#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 -0.08 -3.91 2.89 4.77 -1.26 -4.88 117.00 114.53 2jop n LEU 26 Ca 0.00 -4.58 -0.10 0.00 -0.03 0.00 0.00 56.01 51.31 2jop n LEU 26 Cb 0.00 0.66 -0.09 0.00 -2.33 0.00 0.00 43.42 41.65 2jop n LEU 26 CO 0.00 2.07 -0.20 -0.94 -1.33 0.00 0.00 177.39 176.99 2jop s SER 27 N -1.24 0.14 0.00 -1.43 1.04 -1.25 -0.45 113.70 110.51 2jop s SER 27 Ca 0.35 -0.46 0.00 0.00 0.48 0.00 0.00 55.95 56.31 2jop s SER 27 Cb 0.18 0.23 0.00 0.00 0.10 0.00 0.00 66.02 66.53 2jop s SER 27 CO -0.12 -0.49 0.50 -2.67 0.98 0.00 0.00 173.24 171.44 2jop n TRP 28 N 0.87 0.00 -0.52 5.02 2.14 -1.26 -1.76 117.44 121.93 2jop n TRP 28 Ca -0.20 -0.01 0.02 0.00 2.07 0.00 0.00 57.50 59.38 2jop n TRP 28 Cb 0.58 -0.10 0.02 0.00 -0.81 0.00 0.00 31.31 31.00 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 0.02 0.00 -2.55 -2.67 0.18 -1.26 -4.20 117.16 106.68 2jop n TYR 29 Ca 0.00 -0.43 -0.41 0.00 1.88 0.00 0.00 57.90 58.94 2jop n TYR 29 Cb 0.25 -0.05 -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 -1.06 7.34 0.22 9.48 1.01 -0.73 -4.97 116.67 127.96 2jop s ASP 30 Ca 0.05 2.10 -0.09 0.00 0.71 0.00 0.00 52.55 55.33 2jop s ASP 30 Cb 0.04 -2.61 0.21 0.00 1.01 0.00 0.00 42.92 41.58 2jop s ASP 30 CO 0.00 -0.13 1.87 -0.65 0.21 0.00 0.00 175.17 176.47 2jop h PRO 31 N 4.63 0.96 -0.64 8.23 0.11 -1.96 -2.67 132.00 140.66 2jop h PRO 31 Ca -0.45 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2jop h PRO 31 Cb 1.21 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 32.10 2jop h PRO 31 CO 0.70 0.64 0.00 -0.40 -0.21 0.00 0.00 178.00 178.73 2jop n ASP 32 N -4.59 3.74 -4.67 -2.05 5.75 -1.26 -4.93 116.55 108.54 2jop n ASP 32 Ca 0.09 -2.01 -0.43 0.00 -0.01 0.00 0.00 54.79 52.43 2jop n ASP 32 Cb 0.07 -0.43 -0.02 0.00 -1.03 0.00 0.00 41.12 39.70 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 -1.03 3.34 0.07 2.11 5.36 -1.01 -5.00 117.98 121.83 2jop s PHE 33 Ca 0.43 1.45 -0.27 0.00 -0.96 0.00 0.00 56.93 57.58 2jop s PHE 33 Cb 0.23 -3.28 -0.06 0.00 -0.34 0.00 0.00 43.02 39.57 2jop s PHE 33 CO 0.29 -0.57 0.83 -0.65 -1.46 0.00 0.00 175.22 173.66 2jop s GLN 34 N 2.77 4.57 -0.05 10.12 -1.52 -1.26 -4.90 119.66 129.39 2jop s GLN 34 Ca 0.47 1.20 -0.30 0.00 -1.95 0.00 0.00 55.36 54.79 2jop s GLN 34 Cb -0.17 -3.36 0.07 0.00 -0.22 0.00 0.00 33.01 29.32 2jop s GLN 34 CO 0.12 0.27 0.66 0.00 -0.25 0.00 0.00 175.29 176.10 2jop s ALA 35 N -0.09 -1.73 0.09 6.09 0.00 -1.26 -0.42 121.76 124.43 2jop s ALA 35 Ca 0.41 1.29 -0.17 0.00 0.00 0.00 0.00 51.96 53.50 2jop s ALA 35 Cb -0.22 -0.02 0.06 0.00 0.00 0.00 0.00 23.12 22.94 2jop s ALA 35 CO 0.25 -0.36 0.80 2.89 0.00 0.00 0.00 175.76 179.34 2jop n ARG 36 N 0.97 0.36 -4.46 0.00 1.85 -0.54 -4.91 116.66 109.92 2jop n ARG 36 Ca -0.19 -0.90 -0.33 0.00 -1.00 0.00 0.00 57.85 55.43 2jop n ARG 36 Cb 0.57 1.27 -0.16 0.00 -1.05 0.00 0.00 32.46 33.10 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 2.34 0.48 2.89 1.02 -1.26 -0.09 118.68 124.07 2jop s LEU 37 Ca 0.18 -0.53 0.02 0.00 0.02 0.00 0.00 54.13 53.82 2jop s LEU 37 Cb -0.02 -1.53 -0.01 0.00 0.02 0.00 0.00 46.19 44.66 2jop s LEU 37 CO 0.03 0.06 0.07 0.42 0.02 0.00 0.00 176.35 176.94 2jop s THR 38 N 0.93 0.79 -1.83 5.49 -4.23 0.04 -4.19 115.64 112.65 2jop s THR 38 Ca -0.03 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.48 2jop s THR 38 Cb -0.15 -2.13 0.00 0.00 1.34 0.00 0.00 72.50 71.56 2jop s THR 38 CO -0.03 0.00 0.00 -1.14 -0.54 0.00 0.00 174.62 172.91 2jop n ARG 39 N -1.16 -1.60 0.00 3.99 0.63 -1.26 -2.80 116.66 114.46 2jop n ARG 39 Ca -0.15 1.03 0.00 0.00 -0.92 0.00 0.00 57.85 57.82 2jop n ARG 39 Cb 0.66 -5.62 0.00 0.00 0.45 0.00 0.00 32.46 27.94 2jop n ARG 39 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 2jop n SER 40 N -1.80 0.00 -0.98 6.15 7.64 -1.26 -4.90 113.62 118.47 2jop n SER 40 Ca -0.24 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.52 2jop n SER 40 Cb 0.68 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.84 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 -0.59 -4.38 -4.51 6.43 5.15 -1.26 -4.99 115.26 111.11 2jop n ASN 41 Ca 0.00 0.26 -0.36 0.00 -0.60 0.00 0.00 54.58 53.88 2jop n ASN 41 Cb 0.00 -3.03 -0.12 0.00 -0.53 0.00 0.00 39.78 36.11 2jop n ASN 41 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 2jop s SER 42 N -2.82 5.43 0.00 1.20 0.15 -1.23 -4.96 113.70 111.47 2jop s SER 42 Ca 0.00 -0.11 0.14 0.00 0.70 0.00 0.00 55.95 56.68 2jop s SER 42 Cb 0.00 -1.98 0.82 0.00 -1.71 0.00 0.00 66.02 63.16 2jop s SER 42 CO 0.00 -0.00 1.26 2.29 1.20 0.00 0.00 173.24 177.99 2jop n LYS 43 N 4.71 0.42 -0.03 5.44 0.00 -1.26 -1.45 118.16 125.99 2jop n LYS 43 Ca -0.16 0.01 0.01 0.00 -0.00 0.00 0.00 58.31 58.17 2jop n LYS 43 Cb 0.52 -1.50 0.01 0.00 -0.00 0.00 0.00 35.03 34.06 2jop n LYS 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2jop s GLN 45 N -0.66 0.72 0.00 0.00 0.74 -0.53 -0.06 119.66 119.87 2jop s GLN 45 Ca 0.02 1.18 0.00 0.00 0.05 0.00 0.00 55.36 56.61 2jop s GLN 45 Cb 0.02 0.18 0.00 0.00 1.10 0.00 0.00 33.01 34.30 2jop s GLN 45 CO 0.00 -0.14 0.00 0.41 -0.55 0.00 0.00 175.29 175.01 2jop n GLY 46 N 4.07 0.58 3.79 2.59 0.00 0.61 -3.50 105.19 113.32 2jop n GLY 46 Ca -0.19 -1.66 -0.36 0.00 0.00 0.00 0.00 46.02 43.81 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 -1.49 4.17 -0.30 1.61 -0.21 -1.12 -1.62 119.66 120.69 2jop s GLN 47 Ca 0.00 1.44 -0.29 0.00 0.02 0.00 0.00 55.36 56.53 2jop s GLN 47 Cb 0.00 -2.49 -0.00 0.00 1.00 0.00 0.00 33.01 31.52 2jop s GLN 47 CO 0.00 -0.12 1.40 -1.17 -2.12 0.00 0.00 175.29 173.27 2jop s LEU 48 N -2.72 3.84 -0.35 2.90 2.96 -1.26 -0.78 118.68 123.27 2jop s LEU 48 Ca 0.58 1.25 -0.08 0.00 -0.22 0.00 0.00 54.13 55.67 2jop s LEU 48 Cb -0.20 -3.54 0.03 0.00 0.50 0.00 0.00 46.19 42.99 2jop s LEU 48 CO 0.25 -1.18 0.13 -0.70 -1.32 0.00 0.00 176.35 173.53 2jop s GLU 49 N 4.41 2.70 -0.00 1.98 2.12 0.87 -0.71 118.70 130.08 2jop s GLU 49 Ca 0.61 -1.14 0.02 0.00 0.36 0.00 0.00 54.97 54.82 2jop s GLU 49 Cb -0.18 -3.53 -0.03 0.00 0.26 0.00 0.00 34.13 30.64 2jop s GLU 49 CO 0.26 -0.67 -0.04 0.14 -0.54 0.00 0.00 175.26 174.42 2jop s VAL 50 N 1.45 3.88 -0.78 3.70 -7.23 -0.73 -1.47 120.40 119.22 2jop s VAL 50 Ca -0.00 -0.68 -0.12 0.00 -1.81 0.00 0.00 61.98 59.36 2jop s VAL 50 Cb -0.19 -2.70 0.21 0.00 0.56 0.00 0.00 36.38 34.25 2jop s VAL 50 CO 0.04 0.40 0.70 -0.47 -0.31 0.00 0.00 175.10 175.45 2jop s TYR 51 N -1.03 3.68 -0.89 2.82 5.04 0.44 -0.36 117.35 127.05 2jop s TYR 51 Ca 0.18 -2.09 -0.18 0.00 -2.44 0.00 0.00 57.07 52.54 2jop s TYR 51 Cb -0.11 -3.71 0.14 0.00 0.35 0.00 0.00 41.96 38.62 2jop s TYR 51 CO 0.08 -0.97 1.05 -0.48 -1.34 0.00 0.00 175.55 173.90 2jop s LEU 52 N 0.19 5.30 0.00 6.97 0.05 -0.72 -4.27 118.68 126.20 2jop s LEU 52 Ca 0.17 -2.08 0.00 0.00 0.05 0.00 0.00 54.13 52.27 2jop s LEU 52 Cb -0.13 -2.37 0.00 0.00 -2.05 0.00 0.00 46.19 41.64 2jop s LEU 52 CO -0.07 -1.01 0.00 1.17 -0.55 0.00 0.00 176.35 175.89 2jop n LYS 53 N 6.20 0.00 0.00 1.48 4.81 -1.26 -1.99 118.16 127.40 2jop n LYS 53 Ca 0.20 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.64 2jop n LYS 53 Cb 0.48 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.53 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 1.22 0.00 -4.02 3.14 5.75 -1.26 -5.06 116.55 116.32 2jop n ASP 54 Ca 0.00 -1.00 -0.32 0.00 -0.01 0.00 0.00 54.79 53.46 2jop n ASP 54 Cb 0.00 0.00 -0.14 0.00 -1.03 0.00 0.00 41.12 39.95 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 2.11 -1.01 6.12 0.00 -0.84 -4.99 107.32 108.70 2jop s GLY 55 Ca 0.00 -2.77 -0.24 0.00 0.00 0.00 0.00 44.72 41.71 2jop s GLY 55 CO 0.00 0.98 1.94 0.79 0.00 0.00 0.00 173.10 176.81 2jop n TRP 56 N 3.95 2.08 -2.88 1.90 7.02 -1.24 -1.76 117.44 126.51 2jop n TRP 56 Ca 0.04 -1.25 -0.42 0.00 -1.02 0.00 0.00 57.50 54.85 2jop n TRP 56 Cb 0.39 -2.32 -0.04 0.00 -2.42 0.00 0.00 31.31 26.91 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 10.73 3.16 -0.58 -5.99 3.76 0.51 -4.78 115.29 122.11 2jop s HIS 57 Ca 0.69 0.82 -0.28 0.00 -0.15 0.00 0.00 55.06 56.13 2jop s HIS 57 Cb 0.03 -3.37 0.03 0.00 1.11 0.00 0.00 32.58 30.37 2jop s HIS 57 CO 0.16 -0.66 1.21 -1.64 -0.85 0.00 0.00 174.74 172.97 2jop s MET 58 N 3.14 3.50 0.45 1.40 -1.94 -1.13 -1.77 119.30 122.95 2jop s MET 58 Ca 0.35 0.28 -0.07 0.00 -1.71 0.00 0.00 55.69 54.53 2jop s MET 58 Cb -0.13 -4.02 -0.05 0.00 2.01 0.00 0.00 34.83 32.64 2jop s MET 58 CO 0.14 -1.70 0.78 0.14 -0.01 0.00 0.00 175.02 174.37 2jop s VAL 59 N 5.05 4.86 -0.63 -6.03 -7.23 0.11 -0.33 120.40 116.20 2jop s VAL 59 Ca 0.44 0.38 0.06 0.00 -1.81 0.00 0.00 61.98 61.05 2jop s VAL 59 Cb -0.08 -3.81 0.38 0.00 0.56 0.00 0.00 36.38 33.44 2jop s VAL 59 CO 0.26 -0.71 1.10 0.00 -0.31 0.00 0.00 175.10 175.44 2jop n SER 61 N 0.27 0.00 -0.08 0.00 7.64 -1.26 -3.91 113.62 116.28 2jop n SER 61 Ca 0.14 0.00 0.10 0.00 1.01 0.00 0.00 58.87 60.11 2jop n SER 61 Cb 0.71 0.00 0.54 0.00 -1.01 0.00 0.00 64.21 64.46 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 1.11 -1.41 1.43 -0.00 -1.26 -4.89 117.38 112.36 2jop n GLN 62 Ca 0.00 -0.16 -0.32 0.00 -0.00 0.00 0.00 57.00 56.51 2jop n GLN 62 Cb 0.00 -1.32 0.08 0.00 -0.00 0.00 0.00 30.24 29.01 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 -1.60 4.47 0.00 2.61 0.01 -1.26 -3.76 113.70 114.17 2jop s SER 63 Ca 0.29 2.04 0.00 0.00 1.31 0.00 0.00 55.95 59.59 2jop s SER 63 Cb 0.14 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.82 2jop s SER 63 CO 0.23 -2.06 0.00 0.79 0.41 0.00 0.00 173.24 172.60 2jop n TRP 64 N -3.04 0.00 0.00 2.43 8.01 0.10 -4.69 117.44 120.25 2jop n TRP 64 Ca 0.11 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.30 2jop n TRP 64 Cb 0.52 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 1.57 3.14 6.99 0.00 -1.25 -3.86 105.19 111.80 2jop n GLY 65 Ca 0.00 -1.23 -0.12 0.00 0.00 0.00 0.00 46.02 44.66 2jop n GLY 65 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jop s ARG 66 N 4.71 0.30 0.13 1.61 0.52 -1.25 -4.96 118.95 120.00 2jop s ARG 66 Ca 0.00 0.49 -0.10 0.00 -0.52 0.00 0.00 55.73 55.60 2jop s ARG 66 Cb 0.00 0.04 0.00 0.00 0.52 0.00 0.00 34.95 35.52 2jop s ARG 66 CO 0.00 -0.10 0.28 0.45 0.02 0.00 0.00 175.30 175.95 2jop s SER 67 N 0.68 0.01 0.03 0.23 0.15 -1.26 -4.99 113.70 108.56 2jop s SER 67 Ca -0.04 -0.67 0.00 0.00 0.70 0.00 0.00 55.95 55.94 2jop s SER 67 Cb -0.06 0.41 0.00 0.00 -1.71 0.00 0.00 66.02 64.66 2jop s SER 67 CO -0.04 -0.83 0.00 -0.24 1.20 0.00 0.00 173.24 173.33 2jop n SER 68 N -0.16 -0.25 -3.09 5.45 2.88 -1.26 -4.94 113.62 112.26 2jop n SER 68 Ca -0.12 0.06 -0.23 0.00 -1.33 0.00 0.00 58.87 57.25 2jop n SER 68 Cb 0.63 0.58 -0.04 0.00 -0.75 0.00 0.00 64.21 64.63 2jop n SER 68 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 2jop n LYS 69 N -2.57 2.16 0.00 -1.46 2.85 -1.26 -4.62 118.16 113.25 2jop n LYS 69 Ca 0.00 -4.18 0.00 0.00 -1.05 0.00 0.00 58.31 53.08 2jop n LYS 69 Cb 0.00 -1.97 0.00 0.00 -0.65 0.00 0.00 35.03 32.41 2jop n LYS 69 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 177.40 178.29 2jop n GLN 70 N 0.13 0.00 -0.07 -1.58 7.27 -1.25 -4.88 117.38 116.99 2jop n GLN 70 Ca 0.28 0.00 0.01 0.00 0.07 0.00 0.00 57.00 57.36 2jop n GLN 70 Cb 0.51 0.00 -0.00 0.00 2.41 0.00 0.00 30.24 33.15 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 0.00 -1.51 1.03 3.69 7.02 -1.26 -4.18 117.44 122.23 2jop n TRP 71 Ca 0.00 0.09 0.13 0.00 -1.02 0.00 0.00 57.50 56.70 2jop n TRP 71 Cb 0.00 -0.08 0.38 0.00 -2.42 0.00 0.00 31.31 29.19 2jop n TRP 71 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 2jop n GLU 72 N -0.86 0.06 -3.40 -0.99 -0.58 -1.26 -4.59 120.64 109.02 2jop n GLU 72 Ca 0.00 -0.03 -0.09 0.00 -0.42 0.00 0.00 57.16 56.63 2jop n GLU 72 Cb 0.03 -1.50 -0.08 0.00 -0.57 0.00 0.00 31.44 29.32 2jop n GLU 72 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 2jop s ASP 73 N -2.96 0.09 0.18 1.62 2.15 -1.26 -5.06 116.67 111.44 2jop s ASP 73 Ca 0.13 0.39 -0.07 0.00 0.43 0.00 0.00 52.55 53.44 2jop s ASP 73 Cb 0.18 1.19 0.09 0.00 -0.30 0.00 0.00 42.92 44.08 2jop s ASP 73 CO 0.63 -0.29 1.55 1.55 -0.17 0.00 0.00 175.17 178.45 2jop h PRO 74 N 8.18 0.81 -1.08 4.34 0.13 -1.81 -3.47 132.00 139.09 2jop h PRO 74 Ca -0.19 -0.39 0.20 0.00 -0.87 0.00 0.00 66.00 64.76 2jop h PRO 74 Cb 1.15 -0.00 -0.31 0.00 0.13 0.00 0.00 31.00 31.96 2jop h PRO 74 CO 0.24 1.02 0.90 -1.54 -0.23 0.00 0.00 178.00 178.39 2jop s SER 75 N -6.81 -0.06 -0.30 1.44 1.04 -1.26 -4.71 113.70 103.04 2jop s SER 75 Ca -0.10 0.09 -0.01 0.00 0.48 0.00 0.00 55.95 56.42 2jop s SER 75 Cb 0.12 0.09 0.23 0.00 0.10 0.00 0.00 66.02 66.56 2jop s SER 75 CO 0.85 -0.03 1.93 0.00 0.98 0.00 0.00 173.24 176.98 2jop n GLN 76 N 1.29 1.77 -1.22 4.02 6.02 -1.26 -4.53 117.38 123.47 2jop n GLN 76 Ca -0.08 -1.54 -0.24 0.00 -0.01 0.00 0.00 57.00 55.14 2jop n GLN 76 Cb 0.57 -1.60 0.15 0.00 1.02 0.00 0.00 30.24 30.39 2jop n GLN 76 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2jop n ALA 77 N 0.26 5.57 -0.29 -1.58 0.00 -1.26 -4.53 120.51 118.68 2jop n ALA 77 Ca 0.30 -3.10 0.08 0.00 0.00 0.00 0.00 53.44 50.71 2jop n ALA 77 Cb 0.65 -1.38 0.23 0.00 0.00 0.00 0.00 19.45 18.95 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 1.27 0.47 -0.61 0.00 0.87 -1.81 -1.61 113.55 112.12 2jop h SER 78 Ca 0.56 0.10 0.02 0.00 -1.23 0.00 0.00 61.79 61.25 2jop h SER 78 Cb 2.19 0.03 -0.04 0.00 -0.44 0.00 0.00 62.40 64.15 2jop h SER 78 CO 1.10 0.18 0.39 0.11 -0.53 0.00 0.00 176.83 178.07 2jop h LYS 79 N 0.57 0.74 -0.25 2.24 1.79 -1.82 0.77 116.57 120.61 2jop h LYS 79 Ca 0.47 -0.04 -0.08 0.00 -2.18 0.00 0.00 60.65 58.81 2jop h LYS 79 Cb 0.70 -0.17 -0.01 0.00 -1.58 0.00 0.00 32.23 31.17 2jop h LYS 79 CO -0.39 0.49 -0.16 -0.39 -1.08 0.00 0.00 179.45 177.93 2jop h VAL 80 N 0.77 1.31 0.00 0.50 -1.51 -1.46 -0.11 116.25 115.74 2jop h VAL 80 Ca 0.24 -1.27 -0.08 0.00 -1.23 0.00 0.00 66.70 64.36 2jop h VAL 80 Cb -0.01 1.60 -0.01 0.00 -2.13 0.00 0.00 31.29 30.73 2jop h VAL 80 CO -0.09 0.40 -0.37 0.00 -1.23 0.00 0.00 177.57 176.28 2jop h GLN 82 N 0.00 0.61 0.00 0.00 5.75 -0.19 0.18 115.11 121.46 2jop h GLN 82 Ca -0.00 -0.07 -0.04 0.00 -0.15 0.00 0.00 58.65 58.39 2jop h GLN 82 Cb 1.15 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 29.57 2jop h GLN 82 CO 0.05 0.47 -0.21 0.00 -2.65 0.00 0.00 178.83 176.49 2jop h ARG 83 N 0.58 0.00 -0.11 1.69 3.08 -0.78 -1.85 114.38 116.99 2jop h ARG 83 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.21 2jop h ARG 83 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.08 2jop h ARG 83 CO -0.03 0.21 0.00 1.28 -1.07 0.00 0.00 179.97 180.36 2jop n LEU 84 N -3.72 0.94 -2.57 3.04 4.77 -0.45 -4.88 117.00 114.12 2jop n LEU 84 Ca -0.01 -0.41 -0.12 0.00 -0.03 0.00 0.00 56.01 55.44 2jop n LEU 84 Cb 0.32 -0.07 -0.00 0.00 -2.33 0.00 0.00 43.42 41.34 2jop n LEU 84 CO 0.33 0.20 -0.12 -0.46 -1.33 0.00 0.00 177.39 176.02 2jop n ASN 85 N -0.13 -3.48 -0.97 -1.43 0.23 -0.47 -4.82 115.26 104.19 2jop n ASN 85 Ca 0.13 0.16 0.08 0.00 -0.53 0.00 0.00 54.58 54.42 2jop n ASN 85 Cb 0.20 -2.97 0.24 0.00 -2.08 0.00 0.00 39.78 35.17 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 0.56 0.40 3.87 0.00 0.00 -1.18 -4.32 105.19 104.52 2jop n GLY 87 Ca 0.18 -0.78 -0.29 0.00 0.00 0.00 0.00 46.02 45.13 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 3.65 0.41 1.61 1.11 -1.26 -1.99 116.67 116.20 2jop s ASP 88 Ca 0.00 0.64 -0.25 0.00 0.18 0.00 0.00 52.55 53.13 2jop s ASP 88 Cb 0.00 -0.99 -0.08 0.00 1.07 0.00 0.00 42.92 42.91 2jop s ASP 88 CO 0.00 -2.43 1.16 -2.16 1.18 0.00 0.00 175.17 172.91 2jop s PRO 89 N -5.61 4.01 -0.28 8.23 0.04 -1.26 -0.63 135.00 139.50 2jop s PRO 89 Ca 0.67 1.79 -0.26 0.00 0.04 0.00 0.00 61.00 63.24 2jop s PRO 89 Cb -0.09 -2.61 -0.11 0.00 0.04 0.00 0.00 34.50 31.72 2jop s PRO 89 CO 0.52 -0.34 1.01 1.47 0.04 0.00 0.00 177.00 179.70 2jop n LEU 90 N -0.04 0.60 -4.84 -3.56 -0.00 -1.25 -0.40 117.00 107.51 2jop n LEU 90 Ca 0.05 0.58 -0.32 0.00 -0.00 0.00 0.00 56.01 56.32 2jop n LEU 90 Cb 0.47 -0.50 -0.01 0.00 -0.00 0.00 0.00 43.42 43.38 2jop n LEU 90 CO 0.49 -0.46 0.70 -0.44 -0.00 0.00 0.00 177.39 177.68 2jop s SER 91 N 2.28 6.24 0.09 1.45 0.01 0.72 -4.30 113.70 120.19 2jop s SER 91 Ca 0.63 1.59 -0.05 0.00 1.31 0.00 0.00 55.95 59.42 2jop s SER 91 Cb -0.85 -2.50 -0.05 0.00 0.21 0.00 0.00 66.02 62.82 2jop s SER 91 CO 0.44 -0.85 0.33 -0.76 0.41 0.00 0.00 173.24 172.81 2jop s LEU 92 N -4.56 4.31 0.00 2.44 1.43 -1.26 -1.07 118.68 119.96 2jop s LEU 92 Ca 0.59 0.57 0.00 0.00 -1.03 0.00 0.00 54.13 54.26 2jop s LEU 92 Cb -0.12 -3.08 0.00 0.00 0.03 0.00 0.00 46.19 43.03 2jop s LEU 92 CO 0.40 0.13 0.00 0.61 0.23 0.00 0.00 176.35 177.72 2jop n GLY 93 N 0.46 1.90 3.68 -3.19 0.00 -0.52 -3.84 105.19 103.67 2jop n GLY 93 Ca -0.05 0.09 -0.49 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.19 1.95 -1.16 1.61 -0.04 -1.26 -0.03 135.00 135.87 2jop n PRO 94 Ca 0.00 0.71 -0.14 0.00 -0.04 0.00 0.00 63.50 64.03 2jop n PRO 94 Cb 0.00 -2.50 0.15 0.00 -0.04 0.00 0.00 33.50 31.11 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 5.39 1.88 0.00 0.54 7.35 0.71 -4.72 117.46 128.60 2jop n PHE 95 Ca 0.22 -1.96 0.00 0.00 -0.76 0.00 0.00 57.45 54.94 2jop n PHE 95 Cb 0.26 -0.64 0.00 0.00 0.35 0.00 0.00 39.48 39.45 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 -1.02 0.00 -3.63 -2.13 4.77 -1.24 -4.48 117.00 109.26 2jop n LEU 96 Ca 0.42 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 56.15 2jop n LEU 96 Cb 1.02 0.00 -0.17 0.00 -2.33 0.00 0.00 43.42 41.94 2jop n LEU 96 CO 0.35 0.00 -0.34 -0.54 -1.33 0.00 0.00 177.39 175.54 2jop s LYS 97 N 0.00 0.10 0.00 3.23 1.02 -1.26 -4.01 119.74 118.82 2jop s LYS 97 Ca 0.00 -0.04 0.00 0.00 0.02 0.00 0.00 55.97 55.95 2jop s LYS 97 Cb 0.00 -1.64 0.00 0.00 -0.52 0.00 0.00 37.83 35.67 2jop s LYS 97 CO 0.00 -0.61 0.00 0.25 -0.92 0.00 0.00 175.35 174.07 2jop n THR 98 N 5.26 0.00 -2.63 2.17 -2.24 -1.26 -5.07 114.28 110.52 2jop n THR 98 Ca -0.07 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.31 2jop n THR 98 Cb 0.49 0.18 -0.04 0.00 -2.10 0.00 0.00 70.33 68.85 2jop n THR 98 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2jop s TYR 99 N 0.00 3.72 -0.12 4.78 5.04 -1.26 -4.99 117.35 124.52 2jop s TYR 99 Ca 0.00 1.71 -0.06 0.00 -2.44 0.00 0.00 57.07 56.29 2jop s TYR 99 Cb 0.00 -3.15 0.05 0.00 0.35 0.00 0.00 41.96 39.21 2jop s TYR 99 CO 0.00 -0.16 0.27 0.99 -1.34 0.00 0.00 175.55 175.31 2jop s THR 100 N -0.21 -0.13 -0.49 4.34 2.01 -1.26 -4.95 115.64 114.96 2jop s THR 100 Ca 0.48 0.17 0.00 0.00 0.31 0.00 0.00 61.69 62.65 2jop s THR 100 Cb -0.26 -0.43 0.00 0.00 0.01 0.00 0.00 72.50 71.82 2jop s THR 100 CO 0.32 0.07 0.32 -2.65 -0.69 0.00 0.00 174.62 171.99 2jop n PRO 101 N 4.49 0.42 -0.08 4.92 -0.02 -1.26 -0.13 135.00 143.33 2jop n PRO 101 Ca -0.21 0.00 -0.17 0.00 -2.02 0.00 0.00 63.50 61.10 2jop n PRO 101 Cb 0.52 -1.25 -0.06 0.00 -0.02 0.00 0.00 33.50 32.70 2jop n PRO 101 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2jop n GLN 102 N 0.55 0.35 0.00 -0.52 6.02 -1.26 -4.82 117.38 117.70 2jop n GLN 102 Ca 0.00 0.15 0.00 0.00 -0.01 0.00 0.00 57.00 57.14 2jop n GLN 102 Cb 0.16 -1.09 0.00 0.00 1.02 0.00 0.00 30.24 30.33 2jop n GLN 102 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2jop n SER 103 N -3.77 0.09 -4.91 1.08 2.88 -1.05 -5.03 113.62 102.92 2jop n SER 103 Ca -0.32 -0.44 -0.30 0.00 -1.33 0.00 0.00 58.87 56.48 2jop n SER 103 Cb 0.71 0.90 -0.04 0.00 -0.75 0.00 0.00 64.21 65.03 2jop n SER 103 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2jop s SER 104 N -0.91 6.46 0.16 -3.46 0.01 0.81 -2.85 113.70 113.92 2jop s SER 104 Ca 0.00 0.56 -0.04 0.00 1.31 0.00 0.00 55.95 57.78 2jop s SER 104 Cb 0.00 -2.08 -0.03 0.00 0.21 0.00 0.00 66.02 64.12 2jop s SER 104 CO 0.00 -0.01 0.16 0.27 0.41 0.00 0.00 173.24 174.08 2jop s ILE 105 N -1.77 0.06 -0.37 1.44 -5.25 0.55 -4.19 121.20 111.68 2jop s ILE 105 Ca 0.41 -1.76 -0.03 0.00 -0.99 0.00 0.00 60.65 58.28 2jop s ILE 105 Cb -0.12 -2.10 0.08 0.00 2.95 0.00 0.00 42.46 43.27 2jop s ILE 105 CO 0.26 -0.29 0.13 -0.63 -1.79 0.00 0.00 174.94 172.63 2jop s ILE 106 N -4.05 3.33 0.66 8.37 1.01 -0.86 -2.54 121.20 127.11 2jop s ILE 106 Ca 0.25 -1.67 -0.08 0.00 0.00 0.00 0.00 60.65 59.15 2jop s ILE 106 Cb 0.06 -3.09 0.02 0.00 0.01 0.00 0.00 42.46 39.46 2jop s ILE 106 CO 0.04 -0.42 0.99 0.00 0.00 0.00 0.00 174.94 175.55 2jop s TYR 108 N -3.17 1.37 0.00 0.00 2.02 -1.25 0.02 117.35 116.33 2jop s TYR 108 Ca 0.57 -1.48 0.00 0.00 -0.37 0.00 0.00 57.07 55.79 2jop s TYR 108 Cb -0.11 -0.61 0.00 0.00 -0.40 0.00 0.00 41.96 40.84 2jop s TYR 108 CO 0.47 -0.72 0.00 0.41 -1.57 0.00 0.00 175.55 174.14 2jop n GLY 109 N -0.39 0.48 3.77 0.71 0.00 -1.25 -4.63 105.19 103.87 2jop n GLY 109 Ca 0.04 -1.67 -0.36 0.00 0.00 0.00 0.00 46.02 44.02 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 4.06 -0.53 1.61 2.00 -1.26 -4.52 119.66 121.02 2jop s GLN 110 Ca 0.00 0.04 -0.27 0.00 -2.00 0.00 0.00 55.36 53.13 2jop s GLN 110 Cb 0.00 -3.36 -0.09 0.00 0.80 0.00 0.00 33.01 30.36 2jop s GLN 110 CO 0.00 0.40 2.43 -0.11 -0.50 0.00 0.00 175.29 177.51 2jop n LEU 111 N 3.07 2.10 0.00 3.68 7.94 -1.26 -0.24 117.00 132.29 2jop n LEU 111 Ca -0.14 -0.30 0.00 0.00 -1.11 0.00 0.00 56.01 54.46 2jop n LEU 111 Cb 0.52 -1.47 0.00 0.00 0.53 0.00 0.00 43.42 43.00 2jop n LEU 111 CO 0.38 -1.33 0.00 0.61 -1.11 0.00 0.00 177.39 175.93 2jop n GLY 112 N 6.09 1.49 3.36 -3.96 0.00 -1.26 -5.01 105.19 105.90 2jop n GLY 112 Ca 0.41 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.97 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 -0.87 6.90 -0.04 1.61 1.04 0.67 -3.86 113.70 119.14 2jop s SER 113 Ca 0.00 -2.83 0.02 0.00 0.48 0.00 0.00 55.95 53.62 2jop s SER 113 Cb 0.00 -2.25 0.12 0.00 0.10 0.00 0.00 66.02 63.99 2jop s SER 113 CO 0.00 -0.59 0.78 0.49 0.98 0.00 0.00 173.24 174.90 2jop n PHE 114 N 4.18 0.35 0.05 5.02 3.01 0.41 -3.96 117.46 126.52 2jop n PHE 114 Ca 0.19 -0.23 -0.08 0.00 1.01 0.00 0.00 57.45 58.35 2jop n PHE 114 Cb 0.45 -0.20 0.07 0.00 -0.01 0.00 0.00 39.48 39.79 2jop n PHE 114 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 2jop h SER 115 N 0.53 0.44 -4.74 4.37 0.87 -1.89 -3.46 113.55 109.67 2jop h SER 115 Ca 0.02 -0.26 -0.20 0.00 -1.23 0.00 0.00 61.79 60.12 2jop h SER 115 Cb 0.84 -0.13 -0.22 0.00 -0.44 0.00 0.00 62.40 62.45 2jop h SER 115 CO 0.10 0.96 -0.71 0.20 -0.53 0.00 0.00 176.83 176.84 2jop s ASN 116 N -6.93 0.32 0.00 6.23 0.01 -1.25 -5.16 114.94 108.16 2jop s ASN 116 Ca -0.05 -0.43 0.00 0.00 -0.71 0.00 0.00 52.86 51.67 2jop s ASN 116 Cb 0.11 0.07 0.00 0.00 0.41 0.00 0.00 41.25 41.84 2jop s ASN 116 CO 0.82 -0.23 0.00 0.00 -1.51 0.00 0.00 177.10 176.18 2jop s SER 118 N 0.84 -0.09 0.52 0.00 0.01 -0.02 -4.71 113.70 110.26 2jop s SER 118 Ca 0.00 -0.20 -0.18 0.00 1.31 0.00 0.00 55.95 56.88 2jop s SER 118 Cb 0.00 0.33 -0.07 0.00 0.21 0.00 0.00 66.02 66.49 2jop s SER 118 CO 0.00 -0.57 1.02 -2.28 0.41 0.00 0.00 173.24 171.82 2jop s HIS 119 N -2.38 3.13 0.00 2.43 2.46 -1.26 -2.03 115.29 117.65 2jop s HIS 119 Ca -0.06 1.53 -0.02 0.00 0.47 0.00 0.00 55.06 56.98 2jop s HIS 119 Cb -0.02 -2.96 -0.11 0.00 -0.13 0.00 0.00 32.58 29.37 2jop s HIS 119 CO -0.02 -0.75 2.23 -1.13 -2.47 0.00 0.00 174.74 172.60 2jop n SER 120 N -1.45 4.00 -0.00 9.88 3.41 -1.26 -3.10 113.62 125.10 2jop n SER 120 Ca 0.08 -2.16 -0.00 0.00 -0.26 0.00 0.00 58.87 56.53 2jop n SER 120 Cb 0.53 -0.97 -0.00 0.00 -0.26 0.00 0.00 64.21 63.51 2jop n SER 120 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 2jop n ARG 121 N 2.15 2.33 0.09 4.33 1.85 -1.26 -4.67 116.66 121.49 2jop n ARG 121 Ca 0.17 -0.00 0.10 0.00 -1.00 0.00 0.00 57.85 57.12 2jop n ARG 121 Cb 0.55 -1.00 0.43 0.00 -1.05 0.00 0.00 32.46 31.38 2jop n ARG 121 CO 0.00 0.00 0.00 0.27 -0.01 0.00 0.00 177.63 177.89 2jop n ASN 122 N -1.80 0.45 -3.64 2.89 2.04 -1.18 -4.80 115.26 109.23 2jop n ASN 122 Ca -0.00 0.62 -0.03 0.00 -0.44 0.00 0.00 54.58 54.73 2jop n ASN 122 Cb 0.29 -0.71 -0.02 0.00 -2.53 0.00 0.00 39.78 36.81 2jop n ASN 122 CO 0.00 0.00 0.00 -0.62 -0.44 0.00 0.00 177.26 176.20 2jop s ASP 123 N -3.84 -0.03 -0.56 0.53 -1.08 -1.26 -5.11 116.67 105.32 2jop s ASP 123 Ca 0.04 0.00 -0.04 0.00 -0.52 0.00 0.00 52.55 52.04 2jop s ASP 123 Cb 0.09 0.03 0.14 0.00 -1.46 0.00 0.00 42.92 41.73 2jop s ASP 123 CO 0.33 -0.05 0.37 -0.04 0.52 0.00 0.00 175.17 176.30 2jop s MET 124 N -2.04 2.42 -0.01 4.34 -1.94 -1.26 -4.79 119.30 116.01 2jop s MET 124 Ca 0.11 -2.26 -0.30 0.00 -1.71 0.00 0.00 55.69 51.53 2jop s MET 124 Cb -0.01 -3.72 -0.05 0.00 2.01 0.00 0.00 34.83 33.05 2jop s MET 124 CO -0.03 -1.15 1.42 0.00 -0.01 0.00 0.00 175.02 175.25 2jop s HIS 126 N 2.61 2.37 -0.68 0.00 3.76 -1.26 -4.81 115.29 117.28 2jop s HIS 126 Ca 0.64 1.33 -0.26 0.00 -0.15 0.00 0.00 55.06 56.62 2jop s HIS 126 Cb -0.31 -3.84 -0.09 0.00 1.11 0.00 0.00 32.58 29.44 2jop s HIS 126 CO 0.26 -2.88 2.30 -1.12 -0.85 0.00 0.00 174.74 172.44 2jop s SER 127 N -0.77 4.36 -0.08 1.40 0.01 -1.26 -4.92 113.70 112.45 2jop s SER 127 Ca 0.67 0.34 -0.24 0.00 1.31 0.00 0.00 55.95 58.03 2jop s SER 127 Cb -0.42 -2.53 -0.03 0.00 0.21 0.00 0.00 66.02 63.25 2jop s SER 127 CO 0.51 -3.25 0.72 -0.76 0.41 0.00 0.00 173.24 170.87 2jop s LEU 128 N 12.77 4.30 -0.13 2.44 1.43 -1.25 -0.21 118.68 138.03 2jop s LEU 128 Ca 0.89 1.19 -0.04 0.00 -1.03 0.00 0.00 54.13 55.14 2jop s LEU 128 Cb -0.13 -3.10 -0.03 0.00 0.03 0.00 0.00 46.19 42.95 2jop s LEU 128 CO 0.14 -0.15 0.00 -0.83 0.23 0.00 0.00 176.35 175.74 2jop s GLY 129 N 0.85 1.82 0.13 -3.19 0.00 0.95 -4.49 107.32 103.40 2jop s GLY 129 Ca 0.38 -0.79 0.02 0.00 0.00 0.00 0.00 44.72 44.33 2jop s GLY 129 CO 0.18 -0.26 0.24 1.08 0.00 0.00 0.00 173.10 174.34 2jop s LEU 130 N -0.20 4.27 -0.28 0.66 1.43 -0.64 -1.44 118.68 122.48 2jop s LEU 130 Ca 0.05 0.15 -0.01 0.00 -1.03 0.00 0.00 54.13 53.30 2jop s LEU 130 Cb -0.12 -2.85 0.17 0.00 0.03 0.00 0.00 46.19 43.41 2jop s LEU 130 CO 0.02 0.08 0.49 0.28 0.23 0.00 0.00 176.35 177.45 2jop s THR 131 N -1.68 -0.80 -0.37 5.49 -1.32 -0.24 -0.28 115.64 116.44 2jop s THR 131 Ca 0.34 -0.06 -0.39 0.00 -1.21 0.00 0.00 61.69 60.37 2jop s THR 131 Cb -0.11 -0.93 -0.15 0.00 -1.51 0.00 0.00 72.50 69.80 2jop s THR 131 CO 0.28 -0.08 2.04 0.00 -2.21 0.00 0.00 174.62 174.64 2jop n LEU 133 N 7.88 0.00 0.00 0.00 7.94 0.46 -4.61 117.00 128.67 2jop n LEU 133 Ca 0.40 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.30 2jop n LEU 133 Cb 0.13 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.08 2jop n LEU 133 CO 0.81 0.00 0.00 -1.84 -1.11 0.00 0.00 177.39 175.25