#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 -0.18 -0.24 1.61 0.01 -1.26 -5.08 113.70 108.56 1v5m s SER 2 Ca 0.00 -0.74 -0.13 0.00 1.31 0.00 0.00 55.95 56.39 1v5m s SER 2 Cb 0.00 0.72 -0.17 0.00 0.21 0.00 0.00 66.02 66.78 1v5m s SER 2 CO 0.00 -1.35 -0.08 -1.20 0.41 0.00 0.00 173.24 171.02 1v5m n SER 3 N -0.57 1.95 0.00 2.44 7.64 -1.26 -5.12 113.62 118.70 1v5m n SER 3 Ca -0.04 0.27 0.00 0.00 1.01 0.00 0.00 58.87 60.11 1v5m n SER 3 Cb 0.60 -0.81 0.00 0.00 -1.01 0.00 0.00 64.21 62.99 1v5m n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1v5m n GLY 4 N 1.55 1.07 3.16 0.23 0.00 -1.26 -5.09 105.19 104.85 1v5m n GLY 4 Ca -0.44 -2.07 -0.08 0.00 0.00 0.00 0.00 46.02 43.43 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 0.00 0.29 0.20 1.61 0.15 -1.26 -5.18 113.70 109.52 1v5m s SER 5 Ca 0.00 -0.86 0.09 0.00 0.70 0.00 0.00 55.95 55.88 1v5m s SER 5 Cb 0.00 0.28 -0.05 0.00 -1.71 0.00 0.00 66.02 64.55 1v5m s SER 5 CO 0.00 -0.68 -0.18 -0.55 1.20 0.00 0.00 173.24 173.02 1v5m s SER 6 N -2.91 2.96 -0.28 5.45 0.15 -1.26 -5.15 113.70 112.66 1v5m s SER 6 Ca 0.08 -0.94 -0.22 0.00 0.70 0.00 0.00 55.95 55.58 1v5m s SER 6 Cb 0.06 -0.20 0.11 0.00 -1.71 0.00 0.00 66.02 64.29 1v5m s SER 6 CO -0.09 -0.03 0.90 -0.83 1.20 0.00 0.00 173.24 174.40 1v5m s GLY 7 N -3.01 -0.27 -1.13 9.45 0.00 -1.26 -5.09 107.32 106.00 1v5m s GLY 7 Ca 0.21 2.61 -0.19 0.00 0.00 0.00 0.00 44.72 47.35 1v5m s GLY 7 CO 0.09 2.07 1.48 0.54 0.00 0.00 0.00 173.10 177.28 1v5m s ASN 8 N 0.71 6.74 -0.33 1.64 2.20 -1.26 -4.94 114.94 119.71 1v5m s ASN 8 Ca -0.02 -2.18 -0.00 0.00 -0.94 0.00 0.00 52.86 49.72 1v5m s ASN 8 Cb -0.05 -2.51 0.07 0.00 -2.00 0.00 0.00 41.25 36.77 1v5m s ASN 8 CO -0.09 -1.17 0.04 -0.76 -2.94 0.00 0.00 177.10 172.18 1v5m s LEU 9 N 3.68 4.33 -0.01 3.54 2.01 -1.26 -5.08 118.68 125.88 1v5m s LEU 9 Ca 0.46 -1.63 0.02 0.00 0.01 0.00 0.00 54.13 52.98 1v5m s LEU 9 Cb -0.00 -1.71 -0.00 0.00 0.01 0.00 0.00 46.19 44.49 1v5m s LEU 9 CO -0.02 -0.34 -0.05 0.00 1.01 0.00 0.00 176.35 176.95 1v5m s ALA 10 N 1.14 0.46 -0.22 4.21 0.00 -1.26 -5.14 121.76 120.96 1v5m s ALA 10 Ca 0.00 -0.20 -0.08 0.00 0.00 0.00 0.00 51.96 51.68 1v5m s ALA 10 Cb -0.20 -0.14 0.09 0.00 0.00 0.00 0.00 23.12 22.87 1v5m s ALA 10 CO -0.04 0.10 0.47 0.00 0.00 0.00 0.00 175.76 176.29 1v5m s ALA 11 N -0.01 -1.33 -0.21 0.00 0.00 -1.26 -5.14 121.76 113.81 1v5m s ALA 11 Ca 0.01 1.69 -0.15 0.00 0.00 0.00 0.00 51.96 53.51 1v5m s ALA 11 Cb -0.03 -1.37 -0.04 0.00 0.00 0.00 0.00 23.12 21.67 1v5m s ALA 11 CO -0.00 -0.73 0.35 0.15 0.00 0.00 0.00 175.76 175.53 1v5m s LYS 12 N 2.51 4.16 -0.01 0.00 3.01 -1.26 -5.07 119.74 123.08 1v5m s LYS 12 Ca -0.04 0.12 0.00 0.00 -1.01 0.00 0.00 55.97 55.05 1v5m s LYS 12 Cb -0.11 -3.53 0.01 0.00 -1.01 0.00 0.00 37.83 33.18 1v5m s LYS 12 CO -0.14 -0.01 -0.01 0.54 0.51 0.00 0.00 175.35 176.24 1v5m s VAL 13 N 1.24 0.13 -0.19 3.17 0.11 -1.26 -5.13 120.40 118.47 1v5m s VAL 13 Ca 0.17 -0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.22 1v5m s VAL 13 Cb -0.14 -0.17 0.04 0.00 -1.53 0.00 0.00 36.38 34.58 1v5m s VAL 13 CO 0.07 0.08 -0.07 -0.70 -3.33 0.00 0.00 175.10 171.14 1v5m s GLU 14 N 0.38 1.72 0.38 1.54 2.12 -1.26 -5.12 118.70 118.46 1v5m s GLU 14 Ca -0.03 -0.71 0.05 0.00 0.36 0.00 0.00 54.97 54.64 1v5m s GLU 14 Cb -0.06 -2.25 -0.02 0.00 0.26 0.00 0.00 34.13 32.05 1v5m s GLU 14 CO -0.01 -0.45 0.20 -0.48 -0.54 0.00 0.00 175.26 173.98 1v5m s LEU 15 N 1.50 1.88 -0.01 2.70 2.34 -1.26 -5.14 118.68 120.70 1v5m s LEU 15 Ca -0.01 -1.73 -0.23 0.00 0.06 0.00 0.00 54.13 52.22 1v5m s LEU 15 Cb -0.16 0.20 -0.05 0.00 -0.56 0.00 0.00 46.19 45.62 1v5m s LEU 15 CO -0.08 -1.01 0.68 0.54 -1.06 0.00 0.00 176.35 175.42 1v5m s VAL 16 N -3.30 4.89 0.15 1.48 0.11 -1.26 -4.98 120.40 117.50 1v5m s VAL 16 Ca 0.30 1.43 -0.30 0.00 -2.93 0.00 0.00 61.98 60.48 1v5m s VAL 16 Cb 0.02 -4.02 -0.07 0.00 -1.53 0.00 0.00 36.38 30.78 1v5m s VAL 16 CO 0.20 0.35 1.47 0.47 -3.33 0.00 0.00 175.10 174.27 1v5m n ASP 17 N 3.07 -1.01 -4.52 3.54 8.00 -1.26 -4.09 116.55 120.28 1v5m n ASP 17 Ca -0.04 1.70 -0.41 0.00 0.71 0.00 0.00 54.79 56.75 1v5m n ASP 17 Cb 0.51 -0.22 -0.07 0.00 -0.02 0.00 0.00 41.12 41.32 1v5m n ASP 17 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1v5m n ILE 18 N -5.19 0.04 0.13 0.53 5.41 -1.26 -4.39 119.36 114.63 1v5m n ILE 18 Ca 0.02 -0.46 -0.14 0.00 1.00 0.00 0.00 62.75 63.17 1v5m n ILE 18 Cb 0.25 -1.99 -0.08 0.00 -0.71 0.00 0.00 39.64 37.11 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 15.76 -0.26 -2.69 0.38 1.08 -1.53 -3.47 115.11 124.38 1v5m h GLN 19 Ca -0.22 0.02 0.10 0.00 -1.45 0.00 0.00 58.65 57.10 1v5m h GLN 19 Cb 1.29 0.06 -0.08 0.00 -0.05 0.00 0.00 27.48 28.70 1v5m h GLN 19 CO 1.16 -0.14 0.35 1.03 -0.95 0.00 0.00 178.83 180.27 1v5m s ARG 20 N -6.00 1.41 -0.12 1.46 0.52 -1.25 -5.09 118.95 109.88 1v5m s ARG 20 Ca -0.14 -0.73 -0.18 0.00 -0.52 0.00 0.00 55.73 54.15 1v5m s ARG 20 Cb 0.05 0.51 0.04 0.00 0.52 0.00 0.00 34.95 36.08 1v5m s ARG 20 CO 0.64 -0.64 0.47 -2.00 0.02 0.00 0.00 175.30 173.79 1v5m s GLU 21 N -3.59 0.66 0.21 3.54 2.12 -1.26 -2.06 118.70 118.32 1v5m s GLU 21 Ca 0.10 0.41 -0.23 0.00 0.36 0.00 0.00 54.97 55.61 1v5m s GLU 21 Cb -0.03 0.31 0.05 0.00 0.26 0.00 0.00 34.13 34.72 1v5m s GLU 21 CO 0.01 -0.13 0.72 0.20 -0.54 0.00 0.00 175.26 175.52 1v5m s GLY 22 N -0.33 -0.30 -0.41 -1.50 0.00 -0.79 -5.04 107.32 98.95 1v5m s GLY 22 Ca -0.05 0.08 -0.01 0.00 0.00 0.00 0.00 44.72 44.74 1v5m s GLY 22 CO 0.03 0.03 0.19 0.00 0.00 0.00 0.00 173.10 173.34 1v5m s ALA 23 N -3.75 3.14 0.36 3.20 0.00 -1.26 -0.32 121.76 123.13 1v5m s ALA 23 Ca 0.08 -2.62 0.04 0.00 0.00 0.00 0.00 51.96 49.45 1v5m s ALA 23 Cb -0.04 -2.33 -0.05 0.00 0.00 0.00 0.00 23.12 20.71 1v5m s ALA 23 CO -0.01 -1.81 0.08 -0.48 0.00 0.00 0.00 175.76 173.54 1v5m s LEU 24 N 0.95 2.11 0.01 0.00 2.34 -0.85 -4.92 118.68 118.32 1v5m s LEU 24 Ca 0.10 -1.49 -0.13 0.00 0.06 0.00 0.00 54.13 52.67 1v5m s LEU 24 Cb -0.22 -0.30 -0.06 0.00 -0.56 0.00 0.00 46.19 45.06 1v5m s LEU 24 CO -0.05 -0.73 0.39 -0.13 -1.06 0.00 0.00 176.35 174.77 1v5m s ARG 25 N -3.84 3.86 0.18 1.48 0.52 -1.20 -2.18 118.95 117.78 1v5m s ARG 25 Ca 0.31 0.34 0.05 0.00 -0.52 0.00 0.00 55.73 55.91 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 0.67 -0.10 -0.59 0.02 0.00 0.00 175.30 175.45 1v5m s PHE 26 N -1.14 1.47 0.21 -0.53 -0.71 -0.98 -0.75 117.98 115.56 1v5m s PHE 26 Ca 0.25 -0.72 -0.16 0.00 -1.04 0.00 0.00 56.93 55.26 1v5m s PHE 26 Cb -0.16 -0.75 0.02 0.00 -1.21 0.00 0.00 43.02 40.92 1v5m s PHE 26 CO 0.14 0.16 0.52 0.00 -1.34 0.00 0.00 175.22 174.70 1v5m s MET 27 N -3.73 1.45 -0.08 1.99 0.23 -0.29 -2.84 119.30 116.03 1v5m s MET 27 Ca 0.21 -0.98 0.02 0.00 -1.03 0.00 0.00 55.69 53.91 1v5m s MET 27 Cb 0.02 0.51 0.01 0.00 -1.53 0.00 0.00 34.83 33.84 1v5m s MET 27 CO 0.04 -0.62 -0.15 0.08 -2.03 0.00 0.00 175.02 172.35 1v5m s VAL 28 N -3.92 1.38 -0.53 5.16 1.01 -1.26 -1.13 120.40 121.12 1v5m s VAL 28 Ca 0.13 -0.61 -0.27 0.00 0.00 0.00 0.00 61.98 61.24 1v5m s VAL 28 Cb -0.01 -1.25 -0.04 0.00 0.00 0.00 0.00 36.38 35.08 1v5m s VAL 28 CO 0.01 0.41 2.03 0.00 0.00 0.00 0.00 175.10 177.55 1v5m s ALA 29 N 0.73 2.11 0.32 5.51 0.00 -1.14 -4.90 121.76 124.38 1v5m s ALA 29 Ca -0.13 -0.30 -0.07 0.00 0.00 0.00 0.00 51.96 51.46 1v5m s ALA 29 Cb -0.16 -4.28 0.01 0.00 0.00 0.00 0.00 23.12 18.69 1v5m s ALA 29 CO 0.03 -3.88 0.51 0.34 0.00 0.00 0.00 175.76 172.75 1v5m s ASP 30 N 9.08 0.48 0.24 0.00 2.15 -1.26 -4.85 116.67 122.50 1v5m s ASP 30 Ca 0.79 -1.27 -0.11 0.00 0.43 0.00 0.00 52.55 52.38 1v5m s ASP 30 Cb -0.16 0.66 0.34 0.00 -0.30 0.00 0.00 42.92 43.46 1v5m s ASP 30 CO 0.24 -1.29 1.60 0.44 -0.17 0.00 0.00 175.17 176.00 1v5m h ASP 31 N 2.15 -0.70 -3.68 -0.34 5.19 -2.03 -3.43 116.42 113.57 1v5m h ASP 31 Ca -0.28 0.23 -0.12 0.00 -0.62 0.00 0.00 57.03 56.24 1v5m h ASP 31 Cb 1.24 0.48 -0.02 0.00 0.18 0.00 0.00 39.33 41.21 1v5m h ASP 31 CO 0.38 -0.26 -0.14 0.00 -3.12 0.00 0.00 179.24 176.11 1v5m n ALA 32 N -3.27 -0.67 -0.02 3.45 0.00 -1.26 -4.79 120.51 113.95 1v5m n ALA 32 Ca 0.11 0.06 -0.16 0.00 0.00 0.00 0.00 53.44 53.45 1v5m n ALA 32 Cb 0.40 -0.92 -0.12 0.00 0.00 0.00 0.00 19.45 18.82 1v5m n ALA 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1v5m h ALA 33 N 1.12 0.03 -2.64 0.00 0.00 -2.01 -3.40 119.26 112.35 1v5m h ALA 33 Ca -0.13 -0.51 -0.77 0.00 0.00 0.00 0.00 54.91 53.50 1v5m h ALA 33 Cb 0.90 0.02 -0.26 0.00 0.00 0.00 0.00 17.79 18.45 1v5m h ALA 33 CO 0.17 0.15 -0.05 0.45 0.00 0.00 0.00 179.25 179.97 1v5m s SER 34 N -6.43 6.45 0.02 0.00 0.15 -1.26 -4.98 113.70 107.64 1v5m s SER 34 Ca -0.15 -2.42 -0.06 0.00 0.70 0.00 0.00 55.95 54.02 1v5m s SER 34 Cb 0.01 -2.17 0.02 0.00 -1.71 0.00 0.00 66.02 62.16 1v5m s SER 34 CO 0.76 -0.64 0.27 0.61 1.20 0.00 0.00 173.24 175.44 1v5m n GLY 35 N 4.34 0.83 3.75 9.45 0.00 -1.26 -5.15 105.19 117.15 1v5m n GLY 35 Ca 0.05 -0.93 -0.41 0.00 0.00 0.00 0.00 46.02 44.73 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 -2.01 4.42 -0.34 1.61 0.04 -1.26 -5.02 135.00 132.44 1v5m s PRO 36 Ca 0.06 2.05 0.01 0.00 0.04 0.00 0.00 61.00 63.15 1v5m s PRO 36 Cb -0.00 -3.17 0.11 0.00 0.04 0.00 0.00 34.50 31.47 1v5m s PRO 36 CO 0.01 -0.17 0.12 0.20 0.04 0.00 0.00 177.00 177.19 1v5m s GLY 37 N 0.02 1.34 0.00 0.56 0.00 -1.26 -4.87 107.32 103.10 1v5m s GLY 37 Ca 0.53 -2.01 0.00 0.00 0.00 0.00 0.00 44.72 43.24 1v5m s GLY 37 CO 0.41 1.50 0.00 0.61 0.00 0.00 0.00 173.10 175.62 1v5m n GLY 38 N 4.46 3.12 0.42 0.20 0.00 -1.26 -5.02 105.19 107.12 1v5m n GLY 38 Ca 0.01 -0.28 -0.16 0.00 0.00 0.00 0.00 46.02 45.59 1v5m n GLY 38 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1v5m h THR 39 N 0.00 0.17 -1.43 2.61 1.35 -1.98 -3.46 112.91 110.17 1v5m h THR 39 Ca 0.00 0.00 0.11 0.00 -0.55 0.00 0.00 66.41 65.97 1v5m h THR 39 Cb 0.00 0.17 -0.28 0.00 -1.73 0.00 0.00 68.15 66.30 1v5m h THR 39 CO 0.00 0.00 0.55 0.00 -0.25 0.00 0.00 175.52 175.82 1v5m s ALA 40 N -5.94 -2.14 0.31 6.62 0.00 -1.26 -5.02 121.76 114.33 1v5m s ALA 40 Ca -0.17 1.91 0.17 0.00 0.00 0.00 0.00 51.96 53.87 1v5m s ALA 40 Cb 0.06 -1.61 1.12 0.00 0.00 0.00 0.00 23.12 22.69 1v5m s ALA 40 CO 0.62 -0.23 1.35 1.04 0.00 0.00 0.00 175.76 178.54 1v5m n GLN 41 N 2.45 -0.05 -1.04 0.00 6.02 -1.26 -4.57 117.38 118.93 1v5m n GLN 41 Ca -0.14 1.19 -0.39 0.00 -0.01 0.00 0.00 57.00 57.65 1v5m n GLN 41 Cb 0.56 -2.12 -0.04 0.00 1.02 0.00 0.00 30.24 29.66 1v5m n GLN 41 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 177.06 176.96 1v5m n TRP 42 N -4.96 0.16 -4.71 1.08 7.02 -1.26 -4.93 117.44 109.84 1v5m n TRP 42 Ca 0.32 0.73 -0.30 0.00 -1.02 0.00 0.00 57.50 57.22 1v5m n TRP 42 Cb 1.08 -1.45 -0.17 0.00 -2.42 0.00 0.00 31.31 28.35 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 -0.26 2.64 0.27 -0.99 -0.21 -1.13 -4.96 119.66 115.02 1v5m s GLN 43 Ca 0.58 -0.72 -0.31 0.00 0.02 0.00 0.00 55.36 54.93 1v5m s GLN 43 Cb -0.81 -2.13 -0.12 0.00 1.00 0.00 0.00 33.01 30.95 1v5m s GLN 43 CO 0.40 0.02 1.61 0.36 -2.12 0.00 0.00 175.29 175.56 1v5m n LYS 44 N 3.97 2.64 -3.86 2.91 0.00 -1.26 -2.32 118.16 120.24 1v5m n LYS 44 Ca -0.20 0.94 -0.09 0.00 -0.00 0.00 0.00 58.31 58.97 1v5m n LYS 44 Cb 0.52 -2.73 -0.00 0.00 -0.00 0.00 0.00 35.03 32.82 1v5m n LYS 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1v5m s ARG 46 N -3.05 2.01 -0.35 0.00 3.52 -0.69 -2.00 118.95 118.39 1v5m s ARG 46 Ca 0.16 -0.75 -0.22 0.00 -0.13 0.00 0.00 55.73 54.79 1v5m s ARG 46 Cb -0.05 -2.30 0.00 0.00 -1.56 0.00 0.00 34.95 31.05 1v5m s ARG 46 CO 0.10 -0.39 0.73 -1.17 -0.81 0.00 0.00 175.30 173.77 1v5m s LEU 47 N 1.44 4.16 -0.19 -0.88 2.96 0.56 -2.48 118.68 124.25 1v5m s LEU 47 Ca 0.00 0.35 -0.03 0.00 -0.22 0.00 0.00 54.13 54.23 1v5m s LEU 47 Cb -0.15 -2.95 -0.02 0.00 0.50 0.00 0.00 46.19 43.57 1v5m s LEU 47 CO -0.09 -0.65 -0.05 -0.22 -1.32 0.00 0.00 176.35 174.02 1v5m s LEU 48 N 2.93 3.00 -0.48 -0.68 2.96 -1.02 -1.88 118.68 123.52 1v5m s LEU 48 Ca 0.29 -0.30 -0.07 0.00 -0.22 0.00 0.00 54.13 53.83 1v5m s LEU 48 Cb -0.14 -1.74 0.12 0.00 0.50 0.00 0.00 46.19 44.93 1v5m s LEU 48 CO 0.15 0.06 0.33 -0.22 -1.32 0.00 0.00 176.35 175.35 1v5m s LEU 49 N 1.01 5.59 0.23 -0.68 0.20 -0.88 -2.81 118.68 121.35 1v5m s LEU 49 Ca 0.00 -2.03 0.05 0.00 0.69 0.00 0.00 54.13 52.85 1v5m s LEU 49 Cb -0.15 -1.96 -0.05 0.00 -0.43 0.00 0.00 46.19 43.60 1v5m s LEU 49 CO 0.00 -0.63 -0.07 0.00 -0.29 0.00 0.00 176.35 175.36 1v5m s ARG 50 N 1.18 1.35 0.30 1.98 1.70 -1.25 -1.89 118.95 122.32 1v5m s ARG 50 Ca 0.07 -1.65 -0.28 0.00 -0.47 0.00 0.00 55.73 53.40 1v5m s ARG 50 Cb -0.25 -0.89 -0.09 0.00 -0.57 0.00 0.00 34.95 33.15 1v5m s ARG 50 CO -0.02 0.03 1.01 1.03 -1.08 0.00 0.00 175.30 176.27 1v5m s ARG 51 N -3.76 4.59 -0.46 3.89 0.52 -1.26 -2.78 118.95 119.70 1v5m s ARG 51 Ca 0.25 1.54 -0.22 0.00 -0.52 0.00 0.00 55.73 56.78 1v5m s ARG 51 Cb 0.03 -2.99 0.03 0.00 0.52 0.00 0.00 34.95 32.54 1v5m s ARG 51 CO 0.08 0.25 0.73 0.00 0.02 0.00 0.00 175.30 176.38 1v5m s ALA 52 N -1.38 3.31 0.19 2.13 0.00 0.72 -4.83 121.76 121.90 1v5m s ALA 52 Ca 0.48 -1.14 -0.15 0.00 0.00 0.00 0.00 51.96 51.14 1v5m s ALA 52 Cb -0.25 -3.42 -0.07 0.00 0.00 0.00 0.00 23.12 19.38 1v5m s ALA 52 CO 0.31 -1.91 0.61 0.14 0.00 0.00 0.00 175.76 174.92 1v5m s VAL 53 N 3.12 4.77 -1.54 0.00 -7.23 -1.26 -4.11 120.40 114.15 1v5m s VAL 53 Ca 0.26 0.93 -0.13 0.00 -1.81 0.00 0.00 61.98 61.23 1v5m s VAL 53 Cb -0.13 -3.74 0.09 0.00 0.56 0.00 0.00 36.38 33.15 1v5m s VAL 53 CO 0.20 0.16 0.88 0.00 -0.31 0.00 0.00 175.10 176.04 1v5m n ALA 54 N 0.57 -1.40 -2.00 1.32 0.00 -1.26 -4.73 120.51 113.00 1v5m n ALA 54 Ca -0.03 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1v5m n ALA 54 Cb 0.52 -3.85 0.00 0.00 0.00 0.00 0.00 19.45 16.12 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 -1.64 0.35 2.44 0.00 0.00 -1.26 -5.17 105.19 99.90 1v5m n GLY 55 Ca -0.01 0.49 -0.13 0.00 0.00 0.00 0.00 46.02 46.37 1v5m n GLY 55 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1v5m n GLU 56 N 0.00 0.53 0.21 1.61 0.00 -1.26 -5.06 120.64 116.67 1v5m n GLU 56 Ca 0.00 -1.86 -0.08 0.00 0.00 0.00 0.00 57.16 55.22 1v5m n GLU 56 Cb 0.00 -0.25 -0.04 0.00 0.00 0.00 0.00 31.44 31.15 1v5m n GLU 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1v5m h ARG 57 N 0.00 -0.53 -5.11 3.44 3.08 -1.98 -3.33 114.38 109.94 1v5m h ARG 57 Ca -0.18 0.04 -0.46 0.00 0.07 0.00 0.00 59.98 59.44 1v5m h ARG 57 Cb 0.77 0.12 -0.14 0.00 0.08 0.00 0.00 29.97 30.81 1v5m h ARG 57 CO 0.23 -0.36 -0.59 -0.06 -1.07 0.00 0.00 179.97 178.13 1v5m s PHE 58 N -3.60 1.83 -0.26 3.04 0.40 -1.26 -0.20 117.98 117.93 1v5m s PHE 58 Ca -0.08 -1.07 -0.12 0.00 -0.60 0.00 0.00 56.93 55.06 1v5m s PHE 58 Cb 0.01 -1.17 0.10 0.00 0.51 0.00 0.00 43.02 42.46 1v5m s PHE 58 CO 0.24 -0.13 0.60 0.50 0.70 0.00 0.00 175.22 177.13 1v5m s ARG 59 N -3.89 0.56 -0.10 0.44 3.52 -1.12 -1.15 118.95 117.22 1v5m s ARG 59 Ca 0.35 1.22 -0.16 0.00 -0.13 0.00 0.00 55.73 57.01 1v5m s ARG 59 Cb 0.07 0.40 -0.05 0.00 -1.56 0.00 0.00 34.95 33.82 1v5m s ARG 59 CO 0.15 -0.18 0.40 -0.51 -0.81 0.00 0.00 175.30 174.35 1v5m s LEU 60 N 2.18 4.32 -0.16 -0.88 2.01 0.17 -3.90 118.68 122.42 1v5m s LEU 60 Ca -0.07 0.75 -0.00 0.00 0.01 0.00 0.00 54.13 54.82 1v5m s LEU 60 Cb -0.09 -2.56 -0.01 0.00 0.01 0.00 0.00 46.19 43.54 1v5m s LEU 60 CO -0.18 0.11 -0.13 -1.61 1.01 0.00 0.00 176.35 175.56 1v5m s GLU 61 N 0.14 3.28 -0.70 1.70 2.02 -1.12 0.28 118.70 124.30 1v5m s GLU 61 Ca 0.22 -0.72 -0.07 0.00 0.02 0.00 0.00 54.97 54.43 1v5m s GLU 61 Cb -0.15 -2.67 0.18 0.00 0.10 0.00 0.00 34.13 31.59 1v5m s GLU 61 CO 0.09 0.04 0.56 -0.06 0.02 0.00 0.00 175.26 175.91 1v5m s PHE 62 N 0.78 3.53 -0.35 1.61 0.40 -1.21 -2.43 117.98 120.31 1v5m s PHE 62 Ca -0.05 -2.44 -0.29 0.00 -0.60 0.00 0.00 56.93 53.55 1v5m s PHE 62 Cb -0.15 -3.43 0.00 0.00 0.51 0.00 0.00 43.02 39.95 1v5m s PHE 62 CO 0.01 -0.90 1.45 -0.06 0.70 0.00 0.00 175.22 176.43 1v5m s PHE 63 N 0.04 2.36 -0.24 0.36 0.08 -1.03 -1.41 117.98 118.13 1v5m s PHE 63 Ca 0.17 0.70 -0.01 0.00 0.12 0.00 0.00 56.93 57.91 1v5m s PHE 63 Cb -0.17 -4.16 0.07 0.00 -0.57 0.00 0.00 43.02 38.20 1v5m s PHE 63 CO -0.05 -2.15 0.03 0.08 -0.10 0.00 0.00 175.22 173.02 1v5m s VAL 64 N 5.31 0.97 1.03 -0.44 1.01 -1.26 -1.24 120.40 125.79 1v5m s VAL 64 Ca 0.63 -1.04 -0.13 0.00 0.00 0.00 0.00 61.98 61.44 1v5m s VAL 64 Cb -0.17 -1.48 0.21 0.00 0.00 0.00 0.00 36.38 34.94 1v5m s VAL 64 CO 0.30 -0.32 1.09 -2.16 0.00 0.00 0.00 175.10 174.02 1v5m s PRO 65 N 1.62 0.15 0.00 2.72 0.04 -1.26 -4.68 135.00 133.59 1v5m s PRO 65 Ca 0.01 0.43 0.00 0.00 0.04 0.00 0.00 61.00 61.47 1v5m s PRO 65 Cb -0.18 -1.71 0.00 0.00 0.04 0.00 0.00 34.50 32.65 1v5m s PRO 65 CO -0.12 -2.90 0.49 -0.35 0.04 0.00 0.00 177.00 174.15 1v5m n PRO 66 N -4.28 0.49 -0.03 0.56 -0.04 -0.38 -2.07 135.00 129.26 1v5m n PRO 66 Ca 0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 1v5m n PRO 66 Cb 0.58 -1.00 -0.10 0.00 -0.04 0.00 0.00 33.50 32.94 1v5m n PRO 66 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1v5m n LYS 67 N -0.49 1.25 -1.56 0.54 4.81 -1.26 -4.75 118.16 116.68 1v5m n LYS 67 Ca 0.00 -0.06 -0.42 0.00 -0.87 0.00 0.00 58.31 56.96 1v5m n LYS 67 Cb 0.00 -1.30 0.01 0.00 0.02 0.00 0.00 35.03 33.76 1v5m n LYS 67 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1v5m n ALA 68 N -2.19 -0.39 0.13 3.14 0.00 -0.88 -4.87 120.51 115.45 1v5m n ALA 68 Ca -0.11 0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1v5m n ALA 68 Cb 0.61 -1.98 0.29 0.00 0.00 0.00 0.00 19.45 18.37 1v5m n ALA 68 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1v5m h SER 69 N 1.30 0.16 -3.67 0.00 0.87 -1.95 -3.44 113.55 106.82 1v5m h SER 69 Ca -0.43 -0.06 -0.68 0.00 -1.23 0.00 0.00 61.79 59.40 1v5m h SER 69 Cb 1.36 -0.04 -0.20 0.00 -0.44 0.00 0.00 62.40 63.08 1v5m h SER 69 CO 0.55 0.51 -0.83 -0.13 -0.53 0.00 0.00 176.83 176.41 1v5m s ARG 70 N -4.23 1.61 0.33 2.24 1.81 -1.26 -5.12 118.95 114.33 1v5m s ARG 70 Ca -0.04 -1.31 -0.28 0.00 -1.72 0.00 0.00 55.73 52.38 1v5m s ARG 70 Cb 0.14 -1.99 -0.10 0.00 -0.45 0.00 0.00 34.95 32.55 1v5m s ARG 70 CO 0.75 0.45 1.22 -1.25 -0.68 0.00 0.00 175.30 175.79 1v5m s PRO 71 N -2.24 4.39 -0.11 3.54 0.04 -1.26 -4.66 135.00 134.71 1v5m s PRO 71 Ca 0.17 2.02 -0.19 0.00 0.04 0.00 0.00 61.00 63.05 1v5m s PRO 71 Cb -0.10 -3.04 -0.27 0.00 0.04 0.00 0.00 34.50 31.13 1v5m s PRO 71 CO 0.09 -0.08 0.61 -0.22 0.04 0.00 0.00 177.00 177.44 1v5m h LYS 72 N 3.39 0.21 -2.17 4.56 3.64 -1.51 -3.41 116.57 121.28 1v5m h LYS 72 Ca -0.48 -0.35 -0.58 0.00 -1.27 0.00 0.00 60.65 57.96 1v5m h LYS 72 Cb 1.22 0.13 -0.41 0.00 -0.41 0.00 0.00 32.23 32.76 1v5m h LYS 72 CO 0.65 1.17 -0.73 0.28 -2.27 0.00 0.00 179.45 178.55 1v5m n VAL 73 N -4.09 1.83 -2.50 2.00 0.31 -0.94 -5.01 118.33 109.93 1v5m n VAL 73 Ca -0.22 -5.06 -0.43 0.00 -0.01 0.00 0.00 64.34 58.63 1v5m n VAL 73 Cb 0.82 -1.78 -0.02 0.00 -0.91 0.00 0.00 33.84 31.95 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 -2.49 6.68 -0.09 4.52 0.15 -1.26 -3.29 113.70 117.92 1v5m s SER 74 Ca 0.41 0.95 0.02 0.00 0.70 0.00 0.00 55.95 58.03 1v5m s SER 74 Cb 0.20 -2.54 -0.02 0.00 -1.71 0.00 0.00 66.02 61.95 1v5m s SER 74 CO -0.06 -1.12 -0.16 -0.63 1.20 0.00 0.00 173.24 172.46 1v5m s ILE 75 N 4.37 2.81 0.37 6.45 1.01 0.14 -4.97 121.20 131.38 1v5m s ILE 75 Ca 0.52 -0.78 -0.27 0.00 0.00 0.00 0.00 60.65 60.13 1v5m s ILE 75 Cb -0.13 -2.12 -0.09 0.00 0.01 0.00 0.00 42.46 40.13 1v5m s ILE 75 CO 0.25 0.55 1.20 -2.16 0.00 0.00 0.00 174.94 174.78 1v5m s PRO 76 N -0.06 4.18 0.51 2.79 0.04 -1.26 0.44 135.00 141.64 1v5m s PRO 76 Ca -0.04 1.94 0.27 0.00 0.04 0.00 0.00 61.00 63.21 1v5m s PRO 76 Cb -0.14 -2.83 1.37 0.00 0.04 0.00 0.00 34.50 32.94 1v5m s PRO 76 CO 0.04 -0.24 2.04 1.25 0.04 0.00 0.00 177.00 180.13 1v5m h LEU 77 N 2.95 0.00 -0.65 -3.56 7.12 -1.45 -2.36 115.31 117.36 1v5m h LEU 77 Ca -0.49 0.00 -0.14 0.00 0.13 0.00 0.00 57.88 57.38 1v5m h LEU 77 Cb 1.23 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 41.35 1v5m h LEU 77 CO 0.64 0.14 -0.55 0.77 -0.13 0.00 0.00 178.44 179.30 1v5m h SER 78 N 0.00 0.40 -0.53 1.25 4.64 -1.92 -3.04 113.55 114.35 1v5m h SER 78 Ca -0.00 -0.21 -0.00 0.00 -0.47 0.00 0.00 61.79 61.10 1v5m h SER 78 Cb 0.39 -0.12 -0.03 0.00 -0.31 0.00 0.00 62.40 62.33 1v5m h SER 78 CO 0.02 0.87 0.33 0.00 -0.87 0.00 0.00 176.83 177.18 1v5m h ALA 79 N 1.14 1.56 -2.48 5.18 0.00 -1.80 -3.43 119.26 119.43 1v5m h ALA 79 Ca 0.00 -0.06 -0.55 0.00 0.00 0.00 0.00 54.91 54.30 1v5m h ALA 79 Cb 1.05 -0.22 0.06 0.00 0.00 0.00 0.00 17.79 18.68 1v5m h ALA 79 CO 0.09 0.39 0.89 -0.89 0.00 0.00 0.00 179.25 179.73 1v5m n ILE 80 N -4.43 0.13 0.00 0.00 2.08 -1.15 0.20 119.36 116.20 1v5m n ILE 80 Ca 0.05 -0.03 0.00 0.00 0.56 0.00 0.00 62.75 63.33 1v5m n ILE 80 Cb 0.07 -1.76 0.00 0.00 -0.75 0.00 0.00 39.64 37.20 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 3.47 0.00 -3.66 1.39 -5.35 -0.78 -4.83 119.36 109.59 1v5m n ILE 81 Ca 0.16 0.00 -0.11 0.00 -0.27 0.00 0.00 62.75 62.53 1v5m n ILE 81 Cb 0.32 -0.80 -0.11 0.00 -1.74 0.00 0.00 39.64 37.31 1v5m n ILE 81 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 1v5m s GLU 82 N -1.97 0.24 -0.36 6.28 2.12 -0.92 -5.07 118.70 119.03 1v5m s GLU 82 Ca 0.00 0.90 0.00 0.00 0.36 0.00 0.00 54.97 56.23 1v5m s GLU 82 Cb 0.00 0.16 0.09 0.00 0.26 0.00 0.00 34.13 34.64 1v5m s GLU 82 CO 0.00 -0.26 0.10 0.54 -0.54 0.00 0.00 175.26 175.09 1v5m s VAL 83 N 2.48 2.78 0.23 3.70 0.11 -1.26 -0.76 120.40 127.68 1v5m s VAL 83 Ca -0.01 -2.06 -0.01 0.00 -2.93 0.00 0.00 61.98 56.98 1v5m s VAL 83 Cb -0.12 -2.90 -0.04 0.00 -1.53 0.00 0.00 36.38 31.79 1v5m s VAL 83 CO -0.11 -0.54 0.43 0.00 -3.33 0.00 0.00 175.10 171.55 1v5m s ARG 84 N 1.06 3.52 -0.28 1.54 1.70 -0.85 -4.92 118.95 120.71 1v5m s ARG 84 Ca 0.06 -0.33 0.09 0.00 -0.47 0.00 0.00 55.73 55.08 1v5m s ARG 84 Cb -0.21 -2.80 0.46 0.00 -0.57 0.00 0.00 34.95 31.84 1v5m s ARG 84 CO -0.05 0.35 1.35 0.25 -1.08 0.00 0.00 175.30 176.11 1v5m n THR 85 N -0.89 2.49 -3.86 4.99 -2.24 -1.26 0.90 114.28 114.42 1v5m n THR 85 Ca -0.05 -3.28 -0.26 0.00 -2.27 0.00 0.00 64.05 58.20 1v5m n THR 85 Cb 0.54 -0.52 -0.17 0.00 -2.10 0.00 0.00 70.33 68.08 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 -3.64 0.80 0.20 4.28 -4.23 -1.26 -4.80 115.64 106.99 1v5m s THR 86 Ca 0.45 -0.17 0.07 0.00 -1.18 0.00 0.00 61.69 60.85 1v5m s THR 86 Cb 0.40 -0.88 -0.04 0.00 1.34 0.00 0.00 72.50 73.32 1v5m s THR 86 CO -0.02 0.31 0.09 -0.04 -0.54 0.00 0.00 174.62 174.42 1v5m s MET 87 N 1.80 2.67 0.56 3.99 1.00 -1.26 -4.90 119.30 123.17 1v5m s MET 87 Ca 0.05 -1.05 -0.09 0.00 0.00 0.00 0.00 55.69 54.59 1v5m s MET 87 Cb -0.13 -2.48 0.14 0.00 0.00 0.00 0.00 34.83 32.37 1v5m s MET 87 CO -0.07 0.44 0.50 -0.35 0.00 0.00 0.00 175.02 175.54 1v5m n PRO 88 N -0.53 -2.00 -1.85 2.03 -0.04 -1.26 -4.81 135.00 126.55 1v5m n PRO 88 Ca -0.08 -0.80 -0.22 0.00 -0.04 0.00 0.00 63.50 62.36 1v5m n PRO 88 Cb 0.56 -0.75 -0.08 0.00 -0.04 0.00 0.00 33.50 33.19 1v5m n PRO 88 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1v5m s LEU 89 N 0.00 2.76 0.24 1.53 1.02 -1.26 -4.16 118.68 118.81 1v5m s LEU 89 Ca 0.32 -1.23 0.00 0.00 0.02 0.00 0.00 54.13 53.24 1v5m s LEU 89 Cb -0.03 -2.59 0.00 0.00 0.02 0.00 0.00 46.19 43.59 1v5m s LEU 89 CO 0.25 -3.81 0.00 1.21 0.02 0.00 0.00 176.35 174.02 1v5m n GLU 90 N 8.30 0.00 -2.48 1.70 4.07 -1.26 -5.12 120.64 125.85 1v5m n GLU 90 Ca 0.43 0.00 -0.26 0.00 -0.06 0.00 0.00 57.16 57.27 1v5m n GLU 90 Cb 0.47 -0.12 0.03 0.00 -0.06 0.00 0.00 31.44 31.75 1v5m n GLU 90 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1v5m s MET 91 N -1.97 2.90 0.00 5.31 0.23 -1.26 -4.93 119.30 119.59 1v5m s MET 91 Ca 0.00 -0.11 0.00 0.00 -1.03 0.00 0.00 55.69 54.55 1v5m s MET 91 Cb 0.00 -2.32 0.00 0.00 -1.53 0.00 0.00 34.83 30.98 1v5m s MET 91 CO 0.00 -0.65 0.25 -0.35 -2.03 0.00 0.00 175.02 172.24 1v5m n PRO 92 N -2.51 0.49 -2.54 3.16 -0.04 -1.26 -4.72 135.00 127.58 1v5m n PRO 92 Ca 0.04 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.42 1v5m n PRO 92 Cb 0.58 -1.25 0.04 0.00 -0.04 0.00 0.00 33.50 32.83 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 0.27 -2.20 -2.91 0.54 2.13 -1.26 -5.00 120.64 112.21 1v5m n GLU 93 Ca 0.00 0.42 -0.40 0.00 0.66 0.00 0.00 57.16 57.84 1v5m n GLU 93 Cb 0.13 -3.90 -0.05 0.00 0.27 0.00 0.00 31.44 27.89 1v5m n GLU 93 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1v5m s LYS 94 N -4.18 4.54 -0.06 5.31 1.02 -1.26 -4.94 119.74 120.18 1v5m s LYS 94 Ca 0.11 1.16 0.01 0.00 0.02 0.00 0.00 55.97 57.27 1v5m s LYS 94 Cb -0.01 -3.38 0.09 0.00 -0.52 0.00 0.00 37.83 34.01 1v5m s LYS 94 CO 0.36 0.24 1.09 -3.47 -0.92 0.00 0.00 175.35 172.65 1v5m n ASP 95 N 2.91 3.02 -2.88 2.83 -0.08 -1.26 -4.02 116.55 117.06 1v5m n ASP 95 Ca -0.01 -2.20 -0.17 0.00 -1.51 0.00 0.00 54.79 50.90 1v5m n ASP 95 Cb 0.50 -0.54 -0.01 0.00 2.34 0.00 0.00 41.12 43.41 1v5m n ASP 95 CO 0.00 0.00 0.00 -0.46 0.12 0.00 0.00 177.20 176.86 1v5m n ASN 96 N 0.28 2.02 -4.06 1.67 6.94 -1.26 -3.77 115.26 117.08 1v5m n ASN 96 Ca 0.07 -3.08 -0.10 0.00 -0.02 0.00 0.00 54.58 51.45 1v5m n ASN 96 Cb 0.64 -0.56 -0.08 0.00 -2.36 0.00 0.00 39.78 37.42 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 -3.34 0.03 -0.29 5.53 -4.23 -1.26 -0.73 115.64 111.35 1v5m s THR 97 Ca 0.37 -1.63 -0.16 0.00 -1.18 0.00 0.00 61.69 59.09 1v5m s THR 97 Cb 0.39 -2.18 0.15 0.00 1.34 0.00 0.00 72.50 72.20 1v5m s THR 97 CO -0.06 -0.12 1.01 0.72 -0.54 0.00 0.00 174.62 175.62 1v5m s PHE 98 N -4.05 -0.51 -0.01 3.99 -0.12 -0.97 -4.81 117.98 111.50 1v5m s PHE 98 Ca 0.26 1.03 -0.14 0.00 -0.05 0.00 0.00 56.93 58.03 1v5m s PHE 98 Cb 0.04 0.31 -0.06 0.00 -0.63 0.00 0.00 43.02 42.68 1v5m s PHE 98 CO 0.07 -0.25 0.39 0.08 -0.05 0.00 0.00 175.22 175.46 1v5m s VAL 99 N 1.29 5.06 -0.31 -2.49 1.01 0.26 -2.38 120.40 122.84 1v5m s VAL 99 Ca -0.09 0.80 -0.03 0.00 0.00 0.00 0.00 61.98 62.66 1v5m s VAL 99 Cb -0.03 -3.69 0.04 0.00 0.00 0.00 0.00 36.38 32.69 1v5m s VAL 99 CO -0.14 0.58 0.03 -0.76 0.00 0.00 0.00 175.10 174.80 1v5m s LEU 100 N -1.06 3.95 -0.53 3.92 1.43 -0.97 -2.02 118.68 123.41 1v5m s LEU 100 Ca 0.23 -1.18 -0.16 0.00 -1.03 0.00 0.00 54.13 51.99 1v5m s LEU 100 Cb -0.16 -1.76 0.12 0.00 0.03 0.00 0.00 46.19 44.41 1v5m s LEU 100 CO 0.13 -0.26 0.50 -0.75 0.23 0.00 0.00 176.35 176.20 1v5m s LYS 101 N 1.31 3.00 1.05 1.70 2.36 0.06 -1.70 119.74 127.51 1v5m s LYS 101 Ca -0.04 -1.59 -0.17 0.00 -2.55 0.00 0.00 55.97 51.63 1v5m s LYS 101 Cb -0.19 -4.26 0.22 0.00 -1.05 0.00 0.00 37.83 32.55 1v5m s LYS 101 CO -0.00 -1.29 1.22 0.14 1.55 0.00 0.00 175.35 176.97 1v5m s VAL 102 N 1.74 1.85 0.13 4.02 -7.23 -1.02 -1.87 120.40 118.01 1v5m s VAL 102 Ca 0.04 0.00 -0.08 0.00 -1.81 0.00 0.00 61.98 60.13 1v5m s VAL 102 Cb -0.28 -2.78 -0.14 0.00 0.56 0.00 0.00 36.38 33.74 1v5m s VAL 102 CO 0.04 0.00 1.36 1.05 -0.31 0.00 0.00 175.10 177.24 1v5m h GLU 103 N -1.98 0.65 0.00 4.82 -0.00 -0.57 -3.07 114.58 114.43 1v5m h GLU 103 Ca -0.45 -0.53 -0.01 0.00 -0.00 0.00 0.00 59.36 58.37 1v5m h GLU 103 Cb 1.27 0.11 -0.00 0.00 -0.00 0.00 0.00 28.75 30.13 1v5m h GLU 103 CO 0.39 1.15 -0.04 -0.91 -0.00 0.00 0.00 179.01 179.60 1v5m h ASN 104 N 0.44 0.00 0.00 3.06 2.35 -1.94 -3.46 115.58 116.03 1v5m h ASN 104 Ca -0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 1v5m h ASN 104 Cb 1.37 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.74 1v5m h ASN 104 CO 0.15 0.04 0.00 0.61 -1.65 0.00 0.00 177.43 176.58 1v5m n GLY 105 N -1.16 0.84 2.85 2.83 0.00 -1.16 -5.14 105.19 104.25 1v5m n GLY 105 Ca -0.03 -0.82 -0.15 0.00 0.00 0.00 0.00 46.02 45.03 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 -1.76 -0.14 -0.21 4.61 0.00 -1.26 -4.97 121.76 118.04 1v5m s ALA 106 Ca 0.00 0.55 -0.12 0.00 0.00 0.00 0.00 51.96 52.39 1v5m s ALA 106 Cb 0.00 -0.54 -0.05 0.00 0.00 0.00 0.00 23.12 22.53 1v5m s ALA 106 CO 0.00 -0.30 0.23 -1.21 0.00 0.00 0.00 175.76 174.48 1v5m s GLU 107 N 1.57 4.15 -0.38 0.00 2.02 -1.25 -2.45 118.70 122.37 1v5m s GLU 107 Ca -0.04 -0.09 -0.00 0.00 0.02 0.00 0.00 54.97 54.86 1v5m s GLU 107 Cb -0.12 -3.49 0.11 0.00 0.10 0.00 0.00 34.13 30.72 1v5m s GLU 107 CO -0.05 0.12 0.14 0.71 0.02 0.00 0.00 175.26 176.20 1v5m s TYR 108 N 0.85 3.66 -0.40 1.61 1.51 -0.69 -2.90 117.35 120.99 1v5m s TYR 108 Ca 0.12 -2.65 -0.28 0.00 -1.01 0.00 0.00 57.07 53.25 1v5m s TYR 108 Cb -0.13 -3.10 0.02 0.00 -0.11 0.00 0.00 41.96 38.64 1v5m s TYR 108 CO 0.04 -0.96 1.06 0.42 -1.11 0.00 0.00 175.55 175.00 1v5m s ILE 109 N 1.05 4.40 0.02 2.71 1.01 -0.28 -2.28 121.20 127.83 1v5m s ILE 109 Ca 0.09 1.35 0.04 0.00 0.00 0.00 0.00 60.65 62.14 1v5m s ILE 109 Cb -0.21 -4.48 -0.03 0.00 0.01 0.00 0.00 42.46 37.74 1v5m s ILE 109 CO -0.06 -0.73 -0.08 -0.76 0.00 0.00 0.00 174.94 173.30 1v5m s LEU 110 N 3.96 3.08 -0.23 2.97 1.02 -1.00 -1.14 118.68 127.34 1v5m s LEU 110 Ca 0.44 -0.22 0.02 0.00 0.02 0.00 0.00 54.13 54.39 1v5m s LEU 110 Cb -0.10 -1.79 0.04 0.00 0.02 0.00 0.00 46.19 44.36 1v5m s LEU 110 CO 0.23 0.26 -0.14 -0.70 0.02 0.00 0.00 176.35 176.03 1v5m s GLU 111 N -1.55 2.63 0.59 1.70 2.12 0.07 -2.29 118.70 121.95 1v5m s GLU 111 Ca 0.18 -1.09 -0.08 0.00 0.36 0.00 0.00 54.97 54.34 1v5m s GLU 111 Cb -0.11 -2.77 0.13 0.00 0.26 0.00 0.00 34.13 31.64 1v5m s GLU 111 CO 0.08 -0.40 0.80 0.25 -0.54 0.00 0.00 175.26 175.45 1v5m n THR 112 N 4.54 0.00 0.20 -1.70 -2.24 0.09 -3.26 114.28 111.91 1v5m n THR 112 Ca -0.17 -0.73 -0.09 0.00 -2.27 0.00 0.00 64.05 60.79 1v5m n THR 112 Cb 0.46 -1.52 -0.04 0.00 -2.10 0.00 0.00 70.33 67.13 1v5m n THR 112 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 1v5m h ILE 113 N -1.24 0.00 -3.54 2.28 5.03 -1.92 -3.47 117.51 114.66 1v5m h ILE 113 Ca -0.26 -0.54 -0.41 0.00 -0.12 0.00 0.00 64.86 63.53 1v5m h ILE 113 Cb 0.77 0.00 -0.14 0.00 -3.03 0.00 0.00 36.82 34.42 1v5m h ILE 113 CO 0.20 0.00 -0.59 -0.62 -0.68 0.00 0.00 178.15 176.47 1v5m s ASP 114 N -4.77 1.67 0.56 1.72 2.15 -1.26 -4.98 116.67 111.75 1v5m s ASP 114 Ca -0.08 -1.47 0.26 0.00 0.43 0.00 0.00 52.55 51.69 1v5m s ASP 114 Cb 0.01 0.23 1.62 0.00 -0.30 0.00 0.00 42.92 44.47 1v5m s ASP 114 CO 0.25 -0.78 2.19 0.77 -0.17 0.00 0.00 175.17 177.43 1v5m h SER 115 N 2.22 0.00 0.53 -0.34 4.64 -1.93 -0.98 113.55 117.70 1v5m h SER 115 Ca -0.37 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 60.80 1v5m h SER 115 Cb 1.25 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.32 1v5m h SER 115 CO 0.59 0.04 -0.67 -0.07 -0.87 0.00 0.00 176.83 175.85 1v5m h LEU 116 N 0.00 0.15 0.12 5.97 3.38 -1.96 -2.88 115.31 120.09 1v5m h LEU 116 Ca -0.00 -0.09 -0.28 0.00 0.09 0.00 0.00 57.88 57.60 1v5m h LEU 116 Cb 0.09 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1v5m h LEU 116 CO 0.01 0.77 -1.30 1.56 0.09 0.00 0.00 178.44 179.57 1v5m h GLN 117 N 0.09 0.26 0.47 1.13 1.08 -1.61 -3.28 115.11 113.25 1v5m h GLN 117 Ca -0.01 -0.45 -0.02 0.00 -1.45 0.00 0.00 58.65 56.72 1v5m h GLN 117 Cb 1.20 0.17 0.00 0.00 -0.05 0.00 0.00 27.48 28.80 1v5m h GLN 117 CO 0.10 1.19 -0.23 -0.22 -0.95 0.00 0.00 178.83 178.72 1v5m h LYS 118 N 0.07 -0.61 -0.96 1.46 3.64 -1.29 -2.77 116.57 116.10 1v5m h LYS 118 Ca -0.16 0.04 0.31 0.00 -1.27 0.00 0.00 60.65 59.58 1v5m h LYS 118 Cb 1.98 0.14 -0.17 0.00 -0.41 0.00 0.00 32.23 33.77 1v5m h LYS 118 CO 0.19 -0.41 0.29 1.12 -2.27 0.00 0.00 179.45 178.37 1v5m h HIS 119 N -0.69 0.41 -0.14 1.91 2.07 -1.68 0.30 115.15 117.33 1v5m h HIS 119 Ca -0.07 0.05 0.04 0.00 -2.85 0.00 0.00 60.37 57.55 1v5m h HIS 119 Cb 0.49 -0.02 -0.05 0.00 2.57 0.00 0.00 27.41 30.40 1v5m h HIS 119 CO 0.10 -0.36 -0.15 1.03 -3.07 0.00 0.00 177.93 175.48 1v5m h SER 120 N 0.10 -0.46 0.17 3.10 0.87 -1.59 -1.43 113.55 114.31 1v5m h SER 120 Ca 0.67 0.09 0.01 0.00 -1.23 0.00 0.00 61.79 61.33 1v5m h SER 120 Cb 1.53 0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 63.69 1v5m h SER 120 CO -0.77 -0.19 -0.22 -0.50 -0.53 0.00 0.00 176.83 174.62 1v5m h TRP 121 N -0.18 -0.57 -1.00 2.24 4.06 -0.14 0.88 115.95 121.25 1v5m h TRP 121 Ca 0.10 0.01 0.23 0.00 2.06 0.00 0.00 58.89 61.29 1v5m h TRP 121 Cb 0.32 0.23 -0.09 0.00 -1.00 0.00 0.00 29.16 28.61 1v5m h TRP 121 CO -0.27 -0.32 0.64 0.28 -3.56 0.00 0.00 178.44 175.21 1v5m h VAL 122 N -0.44 0.60 -0.02 1.49 2.07 -1.08 0.80 116.25 119.68 1v5m h VAL 122 Ca 0.01 -0.17 -0.05 0.00 0.82 0.00 0.00 66.70 67.31 1v5m h VAL 122 Cb 0.43 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.27 1v5m h VAL 122 CO -0.08 0.09 -0.18 0.00 0.02 0.00 0.00 177.57 177.42 1v5m h ALA 123 N 1.63 0.05 -0.78 1.67 0.00 -0.49 -0.13 119.26 121.21 1v5m h ALA 123 Ca 0.57 -0.41 0.08 0.00 0.00 0.00 0.00 54.91 55.14 1v5m h ALA 123 Cb 1.27 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 19.01 1v5m h ALA 123 CO -0.30 0.03 0.51 -0.44 0.00 0.00 0.00 179.25 179.05 1v5m h ASP 124 N -0.45 0.71 0.04 0.00 5.19 0.45 0.53 116.42 122.88 1v5m h ASP 124 Ca -0.02 0.01 -0.00 0.00 -0.62 0.00 0.00 57.03 56.40 1v5m h ASP 124 Cb 0.87 -0.14 0.00 0.00 0.18 0.00 0.00 39.33 40.24 1v5m h ASP 124 CO 0.04 0.44 -0.02 0.40 -3.12 0.00 0.00 179.24 176.98 1v5m h ILE 125 N 0.80 0.21 -0.68 0.35 2.04 -0.93 -3.13 117.51 116.17 1v5m h ILE 125 Ca 0.35 -1.11 0.13 0.00 1.00 0.00 0.00 64.86 65.22 1v5m h ILE 125 Cb 0.32 0.39 -0.04 0.00 -0.74 0.00 0.00 36.82 36.75 1v5m h ILE 125 CO -0.13 0.07 0.46 1.56 0.00 0.00 0.00 178.15 180.11 1v5m h GLN 126 N -1.01 0.37 0.00 2.37 4.20 -0.94 0.16 115.11 120.27 1v5m h GLN 126 Ca -0.01 -0.02 -0.06 0.00 0.06 0.00 0.00 58.65 58.62 1v5m h GLN 126 Cb 0.15 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.84 1v5m h GLN 126 CO 0.01 0.25 -0.29 0.78 -0.67 0.00 0.00 178.83 178.91 1v5m h GLY 127 N 0.39 0.00 0.00 3.46 0.00 -0.05 -2.75 103.07 104.11 1v5m h GLY 127 Ca 0.32 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.48 1v5m h GLY 127 CO -0.09 0.00 -1.06 0.00 0.00 0.00 0.00 176.54 175.38 1v5m h VAL 129 N -1.00 0.61 -1.26 0.00 3.04 -0.96 -3.43 116.25 113.25 1v5m h VAL 129 Ca -0.27 -0.21 0.16 0.00 -1.01 0.00 0.00 66.70 65.37 1v5m h VAL 129 Cb 1.13 -0.07 -0.31 0.00 -2.01 0.00 0.00 31.29 30.04 1v5m h VAL 129 CO -0.16 0.11 0.63 -1.81 -1.01 0.00 0.00 177.57 175.33 1v5m s ASP 130 N -5.30 -0.23 -0.52 3.17 1.01 -1.04 -5.01 116.67 108.75 1v5m s ASP 130 Ca -0.11 0.39 -0.18 0.00 0.71 0.00 0.00 52.55 53.36 1v5m s ASP 130 Cb 0.25 0.92 -0.12 0.00 1.01 0.00 0.00 42.92 44.99 1v5m s ASP 130 CO 0.79 -0.06 1.47 -0.24 0.21 0.00 0.00 175.17 177.34 1v5m n SER 131 N 2.97 0.20 0.00 0.27 2.88 -1.26 -4.36 113.62 114.32 1v5m n SER 131 Ca -0.16 0.14 0.00 0.00 -1.33 0.00 0.00 58.87 57.52 1v5m n SER 131 Cb 0.57 -0.51 0.00 0.00 -0.75 0.00 0.00 64.21 63.51 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 3.71 2.80 0.00 0.46 0.00 -1.25 -4.94 105.19 105.97 1v5m n GLY 132 Ca 0.36 -0.22 0.06 0.00 0.00 0.00 0.00 46.02 46.22 1v5m n GLY 132 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1v5m n PRO 133 N 0.00 0.49 -1.03 1.61 -0.04 -1.26 -4.88 135.00 129.88 1v5m n PRO 133 Ca 0.00 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 63.05 1v5m n PRO 133 Cb 0.00 -1.36 -0.06 0.00 -0.04 0.00 0.00 33.50 32.05 1v5m n PRO 133 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1v5m n SER 134 N -0.86 0.04 -0.30 3.54 3.41 -1.26 -4.70 113.62 113.48 1v5m n SER 134 Ca 0.08 0.79 0.13 0.00 -0.26 0.00 0.00 58.87 59.62 1v5m n SER 134 Cb 0.04 -0.62 0.26 0.00 -0.26 0.00 0.00 64.21 63.62 1v5m n SER 134 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1v5m n SER 135 N 1.12 -0.10 0.00 4.04 7.64 -1.26 -5.11 113.62 119.95 1v5m n SER 135 Ca 0.14 1.49 0.00 0.00 1.01 0.00 0.00 58.87 61.51 1v5m n SER 135 Cb 0.05 -0.54 0.00 0.00 -1.01 0.00 0.00 64.21 62.71 1v5m n SER 135 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64