#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 2.54 0.05 0.55 1.43 -1.25 -5.01 118.68 116.98 2jop s LEU 26 Ca 0.00 -0.95 -0.06 0.00 -1.03 0.00 0.00 54.13 52.10 2jop s LEU 26 Cb 0.00 -1.15 -0.01 0.00 0.03 0.00 0.00 46.19 45.06 2jop s LEU 26 CO 0.00 0.07 0.10 -0.94 0.23 0.00 0.00 176.35 175.81 2jop s SER 27 N -3.14 0.20 0.00 2.29 1.04 -1.24 -0.28 113.70 112.56 2jop s SER 27 Ca 0.26 -0.60 0.22 0.00 0.48 0.00 0.00 55.95 56.31 2jop s SER 27 Cb -0.06 0.24 1.19 0.00 0.10 0.00 0.00 66.02 67.49 2jop s SER 27 CO 0.13 -0.55 1.69 -2.67 0.98 0.00 0.00 173.24 172.82 2jop n TRP 28 N 0.57 0.00 -0.35 5.02 2.14 -1.26 -1.66 117.44 121.90 2jop n TRP 28 Ca -0.18 0.00 0.09 0.00 2.07 0.00 0.00 57.50 59.48 2jop n TRP 28 Cb 0.59 -0.16 0.27 0.00 -0.81 0.00 0.00 31.31 31.20 2jop n TRP 28 CO 0.00 0.00 0.00 2.48 2.07 0.00 0.00 177.69 182.24 2jop n TYR 29 N -1.16 0.85 -2.96 -2.67 0.18 -1.26 -4.64 117.16 105.51 2jop n TYR 29 Ca 0.13 -0.52 -0.40 0.00 1.88 0.00 0.00 57.90 58.99 2jop n TYR 29 Cb 0.13 -0.05 -0.05 0.00 -0.38 0.00 0.00 39.34 38.99 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 -1.02 7.30 0.33 9.48 1.01 -0.67 -4.98 116.67 128.13 2jop s ASP 30 Ca 0.40 1.54 0.11 0.00 0.71 0.00 0.00 52.55 55.32 2jop s ASP 30 Cb 0.22 -2.49 0.56 0.00 1.01 0.00 0.00 42.92 42.22 2jop s ASP 30 CO 0.26 0.07 1.74 1.55 0.21 0.00 0.00 175.17 179.00 2jop h PRO 31 N 5.21 0.02 -0.06 8.23 0.13 -1.91 -2.48 132.00 141.13 2jop h PRO 31 Ca -0.45 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2jop h PRO 31 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2jop h PRO 31 CO 0.69 0.48 0.00 -0.40 -0.23 0.00 0.00 178.00 178.55 2jop n ASP 32 N -3.98 1.31 -4.44 1.44 5.75 -1.26 -4.70 116.55 110.66 2jop n ASP 32 Ca -0.02 -1.50 -0.42 0.00 -0.01 0.00 0.00 54.79 52.84 2jop n ASP 32 Cb 0.49 -0.03 -0.11 0.00 -1.03 0.00 0.00 41.12 40.44 2jop n ASP 32 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 2jop s PHE 33 N -1.94 3.24 -0.02 2.11 2.19 -0.93 -5.07 117.98 117.55 2jop s PHE 33 Ca 0.37 -0.67 -0.20 0.00 0.33 0.00 0.00 56.93 56.75 2jop s PHE 33 Cb 0.20 -2.51 -0.05 0.00 -1.31 0.00 0.00 43.02 39.34 2jop s PHE 33 CO 0.31 -0.58 0.58 -1.14 1.83 0.00 0.00 175.22 176.22 2jop s GLN 34 N 1.64 4.31 0.02 10.12 0.74 -1.26 -4.75 119.66 130.47 2jop s GLN 34 Ca 0.04 0.69 -0.12 0.00 0.05 0.00 0.00 55.36 56.02 2jop s GLN 34 Cb -0.19 -3.36 0.01 0.00 1.10 0.00 0.00 33.01 30.58 2jop s GLN 34 CO 0.09 0.33 0.24 0.00 -0.55 0.00 0.00 175.29 175.40 2jop s ALA 35 N -0.05 -0.56 0.00 1.58 0.00 -1.26 -2.36 121.76 119.11 2jop s ALA 35 Ca 0.30 -0.00 -0.19 0.00 0.00 0.00 0.00 51.96 52.07 2jop s ALA 35 Cb -0.18 0.19 0.06 0.00 0.00 0.00 0.00 23.12 23.20 2jop s ALA 35 CO 0.16 -0.31 0.88 2.89 0.00 0.00 0.00 175.76 179.37 2jop n ARG 36 N 0.98 0.17 -3.24 0.00 0.00 -0.54 -4.88 116.66 109.15 2jop n ARG 36 Ca -0.20 -0.61 -0.30 0.00 -0.00 0.00 0.00 57.85 56.74 2jop n ARG 36 Cb 0.57 0.96 -0.04 0.00 -0.00 0.00 0.00 32.46 33.96 2jop n ARG 36 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2jop s LEU 37 N 0.00 4.04 0.87 2.89 1.43 -1.26 -0.03 118.68 126.61 2jop s LEU 37 Ca 0.20 0.89 -0.11 0.00 -1.03 0.00 0.00 54.13 54.09 2jop s LEU 37 Cb -0.01 -3.70 0.11 0.00 0.03 0.00 0.00 46.19 42.62 2jop s LEU 37 CO 0.00 -0.21 1.11 0.42 0.23 0.00 0.00 176.35 177.90 2jop s THR 38 N -2.07 2.66 -0.08 5.49 -4.23 0.55 -4.78 115.64 113.19 2jop s THR 38 Ca 0.47 0.22 -0.05 0.00 -1.18 0.00 0.00 61.69 61.15 2jop s THR 38 Cb -0.11 -2.49 -0.21 0.00 1.34 0.00 0.00 72.50 71.04 2jop s THR 38 CO 0.27 -0.28 2.97 -2.11 -0.54 0.00 0.00 174.62 174.93 2jop n ARG 39 N -3.93 1.68 -0.04 3.99 1.85 -1.26 -4.34 116.66 114.60 2jop n ARG 39 Ca 0.10 -0.86 -0.01 0.00 -1.00 0.00 0.00 57.85 56.08 2jop n ARG 39 Cb 0.53 -1.94 -0.00 0.00 -1.05 0.00 0.00 32.46 29.99 2jop n ARG 39 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 2jop h SER 40 N 3.73 0.00 0.00 2.89 4.64 -1.89 -3.46 113.55 119.47 2jop h SER 40 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 2jop h SER 40 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 2jop h SER 40 CO 0.37 0.41 -0.54 0.59 -0.87 0.00 0.00 176.83 176.78 2jop n ASN 41 N -4.00 2.33 -3.47 4.97 4.13 -1.24 -5.11 115.26 112.88 2jop n ASN 41 Ca -0.01 0.00 -0.15 0.00 1.68 0.00 0.00 54.58 56.10 2jop n ASN 41 Cb 0.05 0.08 -0.04 0.00 -1.54 0.00 0.00 39.78 38.33 2jop n ASN 41 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 2jop s SER 42 N -3.12 -0.61 0.56 6.41 0.15 -0.35 -4.94 113.70 111.80 2jop s SER 42 Ca 0.00 0.31 0.30 0.00 0.70 0.00 0.00 55.95 57.27 2jop s SER 42 Cb 0.00 0.57 1.67 0.00 -1.71 0.00 0.00 66.02 66.55 2jop s SER 42 CO 0.00 -0.81 2.16 0.07 1.20 0.00 0.00 173.24 175.86 2jop h LYS 43 N 2.44 0.00 -0.20 5.44 2.10 -1.87 -2.64 116.57 121.83 2jop h LYS 43 Ca -0.31 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.34 2jop h LYS 43 Cb 1.23 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.56 2jop h LYS 43 CO 0.38 0.07 0.00 0.00 -2.00 0.00 0.00 179.45 177.90 2jop s GLN 45 N -2.24 0.56 0.00 0.00 0.74 -1.00 -0.37 119.66 117.36 2jop s GLN 45 Ca 0.32 1.30 0.00 0.00 0.05 0.00 0.00 55.36 57.03 2jop s GLN 45 Cb 0.24 0.57 0.00 0.00 1.10 0.00 0.00 33.01 34.92 2jop s GLN 45 CO 0.08 -0.19 0.00 0.41 -0.55 0.00 0.00 175.29 175.04 2jop n GLY 46 N 5.10 -0.86 3.77 2.59 0.00 -0.13 -1.21 105.19 114.45 2jop n GLY 46 Ca -0.14 -1.27 -0.34 0.00 0.00 0.00 0.00 46.02 44.27 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 3.06 -0.09 1.61 -1.52 -1.26 -1.86 119.66 117.60 2jop s GLN 47 Ca 0.00 1.55 -0.30 0.00 -1.95 0.00 0.00 55.36 54.66 2jop s GLN 47 Cb 0.00 -1.97 -0.02 0.00 -0.22 0.00 0.00 33.01 30.80 2jop s GLN 47 CO 0.00 -1.07 1.08 -1.17 -0.25 0.00 0.00 175.29 173.87 2jop s LEU 48 N -4.29 4.26 -0.23 2.90 2.96 -1.26 -0.33 118.68 122.69 2jop s LEU 48 Ca 0.71 1.64 0.02 0.00 -0.22 0.00 0.00 54.13 56.27 2jop s LEU 48 Cb -0.23 -3.56 0.04 0.00 0.50 0.00 0.00 46.19 42.94 2jop s LEU 48 CO 0.34 -0.49 -0.14 -0.70 -1.32 0.00 0.00 176.35 174.03 2jop s GLU 49 N 2.07 2.60 -0.02 1.98 2.12 0.95 -0.95 118.70 127.44 2jop s GLU 49 Ca 0.51 -1.11 0.05 0.00 0.36 0.00 0.00 54.97 54.78 2jop s GLU 49 Cb -0.21 -2.77 -0.01 0.00 0.26 0.00 0.00 34.13 31.40 2jop s GLU 49 CO 0.19 -0.41 -0.17 0.14 -0.54 0.00 0.00 175.26 174.48 2jop s VAL 50 N 1.20 1.34 -0.51 3.70 -7.23 -0.80 -1.47 120.40 116.63 2jop s VAL 50 Ca -0.03 -0.70 -0.23 0.00 -1.81 0.00 0.00 61.98 59.21 2jop s VAL 50 Cb -0.17 -1.13 0.04 0.00 0.56 0.00 0.00 36.38 35.67 2jop s VAL 50 CO -0.08 0.38 0.85 -0.47 -0.31 0.00 0.00 175.10 175.47 2jop s TYR 51 N -0.21 2.90 -0.12 2.82 5.04 -1.00 -0.19 117.35 126.59 2jop s TYR 51 Ca 0.02 -0.00 -0.04 0.00 -2.44 0.00 0.00 57.07 54.61 2jop s TYR 51 Cb -0.08 -3.86 0.06 0.00 0.35 0.00 0.00 41.96 38.42 2jop s TYR 51 CO 0.00 -1.17 0.21 -0.48 -1.34 0.00 0.00 175.55 172.77 2jop s LEU 52 N 3.54 -0.19 0.00 6.97 -0.00 -0.72 -4.68 118.68 123.61 2jop s LEU 52 Ca 0.29 0.41 0.00 0.00 -0.00 0.00 0.00 54.13 54.83 2jop s LEU 52 Cb -0.13 0.49 0.00 0.00 -0.00 0.00 0.00 46.19 46.55 2jop s LEU 52 CO 0.20 -0.25 0.00 1.17 -0.00 0.00 0.00 176.35 177.47 2jop n LYS 53 N 5.34 0.00 0.00 1.48 4.81 -1.26 -2.48 118.16 126.05 2jop n LYS 53 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.39 2jop n LYS 53 Cb 0.50 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.55 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 1.14 1.49 -3.53 3.14 5.75 -1.26 -5.11 116.55 118.17 2jop n ASP 54 Ca 0.00 0.00 -0.17 0.00 -0.01 0.00 0.00 54.79 54.61 2jop n ASP 54 Cb 0.00 0.29 -0.06 0.00 -1.03 0.00 0.00 41.12 40.32 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 -0.66 -0.55 -1.07 6.12 0.00 -1.03 -5.01 107.32 105.11 2jop s GLY 55 Ca 0.00 1.16 -0.21 0.00 0.00 0.00 0.00 44.72 45.68 2jop s GLY 55 CO 0.00 0.82 1.94 0.79 0.00 0.00 0.00 173.10 176.65 2jop n TRP 56 N 0.82 2.76 -1.85 1.90 7.02 -1.25 -1.75 117.44 125.09 2jop n TRP 56 Ca -0.19 -2.00 -0.42 0.00 -1.02 0.00 0.00 57.50 53.87 2jop n TRP 56 Cb 0.58 -2.25 -0.03 0.00 -2.42 0.00 0.00 31.31 27.19 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 6.58 2.08 -0.64 -5.99 3.76 0.73 -4.48 115.29 117.32 2jop s HIS 57 Ca 0.59 0.09 -0.25 0.00 -0.15 0.00 0.00 55.06 55.34 2jop s HIS 57 Cb 0.08 -4.05 0.05 0.00 1.11 0.00 0.00 32.58 29.77 2jop s HIS 57 CO 0.09 -4.38 1.08 -1.64 -0.85 0.00 0.00 174.74 169.05 2jop s MET 58 N 3.22 3.25 0.65 1.40 -1.94 -1.26 -1.91 119.30 122.70 2jop s MET 58 Ca 0.78 -0.36 -0.06 0.00 -1.71 0.00 0.00 55.69 54.34 2jop s MET 58 Cb -0.40 -4.14 0.04 0.00 2.01 0.00 0.00 34.83 32.33 2jop s MET 58 CO 0.34 -1.81 0.95 0.14 -0.01 0.00 0.00 175.02 174.63 2jop s VAL 59 N 4.66 2.83 -0.48 -6.03 -7.23 -0.13 -0.44 120.40 113.58 2jop s VAL 59 Ca 0.31 -0.21 0.10 0.00 -1.81 0.00 0.00 61.98 60.37 2jop s VAL 59 Cb -0.12 -3.17 0.57 0.00 0.56 0.00 0.00 36.38 34.22 2jop s VAL 59 CO 0.16 -0.17 1.37 0.00 -0.31 0.00 0.00 175.10 176.14 2jop n SER 61 N 0.43 0.00 -0.23 0.00 7.64 -1.26 -3.93 113.62 116.27 2jop n SER 61 Ca 0.19 0.00 0.09 0.00 1.01 0.00 0.00 58.87 60.16 2jop n SER 61 Cb 0.91 0.00 0.44 0.00 -1.01 0.00 0.00 64.21 64.55 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 1.30 -0.67 1.43 -0.00 -1.26 -4.88 117.38 113.31 2jop n GLN 62 Ca 0.00 -0.45 -0.31 0.00 -0.00 0.00 0.00 57.00 56.23 2jop n GLN 62 Cb 0.00 -1.31 0.17 0.00 -0.00 0.00 0.00 30.24 29.10 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 -0.31 -1.26 0.00 2.61 7.64 -1.26 -0.86 113.62 120.17 2jop n SER 63 Ca 0.14 0.18 0.00 0.00 1.01 0.00 0.00 58.87 60.20 2jop n SER 63 Cb 0.17 -1.27 0.00 0.00 -1.01 0.00 0.00 64.21 62.10 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 -4.25 0.00 -0.02 1.43 8.01 0.17 -4.20 117.44 118.58 2jop n TRP 64 Ca 0.07 0.00 -0.13 0.00 -1.31 0.00 0.00 57.50 56.13 2jop n TRP 64 Cb 0.55 0.00 -0.10 0.00 -2.01 0.00 0.00 31.31 29.75 2jop n TRP 64 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.69 177.46 2jop h GLY 65 N 0.00 0.05 -2.05 6.99 0.00 -1.82 -3.38 103.07 102.86 2jop h GLY 65 Ca 0.00 -0.06 -0.39 0.00 0.00 0.00 0.00 47.33 46.88 2jop h GLY 65 CO 0.00 0.05 -0.44 0.54 0.00 0.00 0.00 176.54 176.69 2jop n ARG 66 N -4.79 -1.47 0.09 4.80 1.74 -0.04 -4.93 116.66 112.07 2jop n ARG 66 Ca -0.08 1.03 -0.04 0.00 -0.77 0.00 0.00 57.85 57.98 2jop n ARG 66 Cb 0.29 -5.51 -0.02 0.00 -1.02 0.00 0.00 32.46 26.20 2jop n ARG 66 CO 0.00 0.00 0.00 0.77 -1.52 0.00 0.00 177.63 176.88 2jop h SER 67 N 0.00 -0.30 -2.05 0.55 0.02 -1.91 -3.48 113.55 106.37 2jop h SER 67 Ca -0.44 0.02 -0.06 0.00 -0.84 0.00 0.00 61.79 60.48 2jop h SER 67 Cb 1.31 0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.93 2jop h SER 67 CO 0.56 -0.17 0.01 -1.20 -1.14 0.00 0.00 176.83 174.89 2jop n SER 68 N -2.95 -0.57 -0.02 3.07 7.64 -1.26 -5.02 113.62 114.51 2jop n SER 68 Ca -0.03 -1.57 0.14 0.00 1.01 0.00 0.00 58.87 58.42 2jop n SER 68 Cb 0.11 1.00 0.63 0.00 -1.01 0.00 0.00 64.21 64.95 2jop n SER 68 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2jop n LYS 69 N -0.18 0.25 -3.72 1.43 4.01 -1.26 -4.65 118.16 114.03 2jop n LYS 69 Ca -0.01 -0.04 -0.12 0.00 -0.51 0.00 0.00 58.31 57.63 2jop n LYS 69 Cb 0.19 -1.50 -0.12 0.00 -0.51 0.00 0.00 35.03 33.09 2jop n LYS 69 CO 0.00 0.00 0.00 -1.14 -1.11 0.00 0.00 177.40 175.15 2jop s GLN 70 N -2.78 0.25 0.13 1.97 0.74 -1.26 -4.44 119.66 114.28 2jop s GLN 70 Ca 0.21 0.58 -0.07 0.00 0.05 0.00 0.00 55.36 56.13 2jop s GLN 70 Cb 0.19 -0.08 -0.06 0.00 1.10 0.00 0.00 33.01 34.16 2jop s GLN 70 CO 0.52 -0.16 0.40 -1.58 -0.55 0.00 0.00 175.29 173.92 2jop s TRP 71 N 1.23 3.50 -2.15 1.67 0.52 -1.24 -4.98 118.94 117.50 2jop s TRP 71 Ca -0.09 0.67 0.21 0.00 0.02 0.00 0.00 56.10 56.90 2jop s TRP 71 Cb -0.09 -2.08 0.39 0.00 -1.15 0.00 0.00 33.47 30.53 2jop s TRP 71 CO -0.09 0.44 1.34 -0.85 0.02 0.00 0.00 176.95 177.81 2jop n GLU 72 N 0.34 2.38 -3.81 4.98 0.28 -1.26 -4.78 120.64 118.77 2jop n GLU 72 Ca -0.04 -2.19 -0.30 0.00 -0.16 0.00 0.00 57.16 54.47 2jop n GLU 72 Cb 0.52 -1.46 -0.15 0.00 1.43 0.00 0.00 31.44 31.78 2jop n GLU 72 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 2jop s ASP 73 N -1.34 4.23 -0.30 -1.84 -1.08 -1.26 -4.99 116.67 110.10 2jop s ASP 73 Ca 0.35 -1.78 0.06 0.00 -0.52 0.00 0.00 52.55 50.66 2jop s ASP 73 Cb 0.20 -1.07 0.56 0.00 -1.46 0.00 0.00 42.92 41.16 2jop s ASP 73 CO 0.28 -0.41 1.64 -0.81 0.52 0.00 0.00 175.17 176.40 2jop n PRO 74 N 4.69 2.68 0.00 4.34 -0.04 -1.26 -4.82 135.00 140.58 2jop n PRO 74 Ca -0.00 -2.39 0.00 0.00 -0.04 0.00 0.00 63.50 61.06 2jop n PRO 74 Cb 0.42 -1.98 0.00 0.00 -0.04 0.00 0.00 33.50 31.90 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 -0.36 0.45 0.00 3.54 3.41 -1.26 -4.36 113.62 115.05 2jop n SER 75 Ca 0.38 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.99 2jop n SER 75 Cb 1.28 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 65.23 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 -1.07 4.33 1.13 -1.26 -4.57 117.38 115.94 2jop n GLN 76 Ca 0.00 0.00 -0.13 0.00 -1.94 0.00 0.00 57.00 54.93 2jop n GLN 76 Cb 0.00 -1.06 0.25 0.00 0.11 0.00 0.00 30.24 29.54 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 0.07 4.90 -0.13 -1.58 0.00 -1.26 -4.62 120.51 117.88 2jop n ALA 77 Ca 0.00 -2.45 -0.05 0.00 0.00 0.00 0.00 53.44 50.94 2jop n ALA 77 Cb 0.00 -1.32 0.04 0.00 0.00 0.00 0.00 19.45 18.16 2jop n ALA 77 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2jop h SER 78 N 1.97 0.19 -0.04 0.00 0.02 -1.90 -0.77 113.55 113.02 2jop h SER 78 Ca 0.40 0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 61.37 2jop h SER 78 Cb 2.49 0.02 -0.01 0.00 0.14 0.00 0.00 62.40 65.04 2jop h SER 78 CO 0.86 0.14 -0.02 0.50 -1.14 0.00 0.00 176.83 177.17 2jop h LYS 79 N 0.34 0.19 0.79 3.45 3.11 -1.90 -0.39 116.57 122.15 2jop h LYS 79 Ca 0.20 -0.03 -0.04 0.00 -2.81 0.00 0.00 60.65 57.97 2jop h LYS 79 Cb 0.17 -0.03 0.01 0.00 -1.00 0.00 0.00 32.23 31.37 2jop h LYS 79 CO -0.19 0.23 -0.38 0.28 -2.81 0.00 0.00 179.45 176.58 2jop h VAL 80 N 0.19 0.00 0.00 2.00 2.07 -1.40 -0.11 116.25 119.00 2jop h VAL 80 Ca 0.04 -0.06 -0.12 0.00 0.82 0.00 0.00 66.70 67.38 2jop h VAL 80 Cb 0.17 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 29.92 2jop h VAL 80 CO 0.01 0.00 -0.57 0.00 0.02 0.00 0.00 177.57 177.02 2jop h GLN 82 N 0.00 0.57 0.00 0.00 4.15 -0.89 0.01 115.11 118.95 2jop h GLN 82 Ca -0.01 -0.03 -0.06 0.00 0.77 0.00 0.00 58.65 59.32 2jop h GLN 82 Cb 1.13 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 28.68 2jop h GLN 82 CO 0.07 0.38 -0.29 -0.09 -1.93 0.00 0.00 178.83 176.98 2jop h ARG 83 N 0.59 0.00 -0.64 1.69 2.43 -0.66 -2.00 114.38 115.79 2jop h ARG 83 Ca 0.25 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.42 2jop h ARG 83 Cb 0.13 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.68 2jop h ARG 83 CO -0.15 0.29 0.00 1.28 -1.51 0.00 0.00 179.97 179.87 2jop n LEU 84 N -3.57 3.61 -2.90 3.80 4.32 -0.56 -4.92 117.00 116.78 2jop n LEU 84 Ca -0.01 -1.83 -0.15 0.00 -0.02 0.00 0.00 56.01 54.01 2jop n LEU 84 Cb 0.42 -0.52 -0.01 0.00 -1.62 0.00 0.00 43.42 41.70 2jop n LEU 84 CO 0.35 0.56 -0.08 -0.46 -1.22 0.00 0.00 177.39 176.54 2jop n ASN 85 N 0.62 -2.96 -1.21 -1.43 0.23 -0.58 -4.80 115.26 105.13 2jop n ASN 85 Ca 0.18 -0.02 0.11 0.00 -0.53 0.00 0.00 54.58 54.32 2jop n ASN 85 Cb 0.71 -2.53 0.29 0.00 -2.08 0.00 0.00 39.78 36.17 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 1.55 0.68 3.87 0.00 0.00 -1.24 -4.35 105.19 105.70 2jop n GLY 87 Ca 0.22 -1.07 -0.29 0.00 0.00 0.00 0.00 46.02 44.87 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 4.13 0.50 1.61 1.01 -1.26 -2.80 116.67 115.86 2jop s ASP 88 Ca 0.00 0.79 -0.21 0.00 0.71 0.00 0.00 52.55 53.84 2jop s ASP 88 Cb 0.00 -1.26 -0.07 0.00 1.01 0.00 0.00 42.92 42.60 2jop s ASP 88 CO 0.00 -2.14 1.11 -2.16 0.21 0.00 0.00 175.17 172.19 2jop s PRO 89 N -5.53 3.62 -0.36 8.23 0.04 -1.26 -0.52 135.00 139.22 2jop s PRO 89 Ca 0.63 1.59 -0.33 0.00 0.04 0.00 0.00 61.00 62.93 2jop s PRO 89 Cb -0.11 -2.17 -0.14 0.00 0.04 0.00 0.00 34.50 32.12 2jop s PRO 89 CO 0.50 -0.62 1.35 1.47 0.04 0.00 0.00 177.00 179.74 2jop n LEU 90 N -0.92 0.71 -4.78 -3.56 -0.00 -1.25 -0.43 117.00 106.77 2jop n LEU 90 Ca 0.09 0.68 -0.37 0.00 -0.00 0.00 0.00 56.01 56.41 2jop n LEU 90 Cb 0.50 -0.64 -0.03 0.00 -0.00 0.00 0.00 43.42 43.25 2jop n LEU 90 CO 0.43 -0.58 0.77 -0.55 -0.00 0.00 0.00 177.39 177.46 2jop s SER 91 N 3.24 6.58 -0.22 1.45 0.15 0.78 -4.41 113.70 121.27 2jop s SER 91 Ca 0.81 2.13 -0.04 0.00 0.70 0.00 0.00 55.95 59.55 2jop s SER 91 Cb -1.08 -2.59 -0.01 0.00 -1.71 0.00 0.00 66.02 60.63 2jop s SER 91 CO 0.53 -0.62 -0.04 -0.22 1.20 0.00 0.00 173.24 174.10 2jop s LEU 92 N -2.74 2.94 0.17 3.45 2.96 -1.26 -0.94 118.68 123.26 2jop s LEU 92 Ca 0.59 -0.37 -0.18 0.00 -0.22 0.00 0.00 54.13 53.96 2jop s LEU 92 Cb -0.24 -1.75 0.04 0.00 0.50 0.00 0.00 46.19 44.73 2jop s LEU 92 CO 0.30 -0.01 0.50 -0.83 -1.32 0.00 0.00 176.35 175.00 2jop s GLY 93 N 1.41 -0.21 -0.03 7.98 0.00 -0.85 -3.72 107.32 111.90 2jop s GLY 93 Ca 0.05 -0.09 -0.33 0.00 0.00 0.00 0.00 44.72 44.35 2jop s GLY 93 CO -0.02 -0.22 1.90 -1.55 0.00 0.00 0.00 173.10 173.20 2jop n PRO 94 N -0.32 2.41 -3.55 2.90 -0.04 -1.26 -0.16 135.00 134.98 2jop n PRO 94 Ca -0.12 0.88 -0.29 0.00 -0.04 0.00 0.00 63.50 63.93 2jop n PRO 94 Cb 0.63 -2.76 -0.08 0.00 -0.04 0.00 0.00 33.50 31.25 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 6.72 3.51 0.00 0.54 7.35 -0.57 -4.77 117.46 130.23 2jop n PHE 95 Ca 0.21 -4.10 0.00 0.00 -0.76 0.00 0.00 57.45 52.80 2jop n PHE 95 Cb 0.33 -0.67 0.00 0.00 0.35 0.00 0.00 39.48 39.49 2jop n PHE 95 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 2jop n LEU 96 N 1.31 0.00 -3.34 -2.13 4.77 -1.26 -4.01 117.00 112.33 2jop n LEU 96 Ca 0.26 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 56.12 2jop n LEU 96 Cb 0.38 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.40 2jop n LEU 96 CO 0.39 0.00 -0.11 -0.75 -1.33 0.00 0.00 177.39 175.59 2jop s LYS 97 N 0.00 0.41 -0.11 3.23 2.20 -1.26 -4.60 119.74 119.61 2jop s LYS 97 Ca 0.00 -0.05 0.15 0.00 -0.36 0.00 0.00 55.97 55.71 2jop s LYS 97 Cb 0.00 -0.45 0.33 0.00 -1.51 0.00 0.00 37.83 36.20 2jop s LYS 97 CO 0.00 -1.05 1.16 0.25 -0.36 0.00 0.00 175.35 175.35 2jop n THR 98 N 5.24 1.23 -4.31 3.43 -2.24 -1.26 -5.05 114.28 111.32 2jop n THR 98 Ca 0.01 -1.97 -0.16 0.00 -2.27 0.00 0.00 64.05 59.65 2jop n THR 98 Cb 0.48 0.20 -0.10 0.00 -2.10 0.00 0.00 70.33 68.80 2jop n THR 98 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 2jop s TYR 99 N -1.83 1.48 -0.21 4.78 1.13 -1.26 -4.89 117.35 116.54 2jop s TYR 99 Ca 0.30 -0.97 -0.04 0.00 -1.41 0.00 0.00 57.07 54.96 2jop s TYR 99 Cb 0.30 -0.86 0.07 0.00 -1.10 0.00 0.00 41.96 40.38 2jop s TYR 99 CO -0.06 -0.11 0.08 0.99 -2.51 0.00 0.00 175.55 173.94 2jop s THR 100 N -3.51 0.22 -0.96 -3.49 2.01 -1.26 -5.02 115.64 103.63 2jop s THR 100 Ca 0.28 -0.52 -0.24 0.00 0.31 0.00 0.00 61.69 61.52 2jop s THR 100 Cb 0.06 -0.91 -0.21 0.00 0.01 0.00 0.00 72.50 71.45 2jop s THR 100 CO 0.08 -0.37 2.00 -2.65 -0.69 0.00 0.00 174.62 172.99 2jop n PRO 101 N 5.15 0.09 0.00 4.92 -0.02 -1.26 -0.56 135.00 143.33 2jop n PRO 101 Ca -0.07 -1.49 0.00 0.00 -2.02 0.00 0.00 63.50 59.91 2jop n PRO 101 Cb 0.46 -3.62 0.00 0.00 -0.02 0.00 0.00 33.50 30.33 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 7.74 0.00 0.03 -0.52 7.27 -1.21 -4.77 117.38 125.93 2jop n GLN 102 Ca 0.37 0.00 -0.22 0.00 0.07 0.00 0.00 57.00 57.22 2jop n GLN 102 Cb 0.47 0.00 -0.14 0.00 2.41 0.00 0.00 30.24 32.98 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 0.49 -3.47 1.69 0.02 -1.57 -3.45 113.55 107.27 2jop h SER 103 Ca 0.00 -0.92 -0.53 0.00 -0.84 0.00 0.00 61.79 59.50 2jop h SER 103 Cb 0.00 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 62.36 2jop h SER 103 CO 0.00 1.78 -0.07 -0.94 -1.14 0.00 0.00 176.83 176.46 2jop s SER 104 N -7.15 6.62 0.26 3.07 1.04 0.28 -4.64 113.70 113.18 2jop s SER 104 Ca -0.19 0.96 0.11 0.00 0.48 0.00 0.00 55.95 57.31 2jop s SER 104 Cb 0.06 -2.24 -0.05 0.00 0.10 0.00 0.00 66.02 63.89 2jop s SER 104 CO 0.80 -0.12 -0.20 0.27 0.98 0.00 0.00 173.24 174.97 2jop s ILE 105 N -1.90 2.37 -0.32 -1.02 -5.25 0.42 -2.85 121.20 112.65 2jop s ILE 105 Ca 0.48 -2.33 -0.03 0.00 -0.99 0.00 0.00 60.65 57.77 2jop s ILE 105 Cb -0.11 -2.24 0.05 0.00 2.95 0.00 0.00 42.46 43.11 2jop s ILE 105 CO 0.22 -0.39 0.04 -0.63 -1.79 0.00 0.00 174.94 172.40 2jop s ILE 106 N -2.45 3.27 0.55 8.37 1.01 0.49 -2.22 121.20 130.22 2jop s ILE 106 Ca 0.28 -1.33 -0.07 0.00 0.00 0.00 0.00 60.65 59.53 2jop s ILE 106 Cb -0.05 -2.89 -0.02 0.00 0.01 0.00 0.00 42.46 39.51 2jop s ILE 106 CO 0.13 -0.16 0.89 0.00 0.00 0.00 0.00 174.94 175.80 2jop n TYR 108 N -2.50 0.00 -0.51 0.00 4.01 -1.23 -0.65 117.16 116.28 2jop n TYR 108 Ca 0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.77 2jop n TYR 108 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.59 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 0.91 0.93 3.69 2.72 0.00 -1.26 -4.48 105.19 107.70 2jop n GLY 109 Ca 0.00 -1.56 -0.33 0.00 0.00 0.00 0.00 46.02 44.13 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 2.84 -0.28 1.61 1.11 -1.26 -4.61 119.66 119.06 2jop s GLN 110 Ca 0.00 -0.57 -0.36 0.00 0.01 0.00 0.00 55.36 54.44 2jop s GLN 110 Cb 0.00 -2.70 -0.12 0.00 -1.01 0.00 0.00 33.01 29.18 2jop s GLN 110 CO 0.00 0.64 2.03 -0.11 0.01 0.00 0.00 175.29 177.86 2jop n LEU 111 N 1.48 2.48 0.00 2.90 7.94 -1.26 -0.56 117.00 129.98 2jop n LEU 111 Ca -0.15 0.67 0.00 0.00 -1.11 0.00 0.00 56.01 55.42 2jop n LEU 111 Cb 0.53 -1.26 0.00 0.00 0.53 0.00 0.00 43.42 43.22 2jop n LEU 111 CO 0.33 -0.52 0.00 0.61 -1.11 0.00 0.00 177.39 176.70 2jop n GLY 112 N 5.58 1.76 3.23 -3.96 0.00 -1.26 -5.03 105.19 105.52 2jop n GLY 112 Ca 0.34 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.93 2jop n GLY 112 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2jop n SER 113 N 0.00 4.94 -2.84 1.61 2.88 0.28 -3.69 113.62 116.80 2jop n SER 113 Ca 0.00 -2.98 -0.29 0.00 -1.33 0.00 0.00 58.87 54.27 2jop n SER 113 Cb 0.00 -1.60 -0.08 0.00 -0.75 0.00 0.00 64.21 61.78 2jop n SER 113 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 2jop n PHE 114 N 5.86 1.55 -0.01 0.66 3.01 0.61 -4.04 117.46 125.09 2jop n PHE 114 Ca 0.42 -2.52 -0.01 0.00 1.01 0.00 0.00 57.45 56.36 2jop n PHE 114 Cb 0.41 -2.17 -0.02 0.00 -0.01 0.00 0.00 39.48 37.69 2jop n PHE 114 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 2jop n SER 115 N 3.20 4.43 -3.74 4.37 7.64 -1.26 -3.94 113.62 124.31 2jop n SER 115 Ca 0.66 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 60.42 2jop n SER 115 Cb 0.48 0.65 -0.11 0.00 -1.01 0.00 0.00 64.21 64.22 2jop n SER 115 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 2jop s ASN 116 N -3.11 -0.35 0.17 6.43 3.84 -1.26 -5.01 114.94 115.65 2jop s ASN 116 Ca -0.01 0.65 0.03 0.00 0.21 0.00 0.00 52.86 53.74 2jop s ASN 116 Cb 0.01 0.61 -0.01 0.00 -0.55 0.00 0.00 41.25 41.31 2jop s ASN 116 CO 0.10 -0.14 0.11 0.00 -2.79 0.00 0.00 177.10 174.37 2jop s SER 118 N -2.13 0.26 0.06 0.00 0.15 -0.12 -4.91 113.70 107.02 2jop s SER 118 Ca 0.15 -0.26 -0.30 0.00 0.70 0.00 0.00 55.95 56.24 2jop s SER 118 Cb 0.01 0.03 -0.09 0.00 -1.71 0.00 0.00 66.02 64.26 2jop s SER 118 CO 0.11 -0.12 1.79 -1.00 1.20 0.00 0.00 173.24 175.21 2jop s HIS 119 N -0.71 2.00 0.15 3.44 3.76 -1.26 -0.38 115.29 122.30 2jop s HIS 119 Ca -0.07 0.00 -0.31 0.00 -0.15 0.00 0.00 55.06 54.53 2jop s HIS 119 Cb -0.05 -4.10 -0.11 0.00 1.11 0.00 0.00 32.58 29.44 2jop s HIS 119 CO -0.00 -4.60 1.75 0.45 -0.85 0.00 0.00 174.74 171.49 2jop s SER 120 N 3.11 6.43 0.10 1.40 0.15 -1.13 -4.76 113.70 119.00 2jop s SER 120 Ca 0.80 2.77 -0.00 0.00 0.70 0.00 0.00 55.95 60.22 2jop s SER 120 Cb -0.42 -2.58 -0.00 0.00 -1.71 0.00 0.00 66.02 61.31 2jop s SER 120 CO 0.35 -0.97 -0.00 0.54 1.20 0.00 0.00 173.24 174.37 2jop n ARG 121 N 4.89 0.00 -3.61 5.44 5.12 -1.26 -3.32 116.66 123.92 2jop n ARG 121 Ca 0.17 0.00 -0.02 0.00 -1.93 0.00 0.00 57.85 56.07 2jop n ARG 121 Cb 0.37 -0.49 -0.06 0.00 -1.16 0.00 0.00 32.46 31.12 2jop n ARG 121 CO 0.00 0.00 0.00 1.21 -1.93 0.00 0.00 177.63 176.91 2jop s ASN 122 N -5.98 -0.56 0.00 0.55 3.84 -1.26 -4.93 114.94 106.61 2jop s ASN 122 Ca -0.00 0.87 0.00 0.00 0.21 0.00 0.00 52.86 53.94 2jop s ASN 122 Cb 0.00 1.31 0.00 0.00 -0.55 0.00 0.00 41.25 42.01 2jop s ASN 122 CO 0.00 -0.13 0.00 -0.67 -2.79 0.00 0.00 177.10 173.51 2jop n ASP 123 N 3.96 0.00 0.05 -4.21 -0.08 -1.26 -5.04 116.55 109.97 2jop n ASP 123 Ca -0.17 0.00 0.13 0.00 -1.51 0.00 0.00 54.79 53.24 2jop n ASP 123 Cb 0.57 0.00 0.43 0.00 2.34 0.00 0.00 41.12 44.46 2jop n ASP 123 CO 0.00 0.00 0.00 0.23 0.12 0.00 0.00 177.20 177.55 2jop n MET 124 N 0.00 0.14 -2.52 -0.67 2.81 -1.26 -4.64 117.12 110.98 2jop n MET 124 Ca 0.00 0.09 -0.40 0.00 -1.81 0.00 0.00 57.70 55.58 2jop n MET 124 Cb 0.00 -1.64 -0.03 0.00 -0.71 0.00 0.00 33.22 30.84 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 9.41 2.79 -3.89 0.00 -0.00 -1.26 -4.58 115.22 117.70 2jop n HIS 126 Ca 0.24 -2.68 -0.32 0.00 0.46 0.00 0.00 57.72 55.42 2jop n HIS 126 Cb 0.50 -2.30 0.01 0.00 -0.12 0.00 0.00 29.99 28.08 2jop n HIS 126 CO 0.00 0.00 0.00 -1.13 0.46 0.00 0.00 176.34 175.67 2jop n SER 127 N 5.71 -4.62 -4.75 0.26 3.41 -1.26 -4.49 113.62 107.88 2jop n SER 127 Ca 0.56 -1.08 -0.41 0.00 -0.26 0.00 0.00 58.87 57.68 2jop n SER 127 Cb 0.34 -1.69 -0.04 0.00 -0.26 0.00 0.00 64.21 62.56 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 -5.84 4.54 -0.04 1.04 1.43 -1.25 -1.52 118.68 117.04 2jop s LEU 128 Ca 0.17 2.13 0.07 0.00 -1.03 0.00 0.00 54.13 55.48 2jop s LEU 128 Cb -0.10 -3.61 -0.01 0.00 0.03 0.00 0.00 46.19 42.50 2jop s LEU 128 CO 0.92 -0.14 -0.25 -0.83 0.23 0.00 0.00 176.35 176.28 2jop s GLY 129 N -0.54 1.29 -0.10 -3.19 0.00 0.77 -4.40 107.32 101.14 2jop s GLY 129 Ca 0.46 -1.08 -0.08 0.00 0.00 0.00 0.00 44.72 44.02 2jop s GLY 129 CO 0.37 -0.77 0.18 1.08 0.00 0.00 0.00 173.10 173.96 2jop s LEU 130 N -0.36 4.40 -0.21 0.66 1.43 -0.78 -2.01 118.68 121.81 2jop s LEU 130 Ca 0.02 0.55 -0.04 0.00 -1.03 0.00 0.00 54.13 53.63 2jop s LEU 130 Cb -0.12 -2.15 0.09 0.00 0.03 0.00 0.00 46.19 44.04 2jop s LEU 130 CO 0.02 0.40 0.17 0.28 0.23 0.00 0.00 176.35 177.45 2jop s THR 131 N -1.03 -0.22 -0.37 5.49 -1.32 -0.11 -0.96 115.64 117.11 2jop s THR 131 Ca 0.16 -0.26 -0.38 0.00 -1.21 0.00 0.00 61.69 60.01 2jop s THR 131 Cb -0.13 -0.72 -0.14 0.00 -1.51 0.00 0.00 72.50 70.01 2jop s THR 131 CO 0.05 -0.33 2.10 0.00 -2.21 0.00 0.00 174.62 174.24 2jop n LEU 133 N 8.54 0.00 0.00 0.00 7.94 0.42 -4.61 117.00 129.29 2jop n LEU 133 Ca 0.42 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.32 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 0.80 0.00 0.13 -1.84 -1.11 0.00 0.00 177.39 175.36