#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 2.11 0.01 2.89 1.43 -1.26 -4.88 118.68 118.98 2jop s LEU 26 Ca 0.00 -2.34 -0.08 0.00 -1.03 0.00 0.00 54.13 50.68 2jop s LEU 26 Cb 0.00 -0.82 0.00 0.00 0.03 0.00 0.00 46.19 45.40 2jop s LEU 26 CO 0.00 -0.30 0.15 -0.94 0.23 0.00 0.00 176.35 175.49 2jop s SER 27 N 0.77 0.02 -0.01 2.29 1.04 -1.25 -0.58 113.70 115.98 2jop s SER 27 Ca 0.16 -0.23 0.02 0.00 0.48 0.00 0.00 55.95 56.38 2jop s SER 27 Cb -0.23 0.22 0.06 0.00 0.10 0.00 0.00 66.02 66.18 2jop s SER 27 CO -0.04 -0.41 0.80 -2.67 0.98 0.00 0.00 173.24 171.90 2jop n TRP 28 N 1.29 0.14 -0.79 5.02 4.27 -1.26 -2.26 117.44 123.85 2jop n TRP 28 Ca -0.22 -0.05 0.04 0.00 -3.89 0.00 0.00 57.50 53.38 2jop n TRP 28 Cb 0.56 -0.08 0.06 0.00 -1.36 0.00 0.00 31.31 30.49 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 -0.10 0.00 -3.66 -2.67 0.18 -1.26 -4.23 117.16 105.42 2jop n TYR 29 Ca 0.02 -0.58 -0.36 0.00 1.88 0.00 0.00 57.90 58.87 2jop n TYR 29 Cb 0.21 -0.08 -0.07 0.00 -0.38 0.00 0.00 39.34 39.01 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 -1.63 6.31 0.58 9.48 -1.08 -0.96 -4.93 116.67 124.45 2jop s ASP 30 Ca 0.13 0.36 0.36 0.00 -0.52 0.00 0.00 52.55 52.88 2jop s ASP 30 Cb 0.11 -2.13 1.69 0.00 -1.46 0.00 0.00 42.92 41.13 2jop s ASP 30 CO 0.01 0.16 2.11 -0.65 0.52 0.00 0.00 175.17 177.32 2jop h PRO 31 N 6.56 0.00 -0.03 4.34 0.11 -1.95 -2.30 132.00 138.73 2jop h PRO 31 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 2jop h PRO 31 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2jop h PRO 31 CO 0.75 0.02 -0.10 -3.47 -0.21 0.00 0.00 178.00 174.99 2jop n ASP 32 N -3.14 2.68 -4.77 -2.05 2.03 -1.26 -4.91 116.55 105.13 2jop n ASP 32 Ca -0.01 -1.84 -0.39 0.00 0.52 0.00 0.00 54.79 53.08 2jop n ASP 32 Cb 0.23 0.10 -0.06 0.00 -0.72 0.00 0.00 41.12 40.68 2jop n ASP 32 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 2jop s PHE 33 N -1.99 3.68 -0.35 -0.67 5.36 -0.87 -5.04 117.98 118.11 2jop s PHE 33 Ca 0.24 1.17 -0.23 0.00 -0.96 0.00 0.00 56.93 57.15 2jop s PHE 33 Cb 0.18 -2.57 0.01 0.00 -0.34 0.00 0.00 43.02 40.30 2jop s PHE 33 CO 0.34 0.38 0.78 -0.65 -1.46 0.00 0.00 175.22 174.61 2jop s GLN 34 N -0.27 3.79 -0.00 10.12 1.11 -1.26 -4.88 119.66 128.26 2jop s GLN 34 Ca 0.30 0.36 -0.04 0.00 0.01 0.00 0.00 55.36 55.99 2jop s GLN 34 Cb -0.18 -3.79 -0.00 0.00 -1.01 0.00 0.00 33.01 28.02 2jop s GLN 34 CO 0.17 -0.82 0.06 0.00 0.01 0.00 0.00 175.29 174.71 2jop s ALA 35 N 3.08 -0.14 0.01 6.09 0.00 -1.26 -0.59 121.76 128.95 2jop s ALA 35 Ca 0.32 -0.19 -0.16 0.00 0.00 0.00 0.00 51.96 51.92 2jop s ALA 35 Cb -0.13 0.06 0.05 0.00 0.00 0.00 0.00 23.12 23.10 2jop s ALA 35 CO 0.16 -0.14 0.74 2.89 0.00 0.00 0.00 175.76 179.40 2jop n ARG 36 N 1.94 0.17 -3.61 0.00 1.85 -0.59 -4.80 116.66 111.62 2jop n ARG 36 Ca -0.20 -0.55 -0.20 0.00 -1.00 0.00 0.00 57.85 55.90 2jop n ARG 36 Cb 0.56 0.86 -0.01 0.00 -1.05 0.00 0.00 32.46 32.82 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 4.02 1.06 2.89 1.43 -1.26 -0.24 118.68 126.58 2jop s LEU 37 Ca 0.17 -0.15 -0.17 0.00 -1.03 0.00 0.00 54.13 52.94 2jop s LEU 37 Cb -0.01 -2.73 0.24 0.00 0.03 0.00 0.00 46.19 43.72 2jop s LEU 37 CO 0.00 -0.34 1.24 0.42 0.23 0.00 0.00 176.35 177.90 2jop s THR 38 N -2.14 1.84 0.00 5.49 -4.23 0.15 -4.67 115.64 112.08 2jop s THR 38 Ca 0.42 0.00 -0.03 0.00 -1.18 0.00 0.00 61.69 60.90 2jop s THR 38 Cb -0.09 -2.80 -0.12 0.00 1.34 0.00 0.00 72.50 70.83 2jop s THR 38 CO 0.30 0.00 2.31 -2.11 -0.54 0.00 0.00 174.62 174.58 2jop n ARG 39 N -4.17 1.20 -0.25 3.99 1.85 -1.26 -4.52 116.66 113.49 2jop n ARG 39 Ca 0.15 -0.46 -0.04 0.00 -1.00 0.00 0.00 57.85 56.50 2jop n ARG 39 Cb 0.59 -1.59 0.02 0.00 -1.05 0.00 0.00 32.46 30.44 2jop n ARG 39 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 2jop n SER 40 N 2.25 3.60 -0.09 2.89 7.64 -1.26 -4.73 113.62 123.91 2jop n SER 40 Ca 0.20 -2.29 -0.01 0.00 1.01 0.00 0.00 58.87 57.77 2jop n SER 40 Cb 0.56 -0.66 -0.01 0.00 -1.01 0.00 0.00 64.21 63.10 2jop n SER 40 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2jop n ASN 41 N 0.45 -5.01 -3.61 6.43 4.13 -1.26 -4.90 115.26 111.48 2jop n ASN 41 Ca 0.08 0.03 -0.14 0.00 1.68 0.00 0.00 54.58 56.24 2jop n ASN 41 Cb 0.64 -2.62 -0.13 0.00 -1.54 0.00 0.00 39.78 36.13 2jop n ASN 41 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 2jop s SER 42 N -2.07 0.46 0.45 6.41 0.01 -1.26 -5.00 113.70 112.72 2jop s SER 42 Ca 0.00 0.47 0.29 0.00 1.31 0.00 0.00 55.95 58.02 2jop s SER 42 Cb 0.00 0.72 1.02 0.00 0.21 0.00 0.00 66.02 67.97 2jop s SER 42 CO 0.00 -0.26 1.84 0.11 0.41 0.00 0.00 173.24 175.34 2jop h LYS 43 N 8.28 0.00 -0.12 12.44 1.79 -1.92 -2.79 116.57 134.26 2jop h LYS 43 Ca -0.15 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.32 2jop h LYS 43 Cb 1.12 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.77 2jop h LYS 43 CO 0.17 0.00 0.00 0.00 -1.08 0.00 0.00 179.45 178.54 2jop s GLN 45 N -1.88 0.25 0.00 0.00 -0.21 -1.05 -0.22 119.66 116.55 2jop s GLN 45 Ca 0.22 0.73 0.00 0.00 0.02 0.00 0.00 55.36 56.33 2jop s GLN 45 Cb 0.17 -0.01 0.00 0.00 1.00 0.00 0.00 33.01 34.17 2jop s GLN 45 CO 0.06 -0.21 0.00 0.41 -2.12 0.00 0.00 175.29 173.43 2jop n GLY 46 N 4.73 -0.89 3.89 3.09 0.00 -1.04 -4.00 105.19 110.98 2jop n GLY 46 Ca -0.17 -1.26 -0.29 0.00 0.00 0.00 0.00 46.02 44.30 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 -2.00 3.61 0.00 1.61 -0.21 -1.26 -3.07 119.66 118.34 2jop s GLN 47 Ca 0.00 0.39 -0.30 0.00 0.02 0.00 0.00 55.36 55.46 2jop s GLN 47 Cb 0.00 -2.31 -0.05 0.00 1.00 0.00 0.00 33.01 31.65 2jop s GLN 47 CO 0.00 -0.25 1.31 -1.17 -2.12 0.00 0.00 175.29 173.07 2jop s LEU 48 N -4.63 4.32 -0.18 2.90 2.96 -1.26 -0.67 118.68 122.12 2jop s LEU 48 Ca 0.50 2.04 -0.00 0.00 -0.22 0.00 0.00 54.13 56.44 2jop s LEU 48 Cb -0.10 -3.56 0.05 0.00 0.50 0.00 0.00 46.19 43.07 2jop s LEU 48 CO 0.44 -0.64 -0.05 -0.70 -1.32 0.00 0.00 176.35 174.07 2jop s GLU 49 N 2.03 1.50 0.06 1.98 2.12 0.67 -0.88 118.70 126.18 2jop s GLU 49 Ca 0.61 -0.63 0.08 0.00 0.36 0.00 0.00 54.97 55.39 2jop s GLU 49 Cb -0.30 -2.15 -0.03 0.00 0.26 0.00 0.00 34.13 31.91 2jop s GLU 49 CO 0.26 -0.47 -0.22 0.14 -0.54 0.00 0.00 175.26 174.44 2jop s VAL 50 N 1.58 1.76 -0.52 3.70 -7.23 -0.74 -1.55 120.40 117.40 2jop s VAL 50 Ca -0.01 -1.31 -0.16 0.00 -1.81 0.00 0.00 61.98 58.69 2jop s VAL 50 Cb -0.16 -1.54 0.11 0.00 0.56 0.00 0.00 36.38 35.34 2jop s VAL 50 CO -0.08 0.17 0.49 -0.47 -0.31 0.00 0.00 175.10 174.90 2jop s TYR 51 N -0.88 3.22 0.02 2.82 5.04 0.24 -0.04 117.35 127.77 2jop s TYR 51 Ca 0.08 -1.10 -0.06 0.00 -2.44 0.00 0.00 57.07 53.55 2jop s TYR 51 Cb -0.09 -3.60 -0.01 0.00 0.35 0.00 0.00 41.96 38.61 2jop s TYR 51 CO 0.02 -0.97 0.11 -0.48 -1.34 0.00 0.00 175.55 172.89 2jop s LEU 52 N 1.76 1.72 0.00 6.97 -0.00 -1.04 -4.42 118.68 123.67 2jop s LEU 52 Ca 0.05 -0.38 0.00 0.00 -0.00 0.00 0.00 54.13 53.80 2jop s LEU 52 Cb -0.27 0.60 0.00 0.00 -0.00 0.00 0.00 46.19 46.52 2jop s LEU 52 CO 0.05 -0.43 0.00 1.17 -0.00 0.00 0.00 176.35 177.14 2jop n LYS 53 N 1.15 0.00 0.00 1.48 3.00 -1.26 -1.57 118.16 120.95 2jop n LYS 53 Ca -0.21 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.10 2jop n LYS 53 Cb 0.57 -0.06 0.00 0.00 0.00 0.00 0.00 35.03 35.53 2jop n LYS 53 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 2jop n ASP 54 N 1.52 0.00 -4.65 3.14 5.75 -1.26 -5.13 116.55 115.92 2jop n ASP 54 Ca 0.00 0.00 -0.41 0.00 -0.01 0.00 0.00 54.79 54.37 2jop n ASP 54 Cb 0.00 0.00 -0.05 0.00 -1.03 0.00 0.00 41.12 40.04 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 0.00 1.85 -0.87 6.12 0.00 -0.61 -4.97 107.32 108.84 2jop s GLY 55 Ca 0.00 -0.17 -0.25 0.00 0.00 0.00 0.00 44.72 44.29 2jop s GLY 55 CO 0.00 1.67 2.21 -0.98 0.00 0.00 0.00 173.10 176.00 2jop s TRP 56 N 2.57 1.39 -0.47 1.90 0.52 -1.26 -2.50 118.94 121.09 2jop s TRP 56 Ca 0.33 1.52 -0.25 0.00 0.02 0.00 0.00 56.10 57.73 2jop s TRP 56 Cb -0.16 -3.64 0.03 0.00 -1.15 0.00 0.00 33.47 28.55 2jop s TRP 56 CO 0.09 -1.52 0.89 -1.01 0.02 0.00 0.00 176.95 175.42 2jop s HIS 57 N 13.37 2.92 -0.31 -1.98 3.76 0.94 -4.83 115.29 129.16 2jop s HIS 57 Ca 0.83 0.26 -0.29 0.00 -0.15 0.00 0.00 55.06 55.71 2jop s HIS 57 Cb -0.10 -3.91 -0.01 0.00 1.11 0.00 0.00 32.58 29.67 2jop s HIS 57 CO 0.06 -1.12 1.53 -1.64 -0.85 0.00 0.00 174.74 172.72 2jop s MET 58 N 3.67 3.68 0.63 1.40 -1.94 -1.26 -1.79 119.30 123.69 2jop s MET 58 Ca 0.34 1.34 0.04 0.00 -1.71 0.00 0.00 55.69 55.70 2jop s MET 58 Cb -0.11 -4.03 0.10 0.00 2.01 0.00 0.00 34.83 32.80 2jop s MET 58 CO 0.24 -1.43 0.87 0.14 -0.01 0.00 0.00 175.02 174.83 2jop s VAL 59 N 5.39 2.21 -2.00 -6.03 -7.23 -0.06 -1.31 120.40 111.37 2jop s VAL 59 Ca 0.67 -0.80 0.24 0.00 -1.81 0.00 0.00 61.98 60.28 2jop s VAL 59 Cb -0.20 -2.41 0.69 0.00 0.56 0.00 0.00 36.38 35.02 2jop s VAL 59 CO 0.30 0.00 1.90 0.00 -0.31 0.00 0.00 175.10 176.99 2jop n SER 61 N -0.90 0.00 -0.60 0.00 2.88 -1.26 -3.57 113.62 110.18 2jop n SER 61 Ca 0.18 0.00 0.06 0.00 -1.33 0.00 0.00 58.87 57.78 2jop n SER 61 Cb 0.08 0.00 0.14 0.00 -0.75 0.00 0.00 64.21 63.69 2jop n SER 61 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2jop n GLN 62 N -1.63 1.11 -0.58 -1.46 10.64 -1.26 -4.77 117.38 119.43 2jop n GLN 62 Ca 0.00 -2.70 -0.28 0.00 -1.83 0.00 0.00 57.00 52.18 2jop n GLN 62 Cb 0.00 -1.23 0.25 0.00 -0.86 0.00 0.00 30.24 28.40 2jop n GLN 62 CO 0.00 0.00 0.00 -1.12 -1.83 0.00 0.00 177.06 174.11 2jop s SER 63 N -2.75 0.75 0.00 2.61 0.01 -1.26 -3.05 113.70 110.02 2jop s SER 63 Ca 0.32 1.36 0.00 0.00 1.31 0.00 0.00 55.95 58.95 2jop s SER 63 Cb 0.32 -2.10 0.00 0.00 0.21 0.00 0.00 66.02 64.44 2jop s SER 63 CO -0.05 -4.32 0.00 0.79 0.41 0.00 0.00 173.24 170.07 2jop n TRP 64 N -4.98 0.00 -2.68 2.43 8.01 0.21 -3.96 117.44 116.48 2jop n TRP 64 Ca 0.04 0.00 -0.04 0.00 -1.31 0.00 0.00 57.50 56.18 2jop n TRP 64 Cb 0.55 0.00 0.06 0.00 -2.01 0.00 0.00 31.31 29.91 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 -1.57 3.19 6.99 0.00 -1.26 -3.62 105.19 108.92 2jop n GLY 65 Ca 0.00 1.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.70 2jop n GLY 65 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jop s ARG 66 N 0.41 3.04 -0.04 1.61 1.81 -1.17 -4.86 118.95 119.75 2jop s ARG 66 Ca 0.26 -0.86 -0.30 0.00 -1.72 0.00 0.00 55.73 53.11 2jop s ARG 66 Cb 0.18 -2.40 -0.03 0.00 -0.45 0.00 0.00 34.95 32.25 2jop s ARG 66 CO -0.10 0.05 1.06 -1.12 -0.68 0.00 0.00 175.30 174.51 2jop s SER 67 N 0.66 7.22 -0.77 0.23 0.01 -1.26 -4.91 113.70 114.89 2jop s SER 67 Ca -0.11 1.70 -0.26 0.00 1.31 0.00 0.00 55.95 58.60 2jop s SER 67 Cb -0.16 -2.56 0.01 0.00 0.21 0.00 0.00 66.02 63.51 2jop s SER 67 CO 0.02 -0.42 1.60 -0.94 0.41 0.00 0.00 173.24 173.91 2jop s SER 68 N 1.14 5.77 -0.05 2.44 1.04 -1.26 -4.90 113.70 117.87 2jop s SER 68 Ca 0.53 -0.39 -0.29 0.00 0.48 0.00 0.00 55.95 56.27 2jop s SER 68 Cb -0.22 -2.55 0.07 0.00 0.10 0.00 0.00 66.02 63.41 2jop s SER 68 CO 0.24 -2.10 0.65 -0.75 0.98 0.00 0.00 173.24 172.26 2jop s LYS 69 N 6.23 1.02 -0.71 4.02 2.20 -1.26 -5.10 119.74 126.14 2jop s LYS 69 Ca 0.52 0.25 -0.27 0.00 -0.36 0.00 0.00 55.97 56.11 2jop s LYS 69 Cb -0.08 0.48 0.01 0.00 -1.51 0.00 0.00 37.83 36.73 2jop s LYS 69 CO 0.10 -0.31 1.52 -0.65 -0.36 0.00 0.00 175.35 175.66 2jop s GLN 70 N -1.14 2.98 0.14 4.03 -0.21 -1.26 -4.58 119.66 119.62 2jop s GLN 70 Ca -0.11 0.04 0.00 0.00 0.02 0.00 0.00 55.36 55.31 2jop s GLN 70 Cb -0.01 -4.34 0.00 0.00 1.00 0.00 0.00 33.01 29.67 2jop s GLN 70 CO 0.09 -2.41 0.00 0.91 -2.12 0.00 0.00 175.29 171.76 2jop n TRP 71 N 10.76 -1.95 0.00 0.91 7.02 -0.98 -5.04 117.44 128.16 2jop n TRP 71 Ca 0.12 1.04 0.00 0.00 -1.02 0.00 0.00 57.50 57.64 2jop n TRP 71 Cb 0.50 -2.43 0.00 0.00 -2.42 0.00 0.00 31.31 26.97 2jop n TRP 71 CO 0.00 0.00 0.00 -1.91 -2.02 0.00 0.00 177.69 173.76 2jop n GLU 72 N 0.04 0.00 -3.15 -0.99 4.07 -1.26 -5.02 120.64 114.34 2jop n GLU 72 Ca 0.00 0.00 -0.06 0.00 -0.06 0.00 0.00 57.16 57.04 2jop n GLU 72 Cb 0.00 0.00 -0.03 0.00 -0.06 0.00 0.00 31.44 31.35 2jop n GLU 72 CO 0.00 0.00 0.00 0.34 -0.06 0.00 0.00 177.13 177.41 2jop s ASP 73 N -0.85 -0.70 -0.28 4.31 2.15 -1.26 -5.03 116.67 115.00 2jop s ASP 73 Ca 0.00 -1.36 0.04 0.00 0.43 0.00 0.00 52.55 51.66 2jop s ASP 73 Cb 0.00 1.47 0.48 0.00 -0.30 0.00 0.00 42.92 44.57 2jop s ASP 73 CO 0.00 -0.16 1.59 -0.81 -0.17 0.00 0.00 175.17 175.62 2jop n PRO 74 N 3.90 2.17 0.00 4.34 -0.04 -1.26 -4.76 135.00 139.35 2jop n PRO 74 Ca 0.14 -2.09 0.00 0.00 -0.04 0.00 0.00 63.50 61.51 2jop n PRO 74 Cb 0.53 -1.85 0.00 0.00 -0.04 0.00 0.00 33.50 32.15 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 -0.45 0.00 0.00 3.54 3.41 -1.26 -4.16 113.62 114.70 2jop n SER 75 Ca 0.37 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.98 2jop n SER 75 Cb 1.24 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 65.19 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 -0.40 4.33 1.13 -1.26 -4.46 117.38 116.72 2jop n GLN 76 Ca 0.00 0.00 -0.03 0.00 -1.94 0.00 0.00 57.00 55.03 2jop n GLN 76 Cb 0.00 0.00 0.01 0.00 0.11 0.00 0.00 30.24 30.36 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 0.02 3.66 -0.19 -1.58 0.00 -1.26 -4.44 120.51 116.72 2jop n ALA 77 Ca 0.00 -0.32 -0.02 0.00 0.00 0.00 0.00 53.44 53.10 2jop n ALA 77 Cb 0.00 -1.06 0.08 0.00 0.00 0.00 0.00 19.45 18.47 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 0.69 0.33 -0.08 0.00 0.87 -1.84 -2.08 113.55 111.45 2jop h SER 78 Ca 0.06 0.05 -0.05 0.00 -1.23 0.00 0.00 61.79 60.62 2jop h SER 78 Cb 1.06 -0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.01 2jop h SER 78 CO 0.14 0.22 -0.09 0.50 -0.53 0.00 0.00 176.83 177.06 2jop h LYS 79 N 0.48 0.37 -0.07 2.24 1.63 -1.88 -0.08 116.57 119.27 2jop h LYS 79 Ca 0.27 -0.09 -0.23 0.00 -0.85 0.00 0.00 60.65 59.75 2jop h LYS 79 Cb 0.25 -0.05 0.02 0.00 -0.60 0.00 0.00 32.23 31.84 2jop h LYS 79 CO -0.22 0.48 -0.86 -0.39 -3.45 0.00 0.00 179.45 175.00 2jop h VAL 80 N 0.35 1.29 0.00 2.00 -1.51 -1.64 0.20 116.25 116.95 2jop h VAL 80 Ca 0.07 -2.09 -0.16 0.00 -1.23 0.00 0.00 66.70 63.29 2jop h VAL 80 Cb 0.38 2.22 -0.02 0.00 -2.13 0.00 0.00 31.29 31.74 2jop h VAL 80 CO 0.02 0.65 -0.77 0.00 -1.23 0.00 0.00 177.57 176.24 2jop h GLN 82 N 0.00 0.64 0.00 0.00 4.15 -0.42 0.18 115.11 119.66 2jop h GLN 82 Ca -0.01 -0.18 -0.06 0.00 0.77 0.00 0.00 58.65 59.17 2jop h GLN 82 Cb 1.40 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 29.00 2jop h GLN 82 CO 0.10 0.70 -0.30 -0.09 -1.93 0.00 0.00 178.83 177.31 2jop h ARG 83 N 0.59 0.00 -0.66 1.69 9.65 -0.22 -1.81 114.38 123.62 2jop h ARG 83 Ca 0.11 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.99 2jop h ARG 83 Cb 0.46 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.04 2jop h ARG 83 CO 0.02 0.30 0.00 1.28 2.80 0.00 0.00 179.97 184.37 2jop n LEU 84 N -3.95 3.32 -2.66 3.80 4.77 -0.54 -4.90 117.00 116.85 2jop n LEU 84 Ca -0.02 -1.68 -0.10 0.00 -0.03 0.00 0.00 56.01 54.18 2jop n LEU 84 Cb 0.37 -0.51 -0.01 0.00 -2.33 0.00 0.00 43.42 40.94 2jop n LEU 84 CO 0.36 0.50 -0.08 -0.46 -1.33 0.00 0.00 177.39 176.38 2jop n ASN 85 N 0.48 -2.77 -0.95 -1.43 0.23 -0.68 -4.79 115.26 105.36 2jop n ASN 85 Ca 0.16 0.18 0.12 0.00 -0.53 0.00 0.00 54.58 54.50 2jop n ASN 85 Cb 0.67 -2.40 0.10 0.00 -2.08 0.00 0.00 39.78 36.08 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 1.32 1.52 3.89 0.00 0.00 -1.19 -4.44 105.19 106.30 2jop n GLY 87 Ca 0.14 -0.76 -0.29 0.00 0.00 0.00 0.00 46.02 45.11 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 4.27 0.58 1.61 1.11 -1.26 -2.07 116.67 116.91 2jop s ASP 88 Ca 0.00 0.76 -0.16 0.00 0.18 0.00 0.00 52.55 53.33 2jop s ASP 88 Cb 0.00 -1.22 -0.05 0.00 1.07 0.00 0.00 42.92 42.73 2jop s ASP 88 CO 0.00 -2.05 1.05 -2.16 1.18 0.00 0.00 175.17 173.18 2jop s PRO 89 N -5.57 3.44 -0.46 8.23 0.04 -1.26 -0.82 135.00 138.59 2jop s PRO 89 Ca 0.63 1.18 -0.38 0.00 0.04 0.00 0.00 61.00 62.46 2jop s PRO 89 Cb -0.11 -2.05 -0.17 0.00 0.04 0.00 0.00 34.50 32.21 2jop s PRO 89 CO 0.50 -0.71 1.91 1.47 0.04 0.00 0.00 177.00 180.21 2jop n LEU 90 N -1.91 0.64 -4.77 -3.56 -0.00 -1.23 -0.23 117.00 105.95 2jop n LEU 90 Ca 0.08 0.58 -0.33 0.00 -0.00 0.00 0.00 56.01 56.35 2jop n LEU 90 Cb 0.53 -0.79 0.05 0.00 -0.00 0.00 0.00 43.42 43.21 2jop n LEU 90 CO 0.47 -0.68 0.74 -0.94 -0.00 0.00 0.00 177.39 176.98 2jop s SER 91 N 5.41 5.00 -0.26 1.45 1.04 0.87 -4.41 113.70 122.79 2jop s SER 91 Ca 1.06 1.99 -0.14 0.00 0.48 0.00 0.00 55.95 59.35 2jop s SER 91 Cb -1.31 -2.55 -0.04 0.00 0.10 0.00 0.00 66.02 62.22 2jop s SER 91 CO 0.58 -1.70 0.32 -0.76 0.98 0.00 0.00 173.24 172.65 2jop s LEU 92 N -5.00 4.05 -0.29 2.42 1.43 -1.26 -1.21 118.68 118.82 2jop s LEU 92 Ca 0.67 0.23 -0.15 0.00 -1.03 0.00 0.00 54.13 53.85 2jop s LEU 92 Cb -0.20 -2.35 0.10 0.00 0.03 0.00 0.00 46.19 43.77 2jop s LEU 92 CO 0.43 -0.13 0.73 -0.83 0.23 0.00 0.00 176.35 176.78 2jop s GLY 93 N 1.59 -0.56 0.29 -3.19 0.00 -0.86 -2.33 107.32 102.26 2jop s GLY 93 Ca 0.13 2.52 -0.30 0.00 0.00 0.00 0.00 44.72 47.07 2jop s GLY 93 CO 0.10 2.57 1.60 2.56 0.00 0.00 0.00 173.10 179.93 2jop s PRO 94 N 1.84 4.12 0.11 2.90 0.04 -1.26 -0.41 135.00 142.34 2jop s PRO 94 Ca -0.09 2.59 0.00 0.00 0.04 0.00 0.00 61.00 63.54 2jop s PRO 94 Cb -0.06 -3.02 -0.00 0.00 0.04 0.00 0.00 34.50 31.46 2jop s PRO 94 CO -0.19 -0.64 0.01 0.34 0.04 0.00 0.00 177.00 176.55 2jop n PHE 95 N 2.22 0.23 -3.06 0.56 7.35 0.56 -4.62 117.46 120.70 2jop n PHE 95 Ca 0.08 -0.59 -0.37 0.00 -0.76 0.00 0.00 57.45 55.82 2jop n PHE 95 Cb 0.37 -0.06 -0.06 0.00 0.35 0.00 0.00 39.48 40.08 2jop n PHE 95 CO 0.00 0.00 0.00 -1.17 -0.76 0.00 0.00 176.76 174.83 2jop s LEU 96 N 0.00 4.41 -0.59 -2.13 2.96 -1.26 -4.70 118.68 117.36 2jop s LEU 96 Ca 0.01 1.50 -0.26 0.00 -0.22 0.00 0.00 54.13 55.15 2jop s LEU 96 Cb 0.00 -3.53 -0.04 0.00 0.50 0.00 0.00 46.19 43.13 2jop s LEU 96 CO 0.01 0.07 2.01 -1.59 -1.32 0.00 0.00 176.35 175.53 2jop s LYS 97 N -1.76 2.47 0.00 1.98 -2.85 -1.26 -4.74 119.74 113.58 2jop s LYS 97 Ca 0.41 0.80 0.22 0.00 -1.00 0.00 0.00 55.97 56.40 2jop s LYS 97 Cb -0.18 -4.46 -0.12 0.00 -2.06 0.00 0.00 37.83 31.00 2jop s LYS 97 CO 0.22 -2.91 0.91 2.41 0.10 0.00 0.00 175.35 176.08 2jop n THR 98 N 7.45 0.03 -2.29 3.79 -1.04 -1.26 -4.98 114.28 115.98 2jop n THR 98 Ca 0.25 -0.13 -0.26 0.00 -2.04 0.00 0.00 64.05 61.87 2jop n THR 98 Cb 0.53 0.62 0.14 0.00 -1.82 0.00 0.00 70.33 69.79 2jop n THR 98 CO 0.00 0.00 0.00 -0.72 -0.64 0.00 0.00 175.07 173.71 2jop s TYR 99 N -3.12 1.64 -0.06 -1.42 -0.85 -1.26 -5.11 117.35 107.17 2jop s TYR 99 Ca 0.05 0.01 -0.03 0.00 -0.52 0.00 0.00 57.07 56.57 2jop s TYR 99 Cb 0.16 -3.48 0.03 0.00 0.38 0.00 0.00 41.96 39.04 2jop s TYR 99 CO 0.85 -2.10 0.13 -0.08 -1.52 0.00 0.00 175.55 172.83 2jop s THR 100 N -3.47 -0.03 -0.72 -3.49 -1.32 -1.26 -5.03 115.64 100.32 2jop s THR 100 Ca 0.69 0.11 0.00 0.00 -1.21 0.00 0.00 61.69 61.28 2jop s THR 100 Cb -0.05 -0.21 0.00 0.00 -1.51 0.00 0.00 72.50 70.73 2jop s THR 100 CO 0.48 0.04 0.30 -2.65 -2.21 0.00 0.00 174.62 170.59 2jop n PRO 101 N 3.73 0.48 -0.02 7.08 -0.02 -1.26 -0.31 135.00 144.68 2jop n PRO 101 Ca -0.21 0.00 -0.06 0.00 -2.02 0.00 0.00 63.50 61.21 2jop n PRO 101 Cb 0.55 -1.24 -0.02 0.00 -0.02 0.00 0.00 33.50 32.76 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 0.40 0.20 -0.03 -0.52 7.27 -1.26 -4.57 117.38 118.87 2jop n GLN 102 Ca 0.00 0.08 0.03 0.00 0.07 0.00 0.00 57.00 57.18 2jop n GLN 102 Cb 0.15 -0.85 -0.15 0.00 2.41 0.00 0.00 30.24 31.81 2jop n GLN 102 CO 0.00 0.00 0.00 -1.13 0.07 0.00 0.00 177.06 176.00 2jop n SER 103 N -3.72 0.16 -4.86 1.69 3.41 -1.12 -4.94 113.62 104.23 2jop n SER 103 Ca -0.10 0.07 -0.31 0.00 -0.26 0.00 0.00 58.87 58.26 2jop n SER 103 Cb 0.33 1.37 -0.04 0.00 -0.26 0.00 0.00 64.21 65.62 2jop n SER 103 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2jop s SER 104 N -5.03 6.61 0.14 4.04 0.15 0.58 -4.71 113.70 115.48 2jop s SER 104 Ca -0.08 1.30 0.04 0.00 0.70 0.00 0.00 55.95 57.92 2jop s SER 104 Cb 0.11 -2.39 -0.04 0.00 -1.71 0.00 0.00 66.02 61.98 2jop s SER 104 CO 0.87 -0.42 -0.10 0.27 1.20 0.00 0.00 173.24 175.05 2jop s ILE 105 N -2.38 1.13 -0.25 6.45 -5.25 -0.43 -3.03 121.20 117.44 2jop s ILE 105 Ca 0.54 -2.04 0.00 0.00 -0.99 0.00 0.00 60.65 58.17 2jop s ILE 105 Cb -0.10 -1.82 0.07 0.00 2.95 0.00 0.00 42.46 43.56 2jop s ILE 105 CO 0.28 -0.75 -0.01 -0.63 -1.79 0.00 0.00 174.94 172.05 2jop s ILE 106 N -3.32 1.40 0.62 8.37 1.01 0.60 -2.56 121.20 127.31 2jop s ILE 106 Ca 0.16 -1.31 -0.08 0.00 0.00 0.00 0.00 60.65 59.42 2jop s ILE 106 Cb 0.03 -1.79 0.00 0.00 0.01 0.00 0.00 42.46 40.70 2jop s ILE 106 CO 0.00 -0.27 0.96 0.00 0.00 0.00 0.00 174.94 175.64 2jop s TYR 108 N -3.10 1.14 0.00 0.00 2.02 -1.26 0.67 117.35 116.82 2jop s TYR 108 Ca 0.55 -1.32 0.00 0.00 -0.37 0.00 0.00 57.07 55.93 2jop s TYR 108 Cb -0.11 -0.30 0.00 0.00 -0.40 0.00 0.00 41.96 41.15 2jop s TYR 108 CO 0.48 -0.94 0.00 0.41 -1.57 0.00 0.00 175.55 173.93 2jop n GLY 109 N -0.48 0.34 3.61 0.71 0.00 -1.24 -4.73 105.19 103.40 2jop n GLY 109 Ca 0.02 -1.78 -0.41 0.00 0.00 0.00 0.00 46.02 43.85 2jop n GLY 109 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2jop s GLN 110 N 0.00 3.96 -0.21 1.61 0.74 -1.26 -4.59 119.66 119.92 2jop s GLN 110 Ca 0.00 0.47 -0.37 0.00 0.05 0.00 0.00 55.36 55.51 2jop s GLN 110 Cb 0.00 -3.71 -0.14 0.00 1.10 0.00 0.00 33.01 30.26 2jop s GLN 110 CO 0.00 -0.59 1.84 -0.11 -0.55 0.00 0.00 175.29 175.87 2jop n LEU 111 N 5.99 2.82 0.00 3.68 7.94 -1.26 -1.08 117.00 135.10 2jop n LEU 111 Ca 0.01 0.99 0.00 0.00 -1.11 0.00 0.00 56.01 55.90 2jop n LEU 111 Cb 0.48 -1.24 0.00 0.00 0.53 0.00 0.00 43.42 43.19 2jop n LEU 111 CO 0.47 -0.29 0.00 0.61 -1.11 0.00 0.00 177.39 177.08 2jop n GLY 112 N 4.46 1.10 3.42 -3.96 0.00 -1.26 -5.04 105.19 103.91 2jop n GLY 112 Ca 0.26 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.84 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 -1.17 6.54 -0.13 1.61 0.01 -0.24 -3.93 113.70 116.39 2jop s SER 113 Ca 0.00 -1.96 0.02 0.00 1.31 0.00 0.00 55.95 55.32 2jop s SER 113 Cb 0.00 -2.36 0.23 0.00 0.21 0.00 0.00 66.02 64.10 2jop s SER 113 CO 0.00 -1.03 1.19 0.49 0.41 0.00 0.00 173.24 174.30 2jop n PHE 114 N 6.21 0.91 1.15 2.43 3.01 0.26 -3.76 117.46 127.66 2jop n PHE 114 Ca 0.15 -0.75 0.12 0.00 1.01 0.00 0.00 57.45 57.98 2jop n PHE 114 Cb 0.47 -0.41 0.23 0.00 -0.01 0.00 0.00 39.48 39.76 2jop n PHE 114 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 2jop n SER 115 N 0.03 1.48 -3.77 4.37 3.41 -1.26 -4.74 113.62 113.14 2jop n SER 115 Ca 0.17 -1.18 -0.13 0.00 -0.26 0.00 0.00 58.87 57.46 2jop n SER 115 Cb 0.79 0.27 -0.14 0.00 -0.26 0.00 0.00 64.21 64.87 2jop n SER 115 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2jop s ASN 116 N -2.47 -0.08 0.22 4.04 2.47 -1.25 -5.05 114.94 112.82 2jop s ASN 116 Ca 0.23 0.24 0.03 0.00 0.42 0.00 0.00 52.86 53.78 2jop s ASN 116 Cb 0.19 0.16 -0.01 0.00 -1.45 0.00 0.00 41.25 40.14 2jop s ASN 116 CO 0.53 -0.12 0.23 0.00 -3.72 0.00 0.00 177.10 174.02 2jop s SER 118 N -2.49 -0.16 0.66 0.00 0.01 -1.10 -4.80 113.70 105.81 2jop s SER 118 Ca 0.24 -0.51 -0.13 0.00 1.31 0.00 0.00 55.95 56.86 2jop s SER 118 Cb 0.01 0.49 -0.01 0.00 0.21 0.00 0.00 66.02 66.72 2jop s SER 118 CO 0.17 -0.92 1.06 -1.00 0.41 0.00 0.00 173.24 172.95 2jop s HIS 119 N -3.87 3.05 -0.82 2.43 3.76 -1.26 -0.29 115.29 118.29 2jop s HIS 119 Ca 0.08 1.46 -0.25 0.00 -0.15 0.00 0.00 55.06 56.20 2jop s HIS 119 Cb 0.01 -2.93 -0.01 0.00 1.11 0.00 0.00 32.58 30.76 2jop s HIS 119 CO -0.06 -1.20 1.74 0.45 -0.85 0.00 0.00 174.74 174.82 2jop s SER 120 N -3.39 5.56 0.00 1.40 0.15 -1.17 -4.11 113.70 112.14 2jop s SER 120 Ca 0.60 -0.50 0.29 0.00 0.70 0.00 0.00 55.95 57.04 2jop s SER 120 Cb -0.15 -2.55 1.70 0.00 -1.71 0.00 0.00 66.02 63.31 2jop s SER 120 CO 0.48 -2.29 2.06 0.54 1.20 0.00 0.00 173.24 175.22 2jop n ARG 121 N 9.03 0.86 -4.38 5.44 5.12 -1.26 -4.63 116.66 126.84 2jop n ARG 121 Ca 0.28 0.00 -0.19 0.00 -1.93 0.00 0.00 57.85 56.01 2jop n ARG 121 Cb 0.49 -1.50 -0.10 0.00 -1.16 0.00 0.00 32.46 30.19 2jop n ARG 121 CO 0.00 0.00 0.00 -0.80 -1.93 0.00 0.00 177.63 174.90 2jop s ASN 122 N -2.05 2.39 0.22 0.55 0.01 -1.26 -5.04 114.94 109.75 2jop s ASN 122 Ca 0.42 -1.18 -0.03 0.00 -0.71 0.00 0.00 52.86 51.36 2jop s ASN 122 Cb 0.20 -0.10 0.19 0.00 0.41 0.00 0.00 41.25 41.95 2jop s ASN 122 CO 0.34 -0.38 1.61 -0.78 -1.51 0.00 0.00 177.10 176.38 2jop h ASP 123 N 2.39 0.71 -4.10 -1.22 3.58 -2.00 -3.43 116.42 112.36 2jop h ASP 123 Ca -0.39 -0.28 -0.07 0.00 0.42 0.00 0.00 57.03 56.70 2jop h ASP 123 Cb 1.23 -0.20 -0.22 0.00 1.72 0.00 0.00 39.33 41.86 2jop h ASP 123 CO 0.66 0.97 -0.01 0.00 -2.88 0.00 0.00 179.24 177.98 2jop s MET 124 N -4.44 0.72 0.02 0.28 0.23 -1.26 -4.76 119.30 110.09 2jop s MET 124 Ca -0.09 0.72 0.10 0.00 -1.03 0.00 0.00 55.69 55.39 2jop s MET 124 Cb 0.13 0.35 -0.23 0.00 -1.53 0.00 0.00 34.83 33.55 2jop s MET 124 CO 0.83 -0.11 0.89 0.00 -2.03 0.00 0.00 175.02 174.60 2jop n HIS 126 N -3.18 0.00 -2.39 0.00 8.25 -1.26 -4.95 115.22 111.69 2jop n HIS 126 Ca -0.11 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.25 2jop n HIS 126 Cb 1.01 0.00 0.01 0.00 1.12 0.00 0.00 29.99 32.13 2jop n HIS 126 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2jop n SER 127 N 0.00 -3.53 -4.52 0.41 7.64 -1.23 -4.65 113.62 107.74 2jop n SER 127 Ca 0.00 -0.07 -0.49 0.00 1.01 0.00 0.00 58.87 59.32 2jop n SER 127 Cb 0.00 -2.62 -0.06 0.00 -1.01 0.00 0.00 64.21 60.52 2jop n SER 127 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2jop n LEU 128 N -1.72 2.60 -4.95 -3.43 7.94 -1.26 -0.32 117.00 115.86 2jop n LEU 128 Ca -0.09 0.46 -0.25 0.00 -1.11 0.00 0.00 56.01 55.02 2jop n LEU 128 Cb 0.57 -1.35 0.09 0.00 0.53 0.00 0.00 43.42 43.27 2jop n LEU 128 CO 0.18 -0.61 0.62 -0.83 -1.11 0.00 0.00 177.39 175.63 2jop s GLY 129 N 6.98 1.74 -0.07 -3.96 0.00 0.46 -4.04 107.32 108.43 2jop s GLY 129 Ca 1.05 -1.21 -0.03 0.00 0.00 0.00 0.00 44.72 44.53 2jop s GLY 129 CO 0.47 -0.71 0.12 1.08 0.00 0.00 0.00 173.10 174.06 2jop s LEU 130 N -5.28 0.02 -0.32 0.66 1.43 -1.18 -2.02 118.68 111.99 2jop s LEU 130 Ca 0.64 0.24 0.02 0.00 -1.03 0.00 0.00 54.13 54.00 2jop s LEU 130 Cb -0.08 0.12 0.09 0.00 0.03 0.00 0.00 46.19 46.35 2jop s LEU 130 CO 0.45 -0.25 0.04 -0.89 0.23 0.00 0.00 176.35 175.94 2jop s THR 131 N 2.23 1.85 -0.65 5.49 2.01 -0.35 -2.49 115.64 123.73 2jop s THR 131 Ca 0.04 -1.95 -0.31 0.00 0.31 0.00 0.00 61.69 59.77 2jop s THR 131 Cb -0.12 -2.32 -0.14 0.00 0.01 0.00 0.00 72.50 69.93 2jop s THR 131 CO -0.05 -0.53 2.45 0.00 -0.69 0.00 0.00 174.62 175.81 2jop n LEU 133 N 11.99 0.00 0.00 0.00 7.94 0.68 -4.62 117.00 132.99 2jop n LEU 133 Ca 0.50 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.40 2jop n LEU 133 Cb 0.25 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.20 2jop n LEU 133 CO 0.82 0.00 0.00 -1.84 -1.11 0.00 0.00 177.39 175.26