#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 4.80 0.16 0.55 1.02 -1.26 -4.98 118.68 118.96 2jop s LEU 26 Ca 0.00 -0.79 0.05 0.00 0.02 0.00 0.00 54.13 53.41 2jop s LEU 26 Cb 0.00 -2.11 -0.04 0.00 0.02 0.00 0.00 46.19 44.06 2jop s LEU 26 CO 0.00 -0.37 0.11 -0.44 0.02 0.00 0.00 176.35 175.67 2jop s SER 27 N 1.65 5.41 0.00 2.29 0.01 -1.25 -0.06 113.70 121.75 2jop s SER 27 Ca 0.04 -0.15 0.00 0.00 1.31 0.00 0.00 55.95 57.15 2jop s SER 27 Cb -0.19 -1.39 0.00 0.00 0.21 0.00 0.00 66.02 64.66 2jop s SER 27 CO 0.09 0.08 0.80 -2.67 0.41 0.00 0.00 173.24 171.95 2jop n TRP 28 N -0.22 0.00 0.02 2.43 4.27 -1.08 -1.61 117.44 121.25 2jop n TRP 28 Ca -0.09 0.00 0.02 0.00 -3.89 0.00 0.00 57.50 53.55 2jop n TRP 28 Cb 0.54 -0.02 0.05 0.00 -1.36 0.00 0.00 31.31 30.53 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 -0.40 0.14 -2.40 -2.67 0.18 -1.25 -4.10 117.16 106.66 2jop n TYR 29 Ca 0.00 -0.33 -0.41 0.00 1.88 0.00 0.00 57.90 59.05 2jop n TYR 29 Cb 0.04 -0.03 -0.04 0.00 -0.38 0.00 0.00 39.34 38.93 2jop n TYR 29 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 2jop s ASP 30 N -0.80 7.15 0.00 9.48 1.01 -0.63 -4.80 116.67 128.07 2jop s ASP 30 Ca 0.09 2.33 0.00 0.00 0.71 0.00 0.00 52.55 55.68 2jop s ASP 30 Cb 0.05 -2.63 0.00 0.00 1.01 0.00 0.00 42.92 41.35 2jop s ASP 30 CO 0.07 -0.25 0.64 -0.81 0.21 0.00 0.00 175.17 175.03 2jop n PRO 31 N 1.42 0.69 -0.00 8.23 -0.04 -1.26 -1.86 135.00 142.17 2jop n PRO 31 Ca 0.00 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.48 2jop n PRO 31 Cb 0.44 -1.04 -0.03 0.00 -0.04 0.00 0.00 33.50 32.84 2jop n PRO 31 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2jop n ASP 32 N -0.42 1.11 -4.90 3.54 2.03 -1.26 -5.05 116.55 111.60 2jop n ASP 32 Ca 0.00 -0.46 -0.31 0.00 0.52 0.00 0.00 54.79 54.54 2jop n ASP 32 Cb 0.02 1.05 -0.05 0.00 -0.72 0.00 0.00 41.12 41.42 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 -1.62 3.47 -0.11 -0.67 5.36 -0.78 -5.07 117.98 118.56 2jop s PHE 33 Ca 0.01 0.57 0.00 0.00 -0.96 0.00 0.00 56.93 56.55 2jop s PHE 33 Cb 0.03 -2.02 0.02 0.00 -0.34 0.00 0.00 43.02 40.71 2jop s PHE 33 CO 0.18 0.40 -0.11 -1.14 -1.46 0.00 0.00 175.22 173.09 2jop s GLN 34 N -2.76 1.81 0.22 10.12 2.00 -1.26 -4.82 119.66 124.96 2jop s GLN 34 Ca 0.42 -0.38 0.03 0.00 -2.00 0.00 0.00 55.36 53.42 2jop s GLN 34 Cb -0.12 -1.70 -0.05 0.00 0.80 0.00 0.00 33.01 31.94 2jop s GLN 34 CO 0.25 -0.19 0.02 0.00 -0.50 0.00 0.00 175.29 174.87 2jop s ALA 35 N 1.40 1.70 0.12 1.58 0.00 -1.26 -0.22 121.76 125.08 2jop s ALA 35 Ca 0.00 -1.75 -0.17 0.00 0.00 0.00 0.00 51.96 50.05 2jop s ALA 35 Cb -0.13 0.61 0.06 0.00 0.00 0.00 0.00 23.12 23.65 2jop s ALA 35 CO -0.06 -0.31 0.79 2.89 0.00 0.00 0.00 175.76 179.08 2jop n ARG 36 N -0.39 0.45 -4.67 0.00 1.85 0.44 -4.75 116.66 109.59 2jop n ARG 36 Ca -0.04 -1.05 -0.33 0.00 -1.00 0.00 0.00 57.85 55.42 2jop n ARG 36 Cb 0.64 1.44 -0.12 0.00 -1.05 0.00 0.00 32.46 33.37 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 3.06 0.13 2.89 1.43 -1.26 -0.37 118.68 124.57 2jop s LEU 37 Ca 0.18 -0.08 -0.07 0.00 -1.03 0.00 0.00 54.13 53.13 2jop s LEU 37 Cb -0.02 -1.67 -0.01 0.00 0.03 0.00 0.00 46.19 44.52 2jop s LEU 37 CO 0.04 0.35 0.21 -0.89 0.23 0.00 0.00 176.35 176.29 2jop s THR 38 N -0.81 0.10 0.00 5.49 2.01 -0.41 -4.58 115.64 117.44 2jop s THR 38 Ca 0.13 -1.41 0.00 0.00 0.31 0.00 0.00 61.69 60.71 2jop s THR 38 Cb -0.11 -1.70 0.00 0.00 0.01 0.00 0.00 72.50 70.70 2jop s THR 38 CO 0.02 -0.46 0.00 0.54 -0.69 0.00 0.00 174.62 174.03 2jop n ARG 39 N -0.14 0.00 -0.02 4.92 3.00 -1.26 -3.60 116.66 119.56 2jop n ARG 39 Ca -0.10 0.00 -0.13 0.00 -0.01 0.00 0.00 57.85 57.61 2jop n ARG 39 Cb 0.63 0.00 -0.10 0.00 0.00 0.00 0.00 32.46 32.99 2jop n ARG 39 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.63 178.40 2jop h SER 40 N 0.00 0.06 -6.50 0.55 0.02 -1.91 -3.49 113.55 102.28 2jop h SER 40 Ca 0.00 -0.55 -0.38 0.00 -0.84 0.00 0.00 61.79 60.02 2jop h SER 40 Cb 0.00 -0.02 0.02 0.00 0.14 0.00 0.00 62.40 62.54 2jop h SER 40 CO 0.00 0.60 -1.16 -3.20 -1.14 0.00 0.00 176.83 171.93 2jop n ASN 41 N -4.78 -5.58 -2.20 3.07 5.15 -1.25 -4.98 115.26 104.68 2jop n ASN 41 Ca -0.08 -0.20 -0.10 0.00 -0.60 0.00 0.00 54.58 53.59 2jop n ASN 41 Cb 0.30 -1.88 -0.04 0.00 -0.53 0.00 0.00 39.78 37.63 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 -0.44 0.01 -4.56 1.20 2.88 -0.74 -5.05 113.62 106.92 2jop n SER 42 Ca -0.10 -2.05 -0.15 0.00 -1.33 0.00 0.00 58.87 55.25 2jop n SER 42 Cb 0.67 0.72 -0.07 0.00 -0.75 0.00 0.00 64.21 64.79 2jop n SER 42 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 2jop s LYS 43 N -2.67 1.60 -1.22 -1.46 1.02 -1.26 -2.58 119.74 113.17 2jop s LYS 43 Ca 0.17 0.56 -0.04 0.00 0.02 0.00 0.00 55.97 56.67 2jop s LYS 43 Cb 0.01 -4.77 0.03 0.00 -0.52 0.00 0.00 37.83 32.58 2jop s LYS 43 CO 0.12 -4.41 0.27 0.00 -0.92 0.00 0.00 175.35 170.41 2jop s GLN 45 N -5.50 0.21 0.00 0.00 -2.07 -1.07 -0.29 119.66 110.94 2jop s GLN 45 Ca 0.19 0.39 0.00 0.00 -1.82 0.00 0.00 55.36 54.13 2jop s GLN 45 Cb -0.10 -0.02 0.00 0.00 -1.09 0.00 0.00 33.01 31.80 2jop s GLN 45 CO 0.24 -0.10 0.00 0.41 -1.32 0.00 0.00 175.29 174.52 2jop n GLY 46 N 3.63 -0.58 3.77 2.60 0.00 -0.97 -1.80 105.19 111.84 2jop n GLY 46 Ca -0.19 -1.18 -0.39 0.00 0.00 0.00 0.00 46.02 44.26 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 4.30 0.02 1.61 -0.21 -1.24 -2.80 119.66 119.35 2jop s GLN 47 Ca 0.00 1.76 -0.26 0.00 0.02 0.00 0.00 55.36 56.88 2jop s GLN 47 Cb 0.00 -2.84 -0.05 0.00 1.00 0.00 0.00 33.01 31.13 2jop s GLN 47 CO 0.00 -0.08 0.81 -1.17 -2.12 0.00 0.00 175.29 172.72 2jop s LEU 48 N -2.14 4.41 -0.07 2.90 2.96 -1.26 -1.29 118.68 124.19 2jop s LEU 48 Ca 0.52 1.46 0.00 0.00 -0.22 0.00 0.00 54.13 55.90 2jop s LEU 48 Cb -0.29 -3.29 0.02 0.00 0.50 0.00 0.00 46.19 43.13 2jop s LEU 48 CO 0.37 -0.06 -0.05 -0.70 -1.32 0.00 0.00 176.35 174.58 2jop s GLU 49 N 0.30 1.06 -0.01 1.98 2.12 0.50 -0.48 118.70 124.18 2jop s GLU 49 Ca 0.41 -0.13 0.06 0.00 0.36 0.00 0.00 54.97 55.67 2jop s GLU 49 Cb -0.20 -1.12 -0.02 0.00 0.26 0.00 0.00 34.13 33.05 2jop s GLU 49 CO 0.23 -0.16 -0.18 0.08 -0.54 0.00 0.00 175.26 174.69 2jop s VAL 50 N 1.30 1.45 -0.43 3.70 1.01 -0.67 -0.42 120.40 126.34 2jop s VAL 50 Ca -0.04 -0.82 -0.19 0.00 0.00 0.00 0.00 61.98 60.92 2jop s VAL 50 Cb -0.14 -1.21 0.02 0.00 0.00 0.00 0.00 36.38 35.06 2jop s VAL 50 CO -0.02 0.38 0.56 -0.47 0.00 0.00 0.00 175.10 175.54 2jop s TYR 51 N -0.47 3.11 -0.79 5.22 5.04 0.69 -0.22 117.35 129.93 2jop s TYR 51 Ca 0.07 -0.16 -0.05 0.00 -2.44 0.00 0.00 57.07 54.49 2jop s TYR 51 Cb -0.07 -3.16 0.20 0.00 0.35 0.00 0.00 41.96 39.28 2jop s TYR 51 CO -0.00 -0.79 0.66 -0.48 -1.34 0.00 0.00 175.55 173.60 2jop s LEU 52 N 2.55 5.69 0.00 6.97 2.34 0.28 -4.17 118.68 132.34 2jop s LEU 52 Ca 0.19 -3.19 0.00 0.00 0.06 0.00 0.00 54.13 51.18 2jop s LEU 52 Cb -0.15 -1.96 0.00 0.00 -0.56 0.00 0.00 46.19 43.52 2jop s LEU 52 CO 0.17 -0.33 0.00 0.29 -1.06 0.00 0.00 176.35 175.42 2jop n LYS 53 N 3.10 0.00 0.00 1.48 4.76 -1.26 -2.55 118.16 123.68 2jop n LYS 53 Ca 0.15 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.59 2jop n LYS 53 Cb 0.39 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.58 2jop n LYS 53 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 2jop n ASP 54 N 0.92 1.80 -4.31 4.39 5.75 -1.26 -5.05 116.55 118.79 2jop n ASP 54 Ca 0.00 0.00 -0.36 0.00 -0.01 0.00 0.00 54.79 54.42 2jop n ASP 54 Cb 0.00 0.25 -0.13 0.00 -1.03 0.00 0.00 41.12 40.21 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 -1.32 1.73 -1.09 6.12 0.00 -1.06 -4.98 107.32 106.72 2jop s GLY 55 Ca 0.00 -1.41 -0.19 0.00 0.00 0.00 0.00 44.72 43.12 2jop s GLY 55 CO 0.00 0.59 2.02 0.79 0.00 0.00 0.00 173.10 176.50 2jop n TRP 56 N 4.81 2.76 -2.32 1.90 7.02 -1.26 -0.55 117.44 129.81 2jop n TRP 56 Ca -0.15 -2.26 -0.41 0.00 -1.02 0.00 0.00 57.50 53.65 2jop n TRP 56 Cb 0.48 -2.17 -0.03 0.00 -2.42 0.00 0.00 31.31 27.18 2jop n TRP 56 CO 0.00 0.00 0.00 -1.01 -2.02 0.00 0.00 177.69 174.66 2jop s HIS 57 N 4.92 2.14 -0.33 -5.99 3.76 0.69 -4.71 115.29 115.76 2jop s HIS 57 Ca 0.55 0.48 -0.29 0.00 -0.15 0.00 0.00 55.06 55.65 2jop s HIS 57 Cb 0.12 -4.35 -0.01 0.00 1.11 0.00 0.00 32.58 29.46 2jop s HIS 57 CO 0.05 -2.11 1.52 0.00 -0.85 0.00 0.00 174.74 173.34 2jop s MET 58 N 5.83 3.64 0.65 1.40 0.23 -1.26 -1.67 119.30 128.11 2jop s MET 58 Ca 0.55 1.26 0.02 0.00 -1.03 0.00 0.00 55.69 56.49 2jop s MET 58 Cb -0.12 -4.04 0.10 0.00 -1.53 0.00 0.00 34.83 29.24 2jop s MET 58 CO 0.24 -1.49 0.90 0.14 -2.03 0.00 0.00 175.02 172.78 2jop s VAL 59 N 5.49 2.27 -0.34 5.16 -7.23 0.37 -1.98 120.40 124.14 2jop s VAL 59 Ca 0.67 -0.70 0.11 0.00 -1.81 0.00 0.00 61.98 60.24 2jop s VAL 59 Cb -0.19 -2.57 0.71 0.00 0.56 0.00 0.00 36.38 34.89 2jop s VAL 59 CO 0.30 0.00 1.66 0.00 -0.31 0.00 0.00 175.10 176.76 2jop n SER 61 N 0.24 0.00 -1.18 0.00 7.64 -1.26 -4.26 113.62 114.80 2jop n SER 61 Ca 0.31 0.00 -0.04 0.00 1.01 0.00 0.00 58.87 60.15 2jop n SER 61 Cb 1.20 0.00 0.05 0.00 -1.01 0.00 0.00 64.21 64.44 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 -1.22 1.43 10.64 -1.26 -4.87 117.38 123.47 2jop n GLN 62 Ca 0.00 -0.65 -0.30 0.00 -1.83 0.00 0.00 57.00 54.23 2jop n GLN 62 Cb 0.00 -1.33 0.21 0.00 -0.86 0.00 0.00 30.24 28.27 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 0.39 1.68 0.00 2.61 0.01 -1.26 -3.71 113.70 113.42 2jop s SER 63 Ca 0.12 0.74 0.00 0.00 1.31 0.00 0.00 55.95 58.12 2jop s SER 63 Cb 0.10 -1.08 0.00 0.00 0.21 0.00 0.00 66.02 65.25 2jop s SER 63 CO 0.03 -3.67 0.00 0.79 0.41 0.00 0.00 173.24 170.80 2jop n TRP 64 N -4.47 0.00 -2.65 2.43 8.01 0.19 -3.44 117.44 117.51 2jop n TRP 64 Ca 0.11 0.00 -0.02 0.00 -1.31 0.00 0.00 57.50 56.28 2jop n TRP 64 Cb 0.59 0.00 0.06 0.00 -2.01 0.00 0.00 31.31 29.95 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 -1.54 3.95 6.99 0.00 -1.26 -3.78 105.19 109.56 2jop n GLY 65 Ca 0.00 0.60 -0.24 0.00 0.00 0.00 0.00 46.02 46.38 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 0.00 3.44 0.22 1.61 1.81 -1.22 -4.96 118.95 119.85 2jop s ARG 66 Ca 0.12 -0.65 0.08 0.00 -1.72 0.00 0.00 55.73 53.56 2jop s ARG 66 Cb 0.18 -2.94 -0.04 0.00 -0.45 0.00 0.00 34.95 31.70 2jop s ARG 66 CO -0.14 0.49 0.05 0.45 -0.68 0.00 0.00 175.30 175.47 2jop s SER 67 N -3.48 4.90 -1.38 0.23 0.15 -1.26 -4.91 113.70 107.95 2jop s SER 67 Ca 0.34 -0.44 -0.14 0.00 0.70 0.00 0.00 55.95 56.42 2jop s SER 67 Cb -0.10 -1.07 -0.01 0.00 -1.71 0.00 0.00 66.02 63.13 2jop s SER 67 CO 0.29 0.03 2.33 -0.24 1.20 0.00 0.00 173.24 176.85 2jop n SER 68 N -0.64 4.70 -3.76 5.45 2.88 -1.26 -4.84 113.62 116.16 2jop n SER 68 Ca -0.08 -2.75 -0.14 0.00 -1.33 0.00 0.00 58.87 54.58 2jop n SER 68 Cb 0.57 -1.55 -0.14 0.00 -0.75 0.00 0.00 64.21 62.34 2jop n SER 68 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 2jop s LYS 69 N 3.23 0.08 -0.18 -1.46 2.20 -1.26 -5.13 119.74 117.23 2jop s LYS 69 Ca 0.52 0.34 -0.29 0.00 -0.36 0.00 0.00 55.97 56.19 2jop s LYS 69 Cb 0.15 -0.17 -0.00 0.00 -1.51 0.00 0.00 37.83 36.30 2jop s LYS 69 CO -0.06 -0.15 1.00 -1.14 -0.36 0.00 0.00 175.35 174.64 2jop s GLN 70 N 1.07 4.32 0.26 4.03 0.74 -1.26 -4.80 119.66 124.02 2jop s GLN 70 Ca -0.08 1.31 0.00 0.00 0.05 0.00 0.00 55.36 56.64 2jop s GLN 70 Cb -0.11 -3.60 0.00 0.00 1.10 0.00 0.00 33.01 30.41 2jop s GLN 70 CO -0.05 -0.48 0.00 0.91 -0.55 0.00 0.00 175.29 175.12 2jop n TRP 71 N 5.70 -2.31 -3.72 1.67 7.02 -1.26 -4.93 117.44 119.62 2jop n TRP 71 Ca 0.10 1.18 -0.25 0.00 -1.02 0.00 0.00 57.50 57.51 2jop n TRP 71 Cb 0.47 -2.10 0.05 0.00 -2.42 0.00 0.00 31.31 27.31 2jop n TRP 71 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 2jop n GLU 72 N -3.32 -6.09 0.00 -0.99 -0.58 -1.26 -4.48 120.64 103.92 2jop n GLU 72 Ca -0.01 0.69 0.00 0.00 -0.42 0.00 0.00 57.16 57.42 2jop n GLU 72 Cb 0.42 -5.55 0.00 0.00 -0.57 0.00 0.00 31.44 25.74 2jop n GLU 72 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 2jop n ASP 73 N -2.98 0.00 -4.46 1.62 2.03 -1.26 -5.07 116.55 106.43 2jop n ASP 73 Ca -0.10 0.00 -0.14 0.00 0.52 0.00 0.00 54.79 55.06 2jop n ASP 73 Cb 0.59 0.00 -0.12 0.00 -0.72 0.00 0.00 41.12 40.87 2jop n ASP 73 CO 0.00 0.00 0.00 -2.65 -1.92 0.00 0.00 177.20 172.63 2jop n PRO 74 N 0.00 0.22 -3.89 -0.67 -0.02 -1.26 -4.80 135.00 124.58 2jop n PRO 74 Ca 0.00 -0.56 -0.10 0.00 -2.02 0.00 0.00 63.50 60.81 2jop n PRO 74 Cb 0.00 -2.42 0.00 0.00 -0.02 0.00 0.00 33.50 31.07 2jop n PRO 74 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 2jop s SER 75 N 5.24 0.24 0.00 2.55 0.01 -1.25 -4.79 113.70 115.70 2jop s SER 75 Ca 0.92 -1.22 0.00 0.00 1.31 0.00 0.00 55.95 56.96 2jop s SER 75 Cb -0.35 0.80 0.00 0.00 0.21 0.00 0.00 66.02 66.68 2jop s SER 75 CO 0.26 -1.57 0.00 0.00 0.41 0.00 0.00 173.24 172.33 2jop n GLN 76 N -0.54 -1.48 -0.65 12.44 6.02 -1.26 -4.72 117.38 127.19 2jop n GLN 76 Ca -0.06 0.37 0.09 0.00 -0.01 0.00 0.00 57.00 57.39 2jop n GLN 76 Cb 0.60 -4.59 0.36 0.00 1.02 0.00 0.00 30.24 27.63 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 1.00 3.21 0.11 -1.58 0.00 -1.26 -3.80 120.51 118.19 2jop n ALA 77 Ca 0.00 -1.60 0.09 0.00 0.00 0.00 0.00 53.44 51.93 2jop n ALA 77 Cb 0.37 -1.04 0.58 0.00 0.00 0.00 0.00 19.45 19.35 2jop n ALA 77 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2jop h SER 78 N 4.04 0.16 -0.48 0.00 4.64 -1.84 -2.02 113.55 118.04 2jop h SER 78 Ca 0.00 -0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.25 2jop h SER 78 Cb 1.51 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 63.55 2jop h SER 78 CO 0.27 0.11 0.04 0.50 -0.87 0.00 0.00 176.83 176.87 2jop h LYS 79 N 0.18 0.83 -0.06 4.77 1.63 -1.81 0.32 116.57 122.44 2jop h LYS 79 Ca 0.11 -0.25 -0.13 0.00 -0.85 0.00 0.00 60.65 59.53 2jop h LYS 79 Cb 0.21 -0.08 0.01 0.00 -0.60 0.00 0.00 32.23 31.76 2jop h LYS 79 CO -0.02 0.86 -0.49 -0.39 -3.45 0.00 0.00 179.45 175.96 2jop h VAL 80 N 0.69 1.41 0.00 2.00 -1.51 -1.52 -2.27 116.25 115.05 2jop h VAL 80 Ca 0.14 -1.90 0.00 0.00 -1.23 0.00 0.00 66.70 63.72 2jop h VAL 80 Cb 0.46 2.38 0.00 0.00 -2.13 0.00 0.00 31.29 32.00 2jop h VAL 80 CO 0.02 0.56 0.00 0.00 -1.23 0.00 0.00 177.57 176.91 2jop h GLN 82 N 0.00 0.86 -0.00 0.00 5.75 -0.79 0.25 115.11 121.18 2jop h GLN 82 Ca 0.00 -0.19 -0.02 0.00 -0.15 0.00 0.00 58.65 58.28 2jop h GLN 82 Cb 0.76 -0.12 -0.00 0.00 1.07 0.00 0.00 27.48 29.18 2jop h GLN 82 CO 0.00 0.80 -0.10 0.00 -2.65 0.00 0.00 178.83 176.88 2jop h ARG 83 N 0.77 0.00 -0.32 1.69 3.08 -0.89 -1.15 114.38 117.55 2jop h ARG 83 Ca 0.18 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.22 2jop h ARG 83 Cb 0.30 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.35 2jop h ARG 83 CO -0.00 0.10 0.00 1.28 -1.07 0.00 0.00 179.97 180.28 2jop n LEU 84 N -4.42 1.68 -2.97 3.04 4.77 -0.49 -4.89 117.00 113.71 2jop n LEU 84 Ca -0.03 -0.84 -0.15 0.00 -0.03 0.00 0.00 56.01 54.96 2jop n LEU 84 Cb 0.18 -0.21 -0.01 0.00 -2.33 0.00 0.00 43.42 41.04 2jop n LEU 84 CO 0.35 0.41 -0.07 -0.46 -1.33 0.00 0.00 177.39 176.30 2jop n ASN 85 N 0.40 -2.75 -0.94 -1.43 0.23 -0.41 -4.81 115.26 105.56 2jop n ASN 85 Ca 0.10 -0.05 0.06 0.00 -0.53 0.00 0.00 54.58 54.17 2jop n ASN 85 Cb 0.27 -2.36 0.25 0.00 -2.08 0.00 0.00 39.78 35.86 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 -0.61 2.26 3.90 0.00 0.00 -1.22 -1.61 105.19 107.90 2jop n GLY 87 Ca 0.24 -0.13 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 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 3.62 -1.22 1.61 1.01 -1.24 -3.70 116.67 112.76 2jop s ASP 88 Ca 0.00 0.53 -0.09 0.00 0.71 0.00 0.00 52.55 53.71 2jop s ASP 88 Cb 0.00 -0.80 0.21 0.00 1.01 0.00 0.00 42.92 43.33 2jop s ASP 88 CO 0.00 -2.44 1.69 -0.81 0.21 0.00 0.00 175.17 173.83 2jop n PRO 89 N -3.62 3.79 -2.44 8.23 -0.04 -1.23 -3.89 135.00 135.80 2jop n PRO 89 Ca 0.12 -3.85 -0.01 0.00 -0.04 0.00 0.00 63.50 59.71 2jop n PRO 89 Cb 0.60 -2.83 -0.01 0.00 -0.04 0.00 0.00 33.50 31.22 2jop n PRO 89 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2jop n LEU 90 N 3.44 -4.52 -4.72 1.53 4.32 0.62 -3.91 117.00 113.75 2jop n LEU 90 Ca 0.35 1.98 -0.42 0.00 -0.02 0.00 0.00 56.01 57.90 2jop n LEU 90 Cb 0.36 -2.55 -0.03 0.00 -1.62 0.00 0.00 43.42 39.59 2jop n LEU 90 CO 0.76 -2.82 1.33 -0.44 -1.22 0.00 0.00 177.39 175.00 2jop s SER 91 N -0.37 6.41 -0.24 -1.43 0.01 -0.56 -4.33 113.70 113.20 2jop s SER 91 Ca -0.07 2.84 -0.23 0.00 1.31 0.00 0.00 55.95 59.80 2jop s SER 91 Cb 0.00 -2.60 -0.01 0.00 0.21 0.00 0.00 66.02 63.62 2jop s SER 91 CO 0.18 -0.94 0.77 -0.76 0.41 0.00 0.00 173.24 172.89 2jop s LEU 92 N 0.95 4.09 -0.25 2.44 1.43 -1.26 -2.56 118.68 123.52 2jop s LEU 92 Ca 0.73 0.95 -0.27 0.00 -1.03 0.00 0.00 54.13 54.50 2jop s LEU 92 Cb -0.49 -3.09 0.15 0.00 0.03 0.00 0.00 46.19 42.79 2jop s LEU 92 CO 0.34 -0.46 1.14 -0.83 0.23 0.00 0.00 176.35 176.78 2jop s GLY 93 N 1.35 -0.05 -0.15 -3.19 0.00 -1.02 -4.27 107.32 99.99 2jop s GLY 93 Ca 0.32 2.69 -0.29 0.00 0.00 0.00 0.00 44.72 47.45 2jop s GLY 93 CO 0.08 1.55 2.00 2.56 0.00 0.00 0.00 173.10 179.29 2jop s PRO 94 N -0.33 3.58 0.00 2.90 0.04 -1.26 0.10 135.00 140.03 2jop s PRO 94 Ca 0.03 2.11 0.00 0.00 0.04 0.00 0.00 61.00 63.18 2jop s PRO 94 Cb -0.03 -4.23 0.00 0.00 0.04 0.00 0.00 34.50 30.27 2jop s PRO 94 CO -0.06 -1.58 0.15 0.34 0.04 0.00 0.00 177.00 175.89 2jop n PHE 95 N 9.71 0.00 0.00 0.56 -0.00 0.89 -4.78 117.46 123.84 2jop n PHE 95 Ca 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.69 2jop n PHE 95 Cb 0.44 -0.05 0.00 0.00 -0.00 0.00 0.00 39.48 39.87 2jop n PHE 95 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.76 176.65 2jop n LEU 96 N -0.65 0.00 -4.82 -2.13 7.94 -1.26 -5.03 117.00 111.05 2jop n LEU 96 Ca 0.00 0.00 -0.38 0.00 -1.11 0.00 0.00 56.01 54.52 2jop n LEU 96 Cb 0.00 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 43.89 2jop n LEU 96 CO 0.00 0.00 0.28 -0.54 -1.11 0.00 0.00 177.39 176.02 2jop s LYS 97 N 0.00 4.16 0.51 1.96 1.02 -1.26 -4.98 119.74 121.15 2jop s LYS 97 Ca 0.00 0.70 0.07 0.00 0.02 0.00 0.00 55.97 56.76 2jop s LYS 97 Cb 0.00 -3.13 0.07 0.00 -0.52 0.00 0.00 37.83 34.25 2jop s LYS 97 CO 0.00 0.57 0.57 0.25 -0.92 0.00 0.00 175.35 175.82 2jop n THR 98 N 1.38 0.00 -2.46 2.17 -2.24 -1.26 -4.78 114.28 107.10 2jop n THR 98 Ca -0.08 -1.86 0.00 0.00 -2.27 0.00 0.00 64.05 59.84 2jop n THR 98 Cb 0.51 -0.34 0.00 0.00 -2.10 0.00 0.00 70.33 68.40 2jop n THR 98 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jop n TYR 99 N -1.93 -2.26 -4.25 4.78 0.18 -1.26 -5.04 117.16 107.37 2jop n TYR 99 Ca 0.07 0.00 -0.34 0.00 1.88 0.00 0.00 57.90 59.51 2jop n TYR 99 Cb 0.56 0.00 -0.13 0.00 -0.38 0.00 0.00 39.34 39.38 2jop n TYR 99 CO 0.00 0.00 0.00 0.99 -2.08 0.00 0.00 176.86 175.77 2jop s THR 100 N 1.01 3.55 -0.71 -3.48 2.01 -1.26 -5.01 115.64 111.74 2jop s THR 100 Ca 0.00 -0.46 -0.06 0.00 0.31 0.00 0.00 61.69 61.48 2jop s THR 100 Cb 0.00 -2.57 -0.10 0.00 0.01 0.00 0.00 72.50 69.83 2jop s THR 100 CO 0.00 0.46 2.43 -0.81 -0.69 0.00 0.00 174.62 176.02 2jop n PRO 101 N 4.10 2.10 0.00 4.92 -0.04 -1.26 -1.57 135.00 143.24 2jop n PRO 101 Ca -0.18 -1.31 0.00 0.00 -0.04 0.00 0.00 63.50 61.98 2jop n PRO 101 Cb 0.52 -2.29 0.00 0.00 -0.04 0.00 0.00 33.50 31.68 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 3.55 0.00 0.05 0.54 7.27 -1.26 -4.92 117.38 122.62 2jop n GLN 102 Ca 0.45 0.00 -0.13 0.00 0.07 0.00 0.00 57.00 57.39 2jop n GLN 102 Cb 0.32 0.00 -0.03 0.00 2.41 0.00 0.00 30.24 32.95 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 0.56 -3.92 1.69 0.02 -1.99 -3.44 113.55 106.46 2jop h SER 103 Ca 0.00 -0.42 -0.50 0.00 -0.84 0.00 0.00 61.79 60.04 2jop h SER 103 Cb 0.00 -0.17 0.04 0.00 0.14 0.00 0.00 62.40 62.41 2jop h SER 103 CO 0.00 1.20 0.25 -0.44 -1.14 0.00 0.00 176.83 176.69 2jop s SER 104 N -7.05 6.31 0.17 3.07 0.01 -0.61 -4.88 113.70 110.72 2jop s SER 104 Ca -0.06 1.18 0.07 0.00 1.31 0.00 0.00 55.95 58.45 2jop s SER 104 Cb 0.09 -2.36 -0.04 0.00 0.21 0.00 0.00 66.02 63.92 2jop s SER 104 CO 0.86 -0.66 -0.15 0.27 0.41 0.00 0.00 173.24 173.97 2jop s ILE 105 N -2.85 1.64 -0.32 1.44 -5.25 -0.84 -3.04 121.20 111.98 2jop s ILE 105 Ca 0.52 -2.01 0.00 0.00 -0.99 0.00 0.00 60.65 58.17 2jop s ILE 105 Cb -0.11 -1.86 0.08 0.00 2.95 0.00 0.00 42.46 43.52 2jop s ILE 105 CO 0.46 -0.48 0.03 -0.63 -1.79 0.00 0.00 174.94 172.52 2jop s ILE 106 N -2.54 2.70 0.57 8.37 1.01 1.00 -2.75 121.20 129.57 2jop s ILE 106 Ca 0.17 -1.81 -0.08 0.00 0.00 0.00 0.00 60.65 58.94 2jop s ILE 106 Cb -0.03 -2.73 -0.02 0.00 0.01 0.00 0.00 42.46 39.69 2jop s ILE 106 CO 0.06 -0.33 0.92 0.00 0.00 0.00 0.00 174.94 175.58 2jop s TYR 108 N -2.99 0.52 -4.69 0.00 2.02 -1.24 0.54 117.35 111.51 2jop s TYR 108 Ca 0.52 -1.00 0.00 0.00 -0.37 0.00 0.00 57.07 56.22 2jop s TYR 108 Cb -0.11 -0.38 0.00 0.00 -0.40 0.00 0.00 41.96 41.07 2jop s TYR 108 CO 0.48 -0.34 0.00 0.41 -1.57 0.00 0.00 175.55 174.53 2jop n GLY 109 N 0.26 0.79 3.56 0.71 0.00 -1.25 -4.72 105.19 104.54 2jop n GLY 109 Ca -0.15 -1.72 -0.35 0.00 0.00 0.00 0.00 46.02 43.80 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 -1.88 3.84 0.00 1.61 1.11 -1.26 -4.34 119.66 118.74 2jop s GLN 110 Ca 0.00 -0.41 0.00 0.00 0.01 0.00 0.00 55.36 54.96 2jop s GLN 110 Cb 0.00 -3.21 0.00 0.00 -1.01 0.00 0.00 33.01 28.79 2jop s GLN 110 CO 0.00 0.13 0.00 -0.11 0.01 0.00 0.00 175.29 175.32 2jop n LEU 111 N 3.96 0.00 -2.51 2.90 7.94 -1.26 -2.37 117.00 125.66 2jop n LEU 111 Ca -0.16 0.00 -0.04 0.00 -1.11 0.00 0.00 56.01 54.70 2jop n LEU 111 Cb 0.52 0.00 0.02 0.00 0.53 0.00 0.00 43.42 44.50 2jop n LEU 111 CO 0.34 0.00 0.56 0.61 -1.11 0.00 0.00 177.39 177.78 2jop n GLY 112 N 0.00 -0.14 3.54 -3.96 0.00 -1.26 -4.77 105.19 98.60 2jop n GLY 112 Ca 0.00 -0.05 -0.43 0.00 0.00 0.00 0.00 46.02 45.54 2jop n GLY 112 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2jop s SER 113 N -0.44 6.40 -0.14 1.61 0.15 -1.00 -2.63 113.70 117.65 2jop s SER 113 Ca 0.07 -0.17 -0.00 0.00 0.70 0.00 0.00 55.95 56.55 2jop s SER 113 Cb 0.15 -2.41 0.11 0.00 -1.71 0.00 0.00 66.02 62.16 2jop s SER 113 CO -0.04 -1.05 1.86 0.49 1.20 0.00 0.00 173.24 175.71 2jop n PHE 114 N 7.04 0.74 0.13 3.44 3.01 0.91 -4.08 117.46 128.65 2jop n PHE 114 Ca 0.03 -1.35 0.02 0.00 1.01 0.00 0.00 57.45 57.16 2jop n PHE 114 Cb 0.48 -0.66 0.03 0.00 -0.01 0.00 0.00 39.48 39.31 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 1.05 0.00 -3.80 4.37 4.64 -1.92 -3.46 113.55 114.43 2jop h SER 115 Ca 0.14 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.37 2jop h SER 115 Cb 1.04 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 62.90 2jop h SER 115 CO 0.35 0.54 -0.12 0.54 -0.87 0.00 0.00 176.83 177.28 2jop s ASN 116 N -6.48 -0.56 0.08 4.97 4.22 -1.26 -5.11 114.94 110.80 2jop s ASN 116 Ca 0.03 1.06 0.01 0.00 -2.14 0.00 0.00 52.86 51.82 2jop s ASN 116 Cb 0.08 1.05 -0.00 0.00 1.28 0.00 0.00 41.25 43.66 2jop s ASN 116 CO 0.75 -0.19 0.02 0.00 -2.04 0.00 0.00 177.10 175.65 2jop s SER 118 N -1.47 -0.01 0.87 0.00 0.15 -0.48 -4.79 113.70 107.96 2jop s SER 118 Ca 0.03 -0.59 -0.11 0.00 0.70 0.00 0.00 55.95 55.98 2jop s SER 118 Cb 0.00 0.41 0.11 0.00 -1.71 0.00 0.00 66.02 64.83 2jop s SER 118 CO 0.02 -0.81 1.10 -1.38 1.20 0.00 0.00 173.24 173.37 2jop s HIS 119 N -3.87 2.27 -0.43 3.44 -3.43 -1.26 -0.00 115.29 112.01 2jop s HIS 119 Ca 0.07 1.44 -0.29 0.00 -0.80 0.00 0.00 55.06 55.47 2jop s HIS 119 Cb 0.03 -3.14 -0.09 0.00 -1.43 0.00 0.00 32.58 27.96 2jop s HIS 119 CO -0.09 -2.30 2.34 -1.13 -2.00 0.00 0.00 174.74 171.56 2jop n SER 120 N -3.85 2.34 0.02 7.38 3.41 -1.17 -3.96 113.62 117.78 2jop n SER 120 Ca 0.08 -0.02 -0.01 0.00 -0.26 0.00 0.00 58.87 58.66 2jop n SER 120 Cb 0.54 -1.43 -0.00 0.00 -0.26 0.00 0.00 64.21 63.05 2jop n SER 120 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 2jop h ARG 121 N 15.86 -0.05 -0.50 4.33 2.43 -1.93 -3.44 114.38 131.07 2jop h ARG 121 Ca -0.28 0.00 0.18 0.00 -0.81 0.00 0.00 59.98 59.08 2jop h ARG 121 Cb 1.28 0.01 -0.20 0.00 -0.42 0.00 0.00 29.97 30.64 2jop h ARG 121 CO 1.09 -0.03 -0.05 1.21 -1.51 0.00 0.00 179.97 180.68 2jop s ASN 122 N -2.68 -0.76 0.00 -3.80 3.84 -1.26 -5.05 114.94 105.23 2jop s ASN 122 Ca -0.01 0.28 0.00 0.00 0.21 0.00 0.00 52.86 53.35 2jop s ASN 122 Cb 0.00 1.56 0.00 0.00 -0.55 0.00 0.00 41.25 42.26 2jop s ASN 122 CO 0.02 -0.14 0.00 -0.67 -2.79 0.00 0.00 177.10 173.52 2jop n ASP 123 N 5.35 0.00 0.00 -4.21 2.03 -1.26 -4.82 116.55 113.64 2jop n ASP 123 Ca 0.01 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.32 2jop n ASP 123 Cb 0.55 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.95 2jop n ASP 123 CO 0.00 0.00 0.00 0.23 -1.92 0.00 0.00 177.20 175.51 2jop n MET 124 N 0.00 0.00 -2.35 -0.67 2.81 -1.26 -4.34 117.12 111.32 2jop n MET 124 Ca 0.00 0.00 -0.43 0.00 -1.81 0.00 0.00 57.70 55.46 2jop n MET 124 Cb 0.00 0.00 -0.02 0.00 -0.71 0.00 0.00 33.22 32.49 2jop n MET 124 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2jop n HIS 126 N 6.83 0.00 0.15 0.00 -0.00 -1.26 -4.92 115.22 116.02 2jop n HIS 126 Ca 0.15 0.00 -0.05 0.00 -0.00 0.00 0.00 57.72 57.82 2jop n HIS 126 Cb 0.45 0.00 0.02 0.00 -0.00 0.00 0.00 29.99 30.46 2jop n HIS 126 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.34 175.21 2jop n SER 127 N 0.00 4.12 -4.64 0.41 3.41 -1.26 -4.87 113.62 110.79 2jop n SER 127 Ca 0.00 -2.40 -0.42 0.00 -0.26 0.00 0.00 58.87 55.78 2jop n SER 127 Cb 0.00 -0.77 -0.03 0.00 -0.26 0.00 0.00 64.21 63.15 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 -0.57 4.15 0.65 1.04 1.43 -1.26 -0.08 118.68 124.04 2jop s LEU 128 Ca 0.10 2.41 0.03 0.00 -1.03 0.00 0.00 54.13 55.64 2jop s LEU 128 Cb 0.08 -3.53 0.10 0.00 0.03 0.00 0.00 46.19 42.88 2jop s LEU 128 CO 0.01 -1.30 0.90 -0.83 0.23 0.00 0.00 176.35 175.36 2jop s GLY 129 N 5.43 1.76 -0.17 -3.19 0.00 0.11 -4.51 107.32 106.76 2jop s GLY 129 Ca 0.91 -1.84 -0.04 0.00 0.00 0.00 0.00 44.72 43.74 2jop s GLY 129 CO 0.39 -1.33 0.14 1.08 0.00 0.00 0.00 173.10 173.38 2jop s LEU 130 N -4.94 0.12 -0.42 0.66 1.43 -1.12 -2.44 118.68 111.97 2jop s LEU 130 Ca 0.64 -0.33 0.03 0.00 -1.03 0.00 0.00 54.13 53.44 2jop s LEU 130 Cb -0.06 0.04 0.11 0.00 0.03 0.00 0.00 46.19 46.32 2jop s LEU 130 CO 0.42 -0.32 0.15 -0.89 0.23 0.00 0.00 176.35 175.93 2jop s THR 131 N 2.22 2.51 0.03 5.49 2.01 -1.06 -2.29 115.64 124.56 2jop s THR 131 Ca 0.04 -2.71 -0.07 0.00 0.31 0.00 0.00 61.69 59.26 2jop s THR 131 Cb -0.15 -2.79 -0.01 0.00 0.01 0.00 0.00 72.50 69.55 2jop s THR 131 CO -0.09 -0.69 1.06 0.00 -0.69 0.00 0.00 174.62 174.21 2jop s LEU 133 N -6.91 4.31 0.00 0.00 1.98 -0.64 -0.28 118.68 117.15 2jop s LEU 133 Ca -0.03 -1.77 0.00 0.00 -2.89 0.00 0.00 54.13 49.44 2jop s LEU 133 Cb 0.02 -2.48 0.00 0.00 0.66 0.00 0.00 46.19 44.39 2jop s LEU 133 CO 0.13 -1.27 0.00 -1.84 -1.89 0.00 0.00 176.35 171.48