#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jop s LEU 26 N 0.00 1.79 0.06 0.55 1.43 -1.26 -5.06 118.68 116.19 2jop s LEU 26 Ca 0.00 -0.36 -0.07 0.00 -1.03 0.00 0.00 54.13 52.67 2jop s LEU 26 Cb 0.00 -0.97 -0.01 0.00 0.03 0.00 0.00 46.19 45.24 2jop s LEU 26 CO 0.00 0.08 0.14 -0.94 0.23 0.00 0.00 176.35 175.86 2jop s SER 27 N 0.47 0.17 0.00 2.29 1.04 -1.25 -0.36 113.70 116.06 2jop s SER 27 Ca -0.13 -0.60 0.00 0.00 0.48 0.00 0.00 55.95 55.70 2jop s SER 27 Cb -0.15 0.28 0.00 0.00 0.10 0.00 0.00 66.02 66.25 2jop s SER 27 CO 0.05 -0.61 0.87 -2.67 0.98 0.00 0.00 173.24 171.85 2jop n TRP 28 N 0.36 0.00 -0.22 5.02 4.27 -1.26 -1.98 117.44 123.63 2jop n TRP 28 Ca -0.17 0.00 0.03 0.00 -3.89 0.00 0.00 57.50 53.48 2jop n TRP 28 Cb 0.60 -0.01 0.08 0.00 -1.36 0.00 0.00 31.31 30.62 2jop n TRP 28 CO 0.00 0.00 0.00 2.48 -2.29 0.00 0.00 177.69 177.88 2jop n TYR 29 N -0.43 0.22 -3.03 -2.67 4.11 -1.26 -4.40 117.16 109.70 2jop n TYR 29 Ca 0.00 -0.57 -0.40 0.00 -0.00 0.00 0.00 57.90 56.93 2jop n TYR 29 Cb 0.03 -0.07 -0.05 0.00 -0.00 0.00 0.00 39.34 39.25 2jop n TYR 29 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.86 176.35 2jop s ASP 30 N -1.23 7.13 0.20 9.48 1.01 -0.84 -4.99 116.67 127.44 2jop s ASP 30 Ca 0.14 1.35 -0.09 0.00 0.71 0.00 0.00 52.55 54.66 2jop s ASP 30 Cb 0.09 -2.44 0.14 0.00 1.01 0.00 0.00 42.92 41.72 2jop s ASP 30 CO 0.06 0.01 1.79 -0.65 0.21 0.00 0.00 175.17 176.59 2jop h PRO 31 N 5.85 1.09 -0.01 8.23 0.11 -1.94 -2.49 132.00 142.84 2jop h PRO 31 Ca -0.44 -0.17 0.00 0.00 0.11 0.00 0.00 66.00 65.51 2jop h PRO 31 Cb 1.20 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.12 2jop h PRO 31 CO 0.71 0.86 -0.10 -0.40 -0.21 0.00 0.00 178.00 178.86 2jop n ASP 32 N -4.38 0.66 -4.70 -2.05 5.75 -1.26 -4.83 116.55 105.73 2jop n ASP 32 Ca 0.07 -0.82 -0.42 0.00 -0.01 0.00 0.00 54.79 53.60 2jop n ASP 32 Cb 0.14 -0.03 -0.03 0.00 -1.03 0.00 0.00 41.12 40.18 2jop n ASP 32 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 2jop s PHE 33 N -2.34 3.44 -0.34 2.11 5.36 -0.94 -4.99 117.98 120.28 2jop s PHE 33 Ca 0.32 1.43 -0.22 0.00 -0.96 0.00 0.00 56.93 57.50 2jop s PHE 33 Cb 0.20 -3.31 0.00 0.00 -0.34 0.00 0.00 43.02 39.58 2jop s PHE 33 CO 0.44 -0.79 0.72 -1.14 -1.46 0.00 0.00 175.22 172.99 2jop s GLN 34 N 1.52 3.78 -0.14 10.12 0.74 -1.26 -4.91 119.66 129.51 2jop s GLN 34 Ca 0.55 0.27 -0.21 0.00 0.05 0.00 0.00 55.36 56.01 2jop s GLN 34 Cb -0.24 -3.78 0.05 0.00 1.10 0.00 0.00 33.01 30.14 2jop s GLN 34 CO 0.25 -0.75 0.55 0.00 -0.55 0.00 0.00 175.29 174.79 2jop s ALA 35 N 2.88 -1.38 -0.03 1.58 0.00 -1.26 -1.72 121.76 121.83 2jop s ALA 35 Ca 0.28 1.31 -0.19 0.00 0.00 0.00 0.00 51.96 53.36 2jop s ALA 35 Cb -0.14 -0.54 0.06 0.00 0.00 0.00 0.00 23.12 22.51 2jop s ALA 35 CO 0.15 -0.29 0.88 2.89 0.00 0.00 0.00 175.76 179.38 2jop n ARG 36 N 2.08 0.09 -2.40 0.00 0.00 -0.67 -4.89 116.66 110.86 2jop n ARG 36 Ca -0.16 -0.47 -0.29 0.00 -0.00 0.00 0.00 57.85 56.93 2jop n ARG 36 Cb 0.56 0.81 -0.00 0.00 -0.00 0.00 0.00 32.46 33.83 2jop n ARG 36 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2jop s LEU 37 N 0.00 3.52 0.53 2.89 1.02 -1.26 0.24 118.68 125.62 2jop s LEU 37 Ca 0.21 1.13 -0.18 0.00 0.02 0.00 0.00 54.13 55.30 2jop s LEU 37 Cb -0.00 -4.10 -0.07 0.00 0.02 0.00 0.00 46.19 42.03 2jop s LEU 37 CO -0.01 -0.66 1.03 0.42 0.02 0.00 0.00 176.35 177.15 2jop s THR 38 N -2.84 4.02 -1.14 5.49 -4.23 0.85 -4.70 115.64 113.08 2jop s THR 38 Ca 0.51 1.08 -0.23 0.00 -1.18 0.00 0.00 61.69 61.86 2jop s THR 38 Cb -0.10 -3.50 -0.10 0.00 1.34 0.00 0.00 72.50 70.14 2jop s THR 38 CO 0.46 -0.44 1.96 0.00 -0.54 0.00 0.00 174.62 176.06 2jop s ARG 39 N -3.72 2.37 0.00 3.99 1.70 -1.26 -4.63 118.95 117.40 2jop s ARG 39 Ca 0.64 -0.98 0.00 0.00 -0.47 0.00 0.00 55.73 54.91 2jop s ARG 39 Cb -0.14 -5.19 0.00 0.00 -0.57 0.00 0.00 34.95 29.05 2jop s ARG 39 CO 0.28 -4.06 0.00 -1.13 -1.08 0.00 0.00 175.30 169.31 2jop n SER 40 N 14.89 0.00 0.00 -2.89 3.41 -1.26 -5.00 113.62 122.76 2jop n SER 40 Ca 0.44 0.12 0.00 0.00 -0.26 0.00 0.00 58.87 59.17 2jop n SER 40 Cb 0.47 -0.34 0.00 0.00 -0.26 0.00 0.00 64.21 64.08 2jop n SER 40 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2jop n ASN 41 N -1.93 0.01 -4.73 4.04 4.13 -1.26 -5.09 115.26 110.43 2jop n ASN 41 Ca 0.00 0.00 -0.35 0.00 1.68 0.00 0.00 54.58 55.91 2jop n ASN 41 Cb 0.00 0.00 -0.09 0.00 -1.54 0.00 0.00 39.78 38.15 2jop n ASN 41 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 2jop s SER 42 N -4.41 5.63 0.00 6.41 0.15 -1.26 -4.95 113.70 115.27 2jop s SER 42 Ca 0.00 0.22 0.22 0.00 0.70 0.00 0.00 55.95 57.10 2jop s SER 42 Cb 0.00 -1.74 1.34 0.00 -1.71 0.00 0.00 66.02 63.91 2jop s SER 42 CO 0.00 0.35 1.76 2.29 1.20 0.00 0.00 173.24 178.83 2jop n LYS 43 N 2.37 0.82 -0.19 5.44 2.85 -1.26 -2.49 118.16 125.70 2jop n LYS 43 Ca -0.19 0.00 0.07 0.00 -1.05 0.00 0.00 58.31 57.15 2jop n LYS 43 Cb 0.54 -1.43 0.10 0.00 -0.65 0.00 0.00 35.03 33.59 2jop n LYS 43 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2jop s GLN 45 N -2.08 0.66 0.00 0.00 0.74 -1.04 -0.10 119.66 117.85 2jop s GLN 45 Ca 0.23 1.14 0.00 0.00 0.05 0.00 0.00 55.36 56.78 2jop s GLN 45 Cb 0.20 0.13 0.00 0.00 1.10 0.00 0.00 33.01 34.44 2jop s GLN 45 CO 0.02 -0.15 0.00 0.41 -0.55 0.00 0.00 175.29 175.02 2jop n GLY 46 N 4.22 0.01 3.75 2.59 0.00 0.44 -4.00 105.19 112.18 2jop n GLY 46 Ca -0.20 -1.46 -0.37 0.00 0.00 0.00 0.00 46.02 43.99 2jop n GLY 46 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jop s GLN 47 N -1.78 2.88 -0.24 1.61 -1.52 -1.26 -2.58 119.66 116.77 2jop s GLN 47 Ca 0.00 1.96 -0.28 0.00 -1.95 0.00 0.00 55.36 55.09 2jop s GLN 47 Cb 0.00 -1.96 0.01 0.00 -0.22 0.00 0.00 33.01 30.84 2jop s GLN 47 CO 0.00 -1.32 1.01 -1.17 -0.25 0.00 0.00 175.29 173.56 2jop s LEU 48 N -4.06 4.09 -0.34 2.90 2.96 -1.26 -0.11 118.68 122.86 2jop s LEU 48 Ca 0.78 1.31 -0.09 0.00 -0.22 0.00 0.00 54.13 55.91 2jop s LEU 48 Cb -0.34 -3.48 0.02 0.00 0.50 0.00 0.00 46.19 42.89 2jop s LEU 48 CO 0.37 -0.65 0.15 -0.70 -1.32 0.00 0.00 176.35 174.20 2jop s GLU 49 N 3.15 2.86 -0.07 1.98 2.12 0.14 -0.66 118.70 128.22 2jop s GLU 49 Ca 0.42 -1.03 0.03 0.00 0.36 0.00 0.00 54.97 54.75 2jop s GLU 49 Cb -0.15 -3.57 0.01 0.00 0.26 0.00 0.00 34.13 30.68 2jop s GLU 49 CO 0.07 -0.61 -0.17 0.14 -0.54 0.00 0.00 175.26 174.14 2jop s VAL 50 N 1.50 1.47 -0.44 3.70 -7.23 -0.87 -1.67 120.40 116.85 2jop s VAL 50 Ca 0.01 -0.68 -0.19 0.00 -1.81 0.00 0.00 61.98 59.31 2jop s VAL 50 Cb -0.19 -1.30 0.03 0.00 0.56 0.00 0.00 36.38 35.48 2jop s VAL 50 CO 0.05 0.43 0.56 -0.47 -0.31 0.00 0.00 175.10 175.36 2jop s TYR 51 N 0.46 3.10 -0.12 2.82 5.04 -0.70 -0.14 117.35 127.81 2jop s TYR 51 Ca -0.14 -0.25 -0.14 0.00 -2.44 0.00 0.00 57.07 54.10 2jop s TYR 51 Cb -0.16 -3.20 0.04 0.00 0.35 0.00 0.00 41.96 38.99 2jop s TYR 51 CO 0.05 -0.83 0.38 -0.48 -1.34 0.00 0.00 175.55 173.33 2jop s LEU 52 N 2.53 0.56 0.00 6.97 -0.00 -0.68 -4.50 118.68 123.55 2jop s LEU 52 Ca 0.17 0.66 0.00 0.00 -0.00 0.00 0.00 54.13 54.97 2jop s LEU 52 Cb -0.16 1.34 0.00 0.00 -0.00 0.00 0.00 46.19 47.37 2jop s LEU 52 CO 0.16 -0.19 0.00 1.17 -0.00 0.00 0.00 176.35 177.48 2jop n LYS 53 N 2.57 0.00 0.00 1.48 4.81 -1.26 -1.98 118.16 123.77 2jop n LYS 53 Ca -0.15 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.29 2jop n LYS 53 Cb 0.57 -0.36 0.00 0.00 0.02 0.00 0.00 35.03 35.27 2jop n LYS 53 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 2jop n ASP 54 N 0.88 0.00 -4.47 3.14 5.75 -1.26 -5.15 116.55 115.43 2jop n ASP 54 Ca 0.00 0.00 -0.32 0.00 -0.01 0.00 0.00 54.79 54.46 2jop n ASP 54 Cb 0.00 0.00 -0.13 0.00 -1.03 0.00 0.00 41.12 39.96 2jop n ASP 54 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 2jop s GLY 55 N -0.46 1.54 -1.02 6.12 0.00 -0.84 -4.99 107.32 107.67 2jop s GLY 55 Ca 0.00 -1.03 -0.22 0.00 0.00 0.00 0.00 44.72 43.47 2jop s GLY 55 CO 0.00 -0.85 1.93 0.79 0.00 0.00 0.00 173.10 174.97 2jop n TRP 56 N 2.10 2.52 -2.52 1.90 5.03 -1.26 -1.69 117.44 123.52 2jop n TRP 56 Ca -0.17 -1.76 -0.42 0.00 3.03 0.00 0.00 57.50 58.18 2jop n TRP 56 Cb 0.52 -2.22 -0.03 0.00 -1.03 0.00 0.00 31.31 28.55 2jop n TRP 56 CO 0.00 0.00 0.00 -1.01 -0.03 0.00 0.00 177.69 176.65 2jop s HIS 57 N 7.68 2.45 -0.54 -5.99 3.76 0.80 -4.75 115.29 118.70 2jop s HIS 57 Ca 0.62 0.36 -0.27 0.00 -0.15 0.00 0.00 55.06 55.61 2jop s HIS 57 Cb 0.07 -4.50 -0.00 0.00 1.11 0.00 0.00 32.58 29.26 2jop s HIS 57 CO 0.12 -1.79 1.62 -1.64 -0.85 0.00 0.00 174.74 172.20 2jop s MET 58 N 5.26 3.09 0.81 1.40 -1.94 -1.26 -2.06 119.30 124.60 2jop s MET 58 Ca 0.45 0.67 -0.07 0.00 -1.71 0.00 0.00 55.69 55.02 2jop s MET 58 Cb -0.09 -4.22 0.14 0.00 2.01 0.00 0.00 34.83 32.68 2jop s MET 58 CO 0.24 -2.17 1.12 0.14 -0.01 0.00 0.00 175.02 174.33 2jop s VAL 59 N 7.15 2.11 -0.73 -6.03 -7.23 0.17 -0.49 120.40 115.35 2jop s VAL 59 Ca 0.62 -0.32 0.16 0.00 -1.81 0.00 0.00 61.98 60.63 2jop s VAL 59 Cb -0.13 -2.79 0.68 0.00 0.56 0.00 0.00 36.38 34.69 2jop s VAL 59 CO 0.25 0.00 1.60 0.00 -0.31 0.00 0.00 175.10 176.64 2jop n SER 61 N 0.67 0.00 -0.28 0.00 7.64 -1.26 -3.59 113.62 116.80 2jop n SER 61 Ca 0.24 0.00 0.09 0.00 1.01 0.00 0.00 58.87 60.22 2jop n SER 61 Cb 0.93 0.00 0.43 0.00 -1.01 0.00 0.00 64.21 64.57 2jop n SER 61 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jop n GLN 62 N 0.00 1.37 -0.79 1.43 -0.00 -1.26 -4.89 117.38 113.24 2jop n GLN 62 Ca 0.00 -0.55 -0.32 0.00 -0.00 0.00 0.00 57.00 56.12 2jop n GLN 62 Cb 0.00 -1.33 0.13 0.00 -0.00 0.00 0.00 30.24 29.05 2jop n GLN 62 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 2jop n SER 63 N -0.22 -1.16 0.00 2.61 7.64 -1.26 -0.96 113.62 120.26 2jop n SER 63 Ca 0.14 0.38 0.00 0.00 1.01 0.00 0.00 58.87 60.40 2jop n SER 63 Cb 0.19 -1.30 0.00 0.00 -1.01 0.00 0.00 64.21 62.09 2jop n SER 63 CO 0.00 0.00 0.00 0.79 -3.01 0.00 0.00 175.04 172.82 2jop n TRP 64 N -3.74 0.00 0.20 1.43 8.01 0.85 -4.32 117.44 119.87 2jop n TRP 64 Ca 0.09 0.00 -0.15 0.00 -1.31 0.00 0.00 57.50 56.13 2jop n TRP 64 Cb 0.53 0.00 -0.08 0.00 -2.01 0.00 0.00 31.31 29.75 2jop n TRP 64 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.69 177.46 2jop h GLY 65 N 0.00 -0.48 -3.40 6.99 0.00 -1.79 -3.33 103.07 101.06 2jop h GLY 65 Ca 0.00 0.18 -0.42 0.00 0.00 0.00 0.00 47.33 47.09 2jop h GLY 65 CO 0.00 -0.17 -0.56 0.54 0.00 0.00 0.00 176.54 176.35 2jop n ARG 66 N -5.24 -2.54 0.19 4.80 1.74 -0.14 -4.92 116.66 110.54 2jop n ARG 66 Ca -0.10 0.99 -0.07 0.00 -0.77 0.00 0.00 57.85 57.89 2jop n ARG 66 Cb 0.23 -5.71 -0.03 0.00 -1.02 0.00 0.00 32.46 25.92 2jop n ARG 66 CO 0.00 0.00 0.00 0.77 -1.52 0.00 0.00 177.63 176.88 2jop h SER 67 N -0.37 -0.41 -0.04 0.55 0.02 -1.91 -3.50 113.55 107.90 2jop h SER 67 Ca -0.51 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.46 2jop h SER 67 Cb 1.37 0.10 0.00 0.00 0.14 0.00 0.00 62.40 64.01 2jop h SER 67 CO 0.58 -0.28 0.00 -0.24 -1.14 0.00 0.00 176.83 175.75 2jop n SER 68 N -3.32 0.00 -4.67 3.07 2.88 -1.26 -5.13 113.62 105.20 2jop n SER 68 Ca -0.06 -0.22 -0.41 0.00 -1.33 0.00 0.00 58.87 56.85 2jop n SER 68 Cb 0.19 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.60 2jop n SER 68 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 2jop s LYS 69 N 0.33 4.26 -0.10 -1.46 1.02 -1.26 -4.67 119.74 117.85 2jop s LYS 69 Ca 0.00 0.79 -0.07 0.00 0.02 0.00 0.00 55.97 56.71 2jop s LYS 69 Cb 0.00 -3.56 0.03 0.00 -0.52 0.00 0.00 37.83 33.77 2jop s LYS 69 CO 0.00 -0.25 0.15 0.94 -0.92 0.00 0.00 175.35 175.27 2jop n GLN 70 N 5.01 -3.71 -2.69 1.68 7.27 -1.26 -5.01 117.38 118.67 2jop n GLN 70 Ca 0.01 2.87 -0.29 0.00 0.07 0.00 0.00 57.00 59.66 2jop n GLN 70 Cb 0.49 -4.06 -0.01 0.00 2.41 0.00 0.00 30.24 29.07 2jop n GLN 70 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 2jop s TRP 71 N -0.50 3.53 0.21 3.69 0.52 -1.26 -4.99 118.94 120.15 2jop s TRP 71 Ca -0.17 0.92 -0.05 0.00 0.02 0.00 0.00 56.10 56.82 2jop s TRP 71 Cb 0.01 -2.37 0.19 0.00 -1.15 0.00 0.00 33.47 30.15 2jop s TRP 71 CO 0.46 -0.23 1.63 1.05 0.02 0.00 0.00 176.95 179.89 2jop h GLU 72 N 0.61 0.79 -1.44 4.98 4.11 -1.94 -3.42 114.58 118.27 2jop h GLU 72 Ca -0.47 -0.31 -0.16 0.00 0.07 0.00 0.00 59.36 58.49 2jop h GLU 72 Cb 1.20 -0.04 -0.25 0.00 0.50 0.00 0.00 28.75 30.16 2jop h GLU 72 CO 0.63 0.93 -0.52 0.34 0.07 0.00 0.00 179.01 180.45 2jop s ASP 73 N -6.74 -0.32 -0.34 3.06 2.15 -1.26 -5.03 116.67 108.20 2jop s ASP 73 Ca -0.09 -0.68 0.00 0.00 0.43 0.00 0.00 52.55 52.21 2jop s ASP 73 Cb 0.13 1.38 0.32 0.00 -0.30 0.00 0.00 42.92 44.45 2jop s ASP 73 CO 0.84 -0.27 1.81 -0.81 -0.17 0.00 0.00 175.17 176.57 2jop n PRO 74 N 4.84 1.88 0.00 4.34 -0.04 -1.26 -4.85 135.00 139.91 2jop n PRO 74 Ca 0.07 -1.86 0.00 0.00 -0.04 0.00 0.00 63.50 61.67 2jop n PRO 74 Cb 0.51 -1.73 0.00 0.00 -0.04 0.00 0.00 33.50 32.24 2jop n PRO 74 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2jop n SER 75 N -0.16 0.00 0.00 3.54 3.41 -1.26 -4.71 113.62 114.43 2jop n SER 75 Ca 0.36 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.97 2jop n SER 75 Cb 0.86 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.81 2jop n SER 75 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jop n GLN 76 N 0.00 0.00 -0.75 4.33 1.13 -1.26 -4.57 117.38 116.25 2jop n GLN 76 Ca 0.00 0.00 -0.07 0.00 -1.94 0.00 0.00 57.00 54.99 2jop n GLN 76 Cb 0.00 0.00 -0.06 0.00 0.11 0.00 0.00 30.24 30.29 2jop n GLN 76 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2jop n ALA 77 N 0.00 5.03 -0.16 -1.58 0.00 -1.26 -4.50 120.51 118.04 2jop n ALA 77 Ca 0.00 -0.92 -0.04 0.00 0.00 0.00 0.00 53.44 52.48 2jop n ALA 77 Cb 0.00 -1.54 0.05 0.00 0.00 0.00 0.00 19.45 17.96 2jop n ALA 77 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2jop h SER 78 N 1.82 0.35 -0.18 0.00 0.02 -1.86 -1.10 113.55 112.60 2jop h SER 78 Ca 0.11 0.03 -0.03 0.00 -0.84 0.00 0.00 61.79 61.06 2jop h SER 78 Cb 1.16 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 63.65 2jop h SER 78 CO 0.19 0.24 0.02 0.50 -1.14 0.00 0.00 176.83 176.64 2jop h LYS 79 N 0.48 0.40 0.93 3.45 3.11 -1.89 -1.37 116.57 121.68 2jop h LYS 79 Ca 0.22 -0.07 -0.05 0.00 -2.81 0.00 0.00 60.65 57.95 2jop h LYS 79 Cb 0.14 -0.07 0.01 0.00 -1.00 0.00 0.00 32.23 31.31 2jop h LYS 79 CO -0.16 0.42 -0.45 0.28 -2.81 0.00 0.00 179.45 176.73 2jop h VAL 80 N 0.40 0.00 -0.02 2.00 2.07 -1.49 0.21 116.25 119.41 2jop h VAL 80 Ca 0.09 -0.03 -0.12 0.00 0.82 0.00 0.00 66.70 67.46 2jop h VAL 80 Cb 0.23 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 29.99 2jop h VAL 80 CO 0.00 0.00 -0.53 0.00 0.02 0.00 0.00 177.57 177.06 2jop h GLN 82 N 0.05 1.20 0.00 0.00 4.15 -1.05 0.23 115.11 119.69 2jop h GLN 82 Ca -0.00 -0.16 -0.03 0.00 0.77 0.00 0.00 58.65 59.23 2jop h GLN 82 Cb 0.96 -0.23 -0.00 0.00 0.21 0.00 0.00 27.48 28.42 2jop h GLN 82 CO 0.07 0.90 -0.15 -0.09 -1.93 0.00 0.00 178.83 177.63 2jop h ARG 83 N 1.19 0.00 -0.64 1.69 2.43 -0.10 0.19 114.38 119.15 2jop h ARG 83 Ca 0.30 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.47 2jop h ARG 83 Cb 0.07 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.62 2jop h ARG 83 CO -0.04 0.15 0.00 1.28 -1.51 0.00 0.00 179.97 179.85 2jop n LEU 84 N -3.36 4.09 -4.27 3.80 4.32 -0.62 -4.94 117.00 116.02 2jop n LEU 84 Ca -0.00 -2.06 -0.34 0.00 -0.02 0.00 0.00 56.01 53.58 2jop n LEU 84 Cb 0.36 -0.53 -0.06 0.00 -1.62 0.00 0.00 43.42 41.57 2jop n LEU 84 CO 0.31 0.70 -0.20 -0.46 -1.22 0.00 0.00 177.39 176.51 2jop n ASN 85 N 0.93 -1.37 -0.87 -1.43 0.23 0.05 -4.84 115.26 107.97 2jop n ASN 85 Ca 0.22 -1.13 0.08 0.00 -0.53 0.00 0.00 54.58 53.22 2jop n ASN 85 Cb 0.77 -2.27 0.24 0.00 -2.08 0.00 0.00 39.78 36.44 2jop n ASN 85 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2jop n GLY 87 N -0.28 0.65 3.88 0.00 0.00 -1.25 -4.33 105.19 103.86 2jop n GLY 87 Ca 0.20 -1.18 -0.29 0.00 0.00 0.00 0.00 46.02 44.74 2jop n GLY 87 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jop s ASP 88 N -4.00 3.68 0.44 1.61 1.11 -1.26 -2.75 116.67 115.50 2jop s ASP 88 Ca 0.00 0.61 -0.24 0.00 0.18 0.00 0.00 52.55 53.10 2jop s ASP 88 Cb 0.00 -0.93 -0.08 0.00 1.07 0.00 0.00 42.92 42.98 2jop s ASP 88 CO 0.00 -2.41 1.15 -2.16 1.18 0.00 0.00 175.17 172.93 2jop s PRO 89 N -5.65 3.87 -0.31 8.23 0.04 -1.26 -0.52 135.00 139.41 2jop s PRO 89 Ca 0.67 1.76 -0.29 0.00 0.04 0.00 0.00 61.00 63.19 2jop s PRO 89 Cb -0.09 -2.48 -0.12 0.00 0.04 0.00 0.00 34.50 31.85 2jop s PRO 89 CO 0.51 -0.45 1.03 1.47 0.04 0.00 0.00 177.00 179.60 2jop n LEU 90 N -0.31 0.71 -4.82 -3.56 -0.00 -1.25 -0.78 117.00 107.00 2jop n LEU 90 Ca 0.06 0.69 -0.29 0.00 -0.00 0.00 0.00 56.01 56.47 2jop n LEU 90 Cb 0.48 -0.54 0.10 0.00 -0.00 0.00 0.00 43.42 43.45 2jop n LEU 90 CO 0.48 -0.51 0.73 -0.55 -0.00 0.00 0.00 177.39 177.53 2jop s SER 91 N 2.08 4.30 -0.09 1.45 0.15 0.67 -4.44 113.70 117.82 2jop s SER 91 Ca 0.66 1.13 0.02 0.00 0.70 0.00 0.00 55.95 58.45 2jop s SER 91 Cb -0.92 -1.79 0.02 0.00 -1.71 0.00 0.00 66.02 61.61 2jop s SER 91 CO 0.49 -2.07 -0.12 -0.22 1.20 0.00 0.00 173.24 172.52 2jop s LEU 92 N -5.79 1.58 -0.04 3.45 2.96 -1.26 -0.41 118.68 119.17 2jop s LEU 92 Ca 0.62 -0.35 -0.27 0.00 -0.22 0.00 0.00 54.13 53.91 2jop s LEU 92 Cb -0.14 -0.93 0.06 0.00 0.50 0.00 0.00 46.19 45.68 2jop s LEU 92 CO 0.53 -0.00 0.58 -0.83 -1.32 0.00 0.00 176.35 175.31 2jop s GLY 93 N 0.99 -0.47 -0.06 7.98 0.00 -0.45 -4.24 107.32 111.07 2jop s GLY 93 Ca -0.08 1.07 -0.29 0.00 0.00 0.00 0.00 44.72 45.42 2jop s GLY 93 CO -0.01 0.75 2.07 -4.14 0.00 0.00 0.00 173.10 171.78 2jop s PRO 94 N -1.20 3.74 -0.73 2.90 0.02 -1.26 0.07 135.00 138.54 2jop s PRO 94 Ca -0.11 2.39 -0.02 0.00 0.02 0.00 0.00 61.00 63.28 2jop s PRO 94 Cb -0.01 -4.25 0.41 0.00 0.02 0.00 0.00 34.50 30.67 2jop s PRO 94 CO 0.08 -1.41 2.02 0.34 -0.33 0.00 0.00 177.00 177.71 2jop n PHE 95 N 9.18 3.14 0.00 6.54 7.35 -0.81 -4.79 117.46 138.07 2jop n PHE 95 Ca 0.24 -2.76 0.00 0.00 -0.76 0.00 0.00 57.45 54.16 2jop n PHE 95 Cb 0.43 -1.34 0.00 0.00 0.35 0.00 0.00 39.48 38.92 2jop n PHE 95 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 2jop n LEU 96 N -0.77 0.00 -3.25 -2.13 4.77 -1.26 -4.25 117.00 110.11 2jop n LEU 96 Ca 0.59 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 56.56 2jop n LEU 96 Cb 0.50 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.56 2jop n LEU 96 CO 0.68 0.00 0.09 -0.75 -1.33 0.00 0.00 177.39 176.08 2jop s LYS 97 N 0.00 0.49 0.00 3.23 2.20 -1.26 -4.64 119.74 119.75 2jop s LYS 97 Ca 0.00 0.87 0.00 0.00 -0.36 0.00 0.00 55.97 56.48 2jop s LYS 97 Cb 0.00 0.21 0.00 0.00 -1.51 0.00 0.00 37.83 36.53 2jop s LYS 97 CO 0.00 -0.60 0.93 0.25 -0.36 0.00 0.00 175.35 175.56 2jop n THR 98 N 5.41 0.00 -4.46 3.43 -2.24 -1.26 -5.11 114.28 110.05 2jop n THR 98 Ca -0.02 0.00 -0.23 0.00 -2.27 0.00 0.00 64.05 61.53 2jop n THR 98 Cb 0.51 0.45 -0.09 0.00 -2.10 0.00 0.00 70.33 69.09 2jop n THR 98 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 2jop s TYR 99 N 0.00 1.81 -0.15 4.78 1.13 -1.26 -4.80 117.35 118.87 2jop s TYR 99 Ca 0.00 -1.15 0.02 0.00 -1.41 0.00 0.00 57.07 54.53 2jop s TYR 99 Cb 0.00 -1.16 0.01 0.00 -1.10 0.00 0.00 41.96 39.71 2jop s TYR 99 CO 0.00 -0.19 -0.19 0.99 -2.51 0.00 0.00 175.55 173.64 2jop s THR 100 N -3.33 1.89 -0.26 -3.49 2.01 -1.26 -5.01 115.64 106.19 2jop s THR 100 Ca 0.31 -0.86 -0.04 0.00 0.31 0.00 0.00 61.69 61.40 2jop s THR 100 Cb 0.06 -1.70 -0.13 0.00 0.01 0.00 0.00 72.50 70.74 2jop s THR 100 CO 0.15 0.52 2.28 -0.81 -0.69 0.00 0.00 174.62 176.06 2jop n PRO 101 N 4.33 1.44 0.12 4.92 -0.04 -1.26 -0.82 135.00 143.69 2jop n PRO 101 Ca -0.20 -0.84 0.00 0.00 -0.04 0.00 0.00 63.50 62.43 2jop n PRO 101 Cb 0.51 -1.98 0.00 0.00 -0.04 0.00 0.00 33.50 31.99 2jop n PRO 101 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2jop n GLN 102 N 3.11 0.00 0.06 0.54 7.27 -1.25 -4.83 117.38 122.28 2jop n GLN 102 Ca 0.31 0.00 -0.21 0.00 0.07 0.00 0.00 57.00 57.17 2jop n GLN 102 Cb 0.43 0.00 -0.12 0.00 2.41 0.00 0.00 30.24 32.96 2jop n GLN 102 CO 0.00 0.00 0.00 0.77 0.07 0.00 0.00 177.06 177.90 2jop h SER 103 N 0.00 0.89 -4.15 1.69 0.02 -1.91 -3.43 113.55 106.66 2jop h SER 103 Ca 0.00 -0.78 -0.48 0.00 -0.84 0.00 0.00 61.79 59.69 2jop h SER 103 Cb 0.00 -0.28 0.04 0.00 0.14 0.00 0.00 62.40 62.30 2jop h SER 103 CO 0.00 1.57 0.38 -0.44 -1.14 0.00 0.00 176.83 177.19 2jop s SER 104 N -7.34 6.23 0.15 3.07 0.01 0.00 -4.64 113.70 111.19 2jop s SER 104 Ca -0.10 1.78 0.05 0.00 1.31 0.00 0.00 55.95 58.99 2jop s SER 104 Cb 0.06 -2.53 -0.04 0.00 0.21 0.00 0.00 66.02 63.71 2jop s SER 104 CO 0.92 -0.86 -0.11 0.27 0.41 0.00 0.00 173.24 173.87 2jop s ILE 105 N -2.35 1.29 -0.29 1.44 -5.25 0.36 -2.21 121.20 114.19 2jop s ILE 105 Ca 0.63 -2.04 0.03 0.00 -0.99 0.00 0.00 60.65 58.28 2jop s ILE 105 Cb -0.14 -1.84 0.08 0.00 2.95 0.00 0.00 42.46 43.51 2jop s ILE 105 CO 0.29 -0.68 -0.04 -0.63 -1.79 0.00 0.00 174.94 172.10 2jop s ILE 106 N -3.10 2.11 0.63 8.37 1.01 0.57 -2.63 121.20 128.17 2jop s ILE 106 Ca 0.17 -1.86 -0.08 0.00 0.00 0.00 0.00 60.65 58.87 2jop s ILE 106 Cb 0.01 -2.37 0.01 0.00 0.01 0.00 0.00 42.46 40.12 2jop s ILE 106 CO 0.02 -0.27 0.98 0.00 0.00 0.00 0.00 174.94 175.67 2jop n TYR 108 N -2.75 -0.16 0.00 0.00 4.01 -1.25 -0.10 117.16 116.89 2jop n TYR 108 Ca 0.05 -1.19 0.00 0.00 -0.16 0.00 0.00 57.90 56.61 2jop n TYR 108 Cb 0.57 0.07 0.00 0.00 -0.31 0.00 0.00 39.34 39.67 2jop n TYR 108 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2jop n GLY 109 N 0.27 0.78 3.78 2.72 0.00 -1.25 -4.46 105.19 107.03 2jop n GLY 109 Ca 0.01 -1.52 -0.34 0.00 0.00 0.00 0.00 46.02 44.17 2jop n GLY 109 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jop s GLN 110 N 0.00 3.09 -0.02 1.61 1.11 -1.26 -4.54 119.66 119.65 2jop s GLN 110 Ca 0.00 -0.44 -0.30 0.00 0.01 0.00 0.00 55.36 54.63 2jop s GLN 110 Cb 0.00 -2.88 -0.08 0.00 -1.01 0.00 0.00 33.01 29.04 2jop s GLN 110 CO 0.00 0.67 1.93 -1.17 0.01 0.00 0.00 175.29 176.73 2jop s LEU 111 N -1.56 4.28 0.00 2.90 2.96 -1.26 -1.20 118.68 124.80 2jop s LEU 111 Ca 0.21 2.47 0.00 0.00 -0.22 0.00 0.00 54.13 56.58 2jop s LEU 111 Cb -0.12 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 43.04 2jop s LEU 111 CO 0.11 -1.15 0.00 0.61 -1.32 0.00 0.00 176.35 174.60 2jop n GLY 112 N 4.63 2.81 3.23 7.98 0.00 -1.26 -4.99 105.19 117.59 2jop n GLY 112 Ca 0.21 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.80 2jop n GLY 112 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2jop n SER 113 N 0.00 4.91 -2.07 1.61 7.64 -0.34 -3.90 113.62 121.47 2jop n SER 113 Ca 0.00 -2.97 -0.13 0.00 1.01 0.00 0.00 58.87 56.78 2jop n SER 113 Cb 0.00 -1.61 -0.16 0.00 -1.01 0.00 0.00 64.21 61.43 2jop n SER 113 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2jop n PHE 114 N 5.98 0.10 0.22 1.43 3.01 0.52 -3.94 117.46 124.78 2jop n PHE 114 Ca 0.43 -1.51 0.03 0.00 1.01 0.00 0.00 57.45 57.40 2jop n PHE 114 Cb 0.41 -1.60 0.02 0.00 -0.01 0.00 0.00 39.48 38.31 2jop n PHE 114 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 2jop n SER 115 N 2.56 1.45 -3.64 4.37 7.64 -1.26 -4.43 113.62 120.31 2jop n SER 115 Ca 0.43 -1.22 -0.10 0.00 1.01 0.00 0.00 58.87 58.99 2jop n SER 115 Cb 0.86 -0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.99 2jop n SER 115 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 2jop s ASN 116 N -0.44 -0.62 0.26 6.43 3.84 -1.25 -5.08 114.94 118.07 2jop s ASN 116 Ca 0.06 1.14 0.03 0.00 0.21 0.00 0.00 52.86 54.31 2jop s ASN 116 Cb 0.04 1.18 -0.01 0.00 -0.55 0.00 0.00 41.25 41.91 2jop s ASN 116 CO 0.07 -0.19 0.27 0.00 -2.79 0.00 0.00 177.10 174.45 2jop s SER 118 N -2.72 -0.05 0.44 0.00 0.15 -0.95 -4.86 113.70 105.71 2jop s SER 118 Ca 0.27 -0.97 -0.22 0.00 0.70 0.00 0.00 55.95 55.74 2jop s SER 118 Cb 0.01 0.54 -0.10 0.00 -1.71 0.00 0.00 66.02 64.76 2jop s SER 118 CO 0.19 -1.06 1.00 -1.00 1.20 0.00 0.00 173.24 173.58 2jop s HIS 119 N -4.03 3.21 -0.14 3.44 3.76 -1.26 -0.31 115.29 119.97 2jop s HIS 119 Ca 0.24 1.62 -0.27 0.00 -0.15 0.00 0.00 55.06 56.50 2jop s HIS 119 Cb 0.01 -3.00 -0.01 0.00 1.11 0.00 0.00 32.58 30.69 2jop s HIS 119 CO 0.08 -0.46 0.90 0.45 -0.85 0.00 0.00 174.74 174.85 2jop s SER 120 N -1.92 7.08 0.00 1.40 0.15 -0.94 -4.17 113.70 115.30 2jop s SER 120 Ca 0.62 1.32 -0.00 0.00 0.70 0.00 0.00 55.95 58.59 2jop s SER 120 Cb -0.15 -2.49 -0.00 0.00 -1.71 0.00 0.00 66.02 61.66 2jop s SER 120 CO 0.20 -0.41 -0.00 0.54 1.20 0.00 0.00 173.24 174.77 2jop n ARG 121 N 5.07 0.00 -3.15 5.44 5.12 -1.26 -3.88 116.66 124.00 2jop n ARG 121 Ca 0.06 0.00 0.06 0.00 -1.93 0.00 0.00 57.85 56.04 2jop n ARG 121 Cb 0.49 -0.03 -0.01 0.00 -1.16 0.00 0.00 32.46 31.75 2jop n ARG 121 CO 0.00 0.00 0.00 1.21 -1.93 0.00 0.00 177.63 176.91 2jop s ASN 122 N -4.96 -0.14 0.00 0.55 3.04 -1.26 -4.94 114.94 107.23 2jop s ASN 122 Ca -0.00 0.06 0.00 0.00 0.04 0.00 0.00 52.86 52.96 2jop s ASN 122 Cb 0.00 1.11 0.00 0.00 -1.54 0.00 0.00 41.25 40.82 2jop s ASN 122 CO 0.00 -0.03 0.00 -0.67 -3.04 0.00 0.00 177.10 173.36 2jop n ASP 123 N 5.33 0.00 0.24 -4.21 2.03 -1.26 -4.98 116.55 113.69 2jop n ASP 123 Ca -0.02 0.00 0.08 0.00 0.52 0.00 0.00 54.79 55.37 2jop n ASP 123 Cb 0.56 0.00 0.60 0.00 -0.72 0.00 0.00 41.12 41.56 2jop n ASP 123 CO 0.00 0.00 0.00 0.24 -1.92 0.00 0.00 177.20 175.52 2jop h MET 124 N 0.00 0.00 -5.20 -0.67 2.86 -1.98 -3.38 114.93 106.56 2jop h MET 124 Ca 0.00 0.00 -0.67 0.00 -2.06 0.00 0.00 59.70 56.97 2jop h MET 124 Cb 0.00 0.00 -0.16 0.00 0.06 0.00 0.00 31.60 31.50 2jop h MET 124 CO 0.00 0.16 0.74 0.00 1.06 0.00 0.00 176.91 178.87 2jop n HIS 126 N 7.04 3.11 -3.36 0.00 -0.00 -1.26 -4.59 115.22 116.16 2jop n HIS 126 Ca 0.14 -2.88 -0.21 0.00 0.46 0.00 0.00 57.72 55.23 2jop n HIS 126 Cb 0.48 -2.21 0.01 0.00 -0.12 0.00 0.00 29.99 28.15 2jop n HIS 126 CO 0.00 0.00 0.00 -1.13 0.46 0.00 0.00 176.34 175.67 2jop n SER 127 N 4.58 -6.30 -4.75 0.26 3.41 -1.26 -4.50 113.62 105.07 2jop n SER 127 Ca 0.48 -0.21 -0.41 0.00 -0.26 0.00 0.00 58.87 58.48 2jop n SER 127 Cb 0.36 -3.16 -0.04 0.00 -0.26 0.00 0.00 64.21 61.11 2jop n SER 127 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2jop s LEU 128 N -3.45 4.50 -0.15 1.04 1.43 -1.24 -1.92 118.68 118.89 2jop s LEU 128 Ca 0.18 2.20 -0.04 0.00 -1.03 0.00 0.00 54.13 55.44 2jop s LEU 128 Cb -0.03 -3.61 -0.03 0.00 0.03 0.00 0.00 46.19 42.55 2jop s LEU 128 CO 0.84 -0.24 -0.02 -0.83 0.23 0.00 0.00 176.35 176.33 2jop s GLY 129 N -0.31 1.75 -0.04 -3.19 0.00 0.11 -4.45 107.32 101.19 2jop s GLY 129 Ca 0.49 -0.81 -0.06 0.00 0.00 0.00 0.00 44.72 44.34 2jop s GLY 129 CO 0.38 -0.12 0.20 1.08 0.00 0.00 0.00 173.10 174.64 2jop s LEU 130 N 0.22 4.38 -0.22 0.66 1.43 -1.07 -1.35 118.68 122.74 2jop s LEU 130 Ca -0.01 0.47 -0.03 0.00 -1.03 0.00 0.00 54.13 53.52 2jop s LEU 130 Cb -0.14 -2.45 0.10 0.00 0.03 0.00 0.00 46.19 43.73 2jop s LEU 130 CO 0.03 0.31 0.23 0.28 0.23 0.00 0.00 176.35 177.43 2jop s THR 131 N -1.21 -0.33 -0.45 5.49 -1.32 0.45 -0.42 115.64 117.85 2jop s THR 131 Ca 0.23 -0.22 -0.38 0.00 -1.21 0.00 0.00 61.69 60.11 2jop s THR 131 Cb -0.13 -0.76 -0.15 0.00 -1.51 0.00 0.00 72.50 69.96 2jop s THR 131 CO 0.13 -0.28 2.21 0.00 -2.21 0.00 0.00 174.62 174.47 2jop n LEU 133 N 9.16 0.00 0.00 0.00 7.94 0.33 -4.60 117.00 129.83 2jop n LEU 133 Ca 0.48 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.38 2jop n LEU 133 Cb 0.12 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.07 2jop n LEU 133 CO 0.82 0.00 0.00 -1.84 -1.11 0.00 0.00 177.39 175.26