#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jop n LEU 26 N 0.00 -1.85 -3.89 2.89 4.77 -1.26 -4.56 117.00 113.09 2jop n LEU 26 Ca 0.00 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.89 2jop n LEU 26 Cb 0.00 -0.93 -0.09 0.00 -2.33 0.00 0.00 43.42 40.08 2jop n LEU 26 CO 0.00 0.00 -0.16 -0.94 -1.33 0.00 0.00 177.39 174.96 2jop s SER 27 N -0.64 0.14 0.00 -1.43 1.04 -1.26 -1.24 113.70 110.31 2jop s SER 27 Ca 0.00 -0.54 0.00 0.00 0.48 0.00 0.00 55.95 55.89 2jop s SER 27 Cb 0.00 0.27 0.00 0.00 0.10 0.00 0.00 66.02 66.39 2jop s SER 27 CO 0.00 -0.58 0.62 -2.67 0.98 0.00 0.00 173.24 171.58 2jop n TRP 28 N 0.50 0.00 -1.12 5.02 4.27 -1.26 -1.35 117.44 123.49 2jop n TRP 28 Ca -0.18 -0.12 0.01 0.00 -3.89 0.00 0.00 57.50 53.32 2jop n TRP 28 Cb 0.60 -0.14 0.01 0.00 -1.36 0.00 0.00 31.31 30.42 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 0.13 0.00 -2.78 -2.67 0.18 -1.26 -4.06 117.16 106.70 2jop n TYR 29 Ca 0.00 -0.14 -0.41 0.00 1.88 0.00 0.00 57.90 59.24 2jop n TYR 29 Cb 0.31 -0.03 -0.05 0.00 -0.38 0.00 0.00 39.34 39.19 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 -0.59 7.49 0.27 9.48 -1.08 -0.46 -4.97 116.67 126.82 2jop s ASP 30 Ca 0.02 1.78 -0.03 0.00 -0.52 0.00 0.00 52.55 53.80 2jop s ASP 30 Cb 0.02 -2.57 0.39 0.00 -1.46 0.00 0.00 42.92 39.29 2jop s ASP 30 CO 0.00 0.01 1.92 1.55 0.52 0.00 0.00 175.17 179.18 2jop h PRO 31 N 5.18 1.17 0.00 4.34 0.13 -1.98 -1.96 132.00 138.88 2jop h PRO 31 Ca -0.44 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 2jop h PRO 31 Cb 1.21 -0.26 0.00 0.00 0.13 0.00 0.00 31.00 32.07 2jop h PRO 31 CO 0.70 0.77 -1.09 -3.47 -0.23 0.00 0.00 178.00 174.69 2jop n ASP 32 N -4.44 0.75 -4.68 1.44 2.03 -1.26 -4.92 116.55 105.47 2jop n ASP 32 Ca 0.13 0.26 -0.47 0.00 0.52 0.00 0.00 54.79 55.24 2jop n ASP 32 Cb 0.10 0.60 -0.04 0.00 -0.72 0.00 0.00 41.12 41.06 2jop n ASP 32 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 2jop n PHE 33 N -2.58 2.38 -3.49 -0.67 7.35 -0.74 -4.92 117.46 114.79 2jop n PHE 33 Ca -0.00 -0.05 -0.40 0.00 -0.76 0.00 0.00 57.45 56.24 2jop n PHE 33 Cb 0.54 -2.68 -0.10 0.00 0.35 0.00 0.00 39.48 37.59 2jop n PHE 33 CO 0.00 0.00 0.00 -1.14 -0.76 0.00 0.00 176.76 174.86 2jop s GLN 34 N 3.68 3.66 0.03 -4.13 0.74 -1.26 -4.87 119.66 117.52 2jop s GLN 34 Ca 0.90 -0.44 -0.01 0.00 0.05 0.00 0.00 55.36 55.86 2jop s GLN 34 Cb -0.63 -3.76 -0.03 0.00 1.10 0.00 0.00 33.01 29.69 2jop s GLN 34 CO 0.47 -0.40 -0.03 0.00 -0.55 0.00 0.00 175.29 174.79 2jop s ALA 35 N 1.85 0.30 -0.01 1.58 0.00 -1.26 -1.22 121.76 123.01 2jop s ALA 35 Ca 0.09 -0.89 -0.25 0.00 0.00 0.00 0.00 51.96 50.91 2jop s ALA 35 Cb -0.17 0.21 0.08 0.00 0.00 0.00 0.00 23.12 23.25 2jop s ALA 35 CO 0.11 -0.26 1.15 2.89 0.00 0.00 0.00 175.76 179.64 2jop n ARG 36 N 0.87 0.19 -3.89 0.00 1.85 -0.90 -4.87 116.66 109.91 2jop n ARG 36 Ca -0.19 -0.74 -0.35 0.00 -1.00 0.00 0.00 57.85 55.57 2jop n ARG 36 Cb 0.58 1.20 -0.05 0.00 -1.05 0.00 0.00 32.46 33.14 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 4.38 0.32 2.89 1.43 -1.25 -0.24 118.68 126.21 2jop s LEU 37 Ca 0.27 0.40 0.04 0.00 -1.03 0.00 0.00 54.13 53.81 2jop s LEU 37 Cb -0.01 -2.42 -0.03 0.00 0.03 0.00 0.00 46.19 43.76 2jop s LEU 37 CO -0.00 0.32 0.17 0.42 0.23 0.00 0.00 176.35 177.49 2jop s THR 38 N -1.22 0.29 0.00 5.49 -4.23 0.27 -4.23 115.64 112.02 2jop s THR 38 Ca 0.23 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.74 2jop s THR 38 Cb -0.12 -2.49 0.00 0.00 1.34 0.00 0.00 72.50 71.23 2jop s THR 38 CO 0.13 0.00 0.00 0.54 -0.54 0.00 0.00 174.62 174.75 2jop n ARG 39 N -0.62 0.00 -0.05 3.99 1.74 -1.26 -3.45 116.66 117.01 2jop n ARG 39 Ca 0.01 0.00 0.12 0.00 -0.77 0.00 0.00 57.85 57.21 2jop n ARG 39 Cb 0.64 -0.27 0.42 0.00 -1.02 0.00 0.00 32.46 32.23 2jop n ARG 39 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2jop n SER 40 N 1.05 1.66 0.00 0.55 7.64 -1.26 -4.94 113.62 118.32 2jop n SER 40 Ca 0.00 -1.64 0.00 0.00 1.01 0.00 0.00 58.87 58.24 2jop n SER 40 Cb 0.00 -0.07 0.00 0.00 -1.01 0.00 0.00 64.21 63.13 2jop n SER 40 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2jop n ASN 41 N 0.31 0.00 -4.66 6.43 2.85 -1.26 -4.90 115.26 114.03 2jop n ASN 41 Ca 0.17 0.00 -0.45 0.00 -0.11 0.00 0.00 54.58 54.19 2jop n ASN 41 Cb 0.35 0.00 -0.04 0.00 1.24 0.00 0.00 39.78 41.33 2jop n ASN 41 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 2jop n SER 42 N 1.80 3.72 0.17 1.20 7.64 -1.25 -4.83 113.62 122.07 2jop n SER 42 Ca 0.00 0.87 0.13 0.00 1.01 0.00 0.00 58.87 60.88 2jop n SER 42 Cb 0.00 -1.45 0.47 0.00 -1.01 0.00 0.00 64.21 62.22 2jop n SER 42 CO 0.00 0.00 0.00 0.07 -3.01 0.00 0.00 175.04 172.10 2jop h LYS 43 N 10.36 0.00 -0.22 1.43 2.10 -1.91 -2.64 116.57 125.69 2jop h LYS 43 Ca -0.48 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.17 2jop h LYS 43 Cb 1.26 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.59 2jop h LYS 43 CO 0.95 0.00 0.00 0.00 -2.00 0.00 0.00 179.45 178.40 2jop s GLN 45 N -1.49 0.60 0.00 0.00 0.74 -0.99 -0.27 119.66 118.23 2jop s GLN 45 Ca 0.30 1.36 0.00 0.00 0.05 0.00 0.00 55.36 57.07 2jop s GLN 45 Cb 0.19 0.62 0.00 0.00 1.10 0.00 0.00 33.01 34.92 2jop s GLN 45 CO 0.27 -0.19 0.00 0.41 -0.55 0.00 0.00 175.29 175.23 2jop n GLY 46 N 5.11 0.29 3.79 2.59 0.00 -1.01 -3.78 105.19 112.18 2jop n GLY 46 Ca -0.14 -1.70 -0.35 0.00 0.00 0.00 0.00 46.02 43.83 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 -1.42 3.95 -0.10 1.61 1.11 -1.22 -3.53 119.66 120.07 2jop s GLN 47 Ca 0.00 1.39 -0.23 0.00 0.01 0.00 0.00 55.36 56.53 2jop s GLN 47 Cb 0.00 -2.25 -0.03 0.00 -1.01 0.00 0.00 33.01 29.72 2jop s GLN 47 CO 0.00 -0.30 0.70 -1.17 0.01 0.00 0.00 175.29 174.53 2jop s LEU 48 N -3.18 4.27 -0.20 2.90 2.96 -1.26 -0.56 118.68 123.60 2jop s LEU 48 Ca 0.64 1.13 0.01 0.00 -0.22 0.00 0.00 54.13 55.69 2jop s LEU 48 Cb -0.18 -3.07 0.03 0.00 0.50 0.00 0.00 46.19 43.47 2jop s LEU 48 CO 0.22 -0.18 -0.16 -0.70 -1.32 0.00 0.00 176.35 174.21 2jop s GLU 49 N 1.14 2.88 -0.13 1.98 2.12 0.67 -0.86 118.70 126.50 2jop s GLU 49 Ca 0.36 -0.92 0.01 0.00 0.36 0.00 0.00 54.97 54.78 2jop s GLU 49 Cb -0.17 -2.70 -0.01 0.00 0.26 0.00 0.00 34.13 31.51 2jop s GLU 49 CO 0.16 -0.29 -0.16 0.14 -0.54 0.00 0.00 175.26 174.57 2jop s VAL 50 N 1.28 2.73 -0.75 3.70 -7.23 0.19 -2.11 120.40 118.21 2jop s VAL 50 Ca 0.02 -0.77 -0.23 0.00 -1.81 0.00 0.00 61.98 59.20 2jop s VAL 50 Cb -0.15 -2.13 0.07 0.00 0.56 0.00 0.00 36.38 34.73 2jop s VAL 50 CO -0.10 0.53 1.09 -0.47 -0.31 0.00 0.00 175.10 175.84 2jop s TYR 51 N 0.47 2.65 -0.08 2.82 5.04 -0.36 -0.17 117.35 127.72 2jop s TYR 51 Ca -0.11 -0.60 0.03 0.00 -2.44 0.00 0.00 57.07 53.95 2jop s TYR 51 Cb -0.16 -4.39 0.01 0.00 0.35 0.00 0.00 41.96 37.76 2jop s TYR 51 CO 0.05 -1.74 -0.17 -0.48 -1.34 0.00 0.00 175.55 171.87 2jop s LEU 52 N 4.28 1.83 0.00 6.97 0.05 -0.82 -4.40 118.68 126.59 2jop s LEU 52 Ca 0.28 -0.41 0.00 0.00 0.05 0.00 0.00 54.13 54.06 2jop s LEU 52 Cb -0.12 -1.07 0.00 0.00 -2.05 0.00 0.00 46.19 42.95 2jop s LEU 52 CO 0.07 0.09 0.00 1.17 -0.55 0.00 0.00 176.35 177.12 2jop n LYS 53 N 3.70 0.00 0.00 1.48 0.00 -1.26 -1.06 118.16 121.01 2jop n LYS 53 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.10 2jop n LYS 53 Cb 0.52 -0.04 0.00 0.00 0.00 0.00 0.00 35.03 35.51 2jop n LYS 53 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 2jop n ASP 54 N 1.38 0.00 -4.59 3.14 5.75 -1.26 -5.11 116.55 115.86 2jop n ASP 54 Ca 0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 54.79 54.35 2jop n ASP 54 Cb 0.00 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.07 2jop n ASP 54 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 2jop s GLY 55 N 0.00 1.09 -0.99 6.12 0.00 -0.23 -4.93 107.32 108.39 2jop s GLY 55 Ca 0.00 -0.39 -0.25 0.00 0.00 0.00 0.00 44.72 44.09 2jop s GLY 55 CO 0.00 2.69 2.09 -0.98 0.00 0.00 0.00 173.10 176.90 2jop s TRP 56 N 5.36 1.54 -0.23 1.90 0.52 -1.26 -1.94 118.94 124.82 2jop s TRP 56 Ca 0.55 1.31 -0.21 0.00 0.02 0.00 0.00 56.10 57.78 2jop s TRP 56 Cb -0.11 -3.72 -0.02 0.00 -1.15 0.00 0.00 33.47 28.47 2jop s TRP 56 CO 0.30 -1.32 0.64 -1.01 0.02 0.00 0.00 176.95 175.59 2jop s HIS 57 N 13.08 3.32 -0.64 -1.98 3.76 0.76 -4.76 115.29 128.83 2jop s HIS 57 Ca 0.78 0.88 -0.25 0.00 -0.15 0.00 0.00 55.06 56.32 2jop s HIS 57 Cb -0.06 -2.84 0.05 0.00 1.11 0.00 0.00 32.58 30.83 2jop s HIS 57 CO 0.09 -0.28 1.05 1.41 -0.85 0.00 0.00 174.74 176.17 2jop s MET 58 N 2.33 3.24 0.53 1.40 1.75 -1.26 -0.64 119.30 126.65 2jop s MET 58 Ca 0.28 -0.41 -0.07 0.00 -1.25 0.00 0.00 55.69 54.23 2jop s MET 58 Cb -0.16 -4.14 -0.03 0.00 2.84 0.00 0.00 34.83 33.34 2jop s MET 58 CO 0.09 -1.78 0.87 0.14 -0.65 0.00 0.00 175.02 173.69 2jop s VAL 59 N 4.51 4.76 -0.38 10.11 -7.23 -0.04 -0.27 120.40 131.87 2jop s VAL 59 Ca 0.30 0.39 0.12 0.00 -1.81 0.00 0.00 61.98 60.98 2jop s VAL 59 Cb -0.13 -3.84 0.70 0.00 0.56 0.00 0.00 36.38 33.68 2jop s VAL 59 CO 0.16 -0.91 1.57 0.00 -0.31 0.00 0.00 175.10 175.60 2jop n SER 61 N 0.54 0.00 -0.20 0.00 7.64 -1.26 -4.38 113.62 115.96 2jop n SER 61 Ca 0.24 0.00 0.13 0.00 1.01 0.00 0.00 58.87 60.24 2jop n SER 61 Cb 1.06 0.00 0.64 0.00 -1.01 0.00 0.00 64.21 64.90 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 1.27 -0.63 1.43 -0.00 -1.26 -4.72 117.38 113.48 2jop n GLN 62 Ca 0.00 -0.40 -0.31 0.00 -0.00 0.00 0.00 57.00 56.29 2jop n GLN 62 Cb 0.00 -1.41 0.19 0.00 -0.00 0.00 0.00 30.24 29.02 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 -0.45 -1.34 0.00 2.61 7.64 -1.26 -0.73 113.62 120.09 2jop n SER 63 Ca 0.19 0.10 0.00 0.00 1.01 0.00 0.00 58.87 60.16 2jop n SER 63 Cb 0.19 -1.26 0.00 0.00 -1.01 0.00 0.00 64.21 62.13 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 -4.43 0.00 0.00 1.43 8.01 0.22 -3.33 117.44 119.35 2jop n TRP 64 Ca 0.06 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.25 2jop n TRP 64 Cb 0.55 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.85 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 -0.70 2.52 6.99 0.00 -1.20 -3.43 105.19 109.37 2jop n GLY 65 Ca 0.00 0.31 -0.26 0.00 0.00 0.00 0.00 46.02 46.06 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 3.33 -2.09 1.61 5.12 0.09 -4.95 116.66 119.78 2jop n ARG 66 Ca 0.00 -4.50 -0.40 0.00 -1.93 0.00 0.00 57.85 51.02 2jop n ARG 66 Cb 0.00 -2.21 -0.02 0.00 -1.16 0.00 0.00 32.46 29.07 2jop n ARG 66 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 2jop n SER 67 N -0.44 4.05 -4.67 0.55 2.88 -1.26 -4.27 113.62 110.45 2jop n SER 67 Ca 0.37 -2.83 -0.40 0.00 -1.33 0.00 0.00 58.87 54.68 2jop n SER 67 Cb 0.64 -1.65 -0.06 0.00 -0.75 0.00 0.00 64.21 62.40 2jop n SER 67 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2jop s SER 68 N 4.39 6.72 -0.29 -3.46 0.15 -1.26 -4.93 113.70 115.03 2jop s SER 68 Ca 0.55 0.88 0.02 0.00 0.70 0.00 0.00 55.95 58.09 2jop s SER 68 Cb 0.07 -2.35 0.38 0.00 -1.71 0.00 0.00 66.02 62.42 2jop s SER 68 CO 0.05 -0.24 1.62 0.29 1.20 0.00 0.00 173.24 176.16 2jop n LYS 69 N 4.81 1.79 -2.44 5.44 4.76 -1.26 -4.70 118.16 126.57 2jop n LYS 69 Ca -0.02 -1.84 -0.03 0.00 -2.87 0.00 0.00 58.31 53.55 2jop n LYS 69 Cb 0.50 -1.72 0.00 0.00 -1.84 0.00 0.00 35.03 31.97 2jop n LYS 69 CO 0.00 0.00 0.00 0.94 -1.37 0.00 0.00 177.40 176.97 2jop n GLN 70 N -0.42 -2.14 -2.47 1.97 7.27 -1.26 -5.10 117.38 115.24 2jop n GLN 70 Ca 0.36 1.92 -0.06 0.00 0.07 0.00 0.00 57.00 59.30 2jop n GLN 70 Cb 1.12 -4.40 -0.01 0.00 2.41 0.00 0.00 30.24 29.36 2jop n GLN 70 CO 0.00 0.00 0.00 0.91 0.07 0.00 0.00 177.06 178.04 2jop n TRP 71 N 0.05 0.16 -2.71 3.69 7.02 -1.26 -5.03 117.44 119.37 2jop n TRP 71 Ca 0.05 -0.46 -0.43 0.00 -1.02 0.00 0.00 57.50 55.63 2jop n TRP 71 Cb 0.18 -0.06 0.00 0.00 -2.42 0.00 0.00 31.31 29.01 2jop n TRP 71 CO 0.00 0.00 0.00 -1.91 -2.02 0.00 0.00 177.69 173.76 2jop n GLU 72 N -0.25 3.33 0.00 -0.99 4.07 -1.26 -4.35 120.64 121.19 2jop n GLU 72 Ca -0.04 -3.60 0.00 0.00 -0.06 0.00 0.00 57.16 53.46 2jop n GLU 72 Cb 0.12 -3.15 0.00 0.00 -0.06 0.00 0.00 31.44 28.35 2jop n GLU 72 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 2jop n ASP 73 N 6.10 0.00 -4.48 4.31 2.03 -1.26 -5.05 116.55 118.20 2jop n ASP 73 Ca 0.41 0.00 -0.34 0.00 0.52 0.00 0.00 54.79 55.39 2jop n ASP 73 Cb 0.42 0.12 -0.18 0.00 -0.72 0.00 0.00 41.12 40.76 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 -2.40 0.00 0.00 -0.67 -0.02 -1.26 -4.77 135.00 125.88 2jop n PRO 74 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2jop n PRO 74 Cb 0.00 -1.30 0.00 0.00 -0.02 0.00 0.00 33.50 32.18 2jop n PRO 74 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2jop n SER 75 N 8.53 0.30 0.00 2.55 7.64 -1.26 -4.79 113.62 126.59 2jop n SER 75 Ca 0.66 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.54 2jop n SER 75 Cb 0.07 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.27 2jop n SER 75 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jop n GLN 76 N 0.00 0.00 -0.36 1.43 3.00 -1.26 -4.55 117.38 115.65 2jop n GLN 76 Ca 0.00 0.00 -0.03 0.00 -0.01 0.00 0.00 57.00 56.96 2jop n GLN 76 Cb 0.00 0.00 0.01 0.00 0.00 0.00 0.00 30.24 30.25 2jop n GLN 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2jop n ALA 77 N 0.00 3.52 -0.14 -1.58 0.00 -1.26 -4.39 120.51 116.67 2jop n ALA 77 Ca 0.00 -0.36 -0.07 0.00 0.00 0.00 0.00 53.44 53.01 2jop n ALA 77 Cb 0.00 -1.07 0.01 0.00 0.00 0.00 0.00 19.45 18.40 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 0.59 0.42 0.23 0.00 4.64 -1.83 -1.60 113.55 116.00 2jop h SER 78 Ca 0.07 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.35 2jop h SER 78 Cb 1.10 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 63.10 2jop h SER 78 CO 0.15 0.30 -0.20 0.11 -0.87 0.00 0.00 176.83 176.33 2jop h LYS 79 N 0.52 0.00 0.63 4.77 6.56 -1.88 0.58 116.57 127.75 2jop h LYS 79 Ca 0.17 0.00 -0.03 0.00 -1.06 0.00 0.00 60.65 59.73 2jop h LYS 79 Cb -0.00 0.00 0.01 0.00 -0.57 0.00 0.00 32.23 31.66 2jop h LYS 79 CO -0.07 0.20 -0.30 0.28 -2.06 0.00 0.00 179.45 177.49 2jop h VAL 80 N 0.00 0.29 0.00 0.50 2.07 -1.56 0.19 116.25 117.74 2jop h VAL 80 Ca -0.00 -0.22 -0.07 0.00 0.82 0.00 0.00 66.70 67.22 2jop h VAL 80 Cb 0.37 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 2jop h VAL 80 CO 0.03 0.03 -0.33 0.00 0.02 0.00 0.00 177.57 177.31 2jop h GLN 82 N 0.00 0.82 0.00 0.00 4.15 -0.76 0.24 115.11 119.56 2jop h GLN 82 Ca -0.00 -0.27 -0.01 0.00 0.77 0.00 0.00 58.65 59.14 2jop h GLN 82 Cb 0.87 -0.07 -0.00 0.00 0.21 0.00 0.00 27.48 28.48 2jop h GLN 82 CO 0.04 0.88 -0.03 0.00 -1.93 0.00 0.00 178.83 177.80 2jop h ARG 83 N 0.67 0.00 -0.44 1.69 3.08 -0.15 0.01 114.38 119.25 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 0.51 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.56 2jop h ARG 83 CO 0.03 0.03 0.00 1.28 -1.07 0.00 0.00 179.97 180.23 2jop n LEU 84 N -4.05 2.41 -3.38 3.04 4.77 -0.57 -4.92 117.00 114.29 2jop n LEU 84 Ca -0.03 -1.19 -0.23 0.00 -0.03 0.00 0.00 56.01 54.54 2jop n LEU 84 Cb 0.11 -0.29 -0.01 0.00 -2.33 0.00 0.00 43.42 40.90 2jop n LEU 84 CO 0.30 0.59 -0.05 -0.46 -1.33 0.00 0.00 177.39 176.44 2jop n ASN 85 N 0.81 -3.18 0.00 -1.43 6.94 -0.01 -4.82 115.26 113.58 2jop n ASN 85 Ca 0.15 -0.38 0.10 0.00 -0.02 0.00 0.00 54.58 54.44 2jop n ASN 85 Cb 0.38 -2.66 -0.08 0.00 -2.36 0.00 0.00 39.78 35.07 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 1.45 0.83 3.86 0.00 0.00 -1.20 -4.66 105.19 105.47 2jop n GLY 87 Ca 0.03 -1.18 -0.29 0.00 0.00 0.00 0.00 46.02 44.57 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 4.35 0.54 1.61 1.01 -1.26 -3.01 116.67 115.91 2jop s ASP 88 Ca 0.00 0.92 -0.18 0.00 0.71 0.00 0.00 52.55 54.00 2jop s ASP 88 Cb 0.00 -1.50 -0.06 0.00 1.01 0.00 0.00 42.92 42.37 2jop s ASP 88 CO 0.00 -2.02 1.05 -2.16 0.21 0.00 0.00 175.17 172.25 2jop s PRO 89 N -5.43 3.54 -0.45 8.23 0.04 -1.26 -0.82 135.00 138.84 2jop s PRO 89 Ca 0.62 1.28 -0.42 0.00 0.04 0.00 0.00 61.00 62.53 2jop s PRO 89 Cb -0.12 -2.06 -0.18 0.00 0.04 0.00 0.00 34.50 32.18 2jop s PRO 89 CO 0.51 -0.64 1.54 1.47 0.04 0.00 0.00 177.00 179.92 2jop n LEU 90 N -1.54 1.01 -4.77 -3.56 -0.00 -1.24 -0.36 117.00 106.53 2jop n LEU 90 Ca 0.09 0.98 -0.37 0.00 -0.00 0.00 0.00 56.01 56.71 2jop n LEU 90 Cb 0.53 -0.80 -0.00 0.00 -0.00 0.00 0.00 43.42 43.15 2jop n LEU 90 CO 0.44 -0.74 0.85 -0.94 -0.00 0.00 0.00 177.39 176.99 2jop s SER 91 N 3.25 6.05 -0.19 1.45 1.04 0.53 -4.49 113.70 121.33 2jop s SER 91 Ca 0.97 2.36 -0.11 0.00 0.48 0.00 0.00 55.95 59.65 2jop s SER 91 Cb -1.35 -2.61 -0.05 0.00 0.10 0.00 0.00 66.02 62.11 2jop s SER 91 CO 0.71 -1.01 0.18 -0.76 0.98 0.00 0.00 173.24 173.34 2jop s LEU 92 N -3.11 4.21 0.00 2.42 1.43 -1.26 -1.87 118.68 120.49 2jop s LEU 92 Ca 0.65 0.29 0.00 0.00 -1.03 0.00 0.00 54.13 54.04 2jop s LEU 92 Cb -0.30 -2.17 0.00 0.00 0.03 0.00 0.00 46.19 43.75 2jop s LEU 92 CO 0.36 0.14 0.00 0.61 0.23 0.00 0.00 176.35 177.69 2jop n GLY 93 N 3.57 0.53 3.65 -3.19 0.00 -1.08 -4.19 105.19 104.48 2jop n GLY 93 Ca -0.15 -0.73 -0.42 0.00 0.00 0.00 0.00 46.02 44.72 2jop n GLY 93 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2jop s PRO 94 N -2.00 4.08 0.00 1.61 0.04 -1.26 -0.04 135.00 137.43 2jop s PRO 94 Ca 0.00 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.06 2jop s PRO 94 Cb 0.00 -3.98 0.00 0.00 0.04 0.00 0.00 34.50 30.56 2jop s PRO 94 CO 0.00 -0.95 0.00 0.34 0.04 0.00 0.00 177.00 176.43 2jop n PHE 95 N 7.45 -0.69 -1.74 0.56 7.35 0.41 -4.80 117.46 126.00 2jop n PHE 95 Ca 0.17 0.00 -0.34 0.00 -0.76 0.00 0.00 57.45 56.53 2jop n PHE 95 Cb 0.44 0.00 0.05 0.00 0.35 0.00 0.00 39.48 40.32 2jop n PHE 95 CO 0.00 0.00 0.00 -0.48 -0.76 0.00 0.00 176.76 175.52 2jop s LEU 96 N 0.00 3.43 -0.29 -2.13 0.05 -1.26 -4.69 118.68 113.79 2jop s LEU 96 Ca 0.00 2.14 -0.14 0.00 0.05 0.00 0.00 54.13 56.18 2jop s LEU 96 Cb 0.00 -4.57 -0.03 0.00 -2.05 0.00 0.00 46.19 39.54 2jop s LEU 96 CO 0.00 -1.76 0.34 -0.75 -0.55 0.00 0.00 176.35 173.63 2jop s LYS 97 N -3.90 3.92 0.00 1.48 2.20 -1.26 -4.84 119.74 117.34 2jop s LYS 97 Ca 0.70 -0.11 0.00 0.00 -0.36 0.00 0.00 55.97 56.21 2jop s LYS 97 Cb -0.24 -3.68 0.00 0.00 -1.51 0.00 0.00 37.83 32.40 2jop s LYS 97 CO 0.40 -0.31 0.43 -2.37 -0.36 0.00 0.00 175.35 173.14 2jop n THR 98 N 5.13 0.00 -2.68 3.43 5.66 -1.26 -5.12 114.28 119.44 2jop n THR 98 Ca -0.09 0.00 -0.41 0.00 -3.05 0.00 0.00 64.05 60.50 2jop n THR 98 Cb 0.51 0.46 -0.05 0.00 -1.55 0.00 0.00 70.33 69.70 2jop n THR 98 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 175.07 171.71 2jop s TYR 99 N 0.00 3.79 -0.07 1.09 2.02 -1.26 -4.99 117.35 117.92 2jop s TYR 99 Ca 0.00 1.77 0.05 0.00 -0.37 0.00 0.00 57.07 58.52 2jop s TYR 99 Cb 0.00 -3.10 -0.01 0.00 -0.40 0.00 0.00 41.96 38.46 2jop s TYR 99 CO 0.00 0.05 -0.24 0.99 -1.57 0.00 0.00 175.55 174.78 2jop s THR 100 N -0.31 1.99 0.00 -0.71 2.01 -1.26 -4.99 115.64 112.38 2jop s THR 100 Ca 0.46 -1.01 0.00 0.00 0.31 0.00 0.00 61.69 61.45 2jop s THR 100 Cb -0.25 -1.70 0.00 0.00 0.01 0.00 0.00 72.50 70.55 2jop s THR 100 CO 0.32 0.55 0.58 -2.65 -0.69 0.00 0.00 174.62 172.72 2jop n PRO 101 N 3.19 0.39 0.15 4.92 -0.02 -1.26 -0.39 135.00 141.98 2jop n PRO 101 Ca -0.18 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.30 2jop n PRO 101 Cb 0.52 -1.30 0.00 0.00 -0.02 0.00 0.00 33.50 32.70 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 1.28 0.00 -0.00 -0.52 7.27 -1.26 -4.17 117.38 119.98 2jop n GLN 102 Ca 0.00 0.00 -0.09 0.00 0.07 0.00 0.00 57.00 56.98 2jop n GLN 102 Cb 0.20 0.00 0.06 0.00 2.41 0.00 0.00 30.24 32.90 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 0.63 -3.02 1.69 0.02 -1.95 -3.43 113.55 107.49 2jop h SER 103 Ca 0.00 -0.33 -0.61 0.00 -0.84 0.00 0.00 61.79 60.01 2jop h SER 103 Cb 0.00 -0.18 -0.05 0.00 0.14 0.00 0.00 62.40 62.31 2jop h SER 103 CO 0.00 1.04 -0.21 -0.44 -1.14 0.00 0.00 176.83 176.08 2jop s SER 104 N -6.91 6.78 0.18 3.07 0.01 0.48 -4.12 113.70 113.19 2jop s SER 104 Ca -0.07 0.94 0.08 0.00 1.31 0.00 0.00 55.95 58.20 2jop s SER 104 Cb 0.11 -2.24 -0.04 0.00 0.21 0.00 0.00 66.02 64.06 2jop s SER 104 CO 0.84 0.31 -0.17 0.27 0.41 0.00 0.00 173.24 174.90 2jop s ILE 105 N -1.12 1.81 -0.30 1.44 -5.25 0.63 -2.56 121.20 115.85 2jop s ILE 105 Ca 0.25 -2.03 0.03 0.00 -0.99 0.00 0.00 60.65 57.91 2jop s ILE 105 Cb -0.16 -1.92 0.08 0.00 2.95 0.00 0.00 42.46 43.41 2jop s ILE 105 CO 0.14 -0.41 -0.02 -0.63 -1.79 0.00 0.00 174.94 172.23 2jop s ILE 106 N -2.35 2.09 -0.60 8.37 1.01 0.49 -2.38 121.20 127.83 2jop s ILE 106 Ca 0.18 -1.92 -0.18 0.00 0.00 0.00 0.00 60.65 58.73 2jop s ILE 106 Cb -0.04 -2.39 0.12 0.00 0.01 0.00 0.00 42.46 40.15 2jop s ILE 106 CO 0.07 -0.34 0.66 0.00 0.00 0.00 0.00 174.94 175.33 2jop s TYR 108 N 2.22 2.91 -4.30 0.00 1.51 -1.26 0.73 117.35 119.16 2jop s TYR 108 Ca 0.10 1.46 0.00 0.00 -1.01 0.00 0.00 57.07 57.62 2jop s TYR 108 Cb -0.25 -2.95 0.00 0.00 -0.11 0.00 0.00 41.96 38.66 2jop s TYR 108 CO 0.04 -1.46 0.00 0.41 -1.11 0.00 0.00 175.55 173.43 2jop n GLY 109 N -1.71 0.91 3.71 0.71 0.00 -1.22 -4.67 105.19 102.92 2jop n GLY 109 Ca 0.08 -1.93 -0.38 0.00 0.00 0.00 0.00 46.02 43.79 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 -1.72 4.32 -0.34 1.61 -0.21 -1.26 -4.19 119.66 117.87 2jop s GLN 110 Ca 0.00 0.49 -0.40 0.00 0.02 0.00 0.00 55.36 55.47 2jop s GLN 110 Cb 0.00 -3.46 -0.15 0.00 1.00 0.00 0.00 33.01 30.40 2jop s GLN 110 CO 0.00 0.09 1.91 -0.11 -2.12 0.00 0.00 175.29 175.06 2jop n LEU 111 N 3.89 2.04 0.00 2.90 7.94 -1.26 -1.28 117.00 131.23 2jop n LEU 111 Ca -0.06 0.86 0.00 0.00 -1.11 0.00 0.00 56.01 55.70 2jop n LEU 111 Cb 0.51 -1.12 0.00 0.00 0.53 0.00 0.00 43.42 43.34 2jop n LEU 111 CO 0.43 -0.57 0.00 0.61 -1.11 0.00 0.00 177.39 176.75 2jop n GLY 112 N 5.24 3.42 3.56 -3.96 0.00 -1.26 -5.03 105.19 107.16 2jop n GLY 112 Ca 0.34 -1.05 -0.42 0.00 0.00 0.00 0.00 46.02 44.89 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 0.00 6.67 -0.08 1.61 0.01 -0.41 -4.14 113.70 117.36 2jop s SER 113 Ca 0.00 -1.95 0.02 0.00 1.31 0.00 0.00 55.95 55.33 2jop s SER 113 Cb 0.00 -2.56 0.16 0.00 0.21 0.00 0.00 66.02 63.82 2jop s SER 113 CO 0.00 -1.32 1.04 0.49 0.41 0.00 0.00 173.24 173.85 2jop n PHE 114 N 8.49 0.58 1.64 2.43 3.01 -0.37 -4.08 117.46 129.16 2jop n PHE 114 Ca 0.40 -0.55 0.15 0.00 1.01 0.00 0.00 57.45 58.45 2jop n PHE 114 Cb 0.49 -0.32 0.66 0.00 -0.01 0.00 0.00 39.48 40.30 2jop n PHE 114 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 2jop n SER 115 N 0.14 0.90 -3.57 4.37 2.88 -1.25 -4.83 113.62 112.24 2jop n SER 115 Ca 0.10 -1.22 -0.11 0.00 -1.33 0.00 0.00 58.87 56.32 2jop n SER 115 Cb 0.64 -0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 64.06 2jop n SER 115 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2jop s ASN 116 N -2.07 -0.33 0.17 -3.46 6.03 -1.26 -5.09 114.94 108.93 2jop s ASN 116 Ca 0.40 -0.22 -0.23 0.00 -1.03 0.00 0.00 52.86 51.77 2jop s ASN 116 Cb 0.21 0.51 0.07 0.00 -3.03 0.00 0.00 41.25 39.01 2jop s ASN 116 CO 0.37 -0.88 1.01 0.00 -2.03 0.00 0.00 177.10 175.57 2jop s SER 118 N -3.19 -0.19 0.63 0.00 1.04 -1.15 -4.94 113.70 105.90 2jop s SER 118 Ca 0.18 -0.19 -0.18 0.00 0.48 0.00 0.00 55.95 56.24 2jop s SER 118 Cb -0.02 0.41 -0.02 0.00 0.10 0.00 0.00 66.02 66.49 2jop s SER 118 CO 0.04 -0.70 1.30 -1.38 0.98 0.00 0.00 173.24 173.48 2jop s HIS 119 N -2.92 2.11 0.07 5.02 -3.43 -1.26 -0.38 115.29 114.51 2jop s HIS 119 Ca -0.02 1.47 -0.31 0.00 -0.80 0.00 0.00 55.06 55.39 2jop s HIS 119 Cb 0.00 -3.70 -0.11 0.00 -1.43 0.00 0.00 32.58 27.35 2jop s HIS 119 CO -0.06 -2.89 1.87 0.45 -2.00 0.00 0.00 174.74 172.11 2jop n SER 120 N -1.79 3.94 -0.86 7.38 2.88 -1.06 -4.26 113.62 119.85 2jop n SER 120 Ca 0.15 0.97 0.12 0.00 -1.33 0.00 0.00 58.87 58.78 2jop n SER 120 Cb 0.48 -1.51 0.23 0.00 -0.75 0.00 0.00 64.21 62.66 2jop n SER 120 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 2jop n ARG 121 N 6.21 2.17 -2.90 -1.46 0.63 -1.26 -4.67 116.66 115.38 2jop n ARG 121 Ca 0.19 -1.72 -0.09 0.00 -0.92 0.00 0.00 57.85 55.32 2jop n ARG 121 Cb 0.37 -1.47 0.01 0.00 0.45 0.00 0.00 32.46 31.82 2jop n ARG 121 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 2jop n ASN 122 N 1.05 -7.84 0.00 6.15 2.85 -1.26 -5.07 115.26 111.14 2jop n ASN 122 Ca 0.16 0.44 0.00 0.00 -0.11 0.00 0.00 54.58 55.07 2jop n ASN 122 Cb 0.53 -5.23 0.00 0.00 1.24 0.00 0.00 39.78 36.32 2jop n ASN 122 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 2jop n ASP 123 N -0.46 0.00 0.27 1.20 -0.08 -1.26 -4.88 116.55 111.34 2jop n ASP 123 Ca 0.10 0.00 0.13 0.00 -1.51 0.00 0.00 54.79 53.51 2jop n ASP 123 Cb 0.47 0.00 0.75 0.00 2.34 0.00 0.00 41.12 44.69 2jop n ASP 123 CO 0.00 0.00 0.00 -0.03 0.12 0.00 0.00 177.20 177.29 2jop h MET 124 N 0.00 0.00 -5.74 -0.67 -1.53 -1.97 -3.37 114.93 101.65 2jop h MET 124 Ca 0.00 0.00 -0.47 0.00 -3.44 0.00 0.00 59.70 55.79 2jop h MET 124 Cb 0.00 0.00 -0.06 0.00 -0.55 0.00 0.00 31.60 30.99 2jop h MET 124 CO 0.00 0.10 1.41 0.00 0.14 0.00 0.00 176.91 178.56 2jop h HIS 126 N 9.41 -0.12 0.00 0.00 3.86 -1.93 -3.42 115.15 122.96 2jop h HIS 126 Ca 0.26 -0.00 -0.13 0.00 -1.16 0.00 0.00 60.37 59.34 2jop h HIS 126 Cb 0.94 0.04 -0.18 0.00 1.06 0.00 0.00 27.41 29.28 2jop h HIS 126 CO 1.29 0.26 -0.45 -1.13 0.86 0.00 0.00 177.93 178.76 2jop n SER 127 N -4.97 -0.43 -4.69 2.45 3.41 -1.26 -4.82 113.62 103.32 2jop n SER 127 Ca -0.09 -1.92 -0.44 0.00 -0.26 0.00 0.00 58.87 56.16 2jop n SER 127 Cb 0.23 0.13 -0.04 0.00 -0.26 0.00 0.00 64.21 64.26 2jop n SER 127 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2jop n LEU 128 N 0.12 3.52 0.00 1.04 4.77 -1.26 -0.45 117.00 124.74 2jop n LEU 128 Ca -0.17 1.06 0.00 0.00 -0.03 0.00 0.00 56.01 56.86 2jop n LEU 128 Cb 0.79 -1.48 0.00 0.00 -2.33 0.00 0.00 43.42 40.39 2jop n LEU 128 CO -0.10 -0.06 0.00 0.61 -1.33 0.00 0.00 177.39 176.50 2jop n GLY 129 N 3.77 6.10 3.30 -0.72 0.00 0.94 -4.20 105.19 114.39 2jop n GLY 129 Ca 0.17 -1.63 -0.13 0.00 0.00 0.00 0.00 46.02 44.43 2jop n GLY 129 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jop s LEU 130 N 0.00 0.51 -0.28 0.99 1.43 -1.23 -2.62 118.68 117.48 2jop s LEU 130 Ca 0.00 0.06 0.01 0.00 -1.03 0.00 0.00 54.13 53.17 2jop s LEU 130 Cb 0.00 1.61 0.16 0.00 0.03 0.00 0.00 46.19 48.00 2jop s LEU 130 CO 0.00 -0.59 0.45 -0.89 0.23 0.00 0.00 176.35 175.56 2jop s THR 131 N -2.04 -0.73 -0.41 5.49 2.01 -0.78 -2.41 115.64 116.76 2jop s THR 131 Ca -0.08 -0.15 -0.39 0.00 0.31 0.00 0.00 61.69 61.37 2jop s THR 131 Cb -0.02 -0.95 -0.15 0.00 0.01 0.00 0.00 72.50 71.39 2jop s THR 131 CO 0.01 -0.16 2.14 0.00 -0.69 0.00 0.00 174.62 175.92 2jop n LEU 133 N 8.60 0.00 0.00 0.00 0.00 0.51 -4.62 117.00 121.49 2jop n LEU 133 Ca 0.46 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.47 2jop n LEU 133 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.53 2jop n LEU 133 CO 0.81 0.00 0.00 -1.84 0.00 0.00 0.00 177.39 176.36