#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jop s ILE 2 N 0.00 2.77 0.01 1.12 1.01 -0.52 -4.96 121.20 120.64 1jop s ILE 2 Ca 0.00 -0.88 0.02 0.00 0.00 0.00 0.00 60.65 59.79 1jop s ILE 2 Cb 0.00 -2.07 -0.01 0.00 0.01 0.00 0.00 42.46 40.39 1jop s ILE 2 CO 0.00 0.56 -0.07 -0.63 0.00 0.00 0.00 174.94 174.80 1jop s ILE 3 N -0.73 0.51 0.00 2.92 1.01 -1.26 0.53 121.20 124.18 1jop s ILE 3 Ca 0.12 -0.52 0.00 0.00 0.00 0.00 0.00 60.65 60.25 1jop s ILE 3 Cb -0.10 -0.48 0.00 0.00 0.01 0.00 0.00 42.46 41.89 1jop s ILE 3 CO 0.01 -0.02 0.00 -0.24 0.00 0.00 0.00 174.94 174.69 1jop n SER 4 N 2.47 0.00 -3.74 3.58 2.88 -0.87 -4.98 113.62 112.96 1jop n SER 4 Ca -0.16 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.26 1jop n SER 4 Cb 0.57 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.92 1jop n SER 4 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1jop s SER 5 N 0.00 -0.37 0.08 -3.46 0.15 -1.26 0.90 113.70 109.74 1jop s SER 5 Ca 0.00 0.70 0.08 0.00 0.70 0.00 0.00 55.95 57.43 1jop s SER 5 Cb 0.00 0.65 0.38 0.00 -1.71 0.00 0.00 66.02 65.34 1jop s SER 5 CO 0.00 -0.15 1.24 0.18 1.20 0.00 0.00 173.24 175.72 1jop n LEU 6 N 3.55 0.15 -0.21 3.45 4.77 0.30 -1.10 117.00 127.90 1jop n LEU 6 Ca -0.18 0.56 0.01 0.00 -0.03 0.00 0.00 56.01 56.37 1jop n LEU 6 Cb 0.56 -0.57 0.12 0.00 -2.33 0.00 0.00 43.42 41.20 1jop n LEU 6 CO 0.13 -0.56 0.97 0.74 -1.33 0.00 0.00 177.39 177.34 1jop h THR 7 N 0.00 0.71 -3.20 -5.08 2.02 -1.95 -3.41 112.91 102.01 1jop h THR 7 Ca 0.00 -0.12 -0.54 0.00 0.77 0.00 0.00 66.41 66.52 1jop h THR 7 Cb 0.06 0.31 -0.00 0.00 -1.74 0.00 0.00 68.15 66.78 1jop h THR 7 CO 0.00 0.07 0.56 0.21 0.37 0.00 0.00 175.52 176.73 1jop s ASN 8 N -5.35 7.10 0.47 4.18 3.84 -0.26 -4.88 114.94 120.03 1jop s ASN 8 Ca -0.13 1.97 0.27 0.00 0.21 0.00 0.00 52.86 55.18 1jop s ASN 8 Cb 0.18 -2.58 0.94 0.00 -0.55 0.00 0.00 41.25 39.24 1jop s ASN 8 CO 0.75 -0.47 1.83 1.55 -2.79 0.00 0.00 177.10 177.97 1jop h PRO 9 N 6.87 0.00 -0.65 0.43 0.13 -1.87 -2.42 132.00 134.48 1jop h PRO 9 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1jop h PRO 9 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1jop h PRO 9 CO 0.81 0.13 0.00 0.09 -0.23 0.00 0.00 178.00 178.81 1jop n ASN 10 N -3.24 4.30 0.12 1.44 3.02 -1.26 -4.67 115.26 114.97 1jop n ASN 10 Ca 0.01 -2.34 0.09 0.00 -0.03 0.00 0.00 54.58 52.31 1jop n ASN 10 Cb 0.42 -0.54 0.14 0.00 -0.61 0.00 0.00 39.78 39.19 1jop n ASN 10 CO 0.00 0.00 0.00 2.22 -2.62 0.00 0.00 177.26 176.86 1jop n PHE 11 N 1.11 0.00 0.90 3.10 1.16 -0.91 0.19 117.46 123.00 1jop n PHE 11 Ca 0.24 0.00 0.13 0.00 -1.87 0.00 0.00 57.45 55.95 1jop n PHE 11 Cb 0.79 -0.09 0.56 0.00 -1.61 0.00 0.00 39.48 39.13 1jop n PHE 11 CO 0.00 0.00 0.00 1.63 -1.87 0.00 0.00 176.76 176.52 1jop n LYS 12 N -2.63 0.04 -1.63 3.97 5.02 -1.26 -4.68 118.16 116.99 1jop n LYS 12 Ca 0.08 0.06 -0.43 0.00 -2.02 0.00 0.00 58.31 55.99 1jop n LYS 12 Cb 1.11 -1.55 -0.03 0.00 -0.02 0.00 0.00 35.03 34.53 1jop n LYS 12 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1jop n VAL 13 N -1.63 0.59 -0.36 -0.18 0.31 0.50 -2.46 118.33 115.09 1jop n VAL 13 Ca 0.06 -0.25 0.00 0.00 -0.01 0.00 0.00 64.34 64.14 1jop n VAL 13 Cb 0.34 -2.33 0.00 0.00 -0.91 0.00 0.00 33.84 30.94 1jop n VAL 13 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1jop n GLY 14 N 5.02 2.03 3.75 2.92 0.00 -1.26 -4.98 105.19 112.66 1jop n GLY 14 Ca 0.24 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.85 1jop n GLY 14 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jop s LEU 15 N 0.00 4.40 0.87 0.99 1.43 -1.03 -4.97 118.68 120.38 1jop s LEU 15 Ca 0.00 2.58 -0.12 0.00 -1.03 0.00 0.00 54.13 55.56 1jop s LEU 15 Cb 0.00 -3.62 0.10 0.00 0.03 0.00 0.00 46.19 42.69 1jop s LEU 15 CO 0.00 -0.61 1.00 -2.65 0.23 0.00 0.00 176.35 174.33 1jop n PRO 16 N 2.17 -0.16 -0.21 1.29 -0.02 -1.26 -4.81 135.00 132.00 1jop n PRO 16 Ca 0.05 0.02 -0.08 0.00 -2.02 0.00 0.00 63.50 61.47 1jop n PRO 16 Cb 0.41 -2.28 0.02 0.00 -0.02 0.00 0.00 33.50 31.64 1jop n PRO 16 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1jop h LYS 17 N -1.41 0.96 -0.53 -0.52 1.57 -1.93 -2.52 116.57 112.19 1jop h LYS 17 Ca -0.44 -0.24 0.04 0.00 -1.87 0.00 0.00 60.65 58.13 1jop h LYS 17 Cb 1.29 -0.12 -0.04 0.00 0.08 0.00 0.00 32.23 33.44 1jop h LYS 17 CO 0.42 0.90 0.29 0.28 -0.57 0.00 0.00 179.45 180.76 1jop h VAL 18 N 0.87 0.99 0.00 0.50 2.07 -1.92 0.27 116.25 119.02 1jop h VAL 18 Ca 0.18 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 67.49 1jop h VAL 18 Cb 0.39 0.37 -0.00 0.00 -1.52 0.00 0.00 31.29 30.53 1jop h VAL 18 CO 0.01 0.10 -0.09 0.40 0.02 0.00 0.00 177.57 178.01 1jop h ILE 19 N 0.56 0.36 0.00 4.57 2.04 -1.82 -1.00 117.51 122.23 1jop h ILE 19 Ca 0.23 -0.51 -0.02 0.00 1.00 0.00 0.00 64.86 65.55 1jop h ILE 19 Cb 0.11 1.37 -0.00 0.00 -0.74 0.00 0.00 36.82 37.55 1jop h ILE 19 CO -0.14 0.09 -0.14 0.00 0.00 0.00 0.00 178.15 177.96 1jop h ALA 20 N 1.91 0.03 -0.94 1.87 0.00 -0.22 -1.83 119.26 120.07 1jop h ALA 20 Ca -0.00 -0.48 0.40 0.00 0.00 0.00 0.00 54.91 54.83 1jop h ALA 20 Cb 0.36 0.09 -0.17 0.00 0.00 0.00 0.00 17.79 18.07 1jop h ALA 20 CO 0.01 0.08 0.51 0.39 0.00 0.00 0.00 179.25 180.24 1jop n GLU 21 N -4.62 -0.06 -0.03 0.00 1.02 -0.06 -0.63 120.64 116.25 1jop n GLU 21 Ca -0.10 1.30 -0.15 0.00 -0.02 0.00 0.00 57.16 58.19 1jop n GLU 21 Cb 0.41 -2.34 -0.12 0.00 -0.02 0.00 0.00 31.44 29.37 1jop n GLU 21 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1jop h VAL 22 N 0.00 1.59 -0.88 2.62 2.07 -1.01 -1.76 116.25 118.89 1jop h VAL 22 Ca 0.80 -1.99 0.21 0.00 0.82 0.00 0.00 66.70 66.54 1jop h VAL 22 Cb 2.12 2.89 -0.12 0.00 -1.52 0.00 0.00 31.29 34.65 1jop h VAL 22 CO -0.73 0.54 0.36 0.00 0.02 0.00 0.00 177.57 177.76 1jop h ASP 24 N 0.39 -0.36 -0.77 0.00 3.32 -0.76 -0.13 116.42 118.11 1jop h ASP 24 Ca 0.54 0.03 0.07 0.00 0.02 0.00 0.00 57.03 57.69 1jop h ASP 24 Cb 1.00 0.12 -0.09 0.00 0.22 0.00 0.00 39.33 40.58 1jop h ASP 24 CO -0.52 -0.17 -0.46 0.00 -1.72 0.00 0.00 179.24 176.37 1jop n TYR 25 N -3.09 -0.34 -0.30 4.55 9.36 -0.67 -0.68 117.16 125.98 1jop n TYR 25 Ca -0.03 0.97 0.03 0.00 3.32 0.00 0.00 57.90 62.19 1jop n TYR 25 Cb 0.12 -0.55 0.17 0.00 -0.63 0.00 0.00 39.34 38.44 1jop n TYR 25 CO 0.00 0.00 0.00 -0.07 0.22 0.00 0.00 176.86 177.01 1jop h LEU 26 N 0.00 0.72 0.00 2.98 3.38 0.20 0.28 115.31 122.86 1jop h LEU 26 Ca 0.12 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1jop h LEU 26 Cb 0.32 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1jop h LEU 26 CO -0.73 0.41 0.00 0.59 0.09 0.00 0.00 178.44 178.81 1jop n ASN 27 N -4.72 0.00 -1.56 -0.43 3.02 0.14 -1.31 115.26 110.41 1jop n ASN 27 Ca 0.14 0.13 0.08 0.00 -0.03 0.00 0.00 54.58 54.90 1jop n ASN 27 Cb 0.27 -0.23 0.34 0.00 -0.61 0.00 0.00 39.78 39.54 1jop n ASN 27 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 1jop n THR 28 N -1.23 1.93 -4.22 3.41 -1.04 0.97 -4.94 114.28 109.15 1jop n THR 28 Ca 0.03 -1.11 -0.14 0.00 -2.04 0.00 0.00 64.05 60.78 1jop n THR 28 Cb 0.04 -0.07 -0.05 0.00 -1.82 0.00 0.00 70.33 68.43 1jop n THR 28 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1jop n LEU 29 N 0.83 0.00 -3.15 -4.42 4.77 -0.43 -5.05 117.00 109.55 1jop n LEU 29 Ca 0.24 -2.17 -0.30 0.00 -0.03 0.00 0.00 56.01 53.74 1jop n LEU 29 Cb 0.91 1.06 -0.03 0.00 -2.33 0.00 0.00 43.42 43.04 1jop n LEU 29 CO 0.24 -0.36 0.45 -0.67 -1.33 0.00 0.00 177.39 175.72 1jop n ASP 30 N -2.02 5.12 -0.26 -1.43 -0.08 -1.26 -4.87 116.55 111.74 1jop n ASP 30 Ca 0.03 -3.67 0.22 0.00 -1.51 0.00 0.00 54.79 49.87 1jop n ASP 30 Cb 0.42 -0.72 0.34 0.00 2.34 0.00 0.00 41.12 43.50 1jop n ASP 30 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1jop n LEU 31 N -0.10 0.00 -0.02 -2.67 4.77 -1.26 0.26 117.00 117.98 1jop n LEU 31 Ca 0.34 0.45 -0.10 0.00 -0.03 0.00 0.00 56.01 56.67 1jop n LEU 31 Cb 0.36 -0.20 -0.09 0.00 -2.33 0.00 0.00 43.42 41.16 1jop n LEU 31 CO 0.39 -0.45 0.35 0.78 -1.33 0.00 0.00 177.39 177.13 1jop h ASN 32 N 0.00 -0.07 0.00 -1.43 2.35 -1.93 -3.19 115.58 111.31 1jop h ASN 32 Ca 0.39 -0.55 0.00 0.00 -0.55 0.00 0.00 56.30 55.59 1jop h ASN 32 Cb 1.72 0.02 0.00 0.00 0.05 0.00 0.00 38.32 40.11 1jop h ASN 32 CO -0.00 0.64 0.01 0.00 -1.65 0.00 0.00 177.43 176.43 1jop h ALA 33 N -0.23 1.01 -1.05 -0.83 0.00 0.31 -3.44 119.26 115.04 1jop h ALA 33 Ca -0.01 0.00 -0.80 0.00 0.00 0.00 0.00 54.91 54.10 1jop h ALA 33 Cb 0.61 0.00 0.04 0.00 0.00 0.00 0.00 17.79 18.45 1jop h ALA 33 CO 0.01 -0.01 0.20 1.28 0.00 0.00 0.00 179.25 180.73 1jop n LEU 34 N -2.99 0.33 -4.71 0.00 4.77 -0.82 -4.83 117.00 108.75 1jop n LEU 34 Ca -0.03 1.16 -0.42 0.00 -0.03 0.00 0.00 56.01 56.69 1jop n LEU 34 Cb 0.08 -0.93 -0.03 0.00 -2.33 0.00 0.00 43.42 40.21 1jop n LEU 34 CO 0.19 -1.66 1.19 -1.61 -1.33 0.00 0.00 177.39 174.17 1jop s GLU 35 N 0.59 4.25 0.19 3.23 2.02 -1.26 -4.94 118.70 122.78 1jop s GLU 35 Ca 0.93 2.23 -0.33 0.00 0.02 0.00 0.00 54.97 57.83 1jop s GLU 35 Cb -1.29 -3.30 -0.15 0.00 0.10 0.00 0.00 34.13 29.49 1jop s GLU 35 CO 0.61 -0.57 1.30 0.09 0.02 0.00 0.00 175.26 176.71 1jop n ASN 36 N 4.38 2.03 0.00 -0.19 3.02 -1.26 -4.67 115.26 118.56 1jop n ASN 36 Ca 0.13 1.14 0.00 0.00 -0.03 0.00 0.00 54.58 55.82 1jop n ASN 36 Cb 0.40 -1.31 0.00 0.00 -0.61 0.00 0.00 39.78 38.27 1jop n ASN 36 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1jop n GLY 37 N 2.22 0.30 3.60 7.41 0.00 0.32 -4.95 105.19 114.09 1jop n GLY 37 Ca 0.14 -2.30 -0.43 0.00 0.00 0.00 0.00 46.02 43.44 1jop n GLY 37 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1jop s ARG 38 N -0.16 3.77 0.00 1.61 3.52 -1.26 -1.68 118.95 124.76 1jop s ARG 38 Ca 0.00 0.53 0.05 0.00 -0.13 0.00 0.00 55.73 56.19 1jop s ARG 38 Cb 0.00 -3.85 -0.03 0.00 -1.56 0.00 0.00 34.95 29.51 1jop s ARG 38 CO 0.00 -1.10 -0.15 -1.01 -0.81 0.00 0.00 175.30 172.23 1jop s HIS 39 N 3.76 2.64 -0.03 5.12 3.76 0.10 -4.98 115.29 125.67 1jop s HIS 39 Ca 0.41 -0.20 -0.02 0.00 -0.15 0.00 0.00 55.06 55.10 1jop s HIS 39 Cb -0.11 -1.54 -0.04 0.00 1.11 0.00 0.00 32.58 32.01 1jop s HIS 39 CO 0.23 0.23 0.08 -0.51 -0.85 0.00 0.00 174.74 173.92 1jop s ASP 40 N -1.17 5.74 -0.14 1.40 1.01 -1.26 -1.54 116.67 120.72 1jop s ASP 40 Ca 0.14 0.20 0.02 0.00 0.71 0.00 0.00 52.55 53.61 1jop s ASP 40 Cb -0.11 -1.68 -0.09 0.00 1.01 0.00 0.00 42.92 42.05 1jop s ASP 40 CO 0.04 0.31 -0.11 -0.38 0.21 0.00 0.00 175.17 175.23 1jop n ILE 41 N 1.42 0.79 -2.83 0.77 2.08 0.12 -4.98 119.36 116.74 1jop n ILE 41 Ca -0.15 -0.31 0.00 0.00 0.56 0.00 0.00 62.75 62.85 1jop n ILE 41 Cb 0.53 -0.97 0.00 0.00 -0.75 0.00 0.00 39.64 38.45 1jop n ILE 41 CO 0.00 0.00 0.00 0.59 0.56 0.00 0.00 176.55 177.70 1jop n ASN 42 N -2.87 0.33 0.20 4.38 4.13 -0.78 -4.94 115.26 115.71 1jop n ASN 42 Ca -0.24 0.00 0.12 0.00 1.68 0.00 0.00 54.58 56.14 1jop n ASN 42 Cb 0.77 0.00 0.19 0.00 -1.54 0.00 0.00 39.78 39.19 1jop n ASN 42 CO 0.00 0.00 0.00 -2.24 0.28 0.00 0.00 177.26 175.30 1jop h ASP 43 N 0.00 0.00 0.00 6.41 2.03 -2.05 -3.41 116.42 119.40 1jop h ASP 43 Ca 0.00 -0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1jop h ASP 43 Cb 0.00 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.50 1jop h ASP 43 CO 0.00 0.00 -0.69 0.00 -1.03 0.00 0.00 179.24 177.52 1jop n GLN 44 N -3.00 2.15 -4.77 4.15 6.02 -1.26 -5.06 117.38 115.62 1jop n GLN 44 Ca 0.04 0.00 -0.33 0.00 -0.01 0.00 0.00 57.00 56.70 1jop n GLN 44 Cb 0.52 -0.84 -0.15 0.00 1.02 0.00 0.00 30.24 30.79 1jop n GLN 44 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1jop s ILE 45 N -1.48 2.92 0.00 5.09 1.01 -1.26 -4.65 121.20 122.83 1jop s ILE 45 Ca 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 60.65 59.95 1jop s ILE 45 Cb 0.00 -2.22 0.00 0.00 0.01 0.00 0.00 42.46 40.25 1jop s ILE 45 CO 0.00 0.52 0.00 0.00 0.00 0.00 0.00 174.94 175.46 1jop n TYR 46 N 3.62 0.00 -3.29 3.97 4.11 -1.01 0.14 117.16 124.71 1jop n TYR 46 Ca -0.18 0.00 0.03 0.00 -0.00 0.00 0.00 57.90 57.75 1jop n TYR 46 Cb 0.53 0.00 -0.03 0.00 -0.00 0.00 0.00 39.34 39.83 1jop n TYR 46 CO 0.00 0.00 0.00 1.41 -0.00 0.00 0.00 176.86 178.27 1jop s MET 47 N 1.35 0.20 -0.20 -3.48 1.75 -0.59 0.18 119.30 118.51 1jop s MET 47 Ca 0.00 0.48 -0.03 0.00 -1.25 0.00 0.00 55.69 54.89 1jop s MET 47 Cb 0.00 0.29 -0.01 0.00 2.84 0.00 0.00 34.83 37.94 1jop s MET 47 CO 0.00 -0.10 -0.05 -0.80 -0.65 0.00 0.00 175.02 173.42 1jop s ASN 48 N 2.45 4.41 -0.22 1.11 0.01 0.40 0.03 114.94 123.14 1jop s ASN 48 Ca -0.01 -0.31 -0.10 0.00 -0.71 0.00 0.00 52.86 51.72 1jop s ASN 48 Cb -0.06 -1.74 -0.05 0.00 0.41 0.00 0.00 41.25 39.81 1jop s ASN 48 CO -0.16 0.05 0.15 -0.69 -1.51 0.00 0.00 177.10 174.93 1jop s VAL 49 N 1.09 5.39 0.06 1.60 1.01 -0.68 0.12 120.40 128.99 1jop s VAL 49 Ca 0.01 0.19 0.04 0.00 0.00 0.00 0.00 61.98 62.22 1jop s VAL 49 Cb -0.15 -3.49 -0.03 0.00 0.00 0.00 0.00 36.38 32.72 1jop s VAL 49 CO -0.00 0.40 -0.12 -0.04 0.00 0.00 0.00 175.10 175.34 1jop s MET 50 N 0.67 0.72 -0.08 2.72 1.00 -0.55 -0.52 119.30 123.25 1jop s MET 50 Ca 0.08 -0.86 0.03 0.00 0.00 0.00 0.00 55.69 54.94 1jop s MET 50 Cb -0.12 -0.64 0.01 0.00 0.00 0.00 0.00 34.83 34.08 1jop s MET 50 CO 0.01 0.14 -0.15 -1.21 0.00 0.00 0.00 175.02 173.80 1jop s GLU 51 N -1.61 2.11 0.45 2.03 2.02 -1.26 -0.84 118.70 121.60 1jop s GLU 51 Ca -0.04 -0.55 -0.07 0.00 0.02 0.00 0.00 54.97 54.33 1jop s GLU 51 Cb -0.10 -1.71 0.11 0.00 0.10 0.00 0.00 34.13 32.54 1jop s GLU 51 CO 0.01 0.04 0.25 -0.35 0.02 0.00 0.00 175.26 175.24 1jop n PRO 52 N 3.83 -2.50 -0.05 0.39 -0.04 -1.26 -5.06 135.00 130.31 1jop n PRO 52 Ca -0.21 -0.43 -0.02 0.00 -0.04 0.00 0.00 63.50 62.80 1jop n PRO 52 Cb 0.52 -0.58 0.00 0.00 -0.04 0.00 0.00 33.50 33.40 1jop n PRO 52 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 1jop n LYS 61 N -2.86 0.00 -2.55 0.54 2.85 -1.26 -5.14 118.16 109.74 1jop n LYS 61 Ca 0.04 0.00 -0.35 0.00 -1.05 0.00 0.00 58.31 56.96 1jop n LYS 61 Cb 0.18 -0.05 -0.04 0.00 -0.65 0.00 0.00 35.03 34.47 1jop n LYS 61 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1jop s ALA 62 N -0.10 2.92 0.01 0.58 0.00 0.11 -4.76 121.76 120.52 1jop s ALA 62 Ca 0.02 0.62 0.01 0.00 0.00 0.00 0.00 51.96 52.61 1jop s ALA 62 Cb -0.00 -3.25 -0.01 0.00 0.00 0.00 0.00 23.12 19.85 1jop s ALA 62 CO 0.04 -0.28 -0.04 -2.00 0.00 0.00 0.00 175.76 173.49 1jop s GLU 63 N -3.07 0.31 0.38 0.00 2.12 0.18 -1.72 118.70 116.90 1jop s GLU 63 Ca 0.65 -0.31 0.04 0.00 0.36 0.00 0.00 54.97 55.71 1jop s GLU 63 Cb -0.17 -0.19 -0.05 0.00 0.26 0.00 0.00 34.13 33.98 1jop s GLU 63 CO 0.21 0.04 0.07 -0.48 -0.54 0.00 0.00 175.26 174.56 1jop s LEU 64 N -0.58 2.20 0.05 2.70 -0.00 0.54 -0.52 118.68 123.08 1jop s LEU 64 Ca -0.04 -1.50 -0.05 0.00 -0.00 0.00 0.00 54.13 52.55 1jop s LEU 64 Cb -0.04 -0.39 -0.02 0.00 -0.00 0.00 0.00 46.19 45.74 1jop s LEU 64 CO -0.00 -0.72 0.09 -1.00 -0.00 0.00 0.00 176.35 174.72 1jop s HIS 65 N -3.17 0.28 -0.00 3.48 3.76 -1.26 -0.59 115.29 117.79 1jop s HIS 65 Ca 0.29 -0.68 0.01 0.00 -0.15 0.00 0.00 55.06 54.53 1jop s HIS 65 Cb 0.06 -0.19 -0.02 0.00 1.11 0.00 0.00 32.58 33.55 1jop s HIS 65 CO 0.14 -0.42 0.02 0.72 -0.85 0.00 0.00 174.74 174.36 1jop n HIS 66 N 0.37 0.00 0.00 1.40 8.25 -1.26 -0.64 115.22 123.33 1jop n HIS 66 Ca -0.17 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.29 1jop n HIS 66 Cb 0.60 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.68 1jop n HIS 66 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1jop n GLU 67 N -1.61 4.24 -4.96 -0.41 1.02 -1.26 -4.87 120.64 112.78 1jop n GLU 67 Ca -0.00 0.00 -0.32 0.00 -0.02 0.00 0.00 57.16 56.81 1jop n GLU 67 Cb 0.10 -0.63 -0.14 0.00 -0.02 0.00 0.00 31.44 30.76 1jop n GLU 67 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1jop s TYR 68 N -0.56 2.63 0.16 -0.32 1.51 -1.26 -0.66 117.35 118.85 1jop s TYR 68 Ca 0.00 -0.21 -0.26 0.00 -1.01 0.00 0.00 57.07 55.59 1jop s TYR 68 Cb 0.00 -1.60 -0.08 0.00 -0.11 0.00 0.00 41.96 40.17 1jop s TYR 68 CO 0.00 0.15 0.79 -0.48 -1.11 0.00 0.00 175.55 174.89 1jop s LEU 69 N -0.74 4.59 -0.44 -1.29 0.05 0.17 -4.14 118.68 116.88 1jop s LEU 69 Ca 0.11 1.66 -0.24 0.00 0.05 0.00 0.00 54.13 55.71 1jop s LEU 69 Cb -0.10 -3.31 0.02 0.00 -2.05 0.00 0.00 46.19 40.75 1jop s LEU 69 CO 0.00 0.20 0.83 -1.81 -0.55 0.00 0.00 176.35 175.02 1jop s ASP 70 N -1.09 6.46 -0.44 1.48 1.01 -0.47 -1.45 116.67 122.17 1jop s ASP 70 Ca 0.36 0.03 -0.29 0.00 0.71 0.00 0.00 52.55 53.36 1jop s ASP 70 Cb -0.23 -2.41 0.02 0.00 1.01 0.00 0.00 42.92 41.31 1jop s ASP 70 CO 0.26 -0.93 1.24 -0.69 0.21 0.00 0.00 175.17 175.27 1jop s VAL 71 N 3.40 4.11 -0.35 -1.27 1.01 -0.46 -1.49 120.40 125.35 1jop s VAL 71 Ca 0.32 1.15 -0.09 0.00 0.00 0.00 0.00 61.98 63.36 1jop s VAL 71 Cb -0.12 -4.43 0.03 0.00 0.00 0.00 0.00 36.38 31.86 1jop s VAL 71 CO 0.23 -0.87 0.16 -1.10 0.00 0.00 0.00 175.10 173.53 1jop s GLN 72 N 4.57 2.82 -0.15 2.72 -0.21 0.31 -1.29 119.66 128.43 1jop s GLN 72 Ca 0.53 -1.07 -0.06 0.00 0.02 0.00 0.00 55.36 54.79 1jop s GLN 72 Cb -0.10 -3.61 -0.04 0.00 1.00 0.00 0.00 33.01 30.26 1jop s GLN 72 CO 0.31 -0.65 0.04 0.08 -2.12 0.00 0.00 175.29 172.95 1jop s VAL 73 N 1.51 4.63 0.14 1.09 1.01 -1.11 0.04 120.40 127.70 1jop s VAL 73 Ca 0.01 -0.10 -0.29 0.00 0.00 0.00 0.00 61.98 61.60 1jop s VAL 73 Cb -0.19 -3.04 -0.07 0.00 0.00 0.00 0.00 36.38 33.08 1jop s VAL 73 CO 0.05 0.51 0.91 -0.22 0.00 0.00 0.00 175.10 176.35 1jop s LEU 74 N -0.03 4.54 -0.07 3.92 2.96 -0.43 -3.31 118.68 126.27 1jop s LEU 74 Ca 0.05 1.77 -0.02 0.00 -0.22 0.00 0.00 54.13 55.71 1jop s LEU 74 Cb -0.12 -3.51 -0.03 0.00 0.50 0.00 0.00 46.19 43.02 1jop s LEU 74 CO 0.01 0.03 -0.08 -0.38 -1.32 0.00 0.00 176.35 174.62 1jop n ILE 75 N 2.34 0.37 -3.55 6.68 5.41 -0.57 -2.14 119.36 127.90 1jop n ILE 75 Ca -0.00 -0.11 -0.16 0.00 1.00 0.00 0.00 62.75 63.47 1jop n ILE 75 Cb 0.49 -1.25 -0.06 0.00 -0.71 0.00 0.00 39.64 38.11 1jop n ILE 75 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 1jop s ARG 76 N -2.13 1.02 0.27 0.38 0.52 0.12 -4.72 118.95 114.41 1jop s ARG 76 Ca -0.09 0.07 0.00 0.00 -0.52 0.00 0.00 55.73 55.19 1jop s ARG 76 Cb 0.03 0.47 0.00 0.00 0.52 0.00 0.00 34.95 35.98 1jop s ARG 76 CO 0.13 -0.33 0.00 0.41 0.02 0.00 0.00 175.30 175.53 1jop n GLY 77 N 0.79 0.08 3.30 -3.53 0.00 -1.26 0.45 105.19 105.02 1jop n GLY 77 Ca -0.19 -1.74 0.03 0.00 0.00 0.00 0.00 46.02 44.12 1jop n GLY 77 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jop s THR 78 N 0.00 -0.42 0.13 2.61 2.01 -1.26 -4.02 115.64 114.70 1jop s THR 78 Ca 0.00 0.00 0.04 0.00 0.31 0.00 0.00 61.69 62.04 1jop s THR 78 Cb 0.00 -1.00 -0.04 0.00 0.01 0.00 0.00 72.50 71.47 1jop s THR 78 CO 0.00 0.00 -0.09 -0.70 -0.69 0.00 0.00 174.62 173.14 1jop s GLU 79 N 2.54 0.99 -0.19 4.92 2.12 -0.48 -4.88 118.70 123.71 1jop s GLU 79 Ca -0.01 -1.40 -0.02 0.00 0.36 0.00 0.00 54.97 53.90 1jop s GLU 79 Cb -0.07 -0.51 -0.01 0.00 0.26 0.00 0.00 34.13 33.80 1jop s GLU 79 CO -0.16 0.05 -0.08 -0.80 -0.54 0.00 0.00 175.26 173.73 1jop s ASN 80 N -3.08 4.09 -0.29 -1.70 -0.87 -1.26 -0.89 114.94 110.93 1jop s ASN 80 Ca 0.15 -0.40 -0.08 0.00 -1.57 0.00 0.00 52.86 50.96 1jop s ASN 80 Cb 0.03 -1.67 -0.00 0.00 -0.02 0.00 0.00 41.25 39.58 1jop s ASN 80 CO -0.01 0.03 0.10 -0.63 -2.57 0.00 0.00 177.10 174.02 1jop s ILE 81 N 1.15 4.19 -0.31 0.60 1.01 0.72 -3.31 121.20 125.24 1jop s ILE 81 Ca 0.01 -0.53 -0.29 0.00 0.00 0.00 0.00 60.65 59.84 1jop s ILE 81 Cb -0.14 -3.12 0.01 0.00 0.01 0.00 0.00 42.46 39.22 1jop s ILE 81 CO -0.02 0.12 1.11 -1.61 0.00 0.00 0.00 174.94 174.54 1jop s GLU 82 N 1.55 4.05 0.03 2.79 2.02 0.78 -1.06 118.70 128.85 1jop s GLU 82 Ca 0.04 1.11 0.01 0.00 0.02 0.00 0.00 54.97 56.14 1jop s GLU 82 Cb -0.17 -3.75 -0.02 0.00 0.10 0.00 0.00 34.13 30.29 1jop s GLU 82 CO 0.04 -0.92 -0.05 0.08 0.02 0.00 0.00 175.26 174.42 1jop s VAL 83 N 3.74 0.28 0.18 2.63 1.01 -0.74 -1.00 120.40 126.50 1jop s VAL 83 Ca 0.47 -0.96 0.11 0.00 0.00 0.00 0.00 61.98 61.60 1jop s VAL 83 Cb -0.13 -0.39 -0.04 0.00 0.00 0.00 0.00 36.38 35.82 1jop s VAL 83 CO 0.16 -0.44 -0.22 -0.83 0.00 0.00 0.00 175.10 173.77 1jop s GLY 84 N -1.47 1.69 -0.00 4.51 0.00 -1.17 -2.26 107.32 108.63 1jop s GLY 84 Ca -0.13 -1.59 0.01 0.00 0.00 0.00 0.00 44.72 43.01 1jop s GLY 84 CO -0.00 -1.60 0.04 0.00 0.00 0.00 0.00 173.10 171.54 1jop n ALA 85 N 0.35 2.13 -1.77 3.20 0.00 -1.26 -4.35 120.51 118.81 1jop n ALA 85 Ca -0.13 -0.03 -0.39 0.00 0.00 0.00 0.00 53.44 52.88 1jop n ALA 85 Cb 0.55 -0.04 -0.02 0.00 0.00 0.00 0.00 19.45 19.95 1jop n ALA 85 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1jop s THR 86 N -1.13 2.84 0.31 0.00 2.01 -1.26 -4.99 115.64 113.41 1jop s THR 86 Ca 0.00 0.77 -0.29 0.00 0.31 0.00 0.00 61.69 62.48 1jop s THR 86 Cb 0.01 -3.46 -0.11 0.00 0.01 0.00 0.00 72.50 68.95 1jop s THR 86 CO 0.04 0.13 1.48 -0.47 -0.69 0.00 0.00 174.62 175.11 1jop s TYR 87 N -1.26 2.83 0.39 4.92 5.04 -1.26 -4.91 117.35 123.10 1jop s TYR 87 Ca 0.54 1.04 -0.03 0.00 -2.44 0.00 0.00 57.07 56.18 1jop s TYR 87 Cb -0.36 -3.93 -0.04 0.00 0.35 0.00 0.00 41.96 37.98 1jop s TYR 87 CO 0.47 -2.92 0.65 -1.25 -1.34 0.00 0.00 175.55 171.15 1jop s PRO 88 N -1.03 3.55 -0.43 4.97 0.04 -1.26 -5.02 135.00 135.81 1jop s PRO 88 Ca 0.57 -0.03 -0.29 0.00 0.04 0.00 0.00 61.00 61.29 1jop s PRO 88 Cb -0.45 -2.54 0.02 0.00 0.04 0.00 0.00 34.50 31.58 1jop s PRO 88 CO 0.51 0.02 1.14 1.21 0.04 0.00 0.00 177.00 179.92 1jop s ASN 89 N -3.87 6.70 0.00 6.66 3.84 -1.26 -4.92 114.94 122.08 1jop s ASN 89 Ca 0.44 0.67 0.00 0.00 0.21 0.00 0.00 52.86 54.18 1jop s ASN 89 Cb -0.10 -2.55 0.00 0.00 -0.55 0.00 0.00 41.25 38.05 1jop s ASN 89 CO 0.38 -1.16 0.79 0.18 -2.79 0.00 0.00 177.10 174.50 1jop n LEU 90 N 7.63 2.27 -0.00 3.21 4.77 -1.26 -2.43 117.00 131.19 1jop n LEU 90 Ca 0.12 -1.13 0.00 0.00 -0.03 0.00 0.00 56.01 54.97 1jop n LEU 90 Cb 0.48 -0.45 -0.00 0.00 -2.33 0.00 0.00 43.42 41.12 1jop n LEU 90 CO 0.68 0.40 -0.29 -1.54 -1.33 0.00 0.00 177.39 175.31 1jop n SER 91 N 0.42 2.78 0.00 -1.43 3.41 -1.26 -4.44 113.62 113.10 1jop n SER 91 Ca 0.00 -0.22 0.11 0.00 -0.26 0.00 0.00 58.87 58.50 1jop n SER 91 Cb 0.40 1.01 0.64 0.00 -0.26 0.00 0.00 64.21 66.00 1jop n SER 91 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1jop n LYS 92 N -1.30 0.80 -3.88 4.33 4.81 -1.02 -4.74 118.16 117.16 1jop n LYS 92 Ca -0.00 0.00 -0.36 0.00 -0.87 0.00 0.00 58.31 57.08 1jop n LYS 92 Cb 0.01 -1.43 -0.11 0.00 0.02 0.00 0.00 35.03 33.53 1jop n LYS 92 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 1jop s TYR 93 N -2.00 3.20 0.00 5.64 1.51 -1.26 -4.63 117.35 119.81 1jop s TYR 93 Ca 0.33 -0.05 0.00 0.00 -1.01 0.00 0.00 57.07 56.33 1jop s TYR 93 Cb 0.15 -2.16 0.00 0.00 -0.11 0.00 0.00 41.96 39.83 1jop s TYR 93 CO 0.25 -0.03 0.00 0.39 -1.11 0.00 0.00 175.55 175.05 1jop n GLU 94 N 4.13 -0.66 -2.30 -0.62 1.02 -0.55 -4.95 120.64 116.72 1jop n GLU 94 Ca -0.16 0.00 -0.26 0.00 -0.02 0.00 0.00 57.16 56.72 1jop n GLU 94 Cb 0.52 0.00 0.05 0.00 -0.02 0.00 0.00 31.44 31.99 1jop n GLU 94 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1jop s ASP 95 N -1.91 5.28 -0.22 1.62 1.01 -1.26 -4.64 116.67 116.55 1jop s ASP 95 Ca 0.00 0.62 -0.13 0.00 0.71 0.00 0.00 52.55 53.76 1jop s ASP 95 Cb 0.00 -1.47 -0.05 0.00 1.01 0.00 0.00 42.92 42.41 1jop s ASP 95 CO 0.00 -1.29 0.26 -0.47 0.21 0.00 0.00 175.17 173.88 1jop s TYR 96 N -3.11 3.34 -0.45 4.23 5.04 -1.26 -4.50 117.35 120.65 1jop s TYR 96 Ca 0.57 0.39 -0.25 0.00 -2.44 0.00 0.00 57.07 55.34 1jop s TYR 96 Cb -0.11 -2.37 0.03 0.00 0.35 0.00 0.00 41.96 39.85 1jop s TYR 96 CO 0.45 0.04 0.88 1.21 -1.34 0.00 0.00 175.55 176.79 1jop s ASN 97 N 1.03 6.48 0.46 4.32 3.84 -0.92 -4.92 114.94 125.23 1jop s ASN 97 Ca 0.12 0.07 0.26 0.00 0.21 0.00 0.00 52.86 53.52 1jop s ASN 97 Cb -0.14 -2.43 1.00 0.00 -0.55 0.00 0.00 41.25 39.13 1jop s ASN 97 CO 0.06 -0.99 1.86 -0.33 -2.79 0.00 0.00 177.10 174.90 1jop h GLU 98 N 9.00 0.00 0.00 0.43 5.08 -1.95 -2.59 114.58 124.56 1jop h GLU 98 Ca -0.24 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 57.91 1jop h GLU 98 Cb 1.08 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.29 1jop h GLU 98 CO 1.00 0.18 -1.73 0.00 -1.00 0.00 0.00 179.01 177.47 1jop n ALA 99 N -2.20 1.87 -1.29 3.43 0.00 -1.26 -4.12 120.51 116.93 1jop n ALA 99 Ca 0.00 -0.74 -0.03 0.00 0.00 0.00 0.00 53.44 52.67 1jop n ALA 99 Cb 0.41 -0.76 0.22 0.00 0.00 0.00 0.00 19.45 19.32 1jop n ALA 99 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1jop n ASP 100 N -2.81 3.09 -3.86 0.00 8.00 -1.19 -5.04 116.55 114.74 1jop n ASP 100 Ca -0.15 -3.54 -0.30 0.00 0.71 0.00 0.00 54.79 51.51 1jop n ASP 100 Cb 0.91 -0.64 0.01 0.00 -0.02 0.00 0.00 41.12 41.38 1jop n ASP 100 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1jop n ASP 101 N -0.93 -3.06 -3.87 -2.24 2.03 -0.98 -4.97 116.55 102.53 1jop n ASP 101 Ca 0.34 -0.89 -0.09 0.00 0.52 0.00 0.00 54.79 54.66 1jop n ASP 101 Cb 1.09 -1.14 -0.05 0.00 -0.72 0.00 0.00 41.12 40.30 1jop n ASP 101 CO 0.00 0.00 0.00 -0.72 -1.92 0.00 0.00 177.20 174.56 1jop s TYR 102 N -3.63 0.13 -0.08 -0.67 -0.85 -1.22 -4.29 117.35 106.73 1jop s TYR 102 Ca 0.27 -0.49 -0.07 0.00 -0.52 0.00 0.00 57.07 56.26 1jop s TYR 102 Cb -0.15 0.26 0.02 0.00 0.38 0.00 0.00 41.96 42.47 1jop s TYR 102 CO 0.69 -0.92 0.21 -0.65 -1.52 0.00 0.00 175.55 173.36 1jop s GLN 103 N -3.94 0.24 0.19 -3.49 -0.21 0.25 -2.17 119.66 110.53 1jop s GLN 103 Ca 0.15 0.30 0.07 0.00 0.02 0.00 0.00 55.36 55.90 1jop s GLN 103 Cb -0.00 0.10 -0.04 0.00 1.00 0.00 0.00 33.01 34.07 1jop s GLN 103 CO 0.02 -0.04 0.09 -0.51 -2.12 0.00 0.00 175.29 172.73 1jop s LEU 104 N 0.19 3.59 0.15 2.90 1.43 -1.26 -0.34 118.68 125.34 1jop s LEU 104 Ca -0.01 -0.29 -0.04 0.00 -1.03 0.00 0.00 54.13 52.76 1jop s LEU 104 Cb -0.02 -2.19 -0.03 0.00 0.03 0.00 0.00 46.19 43.99 1jop s LEU 104 CO -0.00 0.05 0.16 0.00 0.23 0.00 0.00 176.35 176.79 1jop n ALA 106 N -0.17 2.65 -3.06 0.00 0.00 -1.26 0.08 120.51 118.76 1jop n ALA 106 Ca -0.05 -0.46 -0.11 0.00 0.00 0.00 0.00 53.44 52.82 1jop n ALA 106 Cb 0.64 -1.13 -0.11 0.00 0.00 0.00 0.00 19.45 18.85 1jop n ALA 106 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1jop s ASP 107 N -2.08 0.04 -0.11 0.00 2.15 -1.26 -4.70 116.67 110.70 1jop s ASP 107 Ca 0.35 -0.18 -0.04 0.00 0.43 0.00 0.00 52.55 53.11 1jop s ASP 107 Cb 0.21 0.19 -0.03 0.00 -0.30 0.00 0.00 42.92 42.98 1jop s ASP 107 CO 0.36 -0.29 0.02 -0.63 -0.17 0.00 0.00 175.17 174.46 1jop s ILE 108 N -1.12 4.47 0.06 4.11 1.01 -1.26 -4.92 121.20 123.54 1jop s ILE 108 Ca -0.12 -0.18 -0.31 0.00 0.00 0.00 0.00 60.65 60.05 1jop s ILE 108 Cb -0.07 -2.92 -0.06 0.00 0.01 0.00 0.00 42.46 39.42 1jop s ILE 108 CO 0.01 0.57 1.32 -1.81 0.00 0.00 0.00 174.94 175.03 1jop s ASP 109 N -0.53 6.92 -1.20 3.58 1.01 -1.26 -3.63 116.67 121.56 1jop s ASP 109 Ca 0.09 2.15 0.00 0.00 0.71 0.00 0.00 52.55 55.50 1jop s ASP 109 Cb -0.12 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.24 1jop s ASP 109 CO 0.02 -0.61 0.00 0.47 0.21 0.00 0.00 175.17 175.26 1jop n ASP 110 N 4.38 -4.26 -1.66 0.27 8.00 -1.26 -4.72 116.55 117.31 1jop n ASP 110 Ca 0.11 0.19 -0.21 0.00 0.71 0.00 0.00 54.79 55.59 1jop n ASP 110 Cb 0.44 -3.05 -0.03 0.00 -0.02 0.00 0.00 41.12 38.46 1jop n ASP 110 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1jop n LYS 111 N -2.48 0.00 -4.42 -1.24 5.02 -1.24 -4.77 118.16 109.03 1jop n LYS 111 Ca -0.13 0.00 -0.22 0.00 -2.02 0.00 0.00 58.31 55.94 1jop n LYS 111 Cb 0.47 -0.54 -0.09 0.00 -0.02 0.00 0.00 35.03 34.85 1jop n LYS 111 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 1jop s PHE 112 N -0.03 1.73 -0.11 2.13 -0.71 -0.96 -4.98 117.98 115.05 1jop s PHE 112 Ca 0.33 -1.27 0.02 0.00 -1.04 0.00 0.00 56.93 54.97 1jop s PHE 112 Cb -0.46 -1.04 0.01 0.00 -1.21 0.00 0.00 43.02 40.32 1jop s PHE 112 CO 0.21 -0.35 -0.19 0.99 -1.34 0.00 0.00 175.22 174.54 1jop s THR 113 N -3.40 1.74 -0.30 -4.49 2.01 -1.26 -1.79 115.64 108.14 1jop s THR 113 Ca 0.31 -0.80 -0.08 0.00 0.31 0.00 0.00 61.69 61.43 1jop s THR 113 Cb 0.05 -1.55 0.00 0.00 0.01 0.00 0.00 72.50 71.01 1jop s THR 113 CO 0.16 0.49 0.12 -0.69 -0.69 0.00 0.00 174.62 174.01 1jop s VAL 114 N 0.79 4.29 -0.30 3.82 1.01 -0.23 -4.96 120.40 124.83 1jop s VAL 114 Ca -0.10 -0.56 -0.23 0.00 0.00 0.00 0.00 61.98 61.09 1jop s VAL 114 Cb -0.16 -3.20 -0.00 0.00 0.00 0.00 0.00 36.38 33.02 1jop s VAL 114 CO 0.01 0.07 0.78 -0.89 0.00 0.00 0.00 175.10 175.06 1jop s THR 115 N 1.56 4.81 -0.19 3.92 2.01 -1.26 -0.20 115.64 126.29 1jop s THR 115 Ca 0.04 1.20 -0.08 0.00 0.31 0.00 0.00 61.69 63.16 1jop s THR 115 Cb -0.17 -4.13 -0.04 0.00 0.01 0.00 0.00 72.50 68.17 1jop s THR 115 CO 0.04 -0.22 0.07 -0.04 -0.69 0.00 0.00 174.62 173.78 1jop s MET 116 N 2.92 3.98 0.30 4.92 -1.94 -0.07 -4.95 119.30 124.47 1jop s MET 116 Ca 0.32 -0.34 0.04 0.00 -1.71 0.00 0.00 55.69 54.00 1jop s MET 116 Cb -0.14 -3.23 -0.06 0.00 2.01 0.00 0.00 34.83 33.41 1jop s MET 116 CO 0.12 0.26 0.05 0.15 -0.01 0.00 0.00 175.02 175.59 1jop s LYS 117 N 0.41 1.58 0.28 2.03 -0.14 -1.26 -1.39 119.74 121.26 1jop s LYS 117 Ca 0.03 -1.86 -0.29 0.00 -1.36 0.00 0.00 55.97 52.49 1jop s LYS 117 Cb -0.12 -0.77 -0.14 0.00 -1.68 0.00 0.00 37.83 35.12 1jop s LYS 117 CO 0.00 -0.18 1.04 -2.30 -0.76 0.00 0.00 175.35 173.15 1jop n PRO 118 N -0.62 1.38 -0.03 -1.68 -0.02 -1.26 -2.14 135.00 130.63 1jop n PRO 118 Ca -0.02 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 1jop n PRO 118 Cb 0.66 -1.88 0.00 0.00 -0.02 0.00 0.00 33.50 32.26 1jop n PRO 118 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1jop n LYS 119 N 0.84 0.00 -3.00 -0.52 5.02 -0.91 -4.98 118.16 114.62 1jop n LYS 119 Ca 0.10 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 56.11 1jop n LYS 119 Cb 0.31 -0.82 -0.02 0.00 -0.02 0.00 0.00 35.03 34.48 1jop n LYS 119 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1jop s MET 120 N -0.47 3.63 -0.00 1.97 -1.94 -0.91 -0.54 119.30 121.04 1jop s MET 120 Ca 0.00 0.16 -0.04 0.00 -1.71 0.00 0.00 55.69 54.10 1jop s MET 120 Cb 0.00 -2.49 -0.00 0.00 2.01 0.00 0.00 34.83 34.34 1jop s MET 120 CO 0.00 0.01 0.07 -0.59 -0.01 0.00 0.00 175.02 174.50 1jop s PHE 121 N -2.39 0.08 -0.10 -0.03 -0.12 0.26 -1.31 117.98 114.37 1jop s PHE 121 Ca 0.47 -0.17 -0.00 0.00 -0.05 0.00 0.00 56.93 57.17 1jop s PHE 121 Cb -0.10 -0.07 0.02 0.00 -0.63 0.00 0.00 43.02 42.24 1jop s PHE 121 CO 0.35 -0.19 -0.06 0.00 -0.05 0.00 0.00 175.22 175.27 1jop s ALA 122 N -1.03 1.18 -0.29 1.99 0.00 0.11 -2.06 121.76 121.66 1jop s ALA 122 Ca -0.11 -0.44 -0.11 0.00 0.00 0.00 0.00 51.96 51.31 1jop s ALA 122 Cb -0.07 -0.84 -0.04 0.00 0.00 0.00 0.00 23.12 22.18 1jop s ALA 122 CO 0.00 -0.37 0.17 0.08 0.00 0.00 0.00 175.76 175.64 1jop s VAL 123 N 1.66 5.06 -0.24 0.00 1.01 0.19 0.11 120.40 128.19 1jop s VAL 123 Ca 0.03 -0.01 -0.07 0.00 0.00 0.00 0.00 61.98 61.94 1jop s VAL 123 Cb -0.13 -3.45 -0.03 0.00 0.00 0.00 0.00 36.38 32.77 1jop s VAL 123 CO -0.07 0.21 0.05 -0.36 0.00 0.00 0.00 175.10 174.93 1jop s PHE 124 N 1.71 3.07 0.50 5.22 0.08 -0.56 -1.43 117.98 126.58 1jop s PHE 124 Ca 0.07 -0.47 -0.11 0.00 0.12 0.00 0.00 56.93 56.54 1jop s PHE 124 Cb -0.16 -2.20 -0.06 0.00 -0.57 0.00 0.00 43.02 40.03 1jop s PHE 124 CO 0.09 -0.35 0.89 0.71 -0.10 0.00 0.00 175.22 176.46 1jop s TYR 125 N 1.49 3.53 0.62 0.36 2.02 -1.26 -1.37 117.35 122.73 1jop s TYR 125 Ca 0.06 1.15 -0.18 0.00 -0.37 0.00 0.00 57.07 57.73 1jop s TYR 125 Cb -0.15 -2.56 -0.07 0.00 -0.40 0.00 0.00 41.96 38.78 1jop s TYR 125 CO 0.03 -0.35 0.54 -2.30 -1.57 0.00 0.00 175.55 171.89 1jop n PRO 126 N -1.95 0.47 -0.58 -1.71 -0.02 -1.26 -0.25 135.00 129.70 1jop n PRO 126 Ca 0.04 0.19 0.00 0.00 -2.02 0.00 0.00 63.50 61.71 1jop n PRO 126 Cb 0.54 -1.76 0.00 0.00 -0.02 0.00 0.00 33.50 32.26 1jop n PRO 126 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1jop n TYR 127 N -1.89 0.00 -2.58 6.00 4.01 0.18 -4.93 117.16 117.96 1jop n TYR 127 Ca 0.11 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.43 1jop n TYR 127 Cb 0.48 -1.38 -0.02 0.00 -0.31 0.00 0.00 39.34 38.11 1jop n TYR 127 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 1jop s GLU 128 N -0.97 3.60 0.63 -0.72 2.02 0.65 -4.61 118.70 119.30 1jop s GLU 128 Ca 0.00 0.41 -0.18 0.00 0.02 0.00 0.00 54.97 55.22 1jop s GLU 128 Cb 0.00 -3.97 -0.02 0.00 0.10 0.00 0.00 34.13 30.24 1jop s GLU 128 CO 0.00 -1.56 1.22 -2.14 0.02 0.00 0.00 175.26 172.80 1jop s PRO 129 N 4.77 2.73 -0.15 0.39 0.02 -1.26 -4.57 135.00 136.93 1jop s PRO 129 Ca 0.46 1.85 -0.29 0.00 0.02 0.00 0.00 61.00 63.04 1jop s PRO 129 Cb -0.08 -1.89 0.11 0.00 0.02 0.00 0.00 34.50 32.66 1jop s PRO 129 CO 0.28 -1.40 0.91 -3.38 -0.33 0.00 0.00 177.00 173.08 1jop s HIS 130 N -1.64 -0.48 -0.23 6.54 -3.43 0.32 -3.02 115.29 113.34 1jop s HIS 130 Ca 0.78 0.89 -0.04 0.00 -0.80 0.00 0.00 55.06 55.89 1jop s HIS 130 Cb -0.31 0.42 0.10 0.00 -1.43 0.00 0.00 32.58 31.35 1jop s HIS 130 CO 0.37 -0.40 0.18 0.21 -2.00 0.00 0.00 174.74 173.11 1jop s LYS 131 N -0.87 0.19 -1.32 -0.38 2.20 -0.17 0.51 119.74 119.90 1jop s LYS 131 Ca -0.03 -0.11 -0.17 0.00 -0.36 0.00 0.00 55.97 55.29 1jop s LYS 131 Cb -0.01 -1.22 0.07 0.00 -1.51 0.00 0.00 37.83 35.15 1jop s LYS 131 CO 0.03 -0.82 1.80 -2.30 -0.36 0.00 0.00 175.35 173.69 1jop n PRO 132 N 5.29 3.16 -0.25 4.03 -0.02 -1.26 -0.16 135.00 145.79 1jop n PRO 132 Ca -0.05 -3.19 -0.25 0.00 -2.02 0.00 0.00 63.50 57.98 1jop n PRO 132 Cb 0.47 -3.47 0.24 0.00 -0.02 0.00 0.00 33.50 30.72 1jop n PRO 132 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1jop n VAL 135 N 3.39 0.00 0.00 0.00 0.31 -1.26 -5.07 118.33 115.70 1jop n VAL 135 Ca -0.20 -0.10 0.00 0.00 -0.01 0.00 0.00 64.34 64.03 1jop n VAL 135 Cb 0.53 1.05 0.00 0.00 -0.91 0.00 0.00 33.84 34.50 1jop n VAL 135 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1jop n ILE 143 N -0.19 0.00 -3.82 2.52 5.41 -1.26 -5.02 119.36 117.00 1jop n ILE 143 Ca 0.00 0.00 -0.26 0.00 1.00 0.00 0.00 62.75 63.49 1jop n ILE 143 Cb 0.01 0.00 -0.17 0.00 -0.71 0.00 0.00 39.64 38.77 1jop n ILE 143 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 1jop s LYS 144 N -2.59 1.01 0.12 0.38 2.47 0.17 -4.23 119.74 117.06 1jop s LYS 144 Ca 0.00 -0.22 0.01 0.00 -1.56 0.00 0.00 55.97 54.20 1jop s LYS 144 Cb 0.00 -1.57 -0.00 0.00 -1.46 0.00 0.00 37.83 34.80 1jop s LYS 144 CO 0.00 -0.39 0.04 0.36 0.16 0.00 0.00 175.35 175.52 1jop n LYS 145 N 5.02 0.91 -3.64 4.03 2.85 -0.02 0.11 118.16 127.42 1jop n LYS 145 Ca -0.10 -1.00 -0.06 0.00 -1.05 0.00 0.00 58.31 56.10 1jop n LYS 145 Cb 0.49 0.52 -0.07 0.00 -0.65 0.00 0.00 35.03 35.32 1jop n LYS 145 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 177.40 176.18 1jop s LEU 146 N 0.00 -0.78 -0.18 -5.58 0.20 -1.21 -1.49 118.68 109.64 1jop s LEU 146 Ca 0.05 1.28 -0.01 0.00 0.69 0.00 0.00 54.13 56.14 1jop s LEU 146 Cb 0.00 2.18 0.05 0.00 -0.43 0.00 0.00 46.19 48.00 1jop s LEU 146 CO 0.04 -0.20 -0.00 -0.69 -0.29 0.00 0.00 176.35 175.20 1jop s VAL 147 N 1.38 0.84 0.11 1.68 1.01 0.33 -2.76 120.40 122.99 1jop s VAL 147 Ca -0.08 -0.64 -0.29 0.00 0.00 0.00 0.00 61.98 60.97 1jop s VAL 147 Cb -0.05 -1.19 -0.06 0.00 0.00 0.00 0.00 36.38 35.08 1jop s VAL 147 CO -0.16 -0.07 0.92 -0.69 0.00 0.00 0.00 175.10 175.11 1jop s VAL 148 N 1.73 4.50 -0.31 2.92 1.01 -0.41 -0.45 120.40 129.38 1jop s VAL 148 Ca -0.01 1.99 -0.08 0.00 0.00 0.00 0.00 61.98 63.88 1jop s VAL 148 Cb -0.17 -4.29 0.01 0.00 0.00 0.00 0.00 36.38 31.94 1jop s VAL 148 CO -0.07 0.35 0.12 -0.54 0.00 0.00 0.00 175.10 174.95 1jop s LYS 149 N -0.14 3.11 -0.09 2.72 -0.14 0.47 -1.35 119.74 124.31 1jop s LYS 149 Ca 0.45 -0.86 0.04 0.00 -1.36 0.00 0.00 55.97 54.24 1jop s LYS 149 Cb -0.23 -3.49 -0.00 0.00 -1.68 0.00 0.00 37.83 32.43 1jop s LYS 149 CO 0.29 -0.48 -0.23 0.08 -0.76 0.00 0.00 175.35 174.24 1jop s VAL 150 N 1.54 2.00 0.05 3.17 1.01 -0.53 -2.39 120.40 125.25 1jop s VAL 150 Ca 0.03 -0.99 -0.31 0.00 0.00 0.00 0.00 61.98 60.71 1jop s VAL 150 Cb -0.18 -1.73 -0.06 0.00 0.00 0.00 0.00 36.38 34.42 1jop s VAL 150 CO 0.04 0.55 1.33 -2.84 0.00 0.00 0.00 175.10 174.18 1jop s PRO 151 N 0.32 4.34 0.16 2.72 0.02 -1.26 0.44 135.00 141.73 1jop s PRO 151 Ca -0.17 1.93 -0.16 0.00 0.02 0.00 0.00 61.00 62.61 1jop s PRO 151 Cb -0.17 -3.40 0.07 0.00 0.02 0.00 0.00 34.50 31.02 1jop s PRO 151 CO 0.08 -0.43 1.74 0.28 -0.33 0.00 0.00 177.00 178.35 1jop h VAL 152 N 4.58 0.87 -0.28 3.83 2.07 -1.21 0.64 116.25 126.74 1jop h VAL 152 Ca -0.40 -0.09 0.11 0.00 0.82 0.00 0.00 66.70 67.14 1jop h VAL 152 Cb 1.20 0.59 -0.04 0.00 -1.52 0.00 0.00 31.29 31.52 1jop h VAL 152 CO 0.86 0.05 0.17 0.29 0.02 0.00 0.00 177.57 178.96 1jop n LYS 153 N -5.04 -0.01 0.00 1.57 5.02 -1.26 0.95 118.16 119.39 1jop n LYS 153 Ca 0.02 0.31 0.09 0.00 -2.02 0.00 0.00 58.31 56.70 1jop n LYS 153 Cb 0.14 -0.58 0.49 0.00 -0.02 0.00 0.00 35.03 35.06 1jop n LYS 153 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1jop n LEU 154 N -3.30 0.00 0.00 -0.35 4.77 0.22 -5.21 117.00 113.14 1jop n LEU 154 Ca 0.09 0.21 0.14 0.00 -0.03 0.00 0.00 56.01 56.42 1jop n LEU 154 Cb 0.34 -0.21 0.81 0.00 -2.33 0.00 0.00 43.42 42.03 1jop n LEU 154 CO 0.02 -0.08 0.98 -0.38 -1.33 0.00 0.00 177.39 176.60