v5m h LEU 116 N 0.00 -0.10 -1.56 5.97 4.07 -1.95 -3.00 115.31 118.75 1v5m h LEU 116 Ca 0.11 -0.48 -0.02 0.00 0.08 0.00 0.00 57.88 57.56 1v5m h LEU 116 Cb 1.00 0.03 -0.01 0.00 1.08 0.00 0.00 40.66 42.75 1v5m h LEU 116 CO -0.00 0.49 0.07 1.56 -1.08 0.00 0.00 178.44 179.48 1v5m h GLN 117 N -0.74 0.36 0.45 1.13 1.08 -1.52 -2.85 115.11 113.02 1v5m h GLN 117 Ca -0.01 -0.05 -0.02 0.00 -1.45 0.00 0.00 58.65 57.12 1v5m h GLN 117 Cb 0.57 -0.07 0.00 0.00 -0.05 0.00 0.00 27.48 27.94 1v5m h GLN 117 CO 0.02 0.33 -0.22 -0.22 -0.95 0.00 0.00 178.83 177.79 1v5m h LYS 118 N 0.36 -0.59 -0.95 1.46 3.64 -1.38 -2.12 116.57 116.99 1v5m h LYS 118 Ca 0.09 0.04 0.27 0.00 -1.27 0.00 0.00 60.65 59.78 1v5m h LYS 118 Cb 0.13 0.13 -0.14 0.00 -0.41 0.00 0.00 32.23 31.94 1v5m h LYS 118 CO -0.01 -0.40 0.45 1.12 -2.27 0.00 0.00 179.45 178.35 1v5m h HIS 119 N -0.62 0.73 0.05 1.91 2.07 -1.48 0.52 115.15 118.33 1v5m h HIS 119 Ca -0.06 0.04 0.02 0.00 -2.85 0.00 0.00 60.37 57.52 1v5m h HIS 119 Cb 0.47 -0.17 -0.03 0.00 2.57 0.00 0.00 27.41 30.26 1v5m h HIS 119 CO 0.11 -0.13 -0.18 0.77 -3.07 0.00 0.00 177.93 175.43 1v5m h SER 120 N 0.34 -0.51 0.65 3.10 0.02 -1.33 -2.36 113.55 113.47 1v5m h SER 120 Ca 0.64 0.07 -0.03 0.00 -0.84 0.00 0.00 61.79 61.63 1v5m h SER 120 Cb 1.35 0.20 0.00 0.00 0.14 0.00 0.00 62.40 64.09 1v5m h SER 120 CO -0.59 -0.25 -0.35 -0.50 -1.14 0.00 0.00 176.83 174.00 1v5m h TRP 121 N -0.32 -0.93 -1.02 3.45 4.06 -0.24 -2.41 115.95 118.54 1v5m h TRP 121 Ca 0.04 -0.02 0.39 0.00 2.06 0.00 0.00 58.89 61.37 1v5m h TRP 121 Cb 0.36 0.32 -0.15 0.00 -1.00 0.00 0.00 29.16 28.70 1v5m h TRP 121 CO -0.20 -0.55 0.60 0.28 -3.56 0.00 0.00 178.44 175.00 1v5m n VAL 122 N -4.63 -0.32 -0.12 1.49 0.31 -0.62 0.22 118.33 114.66 1v5m n VAL 122 Ca -0.11 1.73 -0.12 0.00 -0.01 0.00 0.00 64.34 65.82 1v5m n VAL 122 Cb 0.38 -2.81 -0.03 0.00 -0.91 0.00 0.00 33.84 30.47 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 1.64 0.53 -0.84 3.52 0.00 -1.05 0.19 119.26 123.25 1v5m h ALA 123 Ca 0.76 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 55.28 1v5m h ALA 123 Cb 2.20 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 19.82 1v5m h ALA 123 CO -0.58 0.53 0.54 -0.44 0.00 0.00 0.00 179.25 179.30 1v5m h ASP 124 N 0.62 0.98 0.00 0.00 3.32 0.32 0.46 116.42 122.12 1v5m h ASP 124 Ca 0.07 -0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 1v5m h ASP 124 Cb 0.83 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 40.13 1v5m h ASP 124 CO 0.07 0.72 -0.05 0.40 -1.72 0.00 0.00 179.24 178.66 1v5m h ILE 125 N 1.15 1.18 -0.79 0.35 5.03 -1.24 -3.21 117.51 119.98 1v5m h ILE 125 Ca 0.31 -1.90 0.05 0.00 -0.12 0.00 0.00 64.86 63.19 1v5m h ILE 125 Cb -0.11 2.25 -0.05 0.00 -3.03 0.00 0.00 36.82 35.89 1v5m h ILE 125 CO -0.06 0.40 0.52 1.56 -0.68 0.00 0.00 178.15 179.89 1v5m h GLN 126 N -1.00 0.90 0.00 2.37 1.08 -0.59 0.29 115.11 118.15 1v5m h GLN 126 Ca -0.01 -0.05 -0.03 0.00 -1.45 0.00 0.00 58.65 57.11 1v5m h GLN 126 Cb 0.69 -0.20 -0.00 0.00 -0.05 0.00 0.00 27.48 27.91 1v5m h GLN 126 CO -0.01 0.59 -0.12 0.78 -0.95 0.00 0.00 178.83 179.13 1v5m h GLY 127 N 0.92 0.00 0.00 3.46 0.00 -0.20 -3.19 103.07 104.07 1v5m h GLY 127 Ca 0.33 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.58 1v5m h GLY 127 CO -0.10 0.00 -1.01 0.00 0.00 0.00 0.00 176.54 175.43 1v5m n VAL 129 N -4.50 -0.11 -3.64 0.00 3.14 0.86 -4.29 118.33 109.79 1v5m n VAL 129 Ca -0.18 1.26 -0.02 0.00 -2.96 0.00 0.00 64.34 62.44 1v5m n VAL 129 Cb 0.48 -2.08 -0.07 0.00 -1.06 0.00 0.00 33.84 31.12 1v5m n VAL 129 CO 0.00 0.00 0.00 -1.81 -6.46 0.00 0.00 176.83 168.56 1v5m s ASP 130 N -4.17 -0.40 -0.57 6.55 1.01 -1.20 -4.96 116.67 112.93 1v5m s ASP 130 Ca -0.05 0.66 -0.15 0.00 0.71 0.00 0.00 52.55 53.72 1v5m s ASP 130 Cb 0.22 1.08 -0.14 0.00 1.01 0.00 0.00 42.92 45.09 1v5m s ASP 130 CO 0.64 -0.11 1.48 -0.24 0.21 0.00 0.00 175.17 177.16 1v5m n SER 131 N 3.32 -0.04 -4.50 0.27 2.88 -1.26 -4.53 113.62 109.76 1v5m n SER 131 Ca -0.17 0.02 -0.26 0.00 -1.33 0.00 0.00 58.87 57.13 1v5m n SER 131 Cb 0.57 -0.48 -0.10 0.00 -0.75 0.00 0.00 64.21 63.45 1v5m n SER 131 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1v5m s GLY 132 N 4.13 2.45 -1.01 0.46 0.00 -1.25 -5.06 107.32 107.04 1v5m s GLY 132 Ca 0.77 -1.73 -0.24 0.00 0.00 0.00 0.00 44.72 43.53 1v5m s GLY 132 CO 0.29 -1.97 1.94 2.56 0.00 0.00 0.00 173.10 175.92 1v5m s PRO 133 N -3.81 2.53 -0.30 2.90 0.04 -1.26 -4.78 135.00 130.32 1v5m s PRO 133 Ca 0.29 -0.63 -0.15 0.00 0.04 0.00 0.00 61.00 60.55 1v5m s PRO 133 Cb 0.07 -5.13 0.18 0.00 0.04 0.00 0.00 34.50 29.65 1v5m s PRO 133 CO 0.14 -3.62 1.09 0.45 0.04 0.00 0.00 177.00 175.10 1v5m s SER 134 N 7.44 -0.38 0.05 6.66 0.15 -1.26 -4.97 113.70 121.39 1v5m s SER 134 Ca 0.69 0.29 -0.09 0.00 0.70 0.00 0.00 55.95 57.55 1v5m s SER 134 Cb -0.04 1.34 -0.00 0.00 -1.71 0.00 0.00 66.02 65.61 1v5m s SER 134 CO 0.05 -0.07 0.17 -0.55 1.20 0.00 0.00 173.24 174.04 1v5m s SER 135 N 2.81 0.08 0.00 5.45 0.15 -1.26 -4.92 113.70 116.01 1v5m s SER 135 Ca -0.02 -0.45 0.27 0.00 0.70 0.00 0.00 55.95 56.44 1v5m s SER 135 Cb -0.09 0.29 0.82 0.00 -1.71 0.00 0.00 66.02 65.33 1v5m s SER 135 CO -0.12 -0.58 1.61 0.61 1.20 0.00 0.00 173.24 175.97