#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 3.46 -0.04 6.15 1.43 -1.26 -4.73 118.68 123.69 2jop s LEU 26 Ca 0.00 -1.61 -0.07 0.00 -1.03 0.00 0.00 54.13 51.42 2jop s LEU 26 Cb 0.00 -2.57 0.01 0.00 0.03 0.00 0.00 46.19 43.66 2jop s LEU 26 CO 0.00 -1.90 0.17 -0.94 0.23 0.00 0.00 176.35 173.92 2jop s SER 27 N 5.60 -0.11 0.00 2.29 1.04 -1.26 -0.15 113.70 121.11 2jop s SER 27 Ca 0.56 0.15 0.00 0.00 0.48 0.00 0.00 55.95 57.14 2jop s SER 27 Cb -0.00 0.31 0.00 0.00 0.10 0.00 0.00 66.02 66.43 2jop s SER 27 CO 0.00 -0.20 0.52 -2.67 0.98 0.00 0.00 173.24 171.87 2jop n TRP 28 N 2.33 0.00 -0.74 5.02 4.27 -1.26 -1.16 117.44 125.91 2jop n TRP 28 Ca -0.17 -0.12 0.00 0.00 -3.89 0.00 0.00 57.50 53.32 2jop n TRP 28 Cb 0.57 -0.12 0.00 0.00 -1.36 0.00 0.00 31.31 30.40 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 0.26 0.00 -2.99 -2.67 0.18 -1.26 -4.47 117.16 106.20 2jop n TYR 29 Ca 0.00 -0.13 -0.39 0.00 1.88 0.00 0.00 57.90 59.26 2jop n TYR 29 Cb 0.26 -0.01 -0.06 0.00 -0.38 0.00 0.00 39.34 39.15 2jop n TYR 29 CO 0.00 0.00 0.00 0.34 -2.08 0.00 0.00 176.86 175.12 2jop s ASP 30 N -0.25 7.34 0.64 9.48 -1.08 -0.30 -4.96 116.67 127.54 2jop s ASP 30 Ca 0.00 1.63 0.39 0.00 -0.52 0.00 0.00 52.55 54.05 2jop s ASP 30 Cb 0.00 -2.49 2.20 0.00 -1.46 0.00 0.00 42.92 41.17 2jop s ASP 30 CO 0.00 0.17 2.33 -0.65 0.52 0.00 0.00 175.17 177.54 2jop h PRO 31 N 4.13 0.00 -0.35 4.34 0.11 -1.91 -1.93 132.00 136.39 2jop h PRO 31 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2jop h PRO 31 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2jop h PRO 31 CO 0.66 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.20 2jop n ASP 32 N -3.38 4.12 -4.39 -2.05 8.00 -1.26 -4.94 116.55 112.65 2jop n ASP 32 Ca -0.03 -2.82 -0.34 0.00 0.71 0.00 0.00 54.79 52.30 2jop n ASP 32 Cb 0.08 -0.53 -0.13 0.00 -0.02 0.00 0.00 41.12 40.51 2jop n ASP 32 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 2jop s PHE 33 N -2.50 2.96 -0.14 1.24 2.19 -0.73 -5.05 117.98 115.96 2jop s PHE 33 Ca 0.42 -0.64 -0.11 0.00 0.33 0.00 0.00 56.93 56.93 2jop s PHE 33 Cb 0.32 -2.02 -0.05 0.00 -1.31 0.00 0.00 43.02 39.96 2jop s PHE 33 CO 0.12 -0.31 0.24 -0.65 1.83 0.00 0.00 175.22 176.45 2jop s GLN 34 N 0.94 3.99 -0.07 10.12 1.11 -1.26 -4.81 119.66 129.69 2jop s GLN 34 Ca -0.00 0.02 -0.22 0.00 0.01 0.00 0.00 55.36 55.17 2jop s GLN 34 Cb -0.15 -3.34 0.05 0.00 -1.01 0.00 0.00 33.01 28.57 2jop s GLN 34 CO 0.01 0.45 0.50 0.00 0.01 0.00 0.00 175.29 176.26 2jop s ALA 35 N -0.15 -1.27 -0.02 6.09 0.00 -1.26 -0.40 121.76 124.74 2jop s ALA 35 Ca 0.15 0.96 -0.24 0.00 0.00 0.00 0.00 51.96 52.84 2jop s ALA 35 Cb -0.13 -0.17 0.08 0.00 0.00 0.00 0.00 23.12 22.90 2jop s ALA 35 CO 0.04 -0.30 1.08 2.89 0.00 0.00 0.00 175.76 179.47 2jop n ARG 36 N 1.49 0.15 -3.67 0.00 1.85 -0.86 -4.91 116.66 110.72 2jop n ARG 36 Ca -0.19 -0.65 -0.20 0.00 -1.00 0.00 0.00 57.85 55.81 2jop n ARG 36 Cb 0.56 1.07 -0.01 0.00 -1.05 0.00 0.00 32.46 33.03 2jop n ARG 36 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 2jop s LEU 37 N 0.00 4.12 0.00 2.89 1.43 -1.26 -0.17 118.68 125.68 2jop s LEU 37 Ca 0.25 -0.01 0.00 0.00 -1.03 0.00 0.00 54.13 53.35 2jop s LEU 37 Cb -0.01 -2.86 0.00 0.00 0.03 0.00 0.00 46.19 43.36 2jop s LEU 37 CO -0.01 -0.27 0.00 0.35 0.23 0.00 0.00 176.35 176.65 2jop n THR 38 N -1.57 0.00 -0.64 5.49 -2.24 -0.47 -4.82 114.28 110.03 2jop n THR 38 Ca -0.04 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.67 2jop n THR 38 Cb 0.57 -0.82 -0.10 0.00 -2.10 0.00 0.00 70.33 67.89 2jop n THR 38 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2jop n ARG 39 N -0.41 1.27 -0.09 -0.78 5.12 -1.26 -4.05 116.66 116.46 2jop n ARG 39 Ca 0.00 -0.57 -0.18 0.00 -1.93 0.00 0.00 57.85 55.17 2jop n ARG 39 Cb 0.00 -1.72 -0.11 0.00 -1.16 0.00 0.00 32.46 29.47 2jop n ARG 39 CO 0.00 0.00 0.00 0.77 -1.93 0.00 0.00 177.63 176.47 2jop h SER 40 N 3.49 0.00 0.00 0.55 0.02 -1.92 -3.48 113.55 112.21 2jop h SER 40 Ca 0.11 -0.62 0.00 0.00 -0.84 0.00 0.00 61.79 60.44 2jop h SER 40 Cb 1.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.54 2jop h SER 40 CO 0.25 1.29 0.00 -3.20 -1.14 0.00 0.00 176.83 174.03 2jop n ASN 41 N -4.50 -2.00 -2.86 3.07 5.15 -1.17 -4.98 115.26 107.97 2jop n ASN 41 Ca -0.24 0.58 -0.07 0.00 -0.60 0.00 0.00 54.58 54.25 2jop n ASN 41 Cb 0.59 1.99 0.03 0.00 -0.53 0.00 0.00 39.78 41.86 2jop n ASN 41 CO 0.00 0.00 0.00 -0.24 1.40 0.00 0.00 177.26 178.42 2jop n SER 42 N -3.26 -2.08 0.25 1.20 2.88 0.65 -4.98 113.62 108.30 2jop n SER 42 Ca 0.00 -2.36 0.14 0.00 -1.33 0.00 0.00 58.87 55.32 2jop n SER 42 Cb 0.00 3.44 0.61 0.00 -0.75 0.00 0.00 64.21 67.52 2jop n SER 42 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2jop h LYS 43 N 0.00 0.00 -0.39 -1.46 1.79 -1.89 -2.68 116.57 111.93 2jop h LYS 43 Ca -0.31 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.16 2jop h LYS 43 Cb 1.19 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.84 2jop h LYS 43 CO 0.40 0.11 0.00 0.00 -1.08 0.00 0.00 179.45 178.88 2jop s GLN 45 N -1.02 0.57 0.00 0.00 0.74 -1.01 -0.39 119.66 118.56 2jop s GLN 45 Ca 0.28 1.31 0.00 0.00 0.05 0.00 0.00 55.36 57.00 2jop s GLN 45 Cb 0.15 0.57 0.00 0.00 1.10 0.00 0.00 33.01 34.82 2jop s GLN 45 CO 0.19 -0.19 0.00 0.41 -0.55 0.00 0.00 175.29 175.15 2jop n GLY 46 N 5.08 -0.28 3.76 2.59 0.00 -0.82 -0.25 105.19 115.27 2jop n GLY 46 Ca -0.14 -1.30 -0.39 0.00 0.00 0.00 0.00 46.02 44.18 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 -1.97 4.55 -0.17 1.61 -1.52 -1.26 -3.49 119.66 117.42 2jop s GLN 47 Ca 0.00 1.70 -0.28 0.00 -1.95 0.00 0.00 55.36 54.83 2jop s GLN 47 Cb 0.00 -3.05 -0.00 0.00 -0.22 0.00 0.00 33.01 29.74 2jop s GLN 47 CO 0.00 0.17 0.98 -1.17 -0.25 0.00 0.00 175.29 175.01 2jop s LEU 48 N -1.70 4.18 -0.25 2.90 2.96 -1.26 -1.37 118.68 124.14 2jop s LEU 48 Ca 0.47 1.39 -0.04 0.00 -0.22 0.00 0.00 54.13 55.73 2jop s LEU 48 Cb -0.29 -3.48 0.00 0.00 0.50 0.00 0.00 46.19 42.93 2jop s LEU 48 CO 0.37 -0.52 -0.01 -0.70 -1.32 0.00 0.00 176.35 174.17 2jop s GLU 49 N 2.48 3.21 -0.03 1.98 2.12 0.76 -0.37 118.70 128.85 2jop s GLU 49 Ca 0.44 -0.75 0.07 0.00 0.36 0.00 0.00 54.97 55.10 2jop s GLU 49 Cb -0.17 -3.11 -0.02 0.00 0.26 0.00 0.00 34.13 31.09 2jop s GLU 49 CO 0.12 -0.30 -0.24 0.14 -0.54 0.00 0.00 175.26 174.45 2jop s VAL 50 N 1.46 2.26 -0.65 3.70 -7.23 -0.12 -2.02 120.40 117.81 2jop s VAL 50 Ca 0.04 -1.03 -0.18 0.00 -1.81 0.00 0.00 61.98 59.00 2jop s VAL 50 Cb -0.15 -1.81 0.13 0.00 0.56 0.00 0.00 36.38 35.11 2jop s VAL 50 CO -0.02 0.58 0.72 -0.47 -0.31 0.00 0.00 175.10 175.60 2jop s TYR 51 N -0.63 3.16 0.01 2.82 5.04 0.46 -0.16 117.35 128.05 2jop s TYR 51 Ca 0.10 -1.20 0.02 0.00 -2.44 0.00 0.00 57.07 53.55 2jop s TYR 51 Cb -0.10 -3.98 -0.01 0.00 0.35 0.00 0.00 41.96 38.22 2jop s TYR 51 CO -0.01 -1.22 -0.06 -0.48 -1.34 0.00 0.00 175.55 172.43 2jop s LEU 52 N 2.15 2.06 0.00 6.97 -0.00 -0.86 -4.16 118.68 124.84 2jop s LEU 52 Ca 0.13 -0.20 0.00 0.00 -0.00 0.00 0.00 54.13 54.06 2jop s LEU 52 Cb -0.22 -0.29 0.00 0.00 -0.00 0.00 0.00 46.19 45.69 2jop s LEU 52 CO 0.02 0.02 0.00 1.17 -0.00 0.00 0.00 176.35 177.56 2jop n LYS 53 N 2.64 0.00 0.00 1.48 4.81 -1.26 -1.12 118.16 124.71 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 -0.16 0.00 0.00 0.02 0.00 0.00 35.03 35.46 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 1.15 0.00 -4.64 3.14 5.68 -1.26 -5.12 116.55 115.50 2jop n ASP 54 Ca 0.00 0.00 -0.42 0.00 -0.50 0.00 0.00 54.79 53.87 2jop n ASP 54 Cb 0.00 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 39.95 2jop n ASP 54 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 2jop s GLY 55 N 0.00 1.67 -1.04 6.12 0.00 -0.28 -4.95 107.32 108.84 2jop s GLY 55 Ca 0.00 -0.12 -0.24 0.00 0.00 0.00 0.00 44.72 44.36 2jop s GLY 55 CO 0.00 2.02 1.96 -0.98 0.00 0.00 0.00 173.10 176.10 2jop s TRP 56 N 3.20 1.83 -0.23 1.90 0.52 -1.26 -2.02 118.94 122.89 2jop s TRP 56 Ca 0.39 0.67 -0.22 0.00 0.02 0.00 0.00 56.10 56.96 2jop s TRP 56 Cb -0.14 -3.97 -0.02 0.00 -1.15 0.00 0.00 33.47 28.19 2jop s TRP 56 CO 0.11 -1.43 0.70 -1.01 0.02 0.00 0.00 176.95 175.33 2jop s HIS 57 N 10.99 3.33 -0.67 -1.98 3.76 0.78 -4.78 115.29 126.73 2jop s HIS 57 Ca 0.71 0.97 -0.25 0.00 -0.15 0.00 0.00 55.06 56.33 2jop s HIS 57 Cb -0.04 -2.89 0.04 0.00 1.11 0.00 0.00 32.58 30.80 2jop s HIS 57 CO 0.07 -0.29 1.13 -1.64 -0.85 0.00 0.00 174.74 173.16 2jop s MET 58 N 2.36 3.23 0.84 1.40 -1.94 -1.25 -0.95 119.30 123.00 2jop s MET 58 Ca 0.30 -0.34 -0.12 0.00 -1.71 0.00 0.00 55.69 53.82 2jop s MET 58 Cb -0.16 -4.15 0.10 0.00 2.01 0.00 0.00 34.83 32.63 2jop s MET 58 CO 0.09 -1.89 1.17 0.14 -0.01 0.00 0.00 175.02 174.52 2jop s VAL 59 N 4.89 2.00 -0.22 -6.03 -7.23 0.50 -0.08 120.40 114.23 2jop s VAL 59 Ca 0.32 0.00 0.15 0.00 -1.81 0.00 0.00 61.98 60.64 2jop s VAL 59 Cb -0.11 -2.94 0.69 0.00 0.56 0.00 0.00 36.38 34.57 2jop s VAL 59 CO 0.16 0.00 1.61 0.00 -0.31 0.00 0.00 175.10 176.56 2jop n SER 61 N 0.05 0.00 0.00 0.00 7.64 -1.26 -3.86 113.62 116.19 2jop n SER 61 Ca 0.26 0.00 0.12 0.00 1.01 0.00 0.00 58.87 60.26 2jop n SER 61 Cb 1.08 0.00 0.65 0.00 -1.01 0.00 0.00 64.21 64.93 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 0.55 -0.71 1.43 -0.00 -1.26 -4.81 117.38 112.58 2jop n GLN 62 Ca 0.00 0.03 -0.32 0.00 -0.00 0.00 0.00 57.00 56.72 2jop n GLN 62 Cb 0.00 -1.50 0.16 0.00 -0.00 0.00 0.00 30.24 28.90 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 -1.14 -0.52 0.00 2.61 7.64 -1.26 -0.36 113.62 120.59 2jop n SER 63 Ca 0.15 0.37 0.00 0.00 1.01 0.00 0.00 58.87 60.40 2jop n SER 63 Cb 0.13 -1.38 0.00 0.00 -1.01 0.00 0.00 64.21 61.95 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 -4.07 0.00 0.83 1.43 8.01 -1.26 -3.92 117.44 118.46 2jop n TRP 64 Ca 0.10 0.00 0.13 0.00 -1.31 0.00 0.00 57.50 56.42 2jop n TRP 64 Cb 0.53 0.00 0.53 0.00 -2.01 0.00 0.00 31.31 30.36 2jop n TRP 64 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2jop n GLY 65 N 0.00 -1.48 3.23 6.99 0.00 -1.25 -4.23 105.19 108.45 2jop n GLY 65 Ca 0.00 -0.07 -0.22 0.00 0.00 0.00 0.00 46.02 45.73 2jop n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jop n ARG 66 N -1.70 -6.16 -1.92 1.61 1.74 0.52 -4.88 116.66 105.87 2jop n ARG 66 Ca 0.06 0.84 -0.40 0.00 -0.77 0.00 0.00 57.85 57.58 2jop n ARG 66 Cb 0.34 -5.71 -0.03 0.00 -1.02 0.00 0.00 32.46 26.04 2jop n ARG 66 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2jop s SER 67 N -3.00 5.34 0.38 0.55 0.01 -1.08 -4.79 113.70 111.11 2jop s SER 67 Ca 0.42 0.87 0.22 0.00 1.31 0.00 0.00 55.95 58.77 2jop s SER 67 Cb -0.19 -2.52 0.25 0.00 0.21 0.00 0.00 66.02 63.77 2jop s SER 67 CO 0.52 -2.22 1.49 0.77 0.41 0.00 0.00 173.24 174.21 2jop h SER 68 N 15.07 0.00 -4.30 2.44 4.64 -1.90 -3.41 113.55 126.08 2jop h SER 68 Ca -0.29 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.50 2jop h SER 68 Cb 1.19 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 63.15 2jop h SER 68 CO 1.13 0.07 -0.50 -0.54 -0.87 0.00 0.00 176.83 176.13 2jop s LYS 69 N -3.20 1.88 0.23 4.77 1.02 -1.26 -4.89 119.74 118.30 2jop s LYS 69 Ca 0.05 -2.13 -0.04 0.00 0.02 0.00 0.00 55.97 53.87 2jop s LYS 69 Cb 0.06 -0.20 0.25 0.00 -0.52 0.00 0.00 37.83 37.42 2jop s LYS 69 CO 0.70 -0.57 1.70 0.37 -0.92 0.00 0.00 175.35 176.63 2jop h GLN 70 N 1.91 0.83 0.00 1.68 4.15 -1.92 -3.45 115.11 118.31 2jop h GLN 70 Ca -0.30 -0.26 0.00 0.00 0.77 0.00 0.00 58.65 58.85 2jop h GLN 70 Cb 1.26 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 28.87 2jop h GLN 70 CO 0.47 0.88 0.00 0.91 -1.93 0.00 0.00 178.83 179.16 2jop n TRP 71 N -4.18 -1.29 0.02 3.99 5.03 -1.26 -3.84 117.44 115.91 2jop n TRP 71 Ca 0.02 0.00 -0.03 0.00 3.03 0.00 0.00 57.50 60.52 2jop n TRP 71 Cb 0.35 0.17 -0.10 0.00 -1.03 0.00 0.00 31.31 30.70 2jop n TRP 71 CO 0.00 0.00 0.00 1.05 -0.03 0.00 0.00 177.69 178.71 2jop h GLU 72 N 0.00 0.00 -3.11 -0.99 9.09 -2.03 -3.43 114.58 114.11 2jop h GLU 72 Ca 0.00 0.00 -0.50 0.00 0.05 0.00 0.00 59.36 58.91 2jop h GLU 72 Cb 0.00 0.00 -0.40 0.00 -1.65 0.00 0.00 28.75 26.70 2jop h GLU 72 CO 0.00 0.38 -0.76 0.34 0.05 0.00 0.00 179.01 179.01 2jop s ASP 73 N -5.92 2.94 0.05 3.06 2.15 -1.26 -5.05 116.67 112.63 2jop s ASP 73 Ca -0.03 -0.93 -0.18 0.00 0.43 0.00 0.00 52.55 51.83 2jop s ASP 73 Cb 0.08 -0.39 -0.16 0.00 -0.30 0.00 0.00 42.92 42.16 2jop s ASP 73 CO 0.81 -0.37 1.28 1.55 -0.17 0.00 0.00 175.17 178.27 2jop h PRO 74 N 8.36 0.49 -2.07 4.34 0.13 -1.85 -3.47 132.00 137.93 2jop h PRO 74 Ca -0.17 -0.34 -0.03 0.00 -0.87 0.00 0.00 66.00 64.59 2jop h PRO 74 Cb 1.09 0.05 -0.21 0.00 0.13 0.00 0.00 31.00 32.06 2jop h PRO 74 CO 0.36 0.96 0.06 -1.54 -0.23 0.00 0.00 178.00 177.61 2jop s SER 75 N -6.50 -0.77 -0.03 1.44 1.04 -1.26 -4.83 113.70 102.79 2jop s SER 75 Ca -0.13 1.41 0.01 0.00 0.48 0.00 0.00 55.95 57.72 2jop s SER 75 Cb 0.06 1.39 0.08 0.00 0.10 0.00 0.00 66.02 67.65 2jop s SER 75 CO 0.80 -0.24 0.80 0.00 0.98 0.00 0.00 173.24 175.59 2jop n GLN 76 N 3.17 1.32 -1.27 4.02 6.02 -1.26 -4.40 117.38 124.99 2jop n GLN 76 Ca -0.16 -0.34 -0.27 0.00 -0.01 0.00 0.00 57.00 56.22 2jop n GLN 76 Cb 0.56 -1.42 0.14 0.00 1.02 0.00 0.00 30.24 30.54 2jop n GLN 76 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2jop n ALA 77 N 0.16 5.80 -0.32 -1.58 0.00 -1.26 -4.53 120.51 118.78 2jop n ALA 77 Ca 0.04 -3.17 0.03 0.00 0.00 0.00 0.00 53.44 50.34 2jop n ALA 77 Cb 0.45 -1.50 0.22 0.00 0.00 0.00 0.00 19.45 18.62 2jop n ALA 77 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2jop h SER 78 N 1.43 0.95 -0.64 0.00 0.87 -1.87 -0.86 113.55 113.43 2jop h SER 78 Ca 0.59 0.00 0.04 0.00 -1.23 0.00 0.00 61.79 61.20 2jop h SER 78 Cb 1.95 -0.20 -0.05 0.00 -0.44 0.00 0.00 62.40 63.66 2jop h SER 78 CO 1.24 0.62 0.37 0.50 -0.53 0.00 0.00 176.83 179.03 2jop h LYS 79 N 1.09 0.68 0.86 2.24 1.63 -1.86 -1.17 116.57 120.05 2jop h LYS 79 Ca 0.39 -0.04 -0.04 0.00 -0.85 0.00 0.00 60.65 60.11 2jop h LYS 79 Cb 0.15 -0.15 0.00 0.00 -0.60 0.00 0.00 32.23 31.63 2jop h LYS 79 CO -0.14 0.45 -0.47 0.28 -3.45 0.00 0.00 179.45 176.11 2jop h VAL 80 N 0.70 0.00 0.00 2.00 2.07 -1.38 -0.94 116.25 118.70 2jop h VAL 80 Ca 0.27 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.74 2jop h VAL 80 Cb 0.11 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.88 2jop h VAL 80 CO -0.15 0.00 -0.26 0.00 0.02 0.00 0.00 177.57 177.18 2jop h GLN 82 N 0.00 0.99 0.00 0.00 5.75 -0.94 0.20 115.11 121.11 2jop h GLN 82 Ca -0.00 -0.31 -0.03 0.00 -0.15 0.00 0.00 58.65 58.17 2jop h GLN 82 Cb 0.79 -0.10 -0.00 0.00 1.07 0.00 0.00 27.48 29.24 2jop h GLN 82 CO 0.03 0.98 -0.12 0.00 -2.65 0.00 0.00 178.83 177.07 2jop h ARG 83 N 0.91 0.00 -0.48 1.69 3.08 -0.43 -1.43 114.38 117.73 2jop h ARG 83 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.21 2jop h ARG 83 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.59 2jop h ARG 83 CO 0.03 0.12 0.00 1.28 -1.07 0.00 0.00 179.97 180.33 2jop n LEU 84 N -3.31 2.58 -3.13 3.04 7.99 -0.59 -4.92 117.00 118.66 2jop n LEU 84 Ca -0.00 -1.29 -0.18 0.00 -0.01 0.00 0.00 56.01 54.53 2jop n LEU 84 Cb 0.35 -0.33 -0.01 0.00 -0.11 0.00 0.00 43.42 43.31 2jop n LEU 84 CO 0.30 0.60 -0.07 -0.46 -1.51 0.00 0.00 177.39 176.26 2jop n ASN 85 N 0.79 -2.84 -0.90 -1.43 0.23 -0.54 -4.80 115.26 105.78 2jop n ASN 85 Ca 0.15 -0.17 0.10 0.00 -0.53 0.00 0.00 54.58 54.14 2jop n ASN 85 Cb 0.43 -2.42 0.14 0.00 -2.08 0.00 0.00 39.78 35.84 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 1.18 0.96 3.90 0.00 0.00 -1.20 -4.50 105.19 105.52 2jop n GLY 87 Ca 0.14 -1.11 -0.29 0.00 0.00 0.00 0.00 46.02 44.76 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 4.23 0.50 1.61 1.01 -1.26 -2.59 116.67 116.16 2jop s ASP 88 Ca 0.00 0.72 -0.20 0.00 0.71 0.00 0.00 52.55 53.77 2jop s ASP 88 Cb 0.00 -1.15 -0.08 0.00 1.01 0.00 0.00 42.92 42.71 2jop s ASP 88 CO 0.00 -2.08 1.08 -2.16 0.21 0.00 0.00 175.17 172.22 2jop s PRO 89 N -5.61 3.67 -0.38 8.23 0.04 -1.26 -1.01 135.00 138.68 2jop s PRO 89 Ca 0.64 1.48 -0.34 0.00 0.04 0.00 0.00 61.00 62.82 2jop s PRO 89 Cb -0.10 -2.11 -0.15 0.00 0.04 0.00 0.00 34.50 32.18 2jop s PRO 89 CO 0.50 -0.56 1.44 1.47 0.04 0.00 0.00 177.00 179.89 2jop n LEU 90 N -0.99 0.71 -4.79 -3.56 -0.00 -1.24 -0.40 117.00 106.73 2jop n LEU 90 Ca 0.10 0.67 -0.33 0.00 -0.00 0.00 0.00 56.01 56.45 2jop n LEU 90 Cb 0.51 -0.67 0.03 0.00 -0.00 0.00 0.00 43.42 43.29 2jop n LEU 90 CO 0.41 -0.60 0.72 -0.55 -0.00 0.00 0.00 177.39 177.37 2jop s SER 91 N 3.57 5.49 -0.01 1.45 0.15 0.27 -4.33 113.70 120.29 2jop s SER 91 Ca 0.86 1.85 -0.07 0.00 0.70 0.00 0.00 55.95 59.29 2jop s SER 91 Cb -1.13 -2.53 -0.05 0.00 -1.71 0.00 0.00 66.02 60.60 2jop s SER 91 CO 0.55 -1.37 0.26 -0.76 1.20 0.00 0.00 173.24 173.12 2jop s LEU 92 N -4.77 4.38 0.00 3.45 1.43 -1.26 -1.76 118.68 120.14 2jop s LEU 92 Ca 0.64 0.56 0.00 0.00 -1.03 0.00 0.00 54.13 54.30 2jop s LEU 92 Cb -0.17 -2.60 0.00 0.00 0.03 0.00 0.00 46.19 43.45 2jop s LEU 92 CO 0.41 0.28 0.00 0.61 0.23 0.00 0.00 176.35 177.87 2jop n GLY 93 N 1.25 1.71 3.69 -3.19 0.00 -1.03 -4.14 105.19 103.47 2jop n GLY 93 Ca -0.12 -0.46 -0.42 0.00 0.00 0.00 0.00 46.02 45.01 2jop n GLY 93 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2jop s PRO 94 N -2.00 4.20 0.39 1.61 0.04 -1.26 -0.28 135.00 137.70 2jop s PRO 94 Ca 0.00 2.31 0.08 0.00 0.04 0.00 0.00 61.00 63.43 2jop s PRO 94 Cb 0.00 -3.63 -0.01 0.00 0.04 0.00 0.00 34.50 30.90 2jop s PRO 94 CO 0.00 -0.74 0.45 0.12 0.04 0.00 0.00 177.00 176.87 2jop s PHE 95 N 2.75 2.85 -0.13 0.56 5.36 0.06 -4.77 117.98 124.66 2jop s PHE 95 Ca 0.74 -0.38 0.15 0.00 -0.96 0.00 0.00 56.93 56.47 2jop s PHE 95 Cb -0.39 -2.16 0.31 0.00 -0.34 0.00 0.00 43.02 40.45 2jop s PHE 95 CO 0.32 -0.16 1.16 1.47 -1.46 0.00 0.00 175.22 176.55 2jop n LEU 96 N -1.65 2.10 -3.57 6.12 -0.00 -1.26 -4.54 117.00 114.20 2jop n LEU 96 Ca 0.04 -3.05 -0.16 0.00 -0.00 0.00 0.00 56.01 52.84 2jop n LEU 96 Cb 0.60 -0.38 -0.07 0.00 -0.00 0.00 0.00 43.42 43.57 2jop n LEU 96 CO 0.41 0.88 0.42 -0.75 -0.00 0.00 0.00 177.39 178.36 2jop s LYS 97 N -2.44 0.95 -0.05 1.47 2.20 -1.26 -5.07 119.74 115.53 2jop s LYS 97 Ca 0.31 0.60 -0.02 0.00 -0.36 0.00 0.00 55.97 56.50 2jop s LYS 97 Cb 0.29 0.45 0.01 0.00 -1.51 0.00 0.00 37.83 37.07 2jop s LYS 97 CO -0.02 -0.22 0.04 2.41 -0.36 0.00 0.00 175.35 177.19 2jop n THR 98 N 1.75 -4.92 -3.18 3.43 -1.04 -1.26 -4.83 114.28 104.24 2jop n THR 98 Ca -0.17 0.56 0.05 0.00 -2.04 0.00 0.00 64.05 62.46 2jop n THR 98 Cb 0.56 -4.36 -0.02 0.00 -1.82 0.00 0.00 70.33 64.68 2jop n THR 98 CO 0.00 0.00 0.00 -0.47 -0.64 0.00 0.00 175.07 173.96 2jop s TYR 99 N -0.23 -0.27 -0.10 -1.42 5.04 -1.26 -4.79 117.35 114.32 2jop s TYR 99 Ca -0.04 0.34 0.00 0.00 -2.44 0.00 0.00 57.07 54.93 2jop s TYR 99 Cb 0.00 0.11 0.02 0.00 0.35 0.00 0.00 41.96 42.45 2jop s TYR 99 CO 0.18 -0.15 -0.09 0.99 -1.34 0.00 0.00 175.55 175.14 2jop s THR 100 N 2.74 1.09 -0.69 4.34 2.01 -1.26 -5.00 115.64 118.86 2jop s THR 100 Ca -0.04 -0.36 -0.09 0.00 0.31 0.00 0.00 61.69 61.50 2jop s THR 100 Cb -0.07 -1.06 -0.08 0.00 0.01 0.00 0.00 72.50 71.29 2jop s THR 100 CO -0.11 0.37 1.86 -2.65 -0.69 0.00 0.00 174.62 173.39 2jop n PRO 101 N 4.58 1.51 0.00 4.92 -0.02 -1.26 -0.27 135.00 144.46 2jop n PRO 101 Ca -0.16 -1.36 0.00 0.00 -2.02 0.00 0.00 63.50 59.96 2jop n PRO 101 Cb 0.51 -2.48 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 2jop n PRO 101 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 2jop n GLN 102 N 5.12 0.00 0.05 -0.52 7.27 -1.26 -4.89 117.38 123.15 2jop n GLN 102 Ca 0.38 0.00 -0.16 0.00 0.07 0.00 0.00 57.00 57.29 2jop n GLN 102 Cb 0.18 0.00 -0.14 0.00 2.41 0.00 0.00 30.24 32.69 2jop n GLN 102 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 2jop h SER 103 N 0.00 0.35 -3.63 1.69 4.64 -1.90 -3.46 113.55 111.25 2jop h SER 103 Ca 0.00 -0.51 -0.50 0.00 -0.47 0.00 0.00 61.79 60.30 2jop h SER 103 Cb 0.00 -0.11 -0.02 0.00 -0.31 0.00 0.00 62.40 61.96 2jop h SER 103 CO 0.00 1.43 0.05 -0.44 -0.87 0.00 0.00 176.83 177.00 2jop s SER 104 N -6.91 6.64 0.21 4.97 0.01 0.62 -3.78 113.70 115.48 2jop s SER 104 Ca -0.09 1.13 -0.00 0.00 1.31 0.00 0.00 55.95 58.29 2jop s SER 104 Cb 0.07 -2.31 -0.04 0.00 0.21 0.00 0.00 66.02 63.95 2jop s SER 104 CO 0.84 -0.24 0.13 0.27 0.41 0.00 0.00 173.24 174.65 2jop s ILE 105 N -2.08 0.08 -0.23 1.44 -5.25 0.89 -3.96 121.20 112.10 2jop s ILE 105 Ca 0.51 -2.00 0.01 0.00 -0.99 0.00 0.00 60.65 58.18 2jop s ILE 105 Cb -0.10 -2.52 0.06 0.00 2.95 0.00 0.00 42.46 42.84 2jop s ILE 105 CO 0.23 0.00 -0.06 -0.63 -1.79 0.00 0.00 174.94 172.69 2jop s ILE 106 N -4.08 1.52 -0.10 8.37 1.01 -0.31 -1.98 121.20 125.64 2jop s ILE 106 Ca 0.39 -1.17 -0.22 0.00 0.00 0.00 0.00 60.65 59.66 2jop s ILE 106 Cb 0.07 -1.76 -0.28 0.00 0.01 0.00 0.00 42.46 40.50 2jop s ILE 106 CO 0.13 -0.05 0.71 0.00 0.00 0.00 0.00 174.94 175.72 2jop n TYR 108 N -4.20 -2.93 0.00 0.00 4.01 -1.26 -3.85 117.16 108.93 2jop n TYR 108 Ca -0.18 1.04 0.00 0.00 -0.16 0.00 0.00 57.90 58.61 2jop n TYR 108 Cb 0.76 -1.92 0.00 0.00 -0.31 0.00 0.00 39.34 37.87 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 -2.82 -2.13 3.71 2.72 0.00 -1.26 -4.20 105.19 101.21 2jop n GLY 109 Ca 0.01 -2.12 -0.42 0.00 0.00 0.00 0.00 46.02 43.49 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 -0.36 4.57 -0.08 1.61 -0.21 -1.26 -4.27 119.66 119.65 2jop s GLN 110 Ca 0.00 1.38 -0.35 0.00 0.02 0.00 0.00 55.36 56.41 2jop s GLN 110 Cb 0.00 -3.45 -0.13 0.00 1.00 0.00 0.00 33.01 30.44 2jop s GLN 110 CO 0.00 -0.00 1.80 -0.11 -2.12 0.00 0.00 175.29 174.86 2jop n LEU 111 N 3.72 3.19 0.00 2.90 7.94 -1.26 -0.68 117.00 132.81 2jop n LEU 111 Ca 0.05 1.01 0.00 0.00 -1.11 0.00 0.00 56.01 55.96 2jop n LEU 111 Cb 0.51 -1.34 0.00 0.00 0.53 0.00 0.00 43.42 43.12 2jop n LEU 111 CO 0.51 -0.17 0.00 0.61 -1.11 0.00 0.00 177.39 177.23 2jop n GLY 112 N 4.18 1.34 3.39 -3.96 0.00 -1.26 -5.03 105.19 103.86 2jop n GLY 112 Ca 0.22 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.79 2jop n GLY 112 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jop s SER 113 N -0.40 6.60 -0.47 1.61 0.01 0.15 -4.04 113.70 117.16 2jop s SER 113 Ca 0.00 -2.16 -0.03 0.00 1.31 0.00 0.00 55.95 55.07 2jop s SER 113 Cb 0.00 -2.32 0.13 0.00 0.21 0.00 0.00 66.02 64.04 2jop s SER 113 CO 0.00 -0.90 2.56 0.49 0.41 0.00 0.00 173.24 175.79 2jop n PHE 114 N 5.61 1.75 0.05 2.43 3.01 0.78 -4.61 117.46 126.48 2jop n PHE 114 Ca 0.14 -2.02 -0.10 0.00 1.01 0.00 0.00 57.45 56.49 2jop n PHE 114 Cb 0.47 -1.29 0.03 0.00 -0.01 0.00 0.00 39.48 38.68 2jop n PHE 114 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 2jop h SER 115 N 2.68 0.50 -5.28 4.37 4.64 -1.91 -3.43 113.55 115.13 2jop h SER 115 Ca 0.40 -0.32 0.15 0.00 -0.47 0.00 0.00 61.79 61.54 2jop h SER 115 Cb 0.71 -0.15 -0.06 0.00 -0.31 0.00 0.00 62.40 62.59 2jop h SER 115 CO 0.92 1.06 0.46 0.21 -0.87 0.00 0.00 176.83 178.61 2jop s ASN 116 N -6.97 -0.13 0.32 4.97 3.84 -1.26 -4.76 114.94 110.94 2jop s ASN 116 Ca -0.06 -0.55 0.07 0.00 0.21 0.00 0.00 52.86 52.54 2jop s ASN 116 Cb 0.10 0.55 -0.03 0.00 -0.55 0.00 0.00 41.25 41.33 2jop s ASN 116 CO 0.84 -1.04 0.27 0.00 -2.79 0.00 0.00 177.10 174.38 2jop s SER 118 N -3.25 2.07 0.52 0.00 0.15 0.16 -4.89 113.70 108.46 2jop s SER 118 Ca 0.38 -1.51 -0.11 0.00 0.70 0.00 0.00 55.95 55.42 2jop s SER 118 Cb 0.02 0.25 -0.05 0.00 -1.71 0.00 0.00 66.02 64.52 2jop s SER 118 CO 0.27 -0.79 0.91 -1.00 1.20 0.00 0.00 173.24 173.83 2jop s HIS 119 N -3.43 3.55 -1.41 3.44 3.76 -1.26 -1.16 115.29 118.78 2jop s HIS 119 Ca 0.33 1.16 -0.09 0.00 -0.15 0.00 0.00 55.06 56.30 2jop s HIS 119 Cb 0.06 -2.57 0.07 0.00 1.11 0.00 0.00 32.58 31.25 2jop s HIS 119 CO 0.15 -0.41 2.36 -1.13 -0.85 0.00 0.00 174.74 174.86 2jop n SER 120 N -2.11 6.72 -0.83 1.40 3.41 -1.25 -4.24 113.62 116.71 2jop n SER 120 Ca 0.04 -2.95 0.08 0.00 -0.26 0.00 0.00 58.87 55.78 2jop n SER 120 Cb 0.54 -1.49 0.24 0.00 -0.26 0.00 0.00 64.21 63.25 2jop n SER 120 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 2jop n ARG 121 N 3.46 2.69 -4.04 4.33 1.85 -1.26 -4.64 116.66 119.05 2jop n ARG 121 Ca 0.58 -2.84 -0.34 0.00 -1.00 0.00 0.00 57.85 54.25 2jop n ARG 121 Cb 0.30 -1.81 -0.15 0.00 -1.05 0.00 0.00 32.46 29.74 2jop n ARG 121 CO 0.00 0.00 0.00 -0.80 -0.01 0.00 0.00 177.63 176.82 2jop s ASN 122 N -2.07 3.80 -0.01 2.89 0.01 -1.26 -4.99 114.94 113.30 2jop s ASN 122 Ca 0.41 -0.76 0.01 0.00 -0.71 0.00 0.00 52.86 51.82 2jop s ASN 122 Cb 0.34 -1.58 0.05 0.00 0.41 0.00 0.00 41.25 40.47 2jop s ASN 122 CO 0.08 -0.06 0.79 -0.90 -1.51 0.00 0.00 177.10 175.50 2jop n ASP 123 N 4.64 0.80 -0.26 -1.22 5.75 -1.26 -3.76 116.55 121.23 2jop n ASP 123 Ca -0.18 -2.03 -0.05 0.00 -0.01 0.00 0.00 54.79 52.52 2jop n ASP 123 Cb 0.48 -0.28 0.06 0.00 -1.03 0.00 0.00 41.12 40.35 2jop n ASP 123 CO 0.00 0.00 0.00 0.24 -0.11 0.00 0.00 177.20 177.33 2jop h MET 124 N 0.26 0.97 -3.97 0.11 2.86 -2.00 -3.30 114.93 109.86 2jop h MET 124 Ca 0.00 -0.07 -0.78 0.00 -2.06 0.00 0.00 59.70 56.80 2jop h MET 124 Cb 0.34 -0.21 -0.25 0.00 0.06 0.00 0.00 31.60 31.54 2jop h MET 124 CO 0.02 0.66 0.26 0.00 1.06 0.00 0.00 176.91 178.91 2jop n HIS 126 N 4.18 3.05 -3.66 0.00 8.25 -1.24 -4.27 115.22 121.53 2jop n HIS 126 Ca 0.17 -2.50 -0.23 0.00 -0.26 0.00 0.00 57.72 54.90 2jop n HIS 126 Cb 0.46 -2.29 0.06 0.00 1.12 0.00 0.00 29.99 29.34 2jop n HIS 126 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2jop n SER 127 N 7.24 -3.82 -4.70 0.41 2.88 -1.26 -4.49 113.62 109.87 2jop n SER 127 Ca 0.51 -0.68 -0.43 0.00 -1.33 0.00 0.00 58.87 56.94 2jop n SER 127 Cb 0.41 -4.57 -0.02 0.00 -0.75 0.00 0.00 64.21 59.28 2jop n SER 127 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2jop n LEU 128 N -4.56 3.62 -4.64 2.46 7.99 -1.25 -0.76 117.00 119.86 2jop n LEU 128 Ca -0.12 1.17 -0.30 0.00 -0.01 0.00 0.00 56.01 56.75 2jop n LEU 128 Cb 0.60 -1.49 -0.08 0.00 -0.11 0.00 0.00 43.42 42.34 2jop n LEU 128 CO 0.67 -0.32 -0.22 -0.83 -1.51 0.00 0.00 177.39 175.18 2jop s GLY 129 N 0.07 2.86 -0.08 -0.72 0.00 0.61 -4.03 107.32 106.04 2jop s GLY 129 Ca 0.62 -0.75 -0.09 0.00 0.00 0.00 0.00 44.72 44.50 2jop s GLY 129 CO 0.55 -2.02 0.25 1.08 0.00 0.00 0.00 173.10 172.96 2jop s LEU 130 N -3.75 1.07 -0.25 0.66 1.43 -1.23 -2.48 118.68 114.14 2jop s LEU 130 Ca 0.14 0.41 -0.02 0.00 -1.03 0.00 0.00 54.13 53.62 2jop s LEU 130 Cb 0.02 0.88 0.12 0.00 0.03 0.00 0.00 46.19 47.24 2jop s LEU 130 CO 0.09 -0.14 0.30 -0.89 0.23 0.00 0.00 176.35 175.93 2jop s THR 131 N -0.13 -0.44 -0.59 5.49 2.01 -0.72 -1.94 115.64 119.32 2jop s THR 131 Ca -0.02 -0.27 -0.35 0.00 0.31 0.00 0.00 61.69 61.36 2jop s THR 131 Cb -0.03 -0.85 -0.16 0.00 0.01 0.00 0.00 72.50 71.47 2jop s THR 131 CO 0.01 -0.30 2.35 0.00 -0.69 0.00 0.00 174.62 175.99 2jop n LEU 133 N 10.28 0.00 0.00 0.00 7.94 0.46 -4.61 117.00 131.08 2jop n LEU 133 Ca 0.51 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.41 2jop n LEU 133 Cb 0.15 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.10 2jop n LEU 133 CO 0.83 0.00 0.00 -1.84 -1.11 0.00 0.00 177.39 175.27