#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 2.69 0.04 6.15 1.43 -1.26 -5.08 118.68 122.64 2jop s LEU 26 Ca 0.00 -1.12 0.04 0.00 -1.03 0.00 0.00 54.13 52.02 2jop s LEU 26 Cb 0.00 -1.30 -0.02 0.00 0.03 0.00 0.00 46.19 44.89 2jop s LEU 26 CO 0.00 -0.19 -0.13 -0.94 0.23 0.00 0.00 176.35 175.33 2jop s SER 27 N 1.32 1.52 -0.00 2.29 1.04 -1.25 -0.40 113.70 118.21 2jop s SER 27 Ca -0.05 -0.49 0.00 0.00 0.48 0.00 0.00 55.95 55.90 2jop s SER 27 Cb -0.18 -0.08 0.01 0.00 0.10 0.00 0.00 66.02 65.88 2jop s SER 27 CO -0.07 -0.02 0.60 -2.67 0.98 0.00 0.00 173.24 172.06 2jop n TRP 28 N 1.76 0.03 -0.08 5.02 4.27 -1.23 -2.32 117.44 124.88 2jop n TRP 28 Ca -0.19 -0.01 0.04 0.00 -3.89 0.00 0.00 57.50 53.44 2jop n TRP 28 Cb 0.55 -0.09 0.09 0.00 -1.36 0.00 0.00 31.31 30.50 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 -0.06 0.27 -2.74 -2.67 0.18 -1.26 -4.48 117.16 106.40 2jop n TYR 29 Ca 0.00 -0.47 -0.41 0.00 1.88 0.00 0.00 57.90 58.91 2jop n TYR 29 Cb 0.23 -0.03 -0.04 0.00 -0.38 0.00 0.00 39.34 39.11 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 -0.97 7.47 0.39 9.48 1.01 -0.98 -4.96 116.67 128.11 2jop s ASP 30 Ca 0.14 1.76 0.17 0.00 0.71 0.00 0.00 52.55 55.33 2jop s ASP 30 Cb 0.07 -2.58 0.82 0.00 1.01 0.00 0.00 42.92 42.24 2jop s ASP 30 CO 0.10 -0.09 1.84 1.55 0.21 0.00 0.00 175.17 178.77 2jop h PRO 31 N 5.76 0.00 -0.44 8.23 0.13 -1.93 -2.38 132.00 141.37 2jop h PRO 31 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 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 0.72 0.34 0.00 -0.40 -0.23 0.00 0.00 178.00 178.43 2jop n ASP 32 N -3.86 3.20 -4.56 1.44 5.75 -1.26 -4.83 116.55 112.42 2jop n ASP 32 Ca -0.01 -1.96 -0.43 0.00 -0.01 0.00 0.00 54.79 52.38 2jop n ASP 32 Cb 0.41 -0.29 -0.05 0.00 -1.03 0.00 0.00 41.12 40.16 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 -1.43 3.04 -0.22 2.11 5.36 -0.90 -5.00 117.98 120.95 2jop s PHE 33 Ca 0.39 0.35 -0.29 0.00 -0.96 0.00 0.00 56.93 56.42 2jop s PHE 33 Cb 0.22 -3.56 -0.03 0.00 -0.34 0.00 0.00 43.02 39.31 2jop s PHE 33 CO 0.30 -0.88 1.59 -0.65 -1.46 0.00 0.00 175.22 174.12 2jop s GLN 34 N 3.22 3.83 -0.09 10.12 1.11 -1.26 -4.88 119.66 131.72 2jop s GLN 34 Ca 0.31 1.66 -0.08 0.00 0.01 0.00 0.00 55.36 57.25 2jop s GLN 34 Cb -0.12 -4.02 0.02 0.00 -1.01 0.00 0.00 33.01 27.88 2jop s GLN 34 CO 0.20 -1.25 0.23 0.00 0.01 0.00 0.00 175.29 174.48 2jop s ALA 35 N 5.06 -0.57 -0.00 6.09 0.00 -1.26 -0.79 121.76 130.29 2jop s ALA 35 Ca 0.70 0.65 -0.20 0.00 0.00 0.00 0.00 51.96 53.11 2jop s ALA 35 Cb -0.25 -0.37 0.07 0.00 0.00 0.00 0.00 23.12 22.57 2jop s ALA 35 CO 0.28 -0.11 0.90 2.89 0.00 0.00 0.00 175.76 179.72 2jop n ARG 36 N 2.93 0.16 -4.27 0.00 1.85 -0.78 -4.98 116.66 111.58 2jop n ARG 36 Ca -0.13 -0.60 -0.32 0.00 -1.00 0.00 0.00 57.85 55.80 2jop n ARG 36 Cb 0.58 0.97 -0.09 0.00 -1.05 0.00 0.00 32.46 32.87 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 3.52 0.30 2.89 1.43 -1.26 -0.20 118.68 125.36 2jop s LEU 37 Ca 0.21 -0.02 0.03 0.00 -1.03 0.00 0.00 54.13 53.33 2jop s LEU 37 Cb -0.01 -2.04 -0.04 0.00 0.03 0.00 0.00 46.19 44.14 2jop s LEU 37 CO -0.00 0.27 0.17 0.42 0.23 0.00 0.00 176.35 177.44 2jop s THR 38 N -1.11 0.29 -1.41 5.49 -4.23 -0.90 -4.81 115.64 108.96 2jop s THR 38 Ca 0.20 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.71 2jop s THR 38 Cb -0.12 -2.51 0.00 0.00 1.34 0.00 0.00 72.50 71.22 2jop s THR 38 CO 0.11 0.00 0.00 0.54 -0.54 0.00 0.00 174.62 174.73 2jop n ARG 39 N -0.58 -1.04 -3.57 3.99 1.74 -1.26 -3.82 116.66 112.13 2jop n ARG 39 Ca 0.01 0.90 -0.14 0.00 -0.77 0.00 0.00 57.85 57.85 2jop n ARG 39 Cb 0.65 -5.06 -0.06 0.00 -1.02 0.00 0.00 32.46 26.97 2jop n ARG 39 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2jop s SER 40 N -2.69 -0.47 0.20 0.55 1.04 -1.26 -5.00 113.70 106.07 2jop s SER 40 Ca 0.00 0.26 0.11 0.00 0.48 0.00 0.00 55.95 56.80 2jop s SER 40 Cb 0.00 0.49 -0.07 0.00 0.10 0.00 0.00 66.02 66.54 2jop s SER 40 CO 0.00 -0.69 1.35 -1.13 0.98 0.00 0.00 173.24 173.75 2jop h ASN 41 N 2.87 0.00 -2.63 7.02 -0.73 -1.93 -3.44 115.58 116.74 2jop h ASN 41 Ca -0.30 0.00 -0.57 0.00 1.87 0.00 0.00 56.30 57.29 2jop h ASN 41 Cb 1.20 0.00 -0.02 0.00 0.27 0.00 0.00 38.32 39.77 2jop h ASN 41 CO 0.41 0.74 1.25 -0.44 -0.37 0.00 0.00 177.43 179.02 2jop s SER 42 N -6.56 6.01 0.18 1.15 0.01 -1.26 -4.83 113.70 108.40 2jop s SER 42 Ca 0.02 1.49 0.22 0.00 1.31 0.00 0.00 55.95 59.00 2jop s SER 42 Cb 0.09 -2.53 0.89 0.00 0.21 0.00 0.00 66.02 64.68 2jop s SER 42 CO 0.78 -1.58 1.68 0.29 0.41 0.00 0.00 173.24 174.81 2jop n LYS 43 N 8.22 0.15 -0.25 12.44 5.02 -1.26 -2.45 118.16 140.04 2jop n LYS 43 Ca 0.22 0.34 0.07 0.00 -2.02 0.00 0.00 58.31 56.91 2jop n LYS 43 Cb 0.46 -1.76 0.17 0.00 -0.02 0.00 0.00 35.03 33.88 2jop n LYS 43 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2jop s GLN 45 N -1.93 0.44 0.00 0.00 -0.21 -1.03 -0.15 119.66 116.79 2jop s GLN 45 Ca 0.29 1.02 0.00 0.00 0.02 0.00 0.00 55.36 56.68 2jop s GLN 45 Cb 0.21 0.22 0.00 0.00 1.00 0.00 0.00 33.01 34.44 2jop s GLN 45 CO 0.10 -0.19 0.00 0.41 -2.12 0.00 0.00 175.29 173.48 2jop n GLY 46 N 4.79 -2.67 3.83 3.09 0.00 -0.81 -4.36 105.19 109.06 2jop n GLY 46 Ca -0.16 -1.35 -0.35 0.00 0.00 0.00 0.00 46.02 44.15 2jop n GLY 46 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jop s GLN 47 N -1.96 4.16 -0.07 1.61 -0.21 -1.25 -1.26 119.66 120.68 2jop s GLN 47 Ca 0.00 0.78 -0.30 0.00 0.02 0.00 0.00 55.36 55.86 2jop s GLN 47 Cb 0.00 -2.79 -0.03 0.00 1.00 0.00 0.00 33.01 31.19 2jop s GLN 47 CO 0.00 0.36 1.19 -1.17 -2.12 0.00 0.00 175.29 173.55 2jop s LEU 48 N -2.18 4.27 -0.19 2.90 2.96 -1.26 -2.11 118.68 123.07 2jop s LEU 48 Ca 0.45 1.78 0.01 0.00 -0.22 0.00 0.00 54.13 56.14 2jop s LEU 48 Cb -0.15 -3.56 0.03 0.00 0.50 0.00 0.00 46.19 43.01 2jop s LEU 48 CO 0.20 -0.59 -0.18 -0.70 -1.32 0.00 0.00 176.35 173.76 2jop s GLU 49 N 2.32 2.76 -0.06 1.98 2.12 0.72 -0.39 118.70 128.15 2jop s GLU 49 Ca 0.55 -0.85 0.04 0.00 0.36 0.00 0.00 54.97 55.07 2jop s GLU 49 Cb -0.24 -2.53 0.00 0.00 0.26 0.00 0.00 34.13 31.63 2jop s GLU 49 CO 0.21 -0.26 -0.17 0.14 -0.54 0.00 0.00 175.26 174.63 2jop s VAL 50 N 1.30 1.46 -0.55 3.70 -7.23 -0.21 -1.87 120.40 117.01 2jop s VAL 50 Ca 0.03 -0.70 -0.22 0.00 -1.81 0.00 0.00 61.98 59.28 2jop s VAL 50 Cb -0.14 -1.28 0.05 0.00 0.56 0.00 0.00 36.38 35.58 2jop s VAL 50 CO -0.12 0.42 0.85 -0.47 -0.31 0.00 0.00 175.10 175.47 2jop s TYR 51 N 0.28 2.86 -0.06 2.82 5.04 0.03 -0.17 117.35 128.15 2jop s TYR 51 Ca -0.10 -0.26 0.02 0.00 -2.44 0.00 0.00 57.07 54.29 2jop s TYR 51 Cb -0.14 -3.94 0.02 0.00 0.35 0.00 0.00 41.96 38.25 2jop s TYR 51 CO 0.04 -1.29 -0.09 -0.48 -1.34 0.00 0.00 175.55 172.39 2jop s LEU 52 N 3.54 1.50 0.00 6.97 0.05 -0.47 -4.47 118.68 125.80 2jop s LEU 52 Ca 0.24 -0.22 0.00 0.00 0.05 0.00 0.00 54.13 54.20 2jop s LEU 52 Cb -0.15 -0.66 0.00 0.00 -2.05 0.00 0.00 46.19 43.32 2jop s LEU 52 CO 0.16 -0.01 0.00 1.17 -0.55 0.00 0.00 176.35 177.12 2jop n LYS 53 N 3.94 0.00 0.00 1.48 4.81 -1.26 -1.28 118.16 125.85 2jop n LYS 53 Ca -0.24 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.20 2jop n LYS 53 Cb 0.51 -0.14 0.00 0.00 0.02 0.00 0.00 35.03 35.42 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 1.40 0.00 -4.64 3.14 5.68 -1.26 -5.13 116.55 115.74 2jop n ASP 54 Ca 0.00 0.00 -0.42 0.00 -0.50 0.00 0.00 54.79 53.87 2jop n ASP 54 Cb 0.00 0.00 -0.04 0.00 -1.14 0.00 0.00 41.12 39.94 2jop n ASP 54 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 2jop s GLY 55 N 0.00 1.78 -1.01 6.12 0.00 -0.40 -4.94 107.32 108.87 2jop s GLY 55 Ca 0.00 -0.16 -0.22 0.00 0.00 0.00 0.00 44.72 44.34 2jop s GLY 55 CO 0.00 1.76 1.92 0.79 0.00 0.00 0.00 173.10 177.57 2jop n TRP 56 N 5.92 2.39 -2.44 1.90 7.02 -1.26 -1.37 117.44 129.61 2jop n TRP 56 Ca 0.05 -1.62 -0.43 0.00 -1.02 0.00 0.00 57.50 54.48 2jop n TRP 56 Cb 0.48 -2.23 -0.02 0.00 -2.42 0.00 0.00 31.31 27.11 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 8.41 2.57 -0.45 -5.99 3.76 0.75 -4.68 115.29 119.66 2jop s HIS 57 Ca 0.64 0.71 -0.25 0.00 -0.15 0.00 0.00 55.06 56.01 2jop s HIS 57 Cb 0.06 -4.31 0.02 0.00 1.11 0.00 0.00 32.58 29.46 2jop s HIS 57 CO 0.13 -1.72 0.89 0.00 -0.85 0.00 0.00 174.74 173.20 2jop s MET 58 N 4.70 3.55 0.62 1.40 0.23 -1.26 -1.04 119.30 127.50 2jop s MET 58 Ca 0.56 0.16 -0.03 0.00 -1.03 0.00 0.00 55.69 55.36 2jop s MET 58 Cb -0.12 -3.91 0.04 0.00 -1.53 0.00 0.00 34.83 29.31 2jop s MET 58 CO 0.31 -1.16 0.89 0.14 -2.03 0.00 0.00 175.02 173.17 2jop s VAL 59 N 3.62 2.65 -0.81 5.16 -7.23 0.48 -1.16 120.40 123.11 2jop s VAL 59 Ca 0.36 -0.42 0.11 0.00 -1.81 0.00 0.00 61.98 60.22 2jop s VAL 59 Cb -0.11 -3.07 0.55 0.00 0.56 0.00 0.00 36.38 34.32 2jop s VAL 59 CO 0.25 -0.06 1.38 0.00 -0.31 0.00 0.00 175.10 176.35 2jop n SER 61 N 0.57 0.00 0.00 0.00 7.64 -1.26 -3.65 113.62 116.92 2jop n SER 61 Ca 0.19 0.00 0.11 0.00 1.01 0.00 0.00 58.87 60.18 2jop n SER 61 Cb 0.81 0.00 0.62 0.00 -1.01 0.00 0.00 64.21 64.63 2jop n SER 61 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jop n GLN 62 N 0.00 0.48 -0.66 1.43 -0.00 -1.26 -4.81 117.38 112.55 2jop n GLN 62 Ca 0.00 0.05 -0.30 0.00 -0.00 0.00 0.00 57.00 56.74 2jop n GLN 62 Cb 0.00 -1.50 0.18 0.00 -0.00 0.00 0.00 30.24 28.92 2jop n GLN 62 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.06 175.94 2jop s SER 63 N -2.36 2.52 0.00 2.61 0.01 -1.26 -2.69 113.70 112.53 2jop s SER 63 Ca 0.27 2.06 0.00 0.00 1.31 0.00 0.00 55.95 59.58 2jop s SER 63 Cb 0.16 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.87 2jop s SER 63 CO 0.32 -3.33 0.00 0.79 0.41 0.00 0.00 173.24 171.42 2jop n TRP 64 N -4.38 0.00 0.00 2.43 8.01 0.17 -4.21 117.44 119.46 2jop n TRP 64 Ca 0.10 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.29 2jop n TRP 64 Cb 0.52 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.82 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 -0.17 3.03 6.99 0.00 -1.26 -4.19 105.19 109.59 2jop n GLY 65 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2jop n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jop n ARG 66 N -1.76 2.60 -0.09 1.61 3.00 -1.26 -4.64 116.66 116.11 2jop n ARG 66 Ca 0.00 -2.59 -0.06 0.00 -0.01 0.00 0.00 57.85 55.18 2jop n ARG 66 Cb 0.00 -3.29 0.12 0.00 0.00 0.00 0.00 32.46 29.28 2jop n ARG 66 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 2jop h SER 67 N 6.91 0.76 -0.21 0.55 0.87 -1.80 -3.33 113.55 117.30 2jop h SER 67 Ca 0.50 -0.25 -0.20 0.00 -1.23 0.00 0.00 61.79 60.61 2jop h SER 67 Cb 0.71 -0.21 -0.29 0.00 -0.44 0.00 0.00 62.40 62.17 2jop h SER 67 CO 1.77 0.93 -0.87 -1.54 -0.53 0.00 0.00 176.83 176.58 2jop n SER 68 N -4.14 1.95 -4.05 6.23 3.41 -1.26 -4.85 113.62 110.91 2jop n SER 68 Ca 0.01 -2.81 -0.21 0.00 -0.26 0.00 0.00 58.87 55.60 2jop n SER 68 Cb 0.39 -0.41 -0.15 0.00 -0.26 0.00 0.00 64.21 63.78 2jop n SER 68 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2jop s LYS 69 N -2.27 1.09 -0.31 4.33 1.02 -1.25 -5.00 119.74 117.34 2jop s LYS 69 Ca 0.36 -0.39 0.16 0.00 0.02 0.00 0.00 55.97 56.12 2jop s LYS 69 Cb 0.37 -1.01 0.47 0.00 -0.52 0.00 0.00 37.83 37.14 2jop s LYS 69 CO -0.08 0.18 1.07 0.00 -0.92 0.00 0.00 175.35 175.60 2jop n GLN 70 N 3.10 2.15 0.00 1.68 10.64 -1.26 -4.81 117.38 128.89 2jop n GLN 70 Ca -0.17 -3.71 0.00 0.00 -1.83 0.00 0.00 57.00 51.30 2jop n GLN 70 Cb 0.55 -1.72 0.00 0.00 -0.86 0.00 0.00 30.24 28.21 2jop n GLN 70 CO 0.00 0.00 0.00 0.91 -1.83 0.00 0.00 177.06 176.14 2jop n TRP 71 N -0.43 0.00 0.42 2.61 7.02 -1.26 -4.88 117.44 120.92 2jop n TRP 71 Ca 0.19 0.00 0.13 0.00 -1.02 0.00 0.00 57.50 56.80 2jop n TRP 71 Cb 0.81 0.00 0.30 0.00 -2.42 0.00 0.00 31.31 30.00 2jop n TRP 71 CO 0.00 0.00 0.00 1.05 -2.02 0.00 0.00 177.69 176.72 2jop h GLU 72 N 0.00 0.00 -3.37 -0.99 9.09 -1.98 -3.38 114.58 113.96 2jop h GLU 72 Ca 0.00 0.00 -0.64 0.00 0.05 0.00 0.00 59.36 58.77 2jop h GLU 72 Cb 0.00 0.00 -0.40 0.00 -1.65 0.00 0.00 28.75 26.70 2jop h GLU 72 CO 0.00 0.00 -0.59 0.34 0.05 0.00 0.00 179.01 178.81 2jop s ASP 73 N -5.36 4.49 -0.02 3.06 2.15 -1.26 -4.96 116.67 114.77 2jop s ASP 73 Ca 0.09 -3.11 -0.01 0.00 0.43 0.00 0.00 52.55 49.95 2jop s ASP 73 Cb 0.09 -1.67 -0.00 0.00 -0.30 0.00 0.00 42.92 41.04 2jop s ASP 73 CO 0.63 -0.23 -0.02 1.55 -0.17 0.00 0.00 175.17 176.93 2jop h PRO 74 N 6.42 0.00 -3.12 4.34 0.13 -1.91 -3.48 132.00 134.39 2jop h PRO 74 Ca -0.05 0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 64.84 2jop h PRO 74 Cb 0.88 0.00 -0.32 0.00 0.13 0.00 0.00 31.00 31.69 2jop h PRO 74 CO 0.70 0.00 -0.57 -1.12 -0.23 0.00 0.00 178.00 176.77 2jop s SER 75 N -3.75 0.11 -0.23 1.44 0.01 -1.26 -4.76 113.70 105.26 2jop s SER 75 Ca -0.02 0.39 -0.06 0.00 1.31 0.00 0.00 55.95 57.57 2jop s SER 75 Cb 0.00 0.32 -0.21 0.00 0.21 0.00 0.00 66.02 66.33 2jop s SER 75 CO 0.03 -0.19 3.46 0.00 0.41 0.00 0.00 173.24 176.95 2jop n GLN 76 N 4.60 2.25 -1.48 12.44 1.13 -1.26 -4.37 117.38 130.69 2jop n GLN 76 Ca -0.19 -1.29 -0.04 0.00 -1.94 0.00 0.00 57.00 53.54 2jop n GLN 76 Cb 0.51 -2.11 0.10 0.00 0.11 0.00 0.00 30.24 28.85 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 2.45 3.71 0.16 -1.58 0.00 -1.26 -4.73 120.51 119.26 2jop n ALA 77 Ca 0.48 -3.22 0.08 0.00 0.00 0.00 0.00 53.44 50.78 2jop n ALA 77 Cb 0.80 -0.48 0.58 0.00 0.00 0.00 0.00 19.45 20.36 2jop n ALA 77 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2jop h SER 78 N 1.57 0.14 0.36 0.00 0.87 -1.91 -0.30 113.55 114.28 2jop h SER 78 Ca 0.06 -0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.55 2jop h SER 78 Cb 1.35 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 63.27 2jop h SER 78 CO 0.27 0.10 -0.28 0.50 -0.53 0.00 0.00 176.83 176.88 2jop h LYS 79 N 0.16 0.00 0.15 2.24 3.11 -1.89 -0.80 116.57 119.53 2jop h LYS 79 Ca 0.07 0.00 -0.01 0.00 -2.81 0.00 0.00 60.65 57.90 2jop h LYS 79 Cb 0.08 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.31 2jop h LYS 79 CO -0.01 0.28 -0.07 0.28 -2.81 0.00 0.00 179.45 177.12 2jop h VAL 80 N 0.00 0.79 0.00 2.00 2.07 -1.28 -3.05 116.25 116.78 2jop h VAL 80 Ca -0.00 -1.19 -0.07 0.00 0.82 0.00 0.00 66.70 66.26 2jop h VAL 80 Cb 0.54 1.36 -0.01 0.00 -1.52 0.00 0.00 31.29 31.66 2jop h VAL 80 CO 0.04 0.22 -0.32 0.00 0.02 0.00 0.00 177.57 177.53 2jop h GLN 82 N 0.00 0.00 0.00 0.00 3.07 -0.88 0.24 115.11 117.54 2jop h GLN 82 Ca -0.00 0.00 -0.08 0.00 0.09 0.00 0.00 58.65 58.65 2jop h GLN 82 Cb 0.79 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.34 2jop h GLN 82 CO 0.04 0.40 -0.40 -0.09 0.09 0.00 0.00 178.83 178.86 2jop h ARG 83 N 0.00 0.00 -0.56 0.06 9.65 -1.06 -2.43 114.38 120.03 2jop h ARG 83 Ca -0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 2jop h ARG 83 Cb 0.71 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.29 2jop h ARG 83 CO 0.05 0.40 0.00 1.28 2.80 0.00 0.00 179.97 184.50 2jop n LEU 84 N -3.49 3.11 -4.19 3.80 4.77 -0.57 -4.93 117.00 115.50 2jop n LEU 84 Ca 0.00 -1.56 -0.34 0.00 -0.03 0.00 0.00 56.01 54.08 2jop n LEU 84 Cb 0.55 -0.40 -0.03 0.00 -2.33 0.00 0.00 43.42 41.20 2jop n LEU 84 CO 0.37 0.67 -0.10 -0.46 -1.33 0.00 0.00 177.39 176.54 2jop n ASN 85 N 0.93 -2.40 -0.33 -1.43 0.23 -0.42 -4.84 115.26 106.99 2jop n ASN 85 Ca 0.18 -1.03 0.03 0.00 -0.53 0.00 0.00 54.58 53.23 2jop n ASN 85 Cb 0.53 -2.71 0.09 0.00 -2.08 0.00 0.00 39.78 35.61 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 -0.09 1.20 3.88 0.00 0.00 -1.23 -4.38 105.19 104.58 2jop n GLY 87 Ca 0.07 -0.76 -0.29 0.00 0.00 0.00 0.00 46.02 45.04 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 3.78 0.51 1.61 1.01 -1.26 -2.60 116.67 115.72 2jop s ASP 88 Ca 0.00 0.63 -0.19 0.00 0.71 0.00 0.00 52.55 53.70 2jop s ASP 88 Cb 0.00 -0.98 -0.07 0.00 1.01 0.00 0.00 42.92 42.88 2jop s ASP 88 CO 0.00 -2.35 1.05 -2.16 0.21 0.00 0.00 175.17 171.92 2jop s PRO 89 N -5.63 3.68 -0.43 8.23 0.04 -1.26 -0.83 135.00 138.79 2jop s PRO 89 Ca 0.66 1.35 -0.38 0.00 0.04 0.00 0.00 61.00 62.67 2jop s PRO 89 Cb -0.09 -2.08 -0.16 0.00 0.04 0.00 0.00 34.50 32.21 2jop s PRO 89 CO 0.51 -0.53 1.83 1.47 0.04 0.00 0.00 177.00 180.32 2jop n LEU 90 N -1.19 0.65 -4.79 -3.56 -0.00 -1.22 -0.23 117.00 106.66 2jop n LEU 90 Ca 0.09 0.59 -0.35 0.00 -0.00 0.00 0.00 56.01 56.35 2jop n LEU 90 Cb 0.52 -0.77 -0.04 0.00 -0.00 0.00 0.00 43.42 43.13 2jop n LEU 90 CO 0.41 -0.66 0.72 -0.55 -0.00 0.00 0.00 177.39 177.31 2jop s SER 91 N 5.10 6.60 -0.08 1.45 0.15 0.20 -4.22 113.70 122.89 2jop s SER 91 Ca 1.03 1.97 -0.18 0.00 0.70 0.00 0.00 55.95 59.47 2jop s SER 91 Cb -1.29 -2.57 -0.05 0.00 -1.71 0.00 0.00 66.02 60.40 2jop s SER 91 CO 0.57 -0.60 0.48 -0.76 1.20 0.00 0.00 173.24 174.13 2jop s LEU 92 N -3.03 4.33 -0.01 3.45 1.43 -1.26 -2.07 118.68 121.51 2jop s LEU 92 Ca 0.62 0.88 -0.29 0.00 -1.03 0.00 0.00 54.13 54.31 2jop s LEU 92 Cb -0.19 -2.71 0.10 0.00 0.03 0.00 0.00 46.19 43.43 2jop s LEU 92 CO 0.23 0.06 0.97 -0.83 0.23 0.00 0.00 176.35 177.02 2jop s GLY 93 N 0.25 -0.40 -0.28 -3.19 0.00 -1.05 -4.49 107.32 98.16 2jop s GLY 93 Ca 0.26 0.96 -0.29 0.00 0.00 0.00 0.00 44.72 45.66 2jop s GLY 93 CO 0.12 0.31 1.56 2.56 0.00 0.00 0.00 173.10 177.65 2jop s PRO 94 N -3.00 3.72 0.19 2.90 0.04 -1.26 0.02 135.00 137.61 2jop s PRO 94 Ca 0.07 1.46 -0.20 0.00 0.04 0.00 0.00 61.00 62.37 2jop s PRO 94 Cb -0.01 -4.03 -0.08 0.00 0.04 0.00 0.00 34.50 30.42 2jop s PRO 94 CO -0.06 -1.38 0.70 0.12 0.04 0.00 0.00 177.00 176.41 2jop s PHE 95 N 5.34 3.72 -0.13 0.56 2.19 0.96 -4.81 117.98 125.80 2jop s PHE 95 Ca 0.69 1.40 0.17 0.00 0.33 0.00 0.00 56.93 59.51 2jop s PHE 95 Cb -0.22 -2.61 0.24 0.00 -1.31 0.00 0.00 43.02 39.12 2jop s PHE 95 CO 0.29 0.41 1.53 -0.07 1.83 0.00 0.00 175.22 179.21 2jop h LEU 96 N 3.74 0.00 -9.15 6.12 3.38 -1.94 -3.42 115.31 114.04 2jop h LEU 96 Ca -0.48 0.00 -0.59 0.00 0.09 0.00 0.00 57.88 56.90 2jop h LEU 96 Cb 1.20 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.86 2jop h LEU 96 CO 0.65 0.41 0.15 -0.54 0.09 0.00 0.00 178.44 179.20 2jop s LYS 97 N -3.11 4.24 0.92 1.13 -0.14 -1.26 -5.04 119.74 116.48 2jop s LYS 97 Ca 0.04 0.69 -0.14 0.00 -1.36 0.00 0.00 55.97 55.20 2jop s LYS 97 Cb 0.08 -3.56 0.18 0.00 -1.68 0.00 0.00 37.83 32.85 2jop s LYS 97 CO 0.72 -0.22 1.27 -0.08 -0.76 0.00 0.00 175.35 176.28 2jop s THR 98 N 1.83 2.02 0.00 2.17 -1.32 -1.26 -4.80 115.64 114.28 2jop s THR 98 Ca 0.31 -0.08 0.00 0.00 -1.21 0.00 0.00 61.69 60.70 2jop s THR 98 Cb -0.16 -2.94 0.00 0.00 -1.51 0.00 0.00 72.50 67.89 2jop s THR 98 CO 0.11 0.00 0.00 0.00 -2.21 0.00 0.00 174.62 172.52 2jop n TYR 99 N -3.62 0.00 -5.09 9.09 0.18 -1.26 -5.03 117.16 111.44 2jop n TYR 99 Ca 0.15 0.00 -0.32 0.00 1.88 0.00 0.00 57.90 59.61 2jop n TYR 99 Cb 0.60 0.00 -0.16 0.00 -0.38 0.00 0.00 39.34 39.40 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 1.38 2.41 -0.62 -3.48 2.01 -1.26 -5.02 115.64 111.06 2jop s THR 100 Ca 0.00 -0.91 0.00 0.00 0.31 0.00 0.00 61.69 61.09 2jop s THR 100 Cb 0.00 -1.94 0.00 0.00 0.01 0.00 0.00 72.50 70.57 2jop s THR 100 CO 0.00 0.56 0.40 -0.81 -0.69 0.00 0.00 174.62 174.07 2jop n PRO 101 N 3.26 0.57 0.10 4.92 -0.04 -1.26 -2.26 135.00 140.30 2jop n PRO 101 Ca -0.18 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.28 2jop n PRO 101 Cb 0.53 -1.26 0.00 0.00 -0.04 0.00 0.00 33.50 32.73 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 0.40 0.00 -0.37 0.54 -0.06 -1.26 -4.89 117.38 111.74 2jop n GLN 102 Ca 0.00 0.00 -0.01 0.00 -2.00 0.00 0.00 57.00 54.99 2jop n GLN 102 Cb 0.20 0.00 0.13 0.00 -4.06 0.00 0.00 30.24 26.51 2jop n GLN 102 CO 0.00 0.00 0.00 1.03 -0.20 0.00 0.00 177.06 177.89 2jop h SER 103 N 0.00 1.10 -3.90 1.69 0.87 -1.97 -3.42 113.55 107.92 2jop h SER 103 Ca 0.00 -0.02 -0.49 0.00 -1.23 0.00 0.00 61.79 60.05 2jop h SER 103 Cb 0.00 -0.26 0.01 0.00 -0.44 0.00 0.00 62.40 61.72 2jop h SER 103 CO 0.00 0.77 0.43 -0.44 -0.53 0.00 0.00 176.83 177.05 2jop s SER 104 N -6.03 6.99 0.13 6.23 0.01 -0.96 -4.48 113.70 115.59 2jop s SER 104 Ca -0.13 2.10 0.06 0.00 1.31 0.00 0.00 55.95 59.29 2jop s SER 104 Cb 0.19 -2.60 -0.04 0.00 0.21 0.00 0.00 66.02 63.78 2jop s SER 104 CO 0.82 -0.33 -0.15 0.27 0.41 0.00 0.00 173.24 174.26 2jop s ILE 105 N -1.48 1.40 -0.39 1.44 -5.25 -0.31 -2.72 121.20 113.90 2jop s ILE 105 Ca 0.52 -1.75 -0.08 0.00 -0.99 0.00 0.00 60.65 58.35 2jop s ILE 105 Cb -0.25 -1.58 0.06 0.00 2.95 0.00 0.00 42.46 43.64 2jop s ILE 105 CO 0.32 -0.40 0.21 -0.63 -1.79 0.00 0.00 174.94 172.65 2jop s ILE 106 N -2.14 4.13 0.34 8.37 1.01 0.91 -2.55 121.20 131.26 2jop s ILE 106 Ca 0.10 -1.29 -0.01 0.00 0.00 0.00 0.00 60.65 59.46 2jop s ILE 106 Cb -0.05 -3.46 -0.04 0.00 0.01 0.00 0.00 42.46 38.92 2jop s ILE 106 CO 0.03 -0.40 0.55 0.00 0.00 0.00 0.00 174.94 175.13 2jop s TYR 108 N -2.28 1.67 0.00 0.00 2.02 -1.18 0.42 117.35 118.00 2jop s TYR 108 Ca 0.41 -1.21 0.00 0.00 -0.37 0.00 0.00 57.07 55.89 2jop s TYR 108 Cb -0.10 -0.99 0.00 0.00 -0.40 0.00 0.00 41.96 40.47 2jop s TYR 108 CO 0.35 -0.32 0.00 0.41 -1.57 0.00 0.00 175.55 174.42 2jop n GLY 109 N -0.60 -0.40 3.73 0.71 0.00 -1.26 -4.64 105.19 102.73 2jop n GLY 109 Ca -0.01 -2.22 -0.41 0.00 0.00 0.00 0.00 46.02 43.38 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 4.63 -0.30 1.61 0.74 -1.26 -4.12 119.66 120.96 2jop s GLN 110 Ca 0.00 1.55 -0.30 0.00 0.05 0.00 0.00 55.36 56.66 2jop s GLN 110 Cb 0.00 -3.35 -0.08 0.00 1.10 0.00 0.00 33.01 30.68 2jop s GLN 110 CO 0.00 0.11 2.25 -0.11 -0.55 0.00 0.00 175.29 176.98 2jop n LEU 111 N 2.87 2.75 0.00 3.68 7.94 -1.26 -0.81 117.00 132.16 2jop n LEU 111 Ca 0.03 0.19 0.00 0.00 -1.11 0.00 0.00 56.01 55.12 2jop n LEU 111 Cb 0.48 -1.46 0.00 0.00 0.53 0.00 0.00 43.42 42.98 2jop n LEU 111 CO 0.52 -0.80 0.00 0.61 -1.11 0.00 0.00 177.39 176.61 2jop n GLY 112 N 6.06 1.14 3.44 -3.96 0.00 -1.26 -4.97 105.19 105.64 2jop n GLY 112 Ca 0.35 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.93 2jop n GLY 112 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jop s SER 113 N -0.37 6.47 -1.17 1.61 1.04 0.01 -3.55 113.70 117.74 2jop s SER 113 Ca 0.00 -1.74 -0.04 0.00 0.48 0.00 0.00 55.95 54.65 2jop s SER 113 Cb 0.00 -2.38 0.24 0.00 0.10 0.00 0.00 66.02 63.97 2jop s SER 113 CO 0.00 -1.14 1.90 0.49 0.98 0.00 0.00 173.24 175.47 2jop n PHE 114 N 6.69 2.61 0.00 5.02 3.01 0.46 -4.32 117.46 130.94 2jop n PHE 114 Ca 0.12 -2.67 0.00 0.00 1.01 0.00 0.00 57.45 55.91 2jop n PHE 114 Cb 0.47 -1.52 0.00 0.00 -0.01 0.00 0.00 39.48 38.43 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 1.47 2.15 -4.76 4.37 7.64 -1.26 -4.66 113.62 118.57 2jop n SER 115 Ca 0.45 0.00 -0.35 0.00 1.01 0.00 0.00 58.87 59.97 2jop n SER 115 Cb 0.29 0.02 -0.08 0.00 -1.01 0.00 0.00 64.21 63.43 2jop n SER 115 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 2jop s ASN 116 N -3.44 6.20 0.26 6.43 0.01 -1.26 -5.07 114.94 118.06 2jop s ASN 116 Ca 0.00 0.28 -0.17 0.00 -0.71 0.00 0.00 52.86 52.26 2jop s ASN 116 Cb 0.00 -2.07 0.01 0.00 0.41 0.00 0.00 41.25 39.60 2jop s ASN 116 CO 0.00 0.24 0.59 0.00 -1.51 0.00 0.00 177.10 176.42 2jop s SER 118 N -2.96 0.50 0.60 0.00 0.01 -0.21 -4.92 113.70 106.71 2jop s SER 118 Ca 0.16 -1.29 -0.09 0.00 1.31 0.00 0.00 55.95 56.04 2jop s SER 118 Cb -0.03 0.64 -0.02 0.00 0.21 0.00 0.00 66.02 66.82 2jop s SER 118 CO 0.07 -1.26 0.97 -1.00 0.41 0.00 0.00 173.24 172.43 2jop s HIS 119 N -3.34 3.51 0.00 2.43 3.76 -1.26 -0.06 115.29 120.33 2jop s HIS 119 Ca 0.27 1.05 0.00 0.00 -0.15 0.00 0.00 55.06 56.23 2jop s HIS 119 Cb -0.00 -2.69 0.00 0.00 1.11 0.00 0.00 32.58 31.00 2jop s HIS 119 CO 0.16 -0.70 1.20 -1.13 -0.85 0.00 0.00 174.74 173.42 2jop n SER 120 N -2.66 3.37 -0.03 1.40 3.41 -1.10 -3.31 113.62 114.70 2jop n SER 120 Ca 0.05 -1.90 0.04 0.00 -0.26 0.00 0.00 58.87 56.79 2jop n SER 120 Cb 0.55 -0.65 -0.04 0.00 -0.26 0.00 0.00 64.21 63.82 2jop n SER 120 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 2jop n ARG 121 N 0.99 3.82 0.00 4.33 3.00 -1.26 -4.13 116.66 123.41 2jop n ARG 121 Ca 0.00 -0.10 0.00 0.00 -0.00 0.00 0.00 57.85 57.75 2jop n ARG 121 Cb 0.42 -0.93 0.00 0.00 0.00 0.00 0.00 32.46 31.95 2jop n ARG 121 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 2jop n ASN 122 N -1.05 0.00 -0.08 6.15 4.13 -1.21 -4.38 115.26 118.83 2jop n ASN 122 Ca 0.02 0.22 0.12 0.00 1.68 0.00 0.00 54.58 56.62 2jop n ASN 122 Cb 0.14 0.00 0.21 0.00 -1.54 0.00 0.00 39.78 38.59 2jop n ASN 122 CO 0.00 0.00 0.00 -0.90 0.28 0.00 0.00 177.26 176.64 2jop n ASP 123 N -0.43 0.77 -3.53 6.41 5.68 -1.26 -4.97 116.55 119.21 2jop n ASP 123 Ca 0.00 -0.58 -0.23 0.00 -0.50 0.00 0.00 54.79 53.48 2jop n ASP 123 Cb 0.00 0.36 0.05 0.00 -1.14 0.00 0.00 41.12 40.39 2jop n ASP 123 CO 0.00 0.00 0.00 0.23 -1.33 0.00 0.00 177.20 176.10 2jop n MET 124 N -1.24 -2.58 -1.62 0.11 2.81 -1.26 -4.84 117.12 108.51 2jop n MET 124 Ca 0.07 0.64 -0.55 0.00 -1.81 0.00 0.00 57.70 56.05 2jop n MET 124 Cb 0.34 -4.99 -0.07 0.00 -0.71 0.00 0.00 33.22 27.79 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 3.21 -0.39 -2.14 0.00 8.25 -1.26 -4.81 115.22 118.08 2jop n HIS 126 Ca 0.21 0.09 -0.30 0.00 -0.26 0.00 0.00 57.72 57.46 2jop n HIS 126 Cb 0.15 -1.82 -0.05 0.00 1.12 0.00 0.00 29.99 29.38 2jop n HIS 126 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2jop s SER 127 N -2.48 5.29 0.05 0.41 1.04 -1.26 -4.91 113.70 111.84 2jop s SER 127 Ca 0.67 -1.61 -0.30 0.00 0.48 0.00 0.00 55.95 55.19 2jop s SER 127 Cb -0.24 -2.58 -0.04 0.00 0.10 0.00 0.00 66.02 63.25 2jop s SER 127 CO 0.62 -2.77 1.00 -0.76 0.98 0.00 0.00 173.24 172.30 2jop s LEU 128 N 9.96 4.42 0.32 2.42 2.01 -1.24 -0.03 118.68 136.54 2jop s LEU 128 Ca 0.66 1.76 0.08 0.00 0.01 0.00 0.00 54.13 56.63 2jop s LEU 128 Cb -0.01 -3.58 -0.03 0.00 0.01 0.00 0.00 46.19 42.58 2jop s LEU 128 CO 0.10 -0.20 0.25 -0.83 1.01 0.00 0.00 176.35 176.68 2jop s GLY 129 N 0.60 1.75 -0.11 -3.19 0.00 0.10 -4.28 107.32 102.19 2jop s GLY 129 Ca 0.51 -1.65 -0.01 0.00 0.00 0.00 0.00 44.72 43.57 2jop s GLY 129 CO 0.29 -1.59 -0.02 1.08 0.00 0.00 0.00 173.10 172.86 2jop s LEU 130 N -3.95 0.94 -0.30 0.66 1.43 -0.39 -2.52 118.68 114.55 2jop s LEU 130 Ca 0.39 -0.32 0.02 0.00 -1.03 0.00 0.00 54.13 53.18 2jop s LEU 130 Cb -0.06 -0.61 0.09 0.00 0.03 0.00 0.00 46.19 45.64 2jop s LEU 130 CO 0.26 -0.19 0.03 -0.89 0.23 0.00 0.00 176.35 175.78 2jop s THR 131 N 1.85 1.64 -0.55 5.49 2.01 -0.88 -1.92 115.64 123.29 2jop s THR 131 Ca 0.04 -1.73 -0.31 0.00 0.31 0.00 0.00 61.69 60.00 2jop s THR 131 Cb -0.13 -2.12 -0.12 0.00 0.01 0.00 0.00 72.50 70.13 2jop s THR 131 CO -0.07 -0.47 2.40 0.00 -0.69 0.00 0.00 174.62 175.79 2jop n LEU 133 N 12.22 0.00 0.00 0.00 7.94 0.68 -4.62 117.00 133.23 2jop n LEU 133 Ca 0.45 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.35 2jop n LEU 133 Cb 0.30 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.25 2jop n LEU 133 CO 0.78 0.00 0.00 -1.84 -1.11 0.00 0.00 177.39 175.22