#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 3.41 -0.02 6.15 1.43 -1.26 -4.95 118.68 123.44 2jop s LEU 26 Ca 0.00 0.63 -0.07 0.00 -1.03 0.00 0.00 54.13 53.66 2jop s LEU 26 Cb 0.00 -3.04 0.01 0.00 0.03 0.00 0.00 46.19 43.19 2jop s LEU 26 CO 0.00 -1.92 0.15 -0.94 0.23 0.00 0.00 176.35 173.87 2jop s SER 27 N 6.15 -0.05 0.00 2.29 1.04 -1.26 -0.33 113.70 121.54 2jop s SER 27 Ca 0.66 -0.01 0.22 0.00 0.48 0.00 0.00 55.95 57.29 2jop s SER 27 Cb -0.15 0.26 1.07 0.00 0.10 0.00 0.00 66.02 67.30 2jop s SER 27 CO 0.26 -0.26 1.70 -2.67 0.98 0.00 0.00 173.24 173.25 2jop n TRP 28 N 1.98 0.00 0.23 5.02 4.27 -1.26 -2.33 117.44 125.36 2jop n TRP 28 Ca -0.19 0.00 0.12 0.00 -3.89 0.00 0.00 57.50 53.54 2jop n TRP 28 Cb 0.57 -0.32 0.08 0.00 -1.36 0.00 0.00 31.31 30.27 2jop n TRP 28 CO 0.00 0.00 0.00 0.10 -2.29 0.00 0.00 177.69 175.50 2jop h TYR 29 N 0.00 0.00 -2.47 -2.67 -0.00 -1.93 -3.45 116.97 106.45 2jop h TYR 29 Ca 0.00 0.00 -0.58 0.00 0.00 0.00 0.00 58.73 58.15 2jop h TYR 29 Cb 0.23 0.00 0.07 0.00 0.00 0.00 0.00 36.73 37.03 2jop h TYR 29 CO 0.00 0.00 0.75 -3.47 -0.00 0.00 0.00 178.16 175.44 2jop n ASP 30 N -2.63 3.06 -0.32 0.10 -0.08 -0.98 -4.86 116.55 110.84 2jop n ASP 30 Ca 0.02 1.10 0.08 0.00 -1.51 0.00 0.00 54.79 54.48 2jop n ASP 30 Cb 0.52 -1.44 0.24 0.00 2.34 0.00 0.00 41.12 42.78 2jop n ASP 30 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2jop h PRO 31 N 5.35 0.74 -0.38 -0.67 0.11 -1.90 -1.63 132.00 133.62 2jop h PRO 31 Ca -0.45 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2jop h PRO 31 Cb 1.26 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2jop h PRO 31 CO 0.84 0.49 0.00 -0.40 -0.21 0.00 0.00 178.00 178.72 2jop n ASP 32 N -4.77 3.86 -4.70 -2.05 5.68 -1.26 -4.94 116.55 108.37 2jop n ASP 32 Ca 0.18 -2.60 -0.42 0.00 -0.50 0.00 0.00 54.79 51.46 2jop n ASP 32 Cb 0.42 -0.46 -0.03 0.00 -1.14 0.00 0.00 41.12 39.91 2jop n ASP 32 CO 0.00 0.00 0.00 0.12 -1.33 0.00 0.00 177.20 175.99 2jop s PHE 33 N -2.08 3.48 -0.02 2.11 5.36 -0.61 -5.01 117.98 121.20 2jop s PHE 33 Ca 0.39 1.50 -0.28 0.00 -0.96 0.00 0.00 56.93 57.58 2jop s PHE 33 Cb 0.28 -3.26 -0.03 0.00 -0.34 0.00 0.00 43.02 39.67 2jop s PHE 33 CO 0.14 -0.57 0.88 -0.65 -1.46 0.00 0.00 175.22 173.56 2jop s GLN 34 N 1.57 4.52 -0.27 10.12 1.11 -1.26 -4.91 119.66 130.53 2jop s GLN 34 Ca 0.53 1.23 -0.23 0.00 0.01 0.00 0.00 55.36 56.90 2jop s GLN 34 Cb -0.22 -3.46 0.08 0.00 -1.01 0.00 0.00 33.01 28.39 2jop s GLN 34 CO 0.24 -0.01 0.74 0.00 0.01 0.00 0.00 175.29 176.27 2jop s ALA 35 N 0.95 -1.82 0.02 6.09 0.00 -1.26 -0.41 121.76 125.33 2jop s ALA 35 Ca 0.47 2.09 -0.20 0.00 0.00 0.00 0.00 51.96 54.33 2jop s ALA 35 Cb -0.20 -1.25 0.07 0.00 0.00 0.00 0.00 23.12 21.74 2jop s ALA 35 CO 0.24 -0.34 0.89 2.89 0.00 0.00 0.00 175.76 179.45 2jop n ARG 36 N 2.96 0.20 -3.78 0.00 1.85 -0.60 -4.83 116.66 112.47 2jop n ARG 36 Ca -0.15 -0.67 -0.32 0.00 -1.00 0.00 0.00 57.85 55.72 2jop n ARG 36 Cb 0.56 1.04 -0.04 0.00 -1.05 0.00 0.00 32.46 32.96 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 4.31 0.22 2.89 1.43 -1.26 -0.18 118.68 126.10 2jop s LEU 37 Ca 0.21 0.47 -0.00 0.00 -1.03 0.00 0.00 54.13 53.77 2jop s LEU 37 Cb -0.01 -3.10 -0.04 0.00 0.03 0.00 0.00 46.19 43.08 2jop s LEU 37 CO 0.00 0.12 0.16 0.42 0.23 0.00 0.00 176.35 177.29 2jop s THR 38 N -1.56 0.00 0.00 5.49 -4.23 -0.08 -4.87 115.64 110.40 2jop s THR 38 Ca 0.37 -1.98 0.00 0.00 -1.18 0.00 0.00 61.69 58.90 2jop s THR 38 Cb -0.13 -2.49 0.00 0.00 1.34 0.00 0.00 72.50 71.22 2jop s THR 38 CO 0.25 0.00 0.00 0.54 -0.54 0.00 0.00 174.62 174.87 2jop n ARG 39 N -0.32 0.00 -4.03 3.99 3.00 -1.26 -3.46 116.66 114.58 2jop n ARG 39 Ca 0.03 0.00 -0.23 0.00 -0.01 0.00 0.00 57.85 57.64 2jop n ARG 39 Cb 0.65 -2.88 -0.06 0.00 0.00 0.00 0.00 32.46 30.18 2jop n ARG 39 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 2jop s SER 40 N -2.92 4.73 -0.10 0.55 1.04 -1.26 -5.01 113.70 110.72 2jop s SER 40 Ca 0.00 -0.80 0.11 0.00 0.48 0.00 0.00 55.95 55.75 2jop s SER 40 Cb 0.00 -0.69 0.49 0.00 0.10 0.00 0.00 66.02 65.92 2jop s SER 40 CO 0.00 -0.37 1.32 -0.46 0.98 0.00 0.00 173.24 174.71 2jop n ASN 41 N -1.22 3.49 -3.81 7.02 2.04 -1.26 -4.83 115.26 116.68 2jop n ASN 41 Ca -0.02 -2.37 -0.21 0.00 -0.44 0.00 0.00 54.58 51.53 2jop n ASN 41 Cb 0.62 -0.51 -0.17 0.00 -2.53 0.00 0.00 39.78 37.19 2jop n ASN 41 CO 0.00 0.00 0.00 -0.55 -0.44 0.00 0.00 177.26 176.27 2jop s SER 42 N -0.69 1.24 0.08 0.53 0.15 -1.25 -4.98 113.70 108.77 2jop s SER 42 Ca 0.34 -0.09 0.22 0.00 0.70 0.00 0.00 55.95 57.12 2jop s SER 42 Cb 0.23 -0.41 0.88 0.00 -1.71 0.00 0.00 66.02 65.01 2jop s SER 42 CO 0.15 -0.14 1.68 2.29 1.20 0.00 0.00 173.24 178.42 2jop n LYS 43 N 4.68 0.07 -0.13 5.44 2.85 -1.26 -2.59 118.16 127.22 2jop n LYS 43 Ca -0.15 0.21 0.04 0.00 -1.05 0.00 0.00 58.31 57.36 2jop n LYS 43 Cb 0.50 -1.61 0.11 0.00 -0.65 0.00 0.00 35.03 33.38 2jop n LYS 43 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2jop s GLN 45 N -1.20 0.60 0.00 0.00 0.74 -1.07 -0.18 119.66 118.56 2jop s GLN 45 Ca 0.17 1.33 0.00 0.00 0.05 0.00 0.00 55.36 56.91 2jop s GLN 45 Cb 0.10 0.55 0.00 0.00 1.10 0.00 0.00 33.01 34.76 2jop s GLN 45 CO 0.10 -0.18 0.00 0.41 -0.55 0.00 0.00 175.29 175.06 2jop n GLY 46 N 5.00 -2.23 3.85 2.59 0.00 -1.02 -3.90 105.19 109.49 2jop n GLY 46 Ca -0.15 -1.21 -0.32 0.00 0.00 0.00 0.00 46.02 44.34 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 -1.94 3.98 0.13 1.61 -1.52 -1.22 -2.63 119.66 118.06 2jop s GLN 47 Ca 0.00 0.61 -0.27 0.00 -1.95 0.00 0.00 55.36 53.76 2jop s GLN 47 Cb 0.00 -2.47 -0.07 0.00 -0.22 0.00 0.00 33.01 30.25 2jop s GLN 47 CO 0.00 0.18 0.83 -1.17 -0.25 0.00 0.00 175.29 174.88 2jop s LEU 48 N -2.95 4.54 -0.05 2.90 1.98 -1.23 -0.90 118.68 122.98 2jop s LEU 48 Ca 0.53 1.65 0.01 0.00 -2.89 0.00 0.00 54.13 53.43 2jop s LEU 48 Cb -0.10 -3.37 0.02 0.00 0.66 0.00 0.00 46.19 43.40 2jop s LEU 48 CO 0.18 0.10 -0.04 -0.70 -1.89 0.00 0.00 176.35 174.00 2jop s GLU 49 N -0.64 0.81 -0.01 1.98 2.12 0.75 -0.47 118.70 123.24 2jop s GLU 49 Ca 0.39 -0.08 0.04 0.00 0.36 0.00 0.00 54.97 55.68 2jop s GLU 49 Cb -0.23 -0.87 -0.03 0.00 0.26 0.00 0.00 34.13 33.26 2jop s GLU 49 CO 0.27 -0.12 -0.12 0.14 -0.54 0.00 0.00 175.26 174.89 2jop s VAL 50 N 1.09 3.26 -0.97 3.70 -7.23 -0.29 -1.56 120.40 118.40 2jop s VAL 50 Ca -0.08 -0.82 -0.06 0.00 -1.81 0.00 0.00 61.98 59.21 2jop s VAL 50 Cb -0.14 -2.35 0.24 0.00 0.56 0.00 0.00 36.38 34.69 2jop s VAL 50 CO -0.01 0.47 0.91 -0.47 -0.31 0.00 0.00 175.10 175.69 2jop s TYR 51 N -0.87 4.04 -0.76 2.82 5.04 0.46 -0.03 117.35 128.04 2jop s TYR 51 Ca 0.14 -2.79 -0.21 0.00 -2.44 0.00 0.00 57.07 51.77 2jop s TYR 51 Cb -0.11 -3.55 0.09 0.00 0.35 0.00 0.00 41.96 38.74 2jop s TYR 51 CO 0.04 -0.86 1.05 -0.48 -1.34 0.00 0.00 175.55 173.96 2jop s LEU 52 N -1.14 4.52 0.00 6.97 2.34 -0.89 -4.24 118.68 126.24 2jop s LEU 52 Ca 0.28 -1.34 0.00 0.00 0.06 0.00 0.00 54.13 53.13 2jop s LEU 52 Cb -0.09 -2.42 0.00 0.00 -0.56 0.00 0.00 46.19 43.11 2jop s LEU 52 CO -0.10 -1.34 0.00 0.29 -1.06 0.00 0.00 176.35 174.15 2jop n LYS 53 N 7.45 0.00 0.00 1.48 4.76 -1.26 -1.54 118.16 129.04 2jop n LYS 53 Ca 0.07 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.51 2jop n LYS 53 Cb 0.47 -0.14 0.00 0.00 -1.84 0.00 0.00 35.03 33.52 2jop n LYS 53 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 2jop n ASP 54 N 1.33 0.00 -4.56 4.39 5.68 -1.26 -5.06 116.55 117.07 2jop n ASP 54 Ca 0.00 0.00 -0.34 0.00 -0.50 0.00 0.00 54.79 53.95 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 -0.03 0.62 -1.10 6.12 0.00 -0.59 -4.90 107.32 107.44 2jop s GLY 55 Ca 0.00 -1.67 -0.24 0.00 0.00 0.00 0.00 44.72 42.81 2jop s GLY 55 CO 0.00 3.13 2.02 -0.98 0.00 0.00 0.00 173.10 177.27 2jop s TRP 56 N 7.82 1.66 -0.47 1.90 0.52 -1.25 -2.10 118.94 127.03 2jop s TRP 56 Ca 0.58 1.14 -0.23 0.00 0.02 0.00 0.00 56.10 57.62 2jop s TRP 56 Cb -0.05 -3.76 0.03 0.00 -1.15 0.00 0.00 33.47 28.54 2jop s TRP 56 CO -0.00 -1.12 0.79 -1.01 0.02 0.00 0.00 176.95 175.63 2jop s HIS 57 N 13.00 2.97 -0.67 -1.98 3.76 0.96 -4.84 115.29 128.48 2jop s HIS 57 Ca 0.74 0.07 -0.27 0.00 -0.15 0.00 0.00 55.06 55.45 2jop s HIS 57 Cb -0.03 -3.71 -0.00 0.00 1.11 0.00 0.00 32.58 29.94 2jop s HIS 57 CO 0.13 -1.05 1.66 1.41 -0.85 0.00 0.00 174.74 176.04 2jop s MET 58 N 3.33 2.83 0.16 1.40 1.75 -1.26 -1.13 119.30 126.38 2jop s MET 58 Ca 0.28 0.27 0.08 0.00 -1.25 0.00 0.00 55.69 55.07 2jop s MET 58 Cb -0.13 -4.35 -0.04 0.00 2.84 0.00 0.00 34.83 33.15 2jop s MET 58 CO 0.21 -2.55 -0.08 0.54 -0.65 0.00 0.00 175.02 172.50 2jop s VAL 59 N 7.91 3.35 0.21 10.11 0.11 0.38 -0.09 120.40 142.37 2jop s VAL 59 Ca 0.56 -1.51 -0.22 0.00 -2.93 0.00 0.00 61.98 57.87 2jop s VAL 59 Cb -0.11 -2.64 -0.08 0.00 -1.53 0.00 0.00 36.38 32.02 2jop s VAL 59 CO 0.18 -0.06 0.76 0.00 -3.33 0.00 0.00 175.10 172.65 2jop n SER 61 N 1.06 0.51 -0.61 0.00 3.41 -1.22 -1.79 113.62 114.99 2jop n SER 61 Ca -0.03 0.70 0.13 0.00 -0.26 0.00 0.00 58.87 59.41 2jop n SER 61 Cb 0.50 -0.78 0.37 0.00 -0.26 0.00 0.00 64.21 64.05 2jop n SER 61 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jop n GLN 62 N -2.14 1.80 -0.92 4.33 -0.00 -1.26 -4.95 117.38 114.23 2jop n GLN 62 Ca -0.00 -1.22 -0.29 0.00 -0.00 0.00 0.00 57.00 55.48 2jop n GLN 62 Cb 0.09 -1.47 0.23 0.00 -0.00 0.00 0.00 30.24 29.08 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 -2.05 1.29 0.00 2.61 0.01 -0.74 -0.35 113.70 114.47 2jop s SER 63 Ca 0.34 1.04 0.00 0.00 1.31 0.00 0.00 55.95 58.63 2jop s SER 63 Cb 0.21 -1.57 0.00 0.00 0.21 0.00 0.00 66.02 64.86 2jop s SER 63 CO 0.34 -3.94 0.00 0.79 0.41 0.00 0.00 173.24 170.84 2jop n TRP 64 N -4.69 0.00 0.17 2.43 8.01 0.72 -3.64 117.44 120.43 2jop n TRP 64 Ca 0.08 0.00 0.03 0.00 -1.31 0.00 0.00 57.50 56.30 2jop n TRP 64 Cb 0.58 0.00 0.24 0.00 -2.01 0.00 0.00 31.31 30.12 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 0.00 -4.36 6.99 0.00 -1.71 -3.23 103.07 100.76 2jop h GLY 65 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2jop h GLY 65 CO 0.00 0.00 -0.82 0.54 0.00 0.00 0.00 176.54 176.26 2jop n ARG 66 N -3.51 -2.62 -4.36 4.80 1.74 0.52 -5.07 116.66 108.17 2jop n ARG 66 Ca -0.00 2.20 -0.28 0.00 -0.77 0.00 0.00 57.85 59.00 2jop n ARG 66 Cb 0.58 -3.81 -0.11 0.00 -1.02 0.00 0.00 32.46 28.10 2jop n ARG 66 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2jop s SER 67 N -0.81 3.68 0.00 0.55 0.15 -0.94 -5.03 113.70 111.29 2jop s SER 67 Ca -0.08 -0.71 0.19 0.00 0.70 0.00 0.00 55.95 56.05 2jop s SER 67 Cb 0.01 -0.41 0.02 0.00 -1.71 0.00 0.00 66.02 63.92 2jop s SER 67 CO 0.52 0.15 0.98 -1.54 1.20 0.00 0.00 173.24 174.55 2jop n SER 68 N 0.51 1.92 0.15 5.45 3.41 -1.26 -4.82 113.62 118.98 2jop n SER 68 Ca -0.14 -1.46 0.00 0.00 -0.26 0.00 0.00 58.87 57.01 2jop n SER 68 Cb 0.54 0.41 0.00 0.00 -0.26 0.00 0.00 64.21 64.90 2jop n SER 68 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2jop n LYS 69 N 0.09 0.00 -3.95 4.33 4.81 -1.26 -4.87 118.16 117.31 2jop n LYS 69 Ca 0.08 0.00 0.01 0.00 -0.87 0.00 0.00 58.31 57.53 2jop n LYS 69 Cb 0.41 0.00 0.01 0.00 0.02 0.00 0.00 35.03 35.47 2jop n LYS 69 CO 0.00 0.00 0.00 1.14 1.17 0.00 0.00 177.40 179.71 2jop s GLN 70 N -2.00 0.67 0.14 1.64 -2.07 -1.26 -4.20 119.66 112.58 2jop s GLN 70 Ca 0.00 -0.43 0.10 0.00 -1.82 0.00 0.00 55.36 53.21 2jop s GLN 70 Cb 0.00 0.19 -0.04 0.00 -1.09 0.00 0.00 33.01 32.07 2jop s GLN 70 CO 0.00 -0.31 -0.21 -1.58 -1.32 0.00 0.00 175.29 171.86 2jop s TRP 71 N -2.07 2.44 0.07 9.60 0.52 -1.26 -4.93 118.94 123.30 2jop s TRP 71 Ca 0.27 -0.31 0.06 0.00 0.02 0.00 0.00 56.10 56.14 2jop s TRP 71 Cb -0.01 -1.28 -0.23 0.00 -1.15 0.00 0.00 33.47 30.80 2jop s TRP 71 CO 0.01 0.40 1.08 1.49 0.02 0.00 0.00 176.95 179.95 2jop h GLU 72 N 3.65 0.05 -4.16 4.98 4.81 -2.02 -3.42 114.58 118.47 2jop h GLU 72 Ca -0.50 -0.09 -0.74 0.00 -0.13 0.00 0.00 59.36 57.91 2jop h GLU 72 Cb 1.18 0.03 -0.28 0.00 0.63 0.00 0.00 28.75 30.31 2jop h GLU 72 CO 0.44 0.92 -0.29 0.34 -0.73 0.00 0.00 179.01 179.69 2jop s ASP 73 N -6.64 5.93 -0.37 1.04 2.15 -1.26 -4.95 116.67 112.57 2jop s ASP 73 Ca -0.02 -1.97 0.01 0.00 0.43 0.00 0.00 52.55 51.00 2jop s ASP 73 Cb 0.09 -2.09 0.38 0.00 -0.30 0.00 0.00 42.92 41.00 2jop s ASP 73 CO 0.83 -0.73 1.82 -0.81 -0.17 0.00 0.00 175.17 176.11 2jop n PRO 74 N 4.90 1.98 0.00 4.34 -0.04 -1.26 -4.90 135.00 140.02 2jop n PRO 74 Ca -0.08 -2.11 0.00 0.00 -0.04 0.00 0.00 63.50 61.27 2jop n PRO 74 Cb 0.41 -1.83 0.00 0.00 -0.04 0.00 0.00 33.50 32.04 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 -0.37 0.00 0.00 3.54 2.88 -1.26 -4.51 113.62 113.90 2jop n SER 75 Ca 0.41 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.95 2jop n SER 75 Cb 0.96 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.42 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 -0.01 -1.46 1.13 -1.26 -4.45 117.38 111.33 2jop n GLN 76 Ca 0.00 0.00 -0.00 0.00 -1.94 0.00 0.00 57.00 55.06 2jop n GLN 76 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.35 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 2.52 0.00 -1.58 0.00 -1.26 -4.02 120.51 116.17 2jop n ALA 77 Ca 0.00 -0.02 0.16 0.00 0.00 0.00 0.00 53.44 53.59 2jop n ALA 77 Cb 0.00 -1.00 0.63 0.00 0.00 0.00 0.00 19.45 19.07 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 0.02 0.11 -0.41 0.00 0.02 -1.90 -1.77 113.55 109.62 2jop h SER 78 Ca 0.00 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.84 2jop h SER 78 Cb 0.69 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.20 2jop h SER 78 CO 0.01 0.07 -0.19 0.50 -1.14 0.00 0.00 176.83 176.07 2jop h LYS 79 N 0.13 0.86 -0.05 3.45 3.11 -1.91 -1.93 116.57 120.23 2jop h LYS 79 Ca 0.23 -0.37 -0.09 0.00 -2.81 0.00 0.00 60.65 57.62 2jop h LYS 79 Cb 0.76 -0.03 0.00 0.00 -1.00 0.00 0.00 32.23 31.97 2jop h LYS 79 CO -0.03 1.01 -0.31 -0.39 -2.81 0.00 0.00 179.45 176.93 2jop h VAL 80 N 0.67 1.44 0.00 2.00 -1.51 -1.63 -2.58 116.25 114.65 2jop h VAL 80 Ca 0.09 -1.75 -0.06 0.00 -1.23 0.00 0.00 66.70 63.75 2jop h VAL 80 Cb 0.75 2.40 -0.01 0.00 -2.13 0.00 0.00 31.29 32.30 2jop h VAL 80 CO 0.06 0.50 -0.29 0.00 -1.23 0.00 0.00 177.57 176.60 2jop h GLN 82 N 0.00 0.80 0.00 0.00 4.15 -1.24 0.25 115.11 119.07 2jop h GLN 82 Ca -0.00 -0.09 -0.03 0.00 0.77 0.00 0.00 58.65 59.31 2jop h GLN 82 Cb 0.69 -0.16 -0.00 0.00 0.21 0.00 0.00 27.48 28.22 2jop h GLN 82 CO 0.04 0.60 -0.12 0.00 -1.93 0.00 0.00 178.83 177.42 2jop h ARG 83 N 0.78 0.00 -0.36 1.69 3.08 -0.99 0.87 114.38 119.44 2jop h ARG 83 Ca 0.21 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.26 2jop h ARG 83 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.07 2jop h ARG 83 CO -0.04 0.12 0.00 1.28 -1.07 0.00 0.00 179.97 180.26 2jop n LEU 84 N -3.41 2.18 -2.21 3.04 4.77 -0.54 -4.91 117.00 115.92 2jop n LEU 84 Ca -0.01 -1.04 -0.10 0.00 -0.03 0.00 0.00 56.01 54.83 2jop n LEU 84 Cb 0.29 -0.24 -0.01 0.00 -2.33 0.00 0.00 43.42 41.13 2jop n LEU 84 CO 0.30 0.52 -0.12 -0.46 -1.33 0.00 0.00 177.39 176.30 2jop n ASN 85 N 0.68 -3.12 -0.75 -1.43 6.94 0.30 -4.80 115.26 113.07 2jop n ASN 85 Ca 0.15 0.26 0.07 0.00 -0.02 0.00 0.00 54.58 55.04 2jop n ASN 85 Cb 0.36 -2.76 0.21 0.00 -2.36 0.00 0.00 39.78 35.24 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 1.17 1.95 3.88 0.00 0.00 -1.23 -4.36 105.19 106.60 2jop n GLY 87 Ca 0.14 -0.28 -0.29 0.00 0.00 0.00 0.00 46.02 45.59 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 4.45 0.50 1.61 1.01 -1.26 -3.38 116.67 115.59 2jop s ASP 88 Ca 0.00 0.86 -0.18 0.00 0.71 0.00 0.00 52.55 53.94 2jop s ASP 88 Cb 0.00 -1.40 -0.08 0.00 1.01 0.00 0.00 42.92 42.45 2jop s ASP 88 CO 0.00 -1.95 1.00 -2.16 0.21 0.00 0.00 175.17 172.27 2jop s PRO 89 N -5.50 3.88 -0.46 8.23 0.04 -1.26 -1.19 135.00 138.74 2jop s PRO 89 Ca 0.62 1.13 -0.42 0.00 0.04 0.00 0.00 61.00 62.37 2jop s PRO 89 Cb -0.12 -2.12 -0.18 0.00 0.04 0.00 0.00 34.50 32.12 2jop s PRO 89 CO 0.50 -0.34 1.66 1.47 0.04 0.00 0.00 177.00 180.33 2jop n LEU 90 N -1.28 0.95 -4.76 -3.56 -0.00 -1.24 -0.53 117.00 106.58 2jop n LEU 90 Ca 0.08 0.91 -0.41 0.00 -0.00 0.00 0.00 56.01 56.59 2jop n LEU 90 Cb 0.53 -0.81 -0.03 0.00 -0.00 0.00 0.00 43.42 43.11 2jop n LEU 90 CO 0.43 -0.75 0.94 -0.55 -0.00 0.00 0.00 177.39 177.46 2jop s SER 91 N 3.81 6.88 -0.22 1.45 0.15 0.46 -4.53 113.70 121.70 2jop s SER 91 Ca 1.02 2.59 -0.20 0.00 0.70 0.00 0.00 55.95 60.05 2jop s SER 91 Cb -1.38 -2.64 -0.02 0.00 -1.71 0.00 0.00 66.02 60.27 2jop s SER 91 CO 0.70 -0.46 0.62 -0.76 1.20 0.00 0.00 173.24 174.54 2jop s LEU 92 N -1.57 4.12 0.00 3.45 1.43 -1.26 -2.29 118.68 122.56 2jop s LEU 92 Ca 0.49 0.78 0.00 0.00 -1.03 0.00 0.00 54.13 54.37 2jop s LEU 92 Cb -0.38 -2.86 0.00 0.00 0.03 0.00 0.00 46.19 42.98 2jop s LEU 92 CO 0.49 -0.29 0.00 0.61 0.23 0.00 0.00 176.35 177.39 2jop n GLY 93 N 3.92 1.89 3.68 -3.19 0.00 -1.06 -4.26 105.19 106.17 2jop n GLY 93 Ca -0.01 -0.33 -0.45 0.00 0.00 0.00 0.00 46.02 45.22 2jop n GLY 93 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2jop n PRO 94 N -0.34 2.37 0.00 1.61 -0.04 -1.26 -0.26 135.00 137.08 2jop n PRO 94 Ca 0.00 0.86 0.00 0.00 -0.04 0.00 0.00 63.50 64.32 2jop n PRO 94 Cb 0.00 -2.67 0.00 0.00 -0.04 0.00 0.00 33.50 30.79 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 4.27 0.00 -4.31 0.54 7.35 -0.15 -4.63 117.46 120.53 2jop n PHE 95 Ca 0.18 0.00 -0.35 0.00 -0.76 0.00 0.00 57.45 56.52 2jop n PHE 95 Cb 0.31 0.00 -0.10 0.00 0.35 0.00 0.00 39.48 40.04 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 -1.93 3.57 0.55 -2.13 0.05 -1.26 -5.00 118.68 112.54 2jop s LEU 96 Ca 0.00 0.09 -0.15 0.00 0.05 0.00 0.00 54.13 54.12 2jop s LEU 96 Cb 0.00 -1.84 -0.06 0.00 -2.05 0.00 0.00 46.19 42.24 2jop s LEU 96 CO 0.00 0.31 1.01 -0.54 -0.55 0.00 0.00 176.35 176.57 2jop s LYS 97 N -0.44 3.78 0.21 1.48 -0.14 -1.26 -4.63 119.74 118.73 2jop s LYS 97 Ca 0.08 0.92 0.00 0.00 -1.36 0.00 0.00 55.97 55.61 2jop s LYS 97 Cb -0.12 -2.11 0.00 0.00 -1.68 0.00 0.00 37.83 33.92 2jop s LYS 97 CO 0.02 -0.42 0.00 0.25 -0.76 0.00 0.00 175.35 174.44 2jop n THR 98 N -1.97-13.99 -1.85 2.17 -2.24 -1.26 -5.01 114.28 90.13 2jop n THR 98 Ca 0.07 3.55 0.00 0.00 -2.27 0.00 0.00 64.05 65.40 2jop n THR 98 Cb 0.54 -5.67 0.00 0.00 -2.10 0.00 0.00 70.33 63.10 2jop n THR 98 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 2jop n TYR 99 N 1.99 -1.68 -4.01 4.78 4.02 -1.26 -5.02 117.16 115.97 2jop n TYR 99 Ca 0.00 0.00 -0.31 0.00 -0.01 0.00 0.00 57.90 57.58 2jop n TYR 99 Cb 0.00 0.00 -0.16 0.00 -0.02 0.00 0.00 39.34 39.16 2jop n TYR 99 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 2jop s THR 100 N 0.84 1.69 -1.76 -0.72 2.01 -1.26 -5.01 115.64 111.43 2jop s THR 100 Ca 0.00 -1.02 0.00 0.00 0.31 0.00 0.00 61.69 60.98 2jop s THR 100 Cb 0.00 -1.74 0.00 0.00 0.01 0.00 0.00 72.50 70.77 2jop s THR 100 CO 0.00 0.20 0.32 -0.81 -0.69 0.00 0.00 174.62 173.64 2jop n PRO 101 N 4.67 0.37 0.02 4.92 -0.04 -1.26 0.10 135.00 143.78 2jop n PRO 101 Ca -0.15 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.29 2jop n PRO 101 Cb 0.47 -1.04 -0.01 0.00 -0.04 0.00 0.00 33.50 32.88 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 -0.30 0.10 0.10 0.54 7.27 -1.26 -4.09 117.38 119.74 2jop n GLN 102 Ca 0.00 0.04 -0.18 0.00 0.07 0.00 0.00 57.00 56.93 2jop n GLN 102 Cb 0.02 -0.68 -0.14 0.00 2.41 0.00 0.00 30.24 31.85 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 -0.19 0.50 -3.36 1.69 0.02 -1.91 -3.45 113.55 106.84 2jop h SER 103 Ca -0.02 -0.59 -0.55 0.00 -0.84 0.00 0.00 61.79 59.79 2jop h SER 103 Cb 0.30 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 62.64 2jop h SER 103 CO -0.01 1.47 0.04 -0.44 -1.14 0.00 0.00 176.83 176.76 2jop s SER 104 N -7.18 7.16 0.12 3.07 0.01 0.12 -4.08 113.70 112.92 2jop s SER 104 Ca -0.07 1.39 0.05 0.00 1.31 0.00 0.00 55.95 58.63 2jop s SER 104 Cb 0.06 -2.41 -0.04 0.00 0.21 0.00 0.00 66.02 63.85 2jop s SER 104 CO 0.88 0.22 -0.12 0.27 0.41 0.00 0.00 173.24 174.90 2jop s ILE 105 N -1.18 1.23 -0.29 1.44 -5.25 0.87 -3.77 121.20 114.25 2jop s ILE 105 Ca 0.33 -1.79 -0.03 0.00 -0.99 0.00 0.00 60.65 58.17 2jop s ILE 105 Cb -0.20 -1.57 0.04 0.00 2.95 0.00 0.00 42.46 43.67 2jop s ILE 105 CO 0.22 -0.52 0.00 -0.63 -1.79 0.00 0.00 174.94 172.22 2jop s ILE 106 N -2.47 3.19 0.67 8.37 1.01 0.72 -2.73 121.20 129.96 2jop s ILE 106 Ca 0.10 -1.14 -0.06 0.00 0.00 0.00 0.00 60.65 59.55 2jop s ILE 106 Cb -0.03 -2.74 0.05 0.00 0.01 0.00 0.00 42.46 39.76 2jop s ILE 106 CO 0.02 0.01 0.97 0.00 0.00 0.00 0.00 174.94 175.94 2jop s TYR 108 N -3.15 1.70 0.00 0.00 2.02 -1.16 -0.20 117.35 116.55 2jop s TYR 108 Ca 0.59 -1.56 0.00 0.00 -0.37 0.00 0.00 57.07 55.72 2jop s TYR 108 Cb -0.11 -0.78 0.00 0.00 -0.40 0.00 0.00 41.96 40.67 2jop s TYR 108 CO 0.44 -0.74 0.00 0.41 -1.57 0.00 0.00 175.55 174.09 2jop n GLY 109 N -0.64 -0.51 3.75 0.71 0.00 -1.22 -4.51 105.19 102.77 2jop n GLY 109 Ca 0.04 -1.91 -0.37 0.00 0.00 0.00 0.00 46.02 43.79 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 4.18 0.04 1.61 2.00 -1.26 -3.96 119.66 122.26 2jop s GLN 110 Ca 0.00 0.25 -0.35 0.00 -2.00 0.00 0.00 55.36 53.25 2jop s GLN 110 Cb 0.00 -3.38 -0.14 0.00 0.80 0.00 0.00 33.01 30.29 2jop s GLN 110 CO 0.00 0.33 1.59 -0.11 -0.50 0.00 0.00 175.29 176.60 2jop n LEU 111 N 3.19 2.68 0.00 3.68 7.94 -1.26 -0.91 117.00 132.31 2jop n LEU 111 Ca -0.11 1.07 0.00 0.00 -1.11 0.00 0.00 56.01 55.86 2jop n LEU 111 Cb 0.52 -1.32 0.00 0.00 0.53 0.00 0.00 43.42 43.15 2jop n LEU 111 CO 0.40 -0.47 0.00 0.61 -1.11 0.00 0.00 177.39 176.82 2jop n GLY 112 N 3.45 2.37 3.27 -3.96 0.00 -1.26 -5.02 105.19 104.04 2jop n GLY 112 Ca 0.20 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.61 6.70 -0.15 1.61 0.01 -0.09 -4.10 113.70 116.06 2jop s SER 113 Ca 0.00 -3.23 0.00 0.00 1.31 0.00 0.00 55.95 54.03 2jop s SER 113 Cb 0.00 -2.12 0.16 0.00 0.21 0.00 0.00 66.02 64.27 2jop s SER 113 CO 0.00 -0.38 1.60 0.49 0.41 0.00 0.00 173.24 175.36 2jop n PHE 114 N 3.16 0.88 -0.02 2.43 3.01 0.55 -3.95 117.46 123.52 2jop n PHE 114 Ca 0.18 -1.19 -0.07 0.00 1.01 0.00 0.00 57.45 57.38 2jop n PHE 114 Cb 0.41 -0.59 -0.13 0.00 -0.01 0.00 0.00 39.48 39.16 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 0.39 0.79 -4.07 4.37 2.88 -1.26 -4.86 113.62 111.86 2jop n SER 115 Ca 0.17 0.37 -0.30 0.00 -1.33 0.00 0.00 58.87 57.79 2jop n SER 115 Cb 0.70 0.07 -0.17 0.00 -0.75 0.00 0.00 64.21 64.07 2jop n SER 115 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 2jop s ASN 116 N -5.99 2.64 0.36 -3.46 3.84 -1.25 -5.12 114.94 105.96 2jop s ASN 116 Ca -0.05 -0.48 0.06 0.00 0.21 0.00 0.00 52.86 52.61 2jop s ASN 116 Cb 0.08 -1.19 -0.03 0.00 -0.55 0.00 0.00 41.25 39.56 2jop s ASN 116 CO 0.82 0.02 0.24 0.00 -2.79 0.00 0.00 177.10 175.39 2jop s SER 118 N -3.45 -0.24 0.78 0.00 0.01 -0.70 -4.87 113.70 105.23 2jop s SER 118 Ca 0.35 -0.52 -0.11 0.00 1.31 0.00 0.00 55.95 56.98 2jop s SER 118 Cb 0.02 0.58 0.06 0.00 0.21 0.00 0.00 66.02 66.89 2jop s SER 118 CO 0.24 -1.06 1.08 -1.00 0.41 0.00 0.00 173.24 172.91 2jop s HIS 119 N -3.88 2.75 -1.11 2.43 3.76 -1.26 -0.20 115.29 117.78 2jop s HIS 119 Ca 0.10 1.34 -0.22 0.00 -0.15 0.00 0.00 55.06 56.13 2jop s HIS 119 Cb -0.01 -3.04 -0.09 0.00 1.11 0.00 0.00 32.58 30.55 2jop s HIS 119 CO -0.02 -1.74 1.92 0.45 -0.85 0.00 0.00 174.74 174.50 2jop n SER 120 N -3.45 3.10 0.00 1.40 2.88 -1.25 -4.36 113.62 111.95 2jop n SER 120 Ca 0.08 -2.71 0.00 0.00 -1.33 0.00 0.00 58.87 54.90 2jop n SER 120 Cb 0.55 -1.61 0.00 0.00 -0.75 0.00 0.00 64.21 62.40 2jop n SER 120 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2jop n ARG 121 N 7.99 1.78 0.00 -1.46 1.74 -1.26 -4.81 116.66 120.64 2jop n ARG 121 Ca 0.46 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.54 2jop n ARG 121 Cb 0.45 -1.00 0.00 0.00 -1.02 0.00 0.00 32.46 30.89 2jop n ARG 121 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2jop n ASN 122 N -2.27 0.00 -4.44 0.55 5.03 -1.26 -4.78 115.26 108.09 2jop n ASN 122 Ca 0.00 0.00 -0.44 0.00 0.87 0.00 0.00 54.58 55.01 2jop n ASN 122 Cb 0.50 0.00 -0.02 0.00 -1.02 0.00 0.00 39.78 39.24 2jop n ASN 122 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 2jop s ASP 123 N -1.00 6.68 0.07 6.41 1.01 -1.26 -4.99 116.67 123.59 2jop s ASP 123 Ca 0.00 -2.20 -0.31 0.00 0.71 0.00 0.00 52.55 50.76 2jop s ASP 123 Cb 0.00 -2.38 -0.09 0.00 1.01 0.00 0.00 42.92 41.46 2jop s ASP 123 CO 0.00 -0.98 1.82 0.00 0.21 0.00 0.00 175.17 176.21 2jop s MET 124 N 2.32 4.16 0.12 8.23 0.23 -1.26 -4.89 119.30 128.20 2jop s MET 124 Ca 0.32 2.51 -0.31 0.00 -1.03 0.00 0.00 55.69 57.18 2jop s MET 124 Cb -0.05 -3.80 -0.10 0.00 -1.53 0.00 0.00 34.83 29.35 2jop s MET 124 CO -0.09 -0.85 1.84 0.00 -2.03 0.00 0.00 175.02 173.89 2jop n HIS 126 N 5.86 2.62 -2.34 0.00 8.25 -1.26 -4.53 115.22 123.82 2jop n HIS 126 Ca 0.18 -2.74 -0.14 0.00 -0.26 0.00 0.00 57.72 54.76 2jop n HIS 126 Cb 0.38 -2.31 -0.01 0.00 1.12 0.00 0.00 29.99 29.17 2jop n HIS 126 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2jop n SER 127 N 5.06 -4.13 -4.67 0.41 3.41 -1.26 -4.76 113.62 107.68 2jop n SER 127 Ca 0.61 0.18 -0.42 0.00 -0.26 0.00 0.00 58.87 58.98 2jop n SER 127 Cb 0.30 -3.52 -0.03 0.00 -0.26 0.00 0.00 64.21 60.69 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 -5.50 4.41 0.00 1.04 2.01 -1.26 -0.97 118.68 118.40 2jop s LEU 128 Ca 0.00 2.64 0.00 0.00 0.01 0.00 0.00 54.13 56.78 2jop s LEU 128 Cb 0.00 -3.55 0.00 0.00 0.01 0.00 0.00 46.19 42.65 2jop s LEU 128 CO 0.00 -1.01 0.00 0.61 1.01 0.00 0.00 176.35 176.96 2jop n GLY 129 N 4.35 2.74 3.06 -3.19 0.00 0.64 -3.39 105.19 109.40 2jop n GLY 129 Ca 0.19 -2.15 -0.04 0.00 0.00 0.00 0.00 46.02 44.02 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 -0.95 -0.33 0.99 1.43 -1.08 -2.56 118.68 116.18 2jop s LEU 130 Ca 0.00 0.60 0.01 0.00 -1.03 0.00 0.00 54.13 53.71 2jop s LEU 130 Cb 0.00 1.60 0.09 0.00 0.03 0.00 0.00 46.19 47.91 2jop s LEU 130 CO 0.00 -0.28 0.04 -0.89 0.23 0.00 0.00 176.35 175.45 2jop s THR 131 N 2.69 2.57 -0.33 5.49 2.01 -0.97 -2.42 115.64 124.68 2jop s THR 131 Ca 0.14 -1.98 -0.39 0.00 0.31 0.00 0.00 61.69 59.77 2jop s THR 131 Cb -0.15 -2.72 -0.15 0.00 0.01 0.00 0.00 72.50 69.50 2jop s THR 131 CO -0.18 -0.41 1.93 0.00 -0.69 0.00 0.00 174.62 175.27 2jop n LEU 133 N 7.02 0.00 -0.64 0.00 7.94 0.31 -4.60 117.00 127.03 2jop n LEU 133 Ca 0.34 0.00 0.13 0.00 -1.11 0.00 0.00 56.01 55.38 2jop n LEU 133 Cb 0.14 0.00 0.38 0.00 0.53 0.00 0.00 43.42 44.47 2jop n LEU 133 CO 0.80 0.00 0.79 -1.84 -1.11 0.00 0.00 177.39 176.03