#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 4.24 0.05 2.89 1.02 -1.26 -4.97 118.68 120.64 2jop s LEU 26 Ca 0.00 1.85 -0.06 0.00 0.02 0.00 0.00 54.13 55.94 2jop s LEU 26 Cb 0.00 -3.54 -0.01 0.00 0.02 0.00 0.00 46.19 42.66 2jop s LEU 26 CO 0.00 -0.75 0.12 -0.94 0.02 0.00 0.00 176.35 174.80 2jop s SER 27 N 2.10 0.17 -0.00 2.29 1.04 -1.25 -0.57 113.70 117.47 2jop s SER 27 Ca 0.59 -0.56 0.01 0.00 0.48 0.00 0.00 55.95 56.47 2jop s SER 27 Cb -0.25 0.26 0.04 0.00 0.10 0.00 0.00 66.02 66.17 2jop s SER 27 CO 0.20 -0.57 0.90 -2.67 0.98 0.00 0.00 173.24 172.08 2jop n TRP 28 N 0.55 0.08 -0.44 5.02 4.27 -1.26 -2.24 117.44 123.41 2jop n TRP 28 Ca -0.18 -0.03 0.04 0.00 -3.89 0.00 0.00 57.50 53.44 2jop n TRP 28 Cb 0.59 -0.04 0.05 0.00 -1.36 0.00 0.00 31.31 30.56 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 -0.25 0.00 -2.85 -2.67 0.18 -1.26 -4.01 117.16 106.30 2jop n TYR 29 Ca 0.02 -0.67 -0.41 0.00 1.88 0.00 0.00 57.90 58.72 2jop n TYR 29 Cb 0.12 -0.09 -0.04 0.00 -0.38 0.00 0.00 39.34 38.95 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 -1.68 7.29 0.56 9.48 -1.08 -0.95 -4.95 116.67 125.33 2jop s ASP 30 Ca 0.12 1.56 0.25 0.00 -0.52 0.00 0.00 52.55 53.95 2jop s ASP 30 Cb 0.10 -2.52 1.51 0.00 -1.46 0.00 0.00 42.92 40.56 2jop s ASP 30 CO 0.01 -0.11 2.10 -0.65 0.52 0.00 0.00 175.17 177.05 2jop h PRO 31 N 6.15 0.00 0.00 4.34 0.11 -1.95 -2.12 132.00 138.52 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 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2jop h PRO 31 CO 0.73 0.00 -1.88 -3.47 -0.21 0.00 0.00 178.00 173.17 2jop n ASP 32 N -4.14 0.57 -4.76 -2.05 -0.08 -1.26 -4.99 116.55 99.84 2jop n ASP 32 Ca 0.02 -0.01 -0.41 0.00 -1.51 0.00 0.00 54.79 52.88 2jop n ASP 32 Cb 0.31 1.88 -0.00 0.00 2.34 0.00 0.00 41.12 45.64 2jop n ASP 32 CO 0.00 0.00 0.00 0.33 0.12 0.00 0.00 177.20 177.65 2jop n PHE 33 N -2.17 2.84 -3.59 -0.67 7.35 -0.80 -4.96 117.46 115.45 2jop n PHE 33 Ca -0.03 0.46 -0.39 0.00 -0.76 0.00 0.00 57.45 56.72 2jop n PHE 33 Cb 0.50 -2.51 -0.11 0.00 0.35 0.00 0.00 39.48 37.71 2jop n PHE 33 CO 0.00 0.00 0.00 -0.65 -0.76 0.00 0.00 176.76 175.35 2jop s GLN 34 N -1.94 3.54 0.05 -4.13 -0.21 -1.26 -4.91 119.66 110.80 2jop s GLN 34 Ca 0.54 -0.60 -0.02 0.00 0.02 0.00 0.00 55.36 55.30 2jop s GLN 34 Cb -0.50 -3.68 -0.03 0.00 1.00 0.00 0.00 33.01 29.80 2jop s GLN 34 CO 0.62 -0.37 0.01 0.00 -2.12 0.00 0.00 175.29 173.44 2jop s ALA 35 N 1.69 0.30 0.06 6.09 0.00 -1.26 -1.36 121.76 127.27 2jop s ALA 35 Ca 0.06 -0.99 -0.15 0.00 0.00 0.00 0.00 51.96 50.88 2jop s ALA 35 Cb -0.17 0.28 0.05 0.00 0.00 0.00 0.00 23.12 23.29 2jop s ALA 35 CO 0.09 -0.36 0.70 2.89 0.00 0.00 0.00 175.76 179.08 2jop n ARG 36 N 0.32 0.27 -3.99 0.00 1.85 0.12 -4.93 116.66 110.30 2jop n ARG 36 Ca -0.16 -0.72 -0.21 0.00 -1.00 0.00 0.00 57.85 55.76 2jop n ARG 36 Cb 0.60 1.04 -0.03 0.00 -1.05 0.00 0.00 32.46 33.02 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 4.19 0.00 2.89 1.43 -1.26 -0.26 118.68 125.66 2jop s LEU 37 Ca 0.16 -0.02 0.00 0.00 -1.03 0.00 0.00 54.13 53.25 2jop s LEU 37 Cb -0.01 -2.73 0.00 0.00 0.03 0.00 0.00 46.19 43.48 2jop s LEU 37 CO 0.02 -0.07 0.00 0.35 0.23 0.00 0.00 176.35 176.88 2jop n THR 38 N -1.36 0.00 -0.89 5.49 -2.24 0.54 -4.68 114.28 111.14 2jop n THR 38 Ca -0.08 0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.42 2jop n THR 38 Cb 0.57 -1.77 -0.02 0.00 -2.10 0.00 0.00 70.33 67.01 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 -0.72 2.25 -0.06 -0.78 1.74 -1.26 -4.32 116.66 113.51 2jop n ARG 39 Ca 0.00 -1.63 0.12 0.00 -0.77 0.00 0.00 57.85 55.57 2jop n ARG 39 Cb 0.00 -2.57 0.32 0.00 -1.02 0.00 0.00 32.46 29.18 2jop n ARG 39 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2jop n SER 40 N 4.56 2.30 0.00 0.55 3.41 -1.26 -4.95 113.62 118.23 2jop n SER 40 Ca 0.50 -1.78 0.00 0.00 -0.26 0.00 0.00 58.87 57.33 2jop n SER 40 Cb 0.18 -0.08 0.00 0.00 -0.26 0.00 0.00 64.21 64.05 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 0.77 0.00 -4.64 4.04 3.02 -1.26 -4.87 115.26 112.32 2jop n ASN 41 Ca 0.17 0.00 -0.43 0.00 -0.03 0.00 0.00 54.58 54.29 2jop n ASN 41 Cb 0.46 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.60 2jop n ASN 41 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2jop s SER 42 N 0.00 6.67 0.00 6.41 0.15 -1.26 -4.87 113.70 120.79 2jop s SER 42 Ca 0.00 1.51 0.23 0.00 0.70 0.00 0.00 55.95 58.39 2jop s SER 42 Cb 0.00 -2.54 1.04 0.00 -1.71 0.00 0.00 66.02 62.81 2jop s SER 42 CO 0.00 -1.03 1.73 0.29 1.20 0.00 0.00 173.24 175.43 2jop n LYS 43 N 7.21 0.14 -0.02 5.44 4.76 -1.26 -2.49 118.16 131.95 2jop n LYS 43 Ca 0.16 0.10 0.00 0.00 -2.87 0.00 0.00 58.31 55.70 2jop n LYS 43 Cb 0.45 -1.50 0.01 0.00 -1.84 0.00 0.00 35.03 32.16 2jop n LYS 43 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2jop s GLN 45 N -1.00 0.18 0.00 0.00 -0.21 -1.04 0.06 119.66 117.65 2jop s GLN 45 Ca 0.02 0.64 0.00 0.00 0.02 0.00 0.00 55.36 56.04 2jop s GLN 45 Cb 0.01 -0.08 0.00 0.00 1.00 0.00 0.00 33.01 33.94 2jop s GLN 45 CO 0.01 -0.22 0.00 0.41 -2.12 0.00 0.00 175.29 173.37 2jop n GLY 46 N 4.78 -0.94 3.84 3.09 0.00 -0.84 -4.25 105.19 110.86 2jop n GLY 46 Ca -0.16 -1.03 -0.37 0.00 0.00 0.00 0.00 46.02 44.46 2jop n GLY 46 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2jop s GLN 47 N -2.00 3.93 0.25 1.61 0.74 -1.26 -2.85 119.66 120.08 2jop s GLN 47 Ca 0.00 0.42 -0.30 0.00 0.05 0.00 0.00 55.36 55.53 2jop s GLN 47 Cb 0.00 -3.10 -0.09 0.00 1.10 0.00 0.00 33.01 30.91 2jop s GLN 47 CO 0.00 0.60 1.29 -1.17 -0.55 0.00 0.00 175.29 175.46 2jop s LEU 48 N -1.49 4.43 -0.12 3.68 2.96 -1.26 -0.34 118.68 126.54 2jop s LEU 48 Ca 0.30 2.48 -0.01 0.00 -0.22 0.00 0.00 54.13 56.68 2jop s LEU 48 Cb -0.16 -3.62 0.04 0.00 0.50 0.00 0.00 46.19 42.94 2jop s LEU 48 CO 0.17 -0.49 -0.01 -0.70 -1.32 0.00 0.00 176.35 174.00 2jop s GLU 49 N -0.78 0.87 0.02 1.98 2.12 0.64 -1.08 118.70 122.48 2jop s GLU 49 Ca 0.53 -0.18 0.06 0.00 0.36 0.00 0.00 54.97 55.74 2jop s GLU 49 Cb -0.37 -1.52 -0.02 0.00 0.26 0.00 0.00 34.13 32.48 2jop s GLU 49 CO 0.43 -0.41 -0.17 0.14 -0.54 0.00 0.00 175.26 174.71 2jop s VAL 50 N 1.85 1.34 -0.48 3.70 -7.23 -0.32 -0.70 120.40 118.56 2jop s VAL 50 Ca 0.03 -0.94 -0.16 0.00 -1.81 0.00 0.00 61.98 59.10 2jop s VAL 50 Cb -0.14 -1.16 0.07 0.00 0.56 0.00 0.00 36.38 35.71 2jop s VAL 50 CO -0.07 0.20 0.42 -0.47 -0.31 0.00 0.00 175.10 174.87 2jop s TYR 51 N -0.66 3.22 0.08 2.82 5.04 -0.47 -0.09 117.35 127.30 2jop s TYR 51 Ca 0.05 -0.89 -0.24 0.00 -2.44 0.00 0.00 57.07 53.55 2jop s TYR 51 Cb -0.07 -3.22 0.06 0.00 0.35 0.00 0.00 41.96 39.07 2jop s TYR 51 CO 0.01 -0.83 0.58 -0.48 -1.34 0.00 0.00 175.55 173.49 2jop s LEU 52 N 1.75 -0.37 -1.45 6.97 -0.00 -0.73 -4.56 118.68 120.28 2jop s LEU 52 Ca 0.05 0.17 -0.10 0.00 -0.00 0.00 0.00 54.13 54.25 2jop s LEU 52 Cb -0.24 2.40 0.06 0.00 -0.00 0.00 0.00 46.19 48.41 2jop s LEU 52 CO 0.07 -0.82 0.74 1.17 -0.00 0.00 0.00 176.35 177.51 2jop n LYS 53 N 0.11 -4.70 -1.48 1.48 0.00 -1.26 -1.34 118.16 110.97 2jop n LYS 53 Ca -0.18 0.62 -0.17 0.00 0.00 0.00 0.00 58.31 58.59 2jop n LYS 53 Cb 0.62 -5.45 -0.07 0.00 0.00 0.00 0.00 35.03 30.13 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 -2.58 -5.18 -4.12 3.14 5.68 -1.26 -4.93 116.55 107.29 2jop n ASP 54 Ca -0.01 0.42 -0.33 0.00 -0.50 0.00 0.00 54.79 54.37 2jop n ASP 54 Cb 0.55 -4.39 -0.16 0.00 -1.14 0.00 0.00 41.12 35.98 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 -2.54 1.41 -1.18 6.12 0.00 -0.45 -5.02 107.32 105.65 2jop s GLY 55 Ca 0.00 -1.24 -0.23 0.00 0.00 0.00 0.00 44.72 43.25 2jop s GLY 55 CO 0.00 0.30 1.94 -0.98 0.00 0.00 0.00 173.10 174.35 2jop s TRP 56 N 1.29 1.94 -0.15 1.90 0.52 -1.26 -1.77 118.94 121.41 2jop s TRP 56 Ca 0.05 0.49 -0.29 0.00 0.02 0.00 0.00 56.10 56.36 2jop s TRP 56 Cb -0.13 -3.99 -0.01 0.00 -1.15 0.00 0.00 33.47 28.19 2jop s TRP 56 CO -0.12 -1.19 1.07 -1.01 0.02 0.00 0.00 176.95 175.71 2jop s HIS 57 N 11.12 3.35 -0.61 -1.98 3.76 0.87 -4.77 115.29 127.04 2jop s HIS 57 Ca 0.69 1.45 -0.28 0.00 -0.15 0.00 0.00 55.06 56.77 2jop s HIS 57 Cb -0.01 -3.28 0.03 0.00 1.11 0.00 0.00 32.58 30.44 2jop s HIS 57 CO 0.13 -0.59 1.19 -1.64 -0.85 0.00 0.00 174.74 172.99 2jop s MET 58 N 2.62 3.44 0.43 1.40 -1.94 -1.26 -1.17 119.30 122.81 2jop s MET 58 Ca 0.48 0.11 0.00 0.00 -1.71 0.00 0.00 55.69 54.58 2jop s MET 58 Cb -0.18 -4.05 -0.01 0.00 2.01 0.00 0.00 34.83 32.60 2jop s MET 58 CO 0.14 -1.75 0.65 0.14 -0.01 0.00 0.00 175.02 174.18 2jop s VAL 59 N 5.02 4.19 -1.98 -6.03 -7.23 -0.24 -0.26 120.40 113.86 2jop s VAL 59 Ca 0.40 -0.49 0.29 0.00 -1.81 0.00 0.00 61.98 60.37 2jop s VAL 59 Cb -0.08 -3.54 0.82 0.00 0.56 0.00 0.00 36.38 34.14 2jop s VAL 59 CO 0.23 -0.37 2.07 0.00 -0.31 0.00 0.00 175.10 176.72 2jop n SER 61 N -1.01 0.00 -0.61 0.00 7.64 -1.26 -4.09 113.62 114.29 2jop n SER 61 Ca 0.22 0.00 0.10 0.00 1.01 0.00 0.00 58.87 60.20 2jop n SER 61 Cb 0.10 0.00 0.35 0.00 -1.01 0.00 0.00 64.21 63.65 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 1.80 -1.09 1.43 -0.00 -1.25 -4.82 117.38 113.46 2jop n GLN 62 Ca 0.00 -1.20 -0.34 0.00 -0.00 0.00 0.00 57.00 55.46 2jop n GLN 62 Cb 0.00 -1.40 0.11 0.00 -0.00 0.00 0.00 30.24 28.95 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 0.43 -0.44 0.00 2.61 7.64 -1.26 -2.31 113.62 120.28 2jop n SER 63 Ca 0.16 0.53 0.00 0.00 1.01 0.00 0.00 58.87 60.57 2jop n SER 63 Cb 0.35 -1.34 0.00 0.00 -1.01 0.00 0.00 64.21 62.21 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 -3.06 0.00 0.00 1.43 8.01 0.62 -4.80 117.44 119.64 2jop n TRP 64 Ca 0.11 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.30 2jop n TRP 64 Cb 0.51 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.81 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 0.96 2.43 6.99 0.00 -0.98 -3.21 105.19 111.38 2jop n GLY 65 Ca 0.00 -0.58 -0.16 0.00 0.00 0.00 0.00 46.02 45.28 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 0.00 0.41 -3.57 1.61 1.74 -1.23 -4.84 116.66 110.78 2jop n ARG 66 Ca 0.00 -2.52 -0.41 0.00 -0.77 0.00 0.00 57.85 54.15 2jop n ARG 66 Cb 0.00 1.85 -0.10 0.00 -1.02 0.00 0.00 32.46 33.19 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 -2.78 5.73 0.37 0.55 0.01 -1.26 -4.87 113.70 111.45 2jop s SER 67 Ca 0.25 -1.33 0.04 0.00 1.31 0.00 0.00 55.95 56.22 2jop s SER 67 Cb 0.01 -2.02 -0.05 0.00 0.21 0.00 0.00 66.02 64.17 2jop s SER 67 CO 0.18 -0.51 0.07 -0.55 0.41 0.00 0.00 173.24 172.84 2jop s SER 68 N 2.02 2.76 0.09 2.44 0.15 -1.26 -5.05 113.70 114.85 2jop s SER 68 Ca 0.03 -1.49 -0.18 0.00 0.70 0.00 0.00 55.95 55.00 2jop s SER 68 Cb -0.22 0.13 -0.07 0.00 -1.71 0.00 0.00 66.02 64.16 2jop s SER 68 CO 0.04 -0.72 1.55 0.50 1.20 0.00 0.00 173.24 175.81 2jop h LYS 69 N 1.92 0.47 -1.56 5.44 1.63 -2.01 -3.47 116.57 118.99 2jop h LYS 69 Ca -0.40 -0.14 0.07 0.00 -0.85 0.00 0.00 60.65 59.34 2jop h LYS 69 Cb 1.26 -0.05 -0.25 0.00 -0.60 0.00 0.00 32.23 32.59 2jop h LYS 69 CO 0.67 0.61 0.51 1.14 -3.45 0.00 0.00 179.45 178.93 2jop s GLN 70 N -5.09 0.54 -0.09 1.90 -2.07 -1.26 -4.57 119.66 109.02 2jop s GLN 70 Ca -0.13 0.34 -0.17 0.00 -1.82 0.00 0.00 55.36 53.58 2jop s GLN 70 Cb 0.08 0.26 -0.05 0.00 -1.09 0.00 0.00 33.01 32.21 2jop s GLN 70 CO 0.75 -0.13 0.44 -1.58 -1.32 0.00 0.00 175.29 173.46 2jop s TRP 71 N -0.49 3.56 0.15 9.60 0.52 -1.21 -4.97 118.94 126.10 2jop s TRP 71 Ca 0.01 0.89 0.01 0.00 0.02 0.00 0.00 56.10 57.02 2jop s TRP 71 Cb -0.03 -2.47 -0.05 0.00 -1.15 0.00 0.00 33.47 29.77 2jop s TRP 71 CO -0.02 0.28 1.34 0.93 0.02 0.00 0.00 176.95 179.50 2jop h GLU 72 N 6.25 0.22 -3.32 4.98 5.08 -2.02 -3.40 114.58 122.37 2jop h GLU 72 Ca -0.43 -0.26 -0.62 0.00 -1.00 0.00 0.00 59.36 57.05 2jop h GLU 72 Cb 1.19 0.08 -0.40 0.00 0.50 0.00 0.00 28.75 30.11 2jop h GLU 72 CO 0.72 1.00 -0.69 0.34 -1.00 0.00 0.00 179.01 179.38 2jop s ASP 73 N -6.96 4.03 -0.47 1.42 2.15 -1.26 -4.95 116.67 110.63 2jop s ASP 73 Ca -0.03 -2.67 0.02 0.00 0.43 0.00 0.00 52.55 50.30 2jop s ASP 73 Cb 0.10 -1.31 0.56 0.00 -0.30 0.00 0.00 42.92 41.97 2jop s ASP 73 CO 0.84 -0.27 1.90 -0.81 -0.17 0.00 0.00 175.17 176.65 2jop n PRO 74 N 3.52 2.26 0.00 4.34 -0.04 -1.26 -4.95 135.00 138.87 2jop n PRO 74 Ca 0.06 -2.83 0.00 0.00 -0.04 0.00 0.00 63.50 60.69 2jop n PRO 74 Cb 0.35 -2.11 0.00 0.00 -0.04 0.00 0.00 33.50 31.70 2jop n PRO 74 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2jop n SER 75 N -0.94 0.00 0.00 3.54 2.88 -1.26 -4.47 113.62 113.38 2jop n SER 75 Ca 0.56 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 58.10 2jop n SER 75 Cb 1.33 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.79 2jop n SER 75 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2jop n GLN 76 N 0.00 0.00 -0.05 -1.46 1.13 -1.26 -4.58 117.38 111.17 2jop n GLN 76 Ca 0.00 0.00 -0.01 0.00 -1.94 0.00 0.00 57.00 55.05 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 0.00 2.61 -0.19 -1.58 0.00 -1.26 -4.33 120.51 115.76 2jop n ALA 77 Ca 0.00 -0.11 -0.02 0.00 0.00 0.00 0.00 53.44 53.32 2jop n ALA 77 Cb 0.00 -1.02 0.09 0.00 0.00 0.00 0.00 19.45 18.52 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 0.06 0.24 0.46 0.00 0.02 -1.83 -1.46 113.55 111.04 2jop h SER 78 Ca 0.02 0.06 -0.07 0.00 -0.84 0.00 0.00 61.79 60.96 2jop h SER 78 Cb 0.98 0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.54 2jop h SER 78 CO 0.04 0.16 -0.34 0.11 -1.14 0.00 0.00 176.83 175.65 2jop h LYS 79 N 0.41 0.00 0.74 3.45 1.79 -1.87 -0.71 116.57 120.39 2jop h LYS 79 Ca 0.27 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.71 2jop h LYS 79 Cb 0.30 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.96 2jop h LYS 79 CO -0.26 0.34 -0.36 0.28 -1.08 0.00 0.00 179.45 178.38 2jop h VAL 80 N 0.00 0.05 0.00 0.50 2.07 -1.52 -0.99 116.25 116.35 2jop h VAL 80 Ca -0.00 -0.26 -0.04 0.00 0.82 0.00 0.00 66.70 67.22 2jop h VAL 80 Cb 0.67 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 2jop h VAL 80 CO 0.04 0.01 -0.20 0.00 0.02 0.00 0.00 177.57 177.44 2jop h GLN 82 N 0.00 0.53 0.00 0.00 4.15 0.21 0.23 115.11 120.23 2jop h GLN 82 Ca -0.00 -0.06 -0.02 0.00 0.77 0.00 0.00 58.65 59.34 2jop h GLN 82 Cb 0.58 -0.10 -0.00 0.00 0.21 0.00 0.00 27.48 28.17 2jop h GLN 82 CO 0.03 0.44 -0.08 0.00 -1.93 0.00 0.00 178.83 177.28 2jop h ARG 83 N 0.48 0.00 -0.60 1.69 3.08 -0.32 0.40 114.38 119.12 2jop h ARG 83 Ca 0.13 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.18 2jop h ARG 83 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.11 2jop h ARG 83 CO -0.02 0.08 0.00 1.28 -1.07 0.00 0.00 179.97 180.24 2jop n LEU 84 N -3.43 3.26 -1.36 3.04 4.77 -0.54 -4.91 117.00 117.83 2jop n LEU 84 Ca -0.01 -1.64 -0.11 0.00 -0.03 0.00 0.00 56.01 54.22 2jop n LEU 84 Cb 0.23 -0.46 -0.04 0.00 -2.33 0.00 0.00 43.42 40.81 2jop n LEU 84 CO 0.28 0.57 -0.10 -0.46 -1.33 0.00 0.00 177.39 176.34 2jop n ASN 85 N 0.66 -2.85 -1.06 -1.43 6.94 0.13 -4.75 115.26 112.90 2jop n ASN 85 Ca 0.17 0.26 0.12 0.00 -0.02 0.00 0.00 54.58 55.11 2jop n ASN 85 Cb 0.62 -2.75 0.24 0.00 -2.36 0.00 0.00 39.78 35.53 2jop n ASN 85 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2jop n GLY 87 N 1.44 1.64 3.89 0.00 0.00 -1.11 -4.35 105.19 106.71 2jop n GLY 87 Ca 0.19 -0.70 -0.29 0.00 0.00 0.00 0.00 46.02 45.21 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 4.29 0.49 1.61 1.01 -1.26 -1.32 116.67 117.49 2jop s ASP 88 Ca 0.00 0.75 -0.21 0.00 0.71 0.00 0.00 52.55 53.80 2jop s ASP 88 Cb 0.00 -1.21 -0.07 0.00 1.01 0.00 0.00 42.92 42.65 2jop s ASP 88 CO 0.00 -2.04 1.10 -2.16 0.21 0.00 0.00 175.17 172.28 2jop s PRO 89 N -5.58 3.69 -0.50 8.23 0.04 -1.26 -0.76 135.00 138.86 2jop s PRO 89 Ca 0.63 1.56 -0.45 0.00 0.04 0.00 0.00 61.00 62.79 2jop s PRO 89 Cb -0.11 -2.20 -0.19 0.00 0.04 0.00 0.00 34.50 32.04 2jop s PRO 89 CO 0.50 -0.56 1.94 1.47 0.04 0.00 0.00 177.00 180.39 2jop n LEU 90 N -0.84 0.90 -4.77 -3.56 -0.00 -1.23 -0.68 117.00 106.82 2jop n LEU 90 Ca 0.09 0.85 -0.40 0.00 -0.00 0.00 0.00 56.01 56.55 2jop n LEU 90 Cb 0.51 -0.89 -0.03 0.00 -0.00 0.00 0.00 43.42 43.01 2jop n LEU 90 CO 0.43 -0.79 0.87 -0.44 -0.00 0.00 0.00 177.39 177.46 2jop s SER 91 N 4.94 6.90 -0.24 1.45 0.01 -0.10 -4.34 113.70 122.31 2jop s SER 91 Ca 1.14 2.43 -0.21 0.00 1.31 0.00 0.00 55.95 60.63 2jop s SER 91 Cb -1.49 -2.63 -0.02 0.00 0.21 0.00 0.00 66.02 62.09 2jop s SER 91 CO 0.71 -0.42 0.65 -0.76 0.41 0.00 0.00 173.24 173.83 2jop s LEU 92 N -1.85 4.08 -0.29 2.44 1.43 -1.25 -2.23 118.68 121.01 2jop s LEU 92 Ca 0.49 0.76 -0.20 0.00 -1.03 0.00 0.00 54.13 54.16 2jop s LEU 92 Cb -0.34 -2.89 0.16 0.00 0.03 0.00 0.00 46.19 43.15 2jop s LEU 92 CO 0.44 -0.36 1.15 -0.83 0.23 0.00 0.00 176.35 176.98 2jop s GLY 93 N 1.40 0.19 -0.43 -3.19 0.00 -0.11 -3.32 107.32 101.86 2jop s GLY 93 Ca 0.27 3.28 -0.37 0.00 0.00 0.00 0.00 44.72 47.91 2jop s GLY 93 CO 0.09 2.34 2.21 -1.55 0.00 0.00 0.00 173.10 176.19 2jop n PRO 94 N 2.82 0.74 0.00 2.90 -0.04 -1.26 -0.13 135.00 140.03 2jop n PRO 94 Ca -0.15 0.19 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 2jop n PRO 94 Cb 0.57 -2.19 0.00 0.00 -0.04 0.00 0.00 33.50 31.83 2jop n PRO 94 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2jop n PHE 95 N 9.48 0.00 -4.14 0.54 7.35 -1.05 -4.70 117.46 124.93 2jop n PHE 95 Ca 0.46 0.00 -0.15 0.00 -0.76 0.00 0.00 57.45 57.00 2jop n PHE 95 Cb 0.16 0.00 -0.12 0.00 0.35 0.00 0.00 39.48 39.87 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 -2.56 2.20 -0.31 -2.13 2.96 -1.26 -4.97 118.68 112.61 2jop s LEU 96 Ca 0.00 -0.45 -0.00 0.00 -0.22 0.00 0.00 54.13 53.45 2jop s LEU 96 Cb 0.00 -0.29 0.06 0.00 0.50 0.00 0.00 46.19 46.46 2jop s LEU 96 CO 0.00 -0.10 0.00 -0.54 -1.32 0.00 0.00 176.35 174.39 2jop s LYS 97 N -1.24 2.24 -0.26 1.98 3.01 -1.26 -4.84 119.74 119.37 2jop s LYS 97 Ca -0.05 -1.41 0.22 0.00 -1.01 0.00 0.00 55.97 53.72 2jop s LYS 97 Cb -0.08 -3.16 0.51 0.00 -1.01 0.00 0.00 37.83 34.08 2jop s LYS 97 CO 0.01 -0.69 1.11 2.41 0.51 0.00 0.00 175.35 178.70 2jop n THR 98 N 4.54 1.29 -4.37 2.17 -1.04 -1.26 -5.10 114.28 110.51 2jop n THR 98 Ca -0.10 -2.93 -0.19 0.00 -2.04 0.00 0.00 64.05 58.78 2jop n THR 98 Cb 0.43 1.20 -0.10 0.00 -1.82 0.00 0.00 70.33 70.04 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 -3.72 1.80 0.17 -1.42 1.13 -1.26 -5.04 117.35 109.01 2jop s TYR 99 Ca 0.28 -0.59 0.09 0.00 -1.41 0.00 0.00 57.07 55.44 2jop s TYR 99 Cb 0.33 -0.88 -0.04 0.00 -1.10 0.00 0.00 41.96 40.26 2jop s TYR 99 CO -0.04 0.36 -0.19 0.95 -2.51 0.00 0.00 175.55 174.13 2jop s THR 100 N -2.95 1.87 -0.78 -3.49 -4.23 -1.26 -4.98 115.64 99.82 2jop s THR 100 Ca 0.25 -1.93 0.00 0.00 -1.18 0.00 0.00 61.69 58.83 2jop s THR 100 Cb 0.00 -1.87 0.00 0.00 1.34 0.00 0.00 72.50 71.97 2jop s THR 100 CO 0.09 -0.30 0.53 -0.81 -0.54 0.00 0.00 174.62 173.58 2jop n PRO 101 N 0.29 0.86 0.05 3.99 -0.04 -1.26 -1.67 135.00 137.23 2jop n PRO 101 Ca -0.13 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.33 2jop n PRO 101 Cb 0.57 -1.35 0.00 0.00 -0.04 0.00 0.00 33.50 32.68 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 0.18 0.00 0.07 0.54 7.27 -1.26 -4.51 117.38 119.67 2jop n GLN 102 Ca 0.00 0.00 -0.08 0.00 0.07 0.00 0.00 57.00 56.99 2jop n GLN 102 Cb 0.26 -0.05 -0.11 0.00 2.41 0.00 0.00 30.24 32.76 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 0.06 -1.92 1.69 0.02 -1.98 -3.46 113.55 107.96 2jop h SER 103 Ca 0.00 -0.07 -0.44 0.00 -0.84 0.00 0.00 61.79 60.44 2jop h SER 103 Cb 0.06 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.58 2jop h SER 103 CO 0.00 1.03 -0.34 -0.44 -1.14 0.00 0.00 176.83 175.94 2jop s SER 104 N -6.78 6.03 0.24 3.07 0.01 -0.67 -4.53 113.70 111.07 2jop s SER 104 Ca 0.00 -0.12 0.01 0.00 1.31 0.00 0.00 55.95 57.15 2jop s SER 104 Cb 0.10 -1.36 -0.05 0.00 0.21 0.00 0.00 66.02 64.92 2jop s SER 104 CO 0.83 -0.38 0.11 0.27 0.41 0.00 0.00 173.24 174.47 2jop s ILE 105 N -2.16 0.39 -0.23 1.44 -5.25 0.64 -3.11 121.20 112.91 2jop s ILE 105 Ca 0.43 -2.00 -0.02 0.00 -0.99 0.00 0.00 60.65 58.07 2jop s ILE 105 Cb -0.09 -2.59 0.07 0.00 2.95 0.00 0.00 42.46 42.79 2jop s ILE 105 CO 0.31 -0.00 0.04 -0.63 -1.79 0.00 0.00 174.94 172.87 2jop s ILE 106 N -3.88 0.69 0.61 8.37 1.01 0.18 -2.12 121.20 126.06 2jop s ILE 106 Ca 0.38 -0.83 -0.06 0.00 0.00 0.00 0.00 60.65 60.14 2jop s ILE 106 Cb 0.08 -1.26 0.02 0.00 0.01 0.00 0.00 42.46 41.30 2jop s ILE 106 CO 0.13 -0.33 0.93 0.00 0.00 0.00 0.00 174.94 175.67 2jop n TYR 108 N -2.66 -0.19 0.00 0.00 4.01 -1.26 -0.28 117.16 116.79 2jop n TYR 108 Ca 0.05 -1.50 0.00 0.00 -0.16 0.00 0.00 57.90 56.29 2jop n TYR 108 Cb 0.58 0.08 0.00 0.00 -0.31 0.00 0.00 39.34 39.69 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 0.11 0.37 3.45 2.72 0.00 -1.24 -4.44 105.19 106.16 2jop n GLY 109 Ca 0.01 -1.38 -0.32 0.00 0.00 0.00 0.00 46.02 44.32 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 2.36 -0.28 1.61 -1.52 -1.22 -4.66 119.66 115.95 2jop s GLN 110 Ca 0.00 -0.79 -0.28 0.00 -1.95 0.00 0.00 55.36 52.35 2jop s GLN 110 Cb 0.00 -2.30 -0.05 0.00 -0.22 0.00 0.00 33.01 30.44 2jop s GLN 110 CO 0.00 0.60 2.27 -0.11 -0.25 0.00 0.00 175.29 177.80 2jop n LEU 111 N 2.14 3.05 0.00 2.90 7.94 -1.20 -0.85 117.00 130.98 2jop n LEU 111 Ca -0.17 0.03 0.00 0.00 -1.11 0.00 0.00 56.01 54.77 2jop n LEU 111 Cb 0.52 -1.56 0.00 0.00 0.53 0.00 0.00 43.42 42.91 2jop n LEU 111 CO 0.26 -0.90 0.00 0.61 -1.11 0.00 0.00 177.39 176.25 2jop n GLY 112 N 5.83 1.94 3.41 -3.96 0.00 -1.26 -5.01 105.19 106.14 2jop n GLY 112 Ca 0.32 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.89 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 -1.81 6.82 -0.14 1.61 0.01 -0.03 -3.81 113.70 116.34 2jop s SER 113 Ca 0.00 -2.56 -0.01 0.00 1.31 0.00 0.00 55.95 54.70 2jop s SER 113 Cb 0.00 -2.33 0.08 0.00 0.21 0.00 0.00 66.02 63.98 2jop s SER 113 CO 0.00 -0.79 2.10 0.49 0.41 0.00 0.00 173.24 175.45 2jop n PHE 114 N 5.27 0.67 0.02 2.43 3.01 0.27 -4.21 117.46 124.91 2jop n PHE 114 Ca 0.23 -1.44 -0.09 0.00 1.01 0.00 0.00 57.45 57.16 2jop n PHE 114 Cb 0.46 -0.76 -0.13 0.00 -0.01 0.00 0.00 39.48 39.04 2jop n PHE 114 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 2jop h SER 115 N 1.34 0.03 -4.44 4.37 0.02 -1.90 -3.45 113.55 109.52 2jop h SER 115 Ca 0.14 -0.04 -0.11 0.00 -0.84 0.00 0.00 61.79 60.93 2jop h SER 115 Cb 0.98 -0.01 -0.22 0.00 0.14 0.00 0.00 62.40 63.29 2jop h SER 115 CO 0.34 1.04 -0.20 0.21 -1.14 0.00 0.00 176.83 177.09 2jop s ASN 116 N -6.41 -0.37 0.16 3.07 2.47 -1.26 -5.07 114.94 107.54 2jop s ASN 116 Ca -0.03 0.54 0.02 0.00 0.42 0.00 0.00 52.86 53.81 2jop s ASN 116 Cb 0.09 0.62 -0.01 0.00 -1.45 0.00 0.00 41.25 40.50 2jop s ASN 116 CO 0.82 -0.31 0.07 0.00 -3.72 0.00 0.00 177.10 173.96 2jop s SER 118 N -2.03 -0.08 0.76 0.00 0.01 -0.95 -4.85 113.70 106.56 2jop s SER 118 Ca 0.10 -0.92 -0.11 0.00 1.31 0.00 0.00 55.95 56.32 2jop s SER 118 Cb 0.00 0.57 0.05 0.00 0.21 0.00 0.00 66.02 66.85 2jop s SER 118 CO 0.07 -1.11 1.08 -1.00 0.41 0.00 0.00 173.24 172.69 2jop s HIS 119 N -4.01 2.88 -1.25 2.43 3.76 -1.26 -0.65 115.29 117.19 2jop s HIS 119 Ca 0.22 1.32 -0.16 0.00 -0.15 0.00 0.00 55.06 56.30 2jop s HIS 119 Cb -0.00 -3.01 -0.03 0.00 1.11 0.00 0.00 32.58 30.64 2jop s HIS 119 CO 0.08 -1.59 2.20 0.45 -0.85 0.00 0.00 174.74 175.03 2jop n SER 120 N -3.35 3.98 0.19 1.40 2.88 -1.18 -3.63 113.62 113.90 2jop n SER 120 Ca 0.07 -2.74 0.03 0.00 -1.33 0.00 0.00 58.87 54.90 2jop n SER 120 Cb 0.55 -1.46 0.38 0.00 -0.75 0.00 0.00 64.21 62.92 2jop n SER 120 CO 0.00 0.00 0.00 0.08 -1.23 0.00 0.00 175.04 173.89 2jop h ARG 121 N 6.47 0.01 -5.80 -1.46 0.11 -1.90 -3.40 114.38 108.41 2jop h ARG 121 Ca 0.55 -0.00 -0.61 0.00 0.10 0.00 0.00 59.98 60.02 2jop h ARG 121 Cb 0.59 -0.00 -0.11 0.00 1.11 0.00 0.00 29.97 31.56 2jop h ARG 121 CO 1.88 0.35 0.39 -0.80 0.10 0.00 0.00 179.97 181.88 2jop s ASN 122 N -6.95 6.55 0.35 0.08 -0.87 -1.26 -4.92 114.94 107.93 2jop s ASN 122 Ca -0.03 0.35 0.08 0.00 -1.57 0.00 0.00 52.86 51.69 2jop s ASN 122 Cb 0.15 -2.40 0.65 0.00 -0.02 0.00 0.00 41.25 39.63 2jop s ASN 122 CO 0.72 -0.75 1.83 -2.24 -2.57 0.00 0.00 177.10 174.09 2jop h ASP 123 N 8.50 0.23 -3.40 -1.22 2.03 -1.99 -3.37 116.42 117.22 2jop h ASP 123 Ca -0.25 -0.07 -0.61 0.00 -0.73 0.00 0.00 57.03 55.38 2jop h ASP 123 Cb 1.09 -0.06 -0.40 0.00 -0.83 0.00 0.00 39.33 39.13 2jop h ASP 123 CO 0.92 0.49 -0.74 -0.32 -1.03 0.00 0.00 179.24 178.55 2jop s MET 124 N -4.49 1.06 0.00 4.15 0.00 -1.26 -4.89 119.30 113.87 2jop s MET 124 Ca -0.05 -1.52 0.07 0.00 0.00 0.00 0.00 55.69 54.18 2jop s MET 124 Cb 0.15 -2.38 0.22 0.00 0.00 0.00 0.00 34.83 32.81 2jop s MET 124 CO 0.75 -1.02 1.17 0.00 0.00 0.00 0.00 175.02 175.92 2jop n HIS 126 N 0.04 0.00 -3.41 0.00 8.25 -1.26 -4.62 115.22 114.22 2jop n HIS 126 Ca 0.07 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.40 2jop n HIS 126 Cb 0.16 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.28 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 0.87 -6.40 -4.57 0.41 7.64 -1.26 -4.68 113.62 105.63 2jop n SER 127 Ca 0.00 -0.53 -0.39 0.00 1.01 0.00 0.00 58.87 58.95 2jop n SER 127 Cb 0.00 -3.75 -0.03 0.00 -1.01 0.00 0.00 64.21 59.43 2jop n SER 127 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2jop s LEU 128 N -4.70 3.37 0.85 -3.43 1.43 -1.26 -2.53 118.68 112.41 2jop s LEU 128 Ca 0.07 0.76 -0.12 0.00 -1.03 0.00 0.00 54.13 53.81 2jop s LEU 128 Cb -0.02 -2.83 0.10 0.00 0.03 0.00 0.00 46.19 43.46 2jop s LEU 128 CO 0.82 -2.25 1.11 -0.83 0.23 0.00 0.00 176.35 175.43 2jop s GLY 129 N 8.11 1.61 -0.11 -3.19 0.00 0.82 -3.75 107.32 110.80 2jop s GLY 129 Ca 0.76 -0.31 0.01 0.00 0.00 0.00 0.00 44.72 45.18 2jop s GLY 129 CO 0.26 0.17 -0.13 1.08 0.00 0.00 0.00 173.10 174.48 2jop s LEU 130 N -5.91 1.57 -0.25 0.66 1.43 -1.13 -0.93 118.68 114.12 2jop s LEU 130 Ca 0.62 -0.39 -0.01 0.00 -1.03 0.00 0.00 54.13 53.32 2jop s LEU 130 Cb -0.15 -1.02 0.08 0.00 0.03 0.00 0.00 46.19 45.13 2jop s LEU 130 CO 0.54 -0.03 0.03 0.28 0.23 0.00 0.00 176.35 177.40 2jop s THR 131 N 1.24 1.05 -0.84 5.49 -1.32 -0.95 -1.99 115.64 118.33 2jop s THR 131 Ca -0.02 -1.15 -0.28 0.00 -1.21 0.00 0.00 61.69 59.03 2jop s THR 131 Cb -0.14 -1.58 -0.18 0.00 -1.51 0.00 0.00 72.50 69.09 2jop s THR 131 CO -0.05 -0.36 2.57 0.00 -2.21 0.00 0.00 174.62 174.57 2jop n LEU 133 N 12.13 0.00 0.00 0.00 7.94 0.14 -4.61 117.00 132.59 2jop n LEU 133 Ca 0.57 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.47 2jop n LEU 133 Cb 0.21 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.16 2jop n LEU 133 CO 0.87 0.00 0.00 -1.84 -1.11 0.00 0.00 177.39 175.31