#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 1.37 -0.16 1.12 1.01 -1.03 -4.97 121.20 118.53 1jop s ILE 2 Ca 0.00 -0.66 -0.03 0.00 0.00 0.00 0.00 60.65 59.96 1jop s ILE 2 Cb 0.00 -1.19 0.05 0.00 0.01 0.00 0.00 42.46 41.33 1jop s ILE 2 CO 0.00 0.40 0.03 -0.63 0.00 0.00 0.00 174.94 174.74 1jop s ILE 3 N 0.22 0.43 0.00 2.92 1.01 -1.26 -0.83 121.20 123.70 1jop s ILE 3 Ca -0.08 -0.37 0.00 0.00 0.00 0.00 0.00 60.65 60.21 1jop s ILE 3 Cb -0.13 -0.87 0.00 0.00 0.01 0.00 0.00 42.46 41.47 1jop s ILE 3 CO 0.03 -0.11 0.00 -0.24 0.00 0.00 0.00 174.94 174.62 1jop n SER 4 N 5.10 0.00 -4.08 3.58 2.88 0.11 -4.94 113.62 116.26 1jop n SER 4 Ca -0.08 -0.39 -0.16 0.00 -1.33 0.00 0.00 58.87 56.90 1jop n SER 4 Cb 0.48 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.81 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 0.44 1.13 0.00 -3.46 0.15 -1.26 0.12 113.70 110.82 1jop s SER 5 Ca 0.00 -0.44 0.26 0.00 0.70 0.00 0.00 55.95 56.47 1jop s SER 5 Cb 0.00 -0.04 1.53 0.00 -1.71 0.00 0.00 66.02 65.80 1jop s SER 5 CO 0.00 -0.06 1.94 0.18 1.20 0.00 0.00 173.24 176.49 1jop n LEU 6 N 1.88 0.00 -0.00 3.45 4.77 0.19 -1.25 117.00 126.03 1jop n LEU 6 Ca -0.19 0.00 0.06 0.00 -0.03 0.00 0.00 56.01 55.85 1jop n LEU 6 Cb 0.55 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.56 1jop n LEU 6 CO 0.22 0.00 -0.27 0.41 -1.33 0.00 0.00 177.39 176.42 1jop n THR 7 N -0.93 0.00 -3.29 -5.08 -1.04 -1.26 -4.87 114.28 97.80 1jop n THR 7 Ca 0.19 -0.24 -0.38 0.00 -2.04 0.00 0.00 64.05 61.58 1jop n THR 7 Cb 0.09 0.69 -0.06 0.00 -1.82 0.00 0.00 70.33 69.23 1jop n THR 7 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1jop s ASN 8 N -2.73 6.84 0.36 8.00 2.20 -0.38 -4.91 114.94 124.32 1jop s ASN 8 Ca 0.01 1.00 0.16 0.00 -0.94 0.00 0.00 52.86 53.10 1jop s ASN 8 Cb 0.09 -2.32 1.11 0.00 -2.00 0.00 0.00 41.25 38.14 1jop s ASN 8 CO 0.54 0.10 1.68 1.55 -2.94 0.00 0.00 177.10 178.03 1jop h PRO 9 N 5.87 0.32 -0.44 3.55 0.13 -1.89 0.39 132.00 139.93 1jop h PRO 9 Ca -0.45 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1jop h PRO 9 Cb 1.20 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1jop h PRO 9 CO 0.70 0.21 0.00 0.09 -0.23 0.00 0.00 178.00 178.77 1jop n ASN 10 N -4.95 3.17 -0.39 1.44 3.02 -1.26 -4.63 115.26 111.66 1jop n ASN 10 Ca 0.31 -1.99 0.35 0.00 -0.03 0.00 0.00 54.58 53.23 1jop n ASN 10 Cb 1.01 -0.29 0.69 0.00 -0.61 0.00 0.00 39.78 40.58 1jop n ASN 10 CO 0.00 0.00 0.00 2.19 -2.62 0.00 0.00 177.26 176.83 1jop h PHE 11 N 2.64 0.22 -0.14 3.10 -0.00 -0.47 0.67 116.94 122.96 1jop h PHE 11 Ca 0.00 0.01 0.04 0.00 -0.00 0.00 0.00 57.97 58.02 1jop h PHE 11 Cb 0.79 -0.06 -0.01 0.00 -0.00 0.00 0.00 35.95 36.68 1jop h PHE 11 CO 0.29 -0.01 0.15 0.87 -0.00 0.00 0.00 178.31 179.61 1jop h LYS 12 N 0.10 0.00 -6.44 6.09 1.57 -1.82 -3.43 116.57 112.64 1jop h LYS 12 Ca 0.65 0.00 -0.61 0.00 -1.87 0.00 0.00 60.65 58.82 1jop h LYS 12 Cb 2.32 0.00 0.06 0.00 0.08 0.00 0.00 32.23 34.69 1jop h LYS 12 CO -0.13 0.00 0.63 0.28 -0.57 0.00 0.00 179.45 179.66 1jop n VAL 13 N -3.87 0.22 0.00 0.50 0.31 0.23 -0.96 118.33 114.76 1jop n VAL 13 Ca 0.01 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 1jop n VAL 13 Cb 0.27 -1.28 0.00 0.00 -0.91 0.00 0.00 33.84 31.92 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 2.86 2.87 3.79 2.92 0.00 -1.26 -4.98 105.19 111.39 1jop n GLY 14 Ca 0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 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 4.25 0.18 0.99 1.43 -0.14 -4.99 118.68 120.41 1jop s LEU 15 Ca 0.00 1.79 -0.32 0.00 -1.03 0.00 0.00 54.13 54.57 1jop s LEU 15 Cb 0.00 -4.13 -0.11 0.00 0.03 0.00 0.00 46.19 41.98 1jop s LEU 15 CO 0.00 -0.13 1.75 -2.84 0.23 0.00 0.00 176.35 175.36 1jop s PRO 16 N -2.32 4.13 0.31 1.29 0.02 -1.26 -4.79 135.00 132.37 1jop s PRO 16 Ca 0.53 2.60 0.07 0.00 0.02 0.00 0.00 61.00 64.22 1jop s PRO 16 Cb -0.16 -3.22 0.83 0.00 0.02 0.00 0.00 34.50 31.96 1jop s PRO 16 CO 0.21 -0.78 1.69 0.87 -0.33 0.00 0.00 177.00 178.66 1jop h LYS 17 N 7.30 0.38 -0.43 5.54 1.57 -1.94 -0.21 116.57 128.77 1jop h LYS 17 Ca -0.44 -0.02 -0.07 0.00 -1.87 0.00 0.00 60.65 58.24 1jop h LYS 17 Cb 1.21 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 33.41 1jop h LYS 17 CO 0.95 0.25 -0.04 0.28 -0.57 0.00 0.00 179.45 180.32 1jop h VAL 18 N 0.39 1.24 0.00 0.50 2.07 -1.88 1.57 116.25 120.14 1jop h VAL 18 Ca 0.61 -1.02 -0.17 0.00 0.82 0.00 0.00 66.70 66.93 1jop h VAL 18 Cb 1.22 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 31.93 1jop h VAL 18 CO -0.55 0.35 -0.82 0.40 0.02 0.00 0.00 177.57 176.97 1jop h ILE 19 N 0.67 1.57 0.23 4.57 2.04 -1.45 -2.84 117.51 122.30 1jop h ILE 19 Ca 0.13 -2.75 -0.01 0.00 1.00 0.00 0.00 64.86 63.23 1jop h ILE 19 Cb 0.48 2.49 0.00 0.00 -0.74 0.00 0.00 36.82 39.05 1jop h ILE 19 CO 0.02 0.79 -0.11 0.00 0.00 0.00 0.00 178.15 178.85 1jop h ALA 20 N 1.15 -0.31 -0.89 1.87 0.00 -0.05 0.68 119.26 121.71 1jop h ALA 20 Ca -0.01 -0.19 0.24 0.00 0.00 0.00 0.00 54.91 54.95 1jop h ALA 20 Cb 1.45 0.12 -0.15 0.00 0.00 0.00 0.00 17.79 19.21 1jop h ALA 20 CO 0.11 -0.48 0.18 0.93 0.00 0.00 0.00 179.25 179.99 1jop h GLU 21 N -0.69 0.14 0.00 0.00 5.08 0.21 -1.23 114.58 118.10 1jop h GLU 21 Ca -0.03 -0.01 -0.24 0.00 -1.00 0.00 0.00 59.36 58.08 1jop h GLU 21 Cb 0.48 -0.03 0.02 0.00 0.50 0.00 0.00 28.75 29.72 1jop h GLU 21 CO 0.05 0.10 -0.95 0.28 -1.00 0.00 0.00 179.01 177.49 1jop h VAL 22 N 0.15 1.31 -0.76 3.13 2.07 -1.31 -2.46 116.25 118.39 1jop h VAL 22 Ca 0.56 -2.21 0.06 0.00 0.82 0.00 0.00 66.70 65.93 1jop h VAL 22 Cb 1.14 2.44 -0.05 0.00 -1.52 0.00 0.00 31.29 33.30 1jop h VAL 22 CO -0.71 0.68 0.50 0.00 0.02 0.00 0.00 177.57 178.05 1jop h ASP 24 N 0.81 -0.45 0.03 0.00 3.32 -1.08 -1.51 116.42 117.53 1jop h ASP 24 Ca 0.33 0.14 -0.21 0.00 0.02 0.00 0.00 57.03 57.31 1jop h ASP 24 Cb 0.24 0.29 0.00 0.00 0.22 0.00 0.00 39.33 40.09 1jop h ASP 24 CO -0.11 -0.16 -0.75 0.22 -1.72 0.00 0.00 179.24 176.72 1jop h TYR 25 N -0.01 0.84 -0.46 4.55 5.03 -0.83 -1.83 116.97 124.26 1jop h TYR 25 Ca 0.22 -0.37 0.13 0.00 2.58 0.00 0.00 58.73 61.29 1jop h TYR 25 Cb 0.35 -0.13 -0.02 0.00 1.55 0.00 0.00 36.73 38.48 1jop h TYR 25 CO -0.40 1.17 0.42 -0.07 -1.32 0.00 0.00 178.16 177.95 1jop h LEU 26 N 0.43 0.00 -0.46 2.82 3.38 -0.53 0.22 115.31 121.17 1jop h LEU 26 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1jop h LEU 26 Cb 1.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.11 1jop h LEU 26 CO 0.14 0.00 0.00 0.78 0.09 0.00 0.00 178.44 179.45 1jop h ASN 27 N 0.00 0.00 0.59 -0.43 2.35 -0.40 -1.94 115.58 115.75 1jop h ASN 27 Ca 0.22 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.90 1jop h ASN 27 Cb 1.05 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.41 1jop h ASN 27 CO -0.00 0.00 -0.34 0.74 -1.65 0.00 0.00 177.43 176.18 1jop h THR 28 N 0.00 0.98 -3.61 2.81 2.02 -0.47 -3.47 112.91 111.17 1jop h THR 28 Ca 0.00 -1.30 -0.47 0.00 0.77 0.00 0.00 66.41 65.41 1jop h THR 28 Cb 0.81 1.76 0.05 0.00 -1.74 0.00 0.00 68.15 69.03 1jop h THR 28 CO 0.00 0.34 0.16 -0.76 0.37 0.00 0.00 175.52 175.63 1jop s LEU 29 N -7.49 3.26 -0.83 2.58 1.43 -0.73 -4.96 118.68 111.94 1jop s LEU 29 Ca -0.01 0.70 -0.15 0.00 -1.03 0.00 0.00 54.13 53.63 1jop s LEU 29 Cb 0.13 -3.53 0.20 0.00 0.03 0.00 0.00 46.19 43.01 1jop s LEU 29 CO 0.68 -1.04 0.81 -0.62 0.23 0.00 0.00 176.35 176.42 1jop s ASP 30 N -4.30 6.71 0.27 2.29 -1.08 -1.26 -4.90 116.67 114.41 1jop s ASP 30 Ca 0.53 -2.54 -0.01 0.00 -0.52 0.00 0.00 52.55 50.02 1jop s ASP 30 Cb -0.10 -2.24 0.45 0.00 -1.46 0.00 0.00 42.92 39.57 1jop s ASP 30 CO 0.45 -0.67 1.87 -0.07 0.52 0.00 0.00 175.17 177.27 1jop h LEU 31 N 8.25 1.01 -1.35 -1.34 3.38 -1.93 -1.77 115.31 121.55 1jop h LEU 31 Ca 0.09 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 1jop h LEU 31 Cb 1.04 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.58 1jop h LEU 31 CO 0.82 0.61 0.20 0.78 0.09 0.00 0.00 178.44 180.95 1jop h ASN 32 N 1.12 0.58 1.00 -0.43 2.35 -1.93 -2.62 115.58 115.66 1jop h ASN 32 Ca 0.45 -0.06 0.00 0.00 -0.55 0.00 0.00 56.30 56.15 1jop h ASN 32 Cb 0.27 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.49 1jop h ASN 32 CO -0.20 0.51 0.00 0.00 -1.65 0.00 0.00 177.43 176.09 1jop n ALA 33 N -2.47 2.17 -1.75 -0.83 0.00 -0.68 -4.87 120.51 112.09 1jop n ALA 33 Ca 0.03 -0.07 -0.41 0.00 0.00 0.00 0.00 53.44 53.00 1jop n ALA 33 Cb 0.13 -1.43 0.01 0.00 0.00 0.00 0.00 19.45 18.17 1jop n ALA 33 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1jop n LEU 34 N -1.70 4.81 -4.83 0.00 4.77 -0.99 -4.93 117.00 114.12 1jop n LEU 34 Ca 0.06 1.15 -0.36 0.00 -0.03 0.00 0.00 56.01 56.83 1jop n LEU 34 Cb 0.32 -1.59 -0.06 0.00 -2.33 0.00 0.00 43.42 39.77 1jop n LEU 34 CO 0.25 -0.15 0.30 -0.70 -1.33 0.00 0.00 177.39 175.76 1jop s GLU 35 N -2.29 4.09 0.48 3.23 2.12 -1.26 -4.98 118.70 120.09 1jop s GLU 35 Ca 0.59 0.64 -0.23 0.00 0.36 0.00 0.00 54.97 56.32 1jop s GLU 35 Cb -0.47 -2.95 -0.07 0.00 0.26 0.00 0.00 34.13 30.90 1jop s GLU 35 CO 0.60 0.47 1.24 -0.80 -0.54 0.00 0.00 175.26 176.22 1jop s ASN 36 N -1.62 5.94 0.00 -1.70 0.01 -1.26 -4.65 114.94 111.65 1jop s ASN 36 Ca 0.38 2.48 0.00 0.00 -0.71 0.00 0.00 52.86 55.01 1jop s ASN 36 Cb -0.16 -2.62 0.00 0.00 0.41 0.00 0.00 41.25 38.88 1jop s ASN 36 CO 0.20 -1.09 0.00 0.61 -1.51 0.00 0.00 177.10 175.31 1jop n GLY 37 N 0.56 0.89 3.64 0.66 0.00 0.26 -4.90 105.19 106.30 1jop n GLY 37 Ca 0.08 -1.86 -0.37 0.00 0.00 0.00 0.00 46.02 43.86 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 -2.00 4.03 -0.15 1.61 3.52 -1.26 -0.70 118.95 124.01 1jop s ARG 38 Ca 0.00 -0.29 -0.00 0.00 -0.13 0.00 0.00 55.73 55.31 1jop s ARG 38 Cb 0.00 -3.56 -0.01 0.00 -1.56 0.00 0.00 34.95 29.82 1jop s ARG 38 CO 0.00 0.00 -0.14 -1.01 -0.81 0.00 0.00 175.30 173.35 1jop s HIS 39 N 1.22 2.80 0.70 5.12 3.76 0.25 -4.90 115.29 124.25 1jop s HIS 39 Ca 0.07 -0.86 -0.11 0.00 -0.15 0.00 0.00 55.06 54.01 1jop s HIS 39 Cb -0.14 -1.88 0.01 0.00 1.11 0.00 0.00 32.58 31.68 1jop s HIS 39 CO 0.06 -0.36 1.08 -0.51 -0.85 0.00 0.00 174.74 174.16 1jop s ASP 40 N 0.65 5.52 0.00 1.40 1.01 -1.26 0.30 116.67 124.28 1jop s ASP 40 Ca -0.07 1.24 0.00 0.00 0.71 0.00 0.00 52.55 54.42 1jop s ASP 40 Cb -0.16 -2.09 0.00 0.00 1.01 0.00 0.00 42.92 41.69 1jop s ASP 40 CO 0.02 -1.31 0.00 -0.38 0.21 0.00 0.00 175.17 173.72 1jop n ILE 41 N -3.00 0.00 -2.39 0.77 5.41 -0.72 -4.85 119.36 114.58 1jop n ILE 41 Ca 0.07 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.82 1jop n ILE 41 Cb 0.56 -0.16 0.00 0.00 -0.71 0.00 0.00 39.64 39.33 1jop n ILE 41 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 1jop n ASN 42 N -2.41 0.72 0.00 4.38 3.02 -1.17 -5.02 115.26 114.79 1jop n ASN 42 Ca 0.00 -0.03 0.12 0.00 -0.03 0.00 0.00 54.58 54.64 1jop n ASN 42 Cb 0.00 0.00 0.61 0.00 -0.61 0.00 0.00 39.78 39.78 1jop n ASN 42 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1jop n ASP 43 N -0.07 0.00 0.00 6.41 8.00 -1.26 -4.13 116.55 125.50 1jop n ASP 43 Ca 0.00 -0.01 0.00 0.00 0.71 0.00 0.00 54.79 55.49 1jop n ASP 43 Cb 0.00 -0.31 0.00 0.00 -0.02 0.00 0.00 41.12 40.79 1jop n ASP 43 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1jop n GLN 44 N -1.31 1.74 -4.07 -1.24 6.02 -1.26 -5.03 117.38 112.24 1jop n GLN 44 Ca 0.11 0.00 -0.35 0.00 -0.01 0.00 0.00 57.00 56.75 1jop n GLN 44 Cb 0.20 -0.72 -0.09 0.00 1.02 0.00 0.00 30.24 30.65 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 -1.44 4.81 0.24 5.09 1.01 -1.26 -4.73 121.20 124.92 1jop s ILE 45 Ca 0.00 -0.04 0.02 0.00 0.00 0.00 0.00 60.65 60.63 1jop s ILE 45 Cb 0.00 -3.12 -0.01 0.00 0.01 0.00 0.00 42.46 39.34 1jop s ILE 45 CO 0.00 0.52 0.07 0.00 0.00 0.00 0.00 174.94 175.53 1jop n TYR 46 N 2.92 0.17 -3.89 3.97 4.11 -1.23 -1.75 117.16 121.46 1jop n TYR 46 Ca -0.18 -1.48 -0.11 0.00 -0.00 0.00 0.00 57.90 56.13 1jop n TYR 46 Cb 0.53 -0.03 -0.12 0.00 -0.00 0.00 0.00 39.34 39.72 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 -2.91 0.26 -0.05 -3.48 1.75 0.15 -0.58 119.30 114.43 1jop s MET 47 Ca 0.10 -0.23 0.02 0.00 -1.25 0.00 0.00 55.69 54.34 1jop s MET 47 Cb 0.00 0.10 0.01 0.00 2.84 0.00 0.00 34.83 37.79 1jop s MET 47 CO 0.07 -0.05 -0.11 -0.80 -0.65 0.00 0.00 175.02 173.48 1jop s ASN 48 N -0.76 1.63 -0.08 1.11 0.01 -0.87 0.88 114.94 116.87 1jop s ASN 48 Ca -0.08 -0.27 0.04 0.00 -0.71 0.00 0.00 52.86 51.84 1jop s ASN 48 Cb -0.05 -0.69 -0.01 0.00 0.41 0.00 0.00 41.25 40.91 1jop s ASN 48 CO 0.00 0.04 -0.21 -0.69 -1.51 0.00 0.00 177.10 174.73 1jop s VAL 49 N 0.56 2.39 0.01 1.60 1.01 0.13 -1.04 120.40 125.06 1jop s VAL 49 Ca -0.12 -0.93 -0.02 0.00 0.00 0.00 0.00 61.98 60.92 1jop s VAL 49 Cb -0.14 -1.92 -0.01 0.00 0.00 0.00 0.00 36.38 34.31 1jop s VAL 49 CO 0.03 0.56 0.02 0.00 0.00 0.00 0.00 175.10 175.70 1jop s MET 50 N 0.00 0.28 -0.31 2.72 0.23 -0.92 0.92 119.30 122.22 1jop s MET 50 Ca -0.07 -0.42 -0.02 0.00 -1.03 0.00 0.00 55.69 54.16 1jop s MET 50 Cb -0.15 0.11 0.12 0.00 -1.53 0.00 0.00 34.83 33.38 1jop s MET 50 CO 0.05 -0.05 0.21 -1.21 -2.03 0.00 0.00 175.02 171.99 1jop s GLU 51 N -1.10 0.35 0.11 3.16 2.02 -1.26 -3.17 118.70 118.80 1jop s GLU 51 Ca -0.12 -0.68 0.00 0.00 0.02 0.00 0.00 54.97 54.19 1jop s GLU 51 Cb -0.07 -1.05 0.00 0.00 0.10 0.00 0.00 34.13 33.11 1jop s GLU 51 CO -0.00 -1.09 0.00 -2.30 0.02 0.00 0.00 175.26 171.89 1jop n PRO 52 N 4.87 1.49 0.00 0.39 -0.02 -1.26 -4.98 135.00 135.50 1jop n PRO 52 Ca 0.01 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.49 1jop n PRO 52 Cb 0.42 -0.21 0.00 0.00 -0.02 0.00 0.00 33.50 33.69 1jop n PRO 52 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 1jop n LYS 61 N 0.63 0.00 -3.14 -0.52 2.85 -1.26 -5.03 118.16 111.69 1jop n LYS 61 Ca 0.00 0.00 -0.27 0.00 -1.05 0.00 0.00 58.31 56.99 1jop n LYS 61 Cb 0.00 0.00 -0.02 0.00 -0.65 0.00 0.00 35.03 34.36 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 0.00 3.57 0.23 0.58 0.00 0.12 -4.85 121.76 121.41 1jop s ALA 62 Ca 0.00 -0.65 0.11 0.00 0.00 0.00 0.00 51.96 51.42 1jop s ALA 62 Cb 0.00 -2.33 -0.05 0.00 0.00 0.00 0.00 23.12 20.74 1jop s ALA 62 CO 0.00 -0.02 -0.20 -2.00 0.00 0.00 0.00 175.76 173.54 1jop s GLU 63 N -4.14 1.52 0.20 0.00 2.12 0.01 -1.27 118.70 117.15 1jop s GLU 63 Ca 0.44 -1.63 -0.21 0.00 0.36 0.00 0.00 54.97 53.93 1jop s GLU 63 Cb -0.10 -1.62 0.04 0.00 0.26 0.00 0.00 34.13 32.71 1jop s GLU 63 CO 0.36 0.31 0.61 -1.17 -0.54 0.00 0.00 175.26 174.84 1jop s LEU 64 N -3.14 -0.29 0.12 2.70 0.20 -1.06 -1.19 118.68 116.02 1jop s LEU 64 Ca 0.24 -0.32 0.03 0.00 0.69 0.00 0.00 54.13 54.78 1jop s LEU 64 Cb -0.05 2.50 -0.04 0.00 -0.43 0.00 0.00 46.19 48.17 1jop s LEU 64 CO 0.11 -1.10 -0.09 -1.00 -0.29 0.00 0.00 176.35 173.98 1jop s HIS 65 N -3.84 1.10 -0.15 5.38 3.76 -1.26 -1.44 115.29 118.84 1jop s HIS 65 Ca 0.06 -0.77 0.01 0.00 -0.15 0.00 0.00 55.06 54.22 1jop s HIS 65 Cb -0.02 -0.59 -0.10 0.00 1.11 0.00 0.00 32.58 32.98 1jop s HIS 65 CO -0.04 -0.00 -0.13 0.72 -0.85 0.00 0.00 174.74 174.44 1jop n HIS 66 N 0.07 0.00 -0.06 1.40 -0.00 -1.26 -0.06 115.22 115.31 1jop n HIS 66 Ca -0.12 0.00 -0.19 0.00 -0.00 0.00 0.00 57.72 57.40 1jop n HIS 66 Cb 0.60 -0.57 -0.13 0.00 -0.00 0.00 0.00 29.99 29.89 1jop n HIS 66 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.34 176.73 1jop n GLU 67 N -2.92 0.70 -4.21 -0.41 1.02 -1.26 -4.84 120.64 108.73 1jop n GLU 67 Ca -0.26 0.20 -0.23 0.00 -0.02 0.00 0.00 57.16 56.86 1jop n GLU 67 Cb 0.78 -1.62 -0.06 0.00 -0.02 0.00 0.00 31.44 30.52 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 -2.54 2.90 0.43 -0.32 1.51 -1.26 -1.23 117.35 116.84 1jop s TYR 68 Ca -0.27 -0.16 0.08 0.00 -1.01 0.00 0.00 57.07 55.70 1jop s TYR 68 Cb 0.08 -1.30 0.01 0.00 -0.11 0.00 0.00 41.96 40.64 1jop s TYR 68 CO 0.70 0.57 0.55 -0.48 -1.11 0.00 0.00 175.55 175.78 1jop s LEU 69 N -3.71 3.56 -0.09 -1.29 0.05 0.71 -3.84 118.68 114.07 1jop s LEU 69 Ca 0.32 -0.52 0.03 0.00 0.05 0.00 0.00 54.13 54.01 1jop s LEU 69 Cb -0.07 -2.46 -0.01 0.00 -2.05 0.00 0.00 46.19 41.60 1jop s LEU 69 CO 0.22 -0.79 -0.20 -1.81 -0.55 0.00 0.00 176.35 173.22 1jop s ASP 70 N -4.33 3.46 -0.46 1.48 1.11 -0.10 -3.01 116.67 114.81 1jop s ASP 70 Ca 0.54 -0.44 -0.15 0.00 0.18 0.00 0.00 52.55 52.68 1jop s ASP 70 Cb -0.08 -1.26 0.07 0.00 1.07 0.00 0.00 42.92 42.72 1jop s ASP 70 CO 0.32 0.20 0.38 -0.69 1.18 0.00 0.00 175.17 176.56 1jop s VAL 71 N 0.10 5.14 -0.00 -1.27 1.01 -0.89 -0.96 120.40 123.53 1jop s VAL 71 Ca -0.09 -1.07 -0.16 0.00 0.00 0.00 0.00 61.98 60.65 1jop s VAL 71 Cb -0.15 -4.06 -0.06 0.00 0.00 0.00 0.00 36.38 32.11 1jop s VAL 71 CO 0.06 -0.56 0.46 -1.10 0.00 0.00 0.00 175.10 173.96 1jop s GLN 72 N 1.62 4.05 -0.17 2.72 -0.21 0.15 -0.55 119.66 127.27 1jop s GLN 72 Ca 0.04 0.50 -0.04 0.00 0.02 0.00 0.00 55.36 55.88 1jop s GLN 72 Cb -0.24 -3.26 0.06 0.00 1.00 0.00 0.00 33.01 30.57 1jop s GLN 72 CO 0.06 0.59 0.05 0.08 -2.12 0.00 0.00 175.29 173.96 1jop s VAL 73 N -0.81 0.27 0.36 1.09 1.01 -0.71 -0.89 120.40 120.72 1jop s VAL 73 Ca 0.25 -0.35 -0.25 0.00 0.00 0.00 0.00 61.98 61.63 1jop s VAL 73 Cb -0.17 -0.81 -0.09 0.00 0.00 0.00 0.00 36.38 35.31 1jop s VAL 73 CO 0.14 -0.20 1.05 -0.22 0.00 0.00 0.00 175.10 175.87 1jop s LEU 74 N 1.98 4.26 -0.03 3.92 2.96 -1.08 -1.53 118.68 129.15 1jop s LEU 74 Ca 0.01 2.07 0.01 0.00 -0.22 0.00 0.00 54.13 55.99 1jop s LEU 74 Cb -0.16 -4.04 -0.02 0.00 0.50 0.00 0.00 46.19 42.47 1jop s LEU 74 CO -0.08 -0.37 -0.01 -0.38 -1.32 0.00 0.00 176.35 174.19 1jop n ILE 75 N 0.29 0.15 -3.80 6.68 5.41 0.26 -3.03 119.36 125.32 1jop n ILE 75 Ca 0.03 -0.07 -0.13 0.00 1.00 0.00 0.00 62.75 63.59 1jop n ILE 75 Cb 0.49 -0.70 -0.12 0.00 -0.71 0.00 0.00 39.64 38.60 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 -2.05 0.30 0.00 0.38 0.52 -0.39 -4.76 118.95 112.94 1jop s ARG 76 Ca -0.03 0.25 0.00 0.00 -0.52 0.00 0.00 55.73 55.43 1jop s ARG 76 Cb 0.01 0.14 0.00 0.00 0.52 0.00 0.00 34.95 35.62 1jop s ARG 76 CO 0.07 -0.04 0.00 0.41 0.02 0.00 0.00 175.30 175.76 1jop n GLY 77 N 2.79 0.08 3.36 -3.53 0.00 -1.26 -0.76 105.19 105.86 1jop n GLY 77 Ca -0.14 -2.06 -0.13 0.00 0.00 0.00 0.00 46.02 43.69 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 0.00 -0.06 2.61 2.01 -1.26 -4.13 115.64 114.81 1jop s THR 78 Ca 0.00 -0.03 -0.11 0.00 0.31 0.00 0.00 61.69 61.86 1jop s THR 78 Cb 0.00 -0.66 0.02 0.00 0.01 0.00 0.00 72.50 71.88 1jop s THR 78 CO 0.00 -0.01 0.27 -0.70 -0.69 0.00 0.00 174.62 173.48 1jop s GLU 79 N 0.12 0.47 -0.22 4.92 2.12 -0.81 -4.91 118.70 120.39 1jop s GLU 79 Ca -0.01 0.06 -0.05 0.00 0.36 0.00 0.00 54.97 55.33 1jop s GLU 79 Cb -0.03 0.21 -0.02 0.00 0.26 0.00 0.00 34.13 34.56 1jop s GLU 79 CO 0.01 -0.10 -0.01 -0.80 -0.54 0.00 0.00 175.26 173.82 1jop s ASN 80 N -0.61 4.57 -0.11 -1.70 0.01 -1.17 0.35 114.94 116.29 1jop s ASN 80 Ca -0.07 -0.31 -0.02 0.00 -0.71 0.00 0.00 52.86 51.74 1jop s ASN 80 Cb -0.04 -1.79 -0.03 0.00 0.41 0.00 0.00 41.25 39.80 1jop s ASN 80 CO 0.02 0.00 -0.02 -0.63 -1.51 0.00 0.00 177.10 174.96 1jop s ILE 81 N 1.36 4.13 0.14 0.60 1.01 0.33 -3.92 121.20 124.85 1jop s ILE 81 Ca 0.04 -0.30 -0.20 0.00 0.00 0.00 0.00 60.65 60.19 1jop s ILE 81 Cb -0.14 -2.76 -0.07 0.00 0.01 0.00 0.00 42.46 39.49 1jop s ILE 81 CO -0.00 0.56 0.65 -1.61 0.00 0.00 0.00 174.94 174.54 1jop s GLU 82 N -0.43 4.27 -0.22 2.79 2.02 0.28 -1.57 118.70 125.84 1jop s GLU 82 Ca 0.07 0.84 -0.11 0.00 0.02 0.00 0.00 54.97 55.79 1jop s GLU 82 Cb -0.12 -3.13 0.07 0.00 0.10 0.00 0.00 34.13 31.05 1jop s GLU 82 CO 0.02 0.55 0.52 0.08 0.02 0.00 0.00 175.26 176.45 1jop s VAL 83 N -1.25 -0.13 0.24 2.63 1.01 -1.18 0.24 120.40 121.96 1jop s VAL 83 Ca 0.35 0.06 0.11 0.00 0.00 0.00 0.00 61.98 62.50 1jop s VAL 83 Cb -0.19 -0.77 -0.05 0.00 0.00 0.00 0.00 36.38 35.37 1jop s VAL 83 CO 0.21 0.03 -0.19 -0.83 0.00 0.00 0.00 175.10 174.32 1jop s GLY 84 N 1.69 1.80 -0.00 4.51 0.00 0.25 -2.60 107.32 112.97 1jop s GLY 84 Ca -0.09 -1.75 0.05 0.00 0.00 0.00 0.00 44.72 42.93 1jop s GLY 84 CO -0.16 -1.82 0.17 0.00 0.00 0.00 0.00 173.10 171.29 1jop n ALA 85 N -0.32 2.45 -1.78 3.20 0.00 -1.26 -4.06 120.51 118.75 1jop n ALA 85 Ca -0.08 -0.13 -0.37 0.00 0.00 0.00 0.00 53.44 52.86 1jop n ALA 85 Cb 0.58 -0.17 -0.04 0.00 0.00 0.00 0.00 19.45 19.82 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 -1.78 3.70 0.36 0.00 2.01 -1.26 -4.95 115.64 113.72 1jop s THR 86 Ca 0.00 1.35 -0.28 0.00 0.31 0.00 0.00 61.69 63.07 1jop s THR 86 Cb 0.03 -3.72 -0.11 0.00 0.01 0.00 0.00 72.50 68.71 1jop s THR 86 CO 0.20 0.06 1.44 -0.47 -0.69 0.00 0.00 174.62 175.15 1jop s TYR 87 N -1.59 2.73 0.66 4.92 5.04 -1.26 -4.88 117.35 122.97 1jop s TYR 87 Ca 0.56 1.22 -0.12 0.00 -2.44 0.00 0.00 57.07 56.29 1jop s TYR 87 Cb -0.23 -3.92 -0.01 0.00 0.35 0.00 0.00 41.96 38.15 1jop s TYR 87 CO 0.29 -2.68 1.06 -1.25 -1.34 0.00 0.00 175.55 171.63 1jop s PRO 88 N -1.92 3.07 -0.64 4.97 0.04 -1.26 -4.95 135.00 134.31 1jop s PRO 88 Ca 0.52 1.03 -0.27 0.00 0.04 0.00 0.00 61.00 62.33 1jop s PRO 88 Cb -0.44 -2.01 0.03 0.00 0.04 0.00 0.00 34.50 32.12 1jop s PRO 88 CO 0.59 -1.00 1.18 1.21 0.04 0.00 0.00 177.00 179.02 1jop s ASN 89 N -3.46 6.30 0.48 6.66 3.84 -1.26 -4.91 114.94 122.58 1jop s ASN 89 Ca 0.60 -0.25 0.31 0.00 0.21 0.00 0.00 52.86 53.73 1jop s ASN 89 Cb -0.15 -2.53 1.19 0.00 -0.55 0.00 0.00 41.25 39.21 1jop s ASN 89 CO 0.49 -1.58 1.89 -0.07 -2.79 0.00 0.00 177.10 175.04 1jop h LEU 90 N 12.18 0.00 -0.62 3.21 3.38 -1.98 -2.90 115.31 128.58 1jop h LEU 90 Ca -0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.70 1jop h LEU 90 Cb 1.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.81 1jop h LEU 90 CO 1.21 0.00 0.00 0.77 0.09 0.00 0.00 178.44 180.51 1jop h SER 91 N 0.00 0.00 -0.19 -0.43 4.64 -2.00 -0.36 113.55 115.21 1jop h SER 91 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1jop h SER 91 Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 1jop h SER 91 CO 0.00 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.25 1jop n LYS 92 N -2.70 1.99 -3.66 4.77 5.02 -1.09 -4.94 118.16 117.56 1jop n LYS 92 Ca 0.03 -1.48 -0.36 0.00 -2.02 0.00 0.00 58.31 54.48 1jop n LYS 92 Cb 0.36 -1.45 -0.06 0.00 -0.02 0.00 0.00 35.03 33.87 1jop n LYS 92 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1jop s TYR 93 N -1.77 3.63 0.99 2.13 1.51 -0.15 -4.81 117.35 118.89 1jop s TYR 93 Ca 0.34 0.75 -0.11 0.00 -1.01 0.00 0.00 57.07 57.04 1jop s TYR 93 Cb 0.20 -2.12 0.18 0.00 -0.11 0.00 0.00 41.96 40.12 1jop s TYR 93 CO 0.29 0.62 1.08 0.39 -1.11 0.00 0.00 175.55 176.82 1jop n GLU 94 N 1.45 -1.03 -2.20 -0.62 1.02 0.26 -4.92 120.64 114.59 1jop n GLU 94 Ca -0.13 -0.24 -0.27 0.00 -0.02 0.00 0.00 57.16 56.50 1jop n GLU 94 Cb 0.53 -2.30 0.13 0.00 -0.02 0.00 0.00 31.44 29.78 1jop n GLU 94 CO 0.00 0.00 0.00 0.16 1.18 0.00 0.00 177.13 178.47 1jop s ASP 95 N -2.55 3.91 0.29 1.62 -4.77 -1.26 -4.06 116.67 109.85 1jop s ASP 95 Ca 0.67 0.11 -0.27 0.00 -3.30 0.00 0.00 52.55 49.76 1jop s ASP 95 Cb -0.24 -0.40 -0.10 0.00 -1.09 0.00 0.00 42.92 41.10 1jop s ASP 95 CO 0.60 -2.19 0.94 -0.47 0.70 0.00 0.00 175.17 174.75 1jop s TYR 96 N -3.50 3.79 -0.28 2.11 5.04 -1.26 -4.48 117.35 118.76 1jop s TYR 96 Ca 0.68 1.82 -0.04 0.00 -2.44 0.00 0.00 57.07 57.09 1jop s TYR 96 Cb -0.06 -2.93 0.03 0.00 0.35 0.00 0.00 41.96 39.34 1jop s TYR 96 CO 0.48 0.29 0.01 1.21 -1.34 0.00 0.00 175.55 176.21 1jop s ASN 97 N -1.48 4.79 0.53 4.32 3.84 -0.56 -4.94 114.94 121.44 1jop s ASN 97 Ca 0.47 -0.91 0.33 0.00 0.21 0.00 0.00 52.86 52.96 1jop s ASN 97 Cb -0.21 -1.77 1.37 0.00 -0.55 0.00 0.00 41.25 40.09 1jop s ASN 97 CO 0.26 -0.19 1.97 -0.08 -2.79 0.00 0.00 177.10 176.27 1jop h GLU 98 N 8.11 0.00 0.12 0.43 4.81 -1.93 -2.42 114.58 123.70 1jop h GLU 98 Ca -0.29 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.93 1jop h GLU 98 Cb 1.10 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.48 1jop h GLU 98 CO 0.58 0.00 -0.06 0.00 -0.73 0.00 0.00 179.01 178.80 1jop h ALA 99 N 2.02 -0.16 -0.50 2.92 0.00 -1.98 -3.33 119.26 118.24 1jop h ALA 99 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1jop h ALA 99 Cb 0.48 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1jop h ALA 99 CO 0.00 -0.24 0.00 -0.25 0.00 0.00 0.00 179.25 178.76 1jop n ASP 100 N -4.87 4.90 -3.53 0.00 9.92 -1.25 -5.01 116.55 116.71 1jop n ASP 100 Ca -0.08 -2.73 -0.24 0.00 -0.53 0.00 0.00 54.79 51.21 1jop n ASP 100 Cb 0.27 -0.64 0.01 0.00 -0.64 0.00 0.00 41.12 40.12 1jop n ASP 100 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 1jop n ASP 101 N 0.58 -5.72 -3.50 -2.24 2.03 -0.94 -5.00 116.55 101.76 1jop n ASP 101 Ca 0.23 -0.49 -0.12 0.00 0.52 0.00 0.00 54.79 54.94 1jop n ASP 101 Cb 1.02 -2.51 -0.03 0.00 -0.72 0.00 0.00 41.12 38.87 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 -2.53 -0.46 0.12 -0.67 -0.85 -1.04 -4.35 117.35 107.56 1jop s TYR 102 Ca 0.13 0.51 0.04 0.00 -0.52 0.00 0.00 57.07 57.23 1jop s TYR 102 Cb -0.02 0.50 -0.04 0.00 0.38 0.00 0.00 41.96 42.78 1jop s TYR 102 CO 0.86 -0.60 -0.09 -0.65 -1.52 0.00 0.00 175.55 173.55 1jop s GLN 103 N -2.50 0.94 0.28 -3.49 -0.21 -0.52 -1.49 119.66 112.67 1jop s GLN 103 Ca -0.01 -1.33 0.09 0.00 0.02 0.00 0.00 55.36 54.14 1jop s GLN 103 Cb -0.01 -0.51 -0.05 0.00 1.00 0.00 0.00 33.01 33.44 1jop s GLN 103 CO -0.04 0.06 -0.12 -0.51 -2.12 0.00 0.00 175.29 172.55 1jop s LEU 104 N -2.90 2.59 -0.08 2.90 1.43 -1.26 -2.55 118.68 118.81 1jop s LEU 104 Ca 0.12 -1.11 -0.30 0.00 -1.03 0.00 0.00 54.13 51.81 1jop s LEU 104 Cb 0.01 -0.86 0.11 0.00 0.03 0.00 0.00 46.19 45.49 1jop s LEU 104 CO -0.01 -0.17 0.91 0.00 0.23 0.00 0.00 176.35 177.32 1jop n ALA 106 N 0.30 2.42 -2.23 0.00 0.00 -1.26 0.11 120.51 119.84 1jop n ALA 106 Ca -0.10 -0.08 -0.08 0.00 0.00 0.00 0.00 53.44 53.18 1jop n ALA 106 Cb 0.60 -1.43 -0.09 0.00 0.00 0.00 0.00 19.45 18.53 1jop n ALA 106 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1jop s ASP 107 N -3.94 0.39 -0.05 0.00 1.01 -1.26 -4.55 116.67 108.27 1jop s ASP 107 Ca 0.11 -0.89 0.02 0.00 0.71 0.00 0.00 52.55 52.50 1jop s ASP 107 Cb 0.15 0.23 0.02 0.00 1.01 0.00 0.00 42.92 44.33 1jop s ASP 107 CO 0.59 -0.63 -0.08 -0.63 0.21 0.00 0.00 175.17 174.64 1jop s ILE 108 N -3.84 0.79 0.09 0.77 1.01 -1.26 -4.86 121.20 113.90 1jop s ILE 108 Ca 0.06 -0.28 -0.12 0.00 0.00 0.00 0.00 60.65 60.30 1jop s ILE 108 Cb 0.07 -0.76 -0.06 0.00 0.01 0.00 0.00 42.46 41.72 1jop s ILE 108 CO -0.10 0.28 0.46 -1.81 0.00 0.00 0.00 174.94 173.76 1jop s ASP 109 N 0.75 6.74 -0.54 3.58 1.01 -1.26 -4.01 116.67 122.95 1jop s ASP 109 Ca -0.13 0.93 0.00 0.00 0.71 0.00 0.00 52.55 54.06 1jop s ASP 109 Cb -0.15 -2.23 0.00 0.00 1.01 0.00 0.00 42.92 41.55 1jop s ASP 109 CO 0.02 0.18 0.00 0.47 0.21 0.00 0.00 175.17 176.04 1jop n ASP 110 N 1.04 -3.16 -4.77 0.27 8.00 -1.26 -4.59 116.55 112.07 1jop n ASP 110 Ca -0.08 0.08 -0.40 0.00 0.71 0.00 0.00 54.79 55.10 1jop n ASP 110 Cb 0.52 -1.64 -0.01 0.00 -0.02 0.00 0.00 41.12 39.97 1jop n ASP 110 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1jop s LYS 111 N -3.10 4.17 0.17 -1.24 1.02 -1.26 -4.50 119.74 115.00 1jop s LYS 111 Ca 0.00 2.33 -0.00 0.00 0.02 0.00 0.00 55.97 58.31 1jop s LYS 111 Cb 0.00 -2.96 -0.04 0.00 -0.52 0.00 0.00 37.83 34.31 1jop s LYS 111 CO 0.00 -0.39 0.06 -0.59 -0.92 0.00 0.00 175.35 173.52 1jop s PHE 112 N -1.16 1.07 -0.27 3.18 -0.71 -1.07 -5.03 117.98 113.99 1jop s PHE 112 Ca 0.52 -1.21 -0.07 0.00 -1.04 0.00 0.00 56.93 55.13 1jop s PHE 112 Cb -0.42 -0.59 -0.01 0.00 -1.21 0.00 0.00 43.02 40.79 1jop s PHE 112 CO 0.56 -0.45 0.08 0.99 -1.34 0.00 0.00 175.22 175.05 1jop s THR 113 N -3.95 4.18 -0.21 -4.49 2.01 -1.26 -3.12 115.64 108.80 1jop s THR 113 Ca 0.28 -0.41 -0.16 0.00 0.31 0.00 0.00 61.69 61.71 1jop s THR 113 Cb 0.07 -3.05 -0.04 0.00 0.01 0.00 0.00 72.50 69.49 1jop s THR 113 CO 0.06 0.21 0.40 -0.69 -0.69 0.00 0.00 174.62 173.90 1jop s VAL 114 N 1.57 5.19 -0.23 3.82 1.01 -0.61 -4.92 120.40 126.22 1jop s VAL 114 Ca 0.05 0.69 -0.18 0.00 0.00 0.00 0.00 61.98 62.54 1jop s VAL 114 Cb -0.16 -3.73 -0.03 0.00 0.00 0.00 0.00 36.38 32.46 1jop s VAL 114 CO 0.03 0.23 0.51 -0.89 0.00 0.00 0.00 175.10 174.98 1jop s THR 115 N 1.47 5.09 -0.12 3.92 2.01 -1.26 0.12 115.64 126.87 1jop s THR 115 Ca 0.18 0.90 -0.08 0.00 0.31 0.00 0.00 61.69 63.01 1jop s THR 115 Cb -0.15 -3.83 -0.04 0.00 0.01 0.00 0.00 72.50 68.49 1jop s THR 115 CO 0.08 0.13 0.16 -0.04 -0.69 0.00 0.00 174.62 174.26 1jop s MET 116 N 1.99 3.57 0.34 4.92 -1.94 1.10 -4.87 119.30 124.40 1jop s MET 116 Ca 0.22 -0.10 0.09 0.00 -1.71 0.00 0.00 55.69 54.19 1jop s MET 116 Cb -0.15 -3.22 -0.06 0.00 2.01 0.00 0.00 34.83 33.40 1jop s MET 116 CO 0.09 0.71 -0.08 0.15 -0.01 0.00 0.00 175.02 175.88 1jop s LYS 117 N -0.85 1.78 0.38 2.03 1.02 -1.26 -1.93 119.74 120.90 1jop s LYS 117 Ca 0.15 -1.92 -0.26 0.00 0.02 0.00 0.00 55.97 53.95 1jop s LYS 117 Cb -0.12 -1.60 -0.11 0.00 -0.52 0.00 0.00 37.83 35.48 1jop s LYS 117 CO 0.04 0.11 1.17 -2.30 -0.92 0.00 0.00 175.35 173.45 1jop n PRO 118 N -0.77 1.76 0.00 -1.68 -0.02 -1.26 0.10 135.00 133.14 1jop n PRO 118 Ca -0.05 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 1jop n PRO 118 Cb 0.64 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.92 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 0.32 0.00 -1.76 -0.52 5.02 -1.17 -4.96 118.16 115.09 1jop n LYS 119 Ca 0.07 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.95 1jop n LYS 119 Cb 0.37 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.37 1jop n LYS 119 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 1jop n MET 120 N 0.00 2.68 -4.35 1.97 2.81 0.12 -0.64 117.12 119.72 1jop n MET 120 Ca 0.00 0.95 -0.18 0.00 -1.81 0.00 0.00 57.70 56.66 1jop n MET 120 Cb 0.00 -2.71 -0.10 0.00 -0.71 0.00 0.00 33.22 29.70 1jop n MET 120 CO 0.00 0.00 0.00 -0.59 1.51 0.00 0.00 175.97 176.89 1jop s PHE 121 N -0.45 1.70 -0.11 2.03 -0.12 0.32 -2.65 117.98 118.71 1jop s PHE 121 Ca 0.60 -0.59 -0.05 0.00 -0.05 0.00 0.00 56.93 56.84 1jop s PHE 121 Cb -0.49 -0.81 0.05 0.00 -0.63 0.00 0.00 43.02 41.15 1jop s PHE 121 CO 0.55 0.34 0.24 0.00 -0.05 0.00 0.00 175.22 176.29 1jop s ALA 122 N -2.99 -0.51 -0.19 1.99 0.00 -0.07 0.05 121.76 120.03 1jop s ALA 122 Ca 0.23 0.93 -0.03 0.00 0.00 0.00 0.00 51.96 53.09 1jop s ALA 122 Cb -0.00 -0.72 -0.01 0.00 0.00 0.00 0.00 23.12 22.39 1jop s ALA 122 CO 0.07 -0.32 -0.07 0.08 0.00 0.00 0.00 175.76 175.52 1jop s VAL 123 N 1.59 3.24 -0.16 0.00 1.01 -0.01 0.33 120.40 126.40 1jop s VAL 123 Ca -0.06 -0.55 -0.00 0.00 0.00 0.00 0.00 61.98 61.36 1jop s VAL 123 Cb -0.11 -2.44 -0.00 0.00 0.00 0.00 0.00 36.38 33.82 1jop s VAL 123 CO -0.08 0.46 -0.13 -0.36 0.00 0.00 0.00 175.10 174.98 1jop s PHE 124 N 1.16 2.82 0.70 5.22 0.08 -0.13 -2.46 117.98 125.36 1jop s PHE 124 Ca 0.02 -0.99 -0.11 0.00 0.12 0.00 0.00 56.93 55.97 1jop s PHE 124 Cb -0.14 -1.92 0.01 0.00 -0.57 0.00 0.00 43.02 40.40 1jop s PHE 124 CO -0.02 -0.46 1.07 0.71 -0.10 0.00 0.00 175.22 176.42 1jop s TYR 125 N 0.86 3.24 0.23 0.36 1.51 -1.26 -0.93 117.35 121.37 1jop s TYR 125 Ca -0.04 1.23 -0.29 0.00 -1.01 0.00 0.00 57.07 56.97 1jop s TYR 125 Cb -0.15 -2.94 -0.16 0.00 -0.11 0.00 0.00 41.96 38.60 1jop s TYR 125 CO -0.00 -1.19 0.79 -2.30 -1.11 0.00 0.00 175.55 171.73 1jop n PRO 126 N -3.06 0.66 -0.57 -1.71 -0.02 -1.25 0.13 135.00 129.17 1jop n PRO 126 Ca 0.07 0.23 0.00 0.00 -2.02 0.00 0.00 63.50 61.78 1jop n PRO 126 Cb 0.55 -1.44 0.00 0.00 -0.02 0.00 0.00 33.50 32.60 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 0.23 0.00 -2.99 6.00 4.01 0.91 -4.88 117.16 120.44 1jop n TYR 127 Ca 0.14 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.47 1jop n TYR 127 Cb 0.28 -0.34 -0.05 0.00 -0.31 0.00 0.00 39.34 38.91 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 -0.17 4.17 0.32 -0.72 2.02 0.12 -4.41 118.70 120.03 1jop s GLU 128 Ca 0.00 0.78 -0.20 0.00 0.02 0.00 0.00 54.97 55.57 1jop s GLU 128 Cb 0.00 -3.63 -0.09 0.00 0.10 0.00 0.00 34.13 30.50 1jop s GLU 128 CO 0.00 -0.43 0.82 -1.25 0.02 0.00 0.00 175.26 174.42 1jop s PRO 129 N 2.56 4.24 0.21 0.39 0.04 -1.26 -4.63 135.00 136.54 1jop s PRO 129 Ca 0.32 0.95 -0.16 0.00 0.04 0.00 0.00 61.00 62.14 1jop s PRO 129 Cb -0.16 -2.58 0.02 0.00 0.04 0.00 0.00 34.50 31.83 1jop s PRO 129 CO 0.08 0.21 0.51 -3.38 0.04 0.00 0.00 177.00 174.47 1jop s HIS 130 N -1.82 -0.02 -0.48 0.56 -3.43 -0.33 0.88 115.29 110.65 1jop s HIS 130 Ca 0.52 -0.34 0.05 0.00 -0.80 0.00 0.00 55.06 54.50 1jop s HIS 130 Cb -0.13 0.35 0.24 0.00 -1.43 0.00 0.00 32.58 31.60 1jop s HIS 130 CO 0.19 -0.94 0.89 1.17 -2.00 0.00 0.00 174.74 174.06 1jop n LYS 131 N -0.34 0.69 -1.57 -0.38 4.81 0.67 -0.81 118.16 121.23 1jop n LYS 131 Ca -0.08 -1.69 -0.49 0.00 -0.87 0.00 0.00 58.31 55.18 1jop n LYS 131 Cb 0.62 -1.36 -0.06 0.00 0.02 0.00 0.00 35.03 34.25 1jop n LYS 131 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 1jop n PRO 132 N 1.83 1.60 0.00 1.64 -0.02 -1.26 -0.56 135.00 138.23 1jop n PRO 132 Ca 0.10 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 1jop n PRO 132 Cb 0.63 -2.64 0.00 0.00 -0.02 0.00 0.00 33.50 31.46 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 -0.49 0.00 0.00 0.00 0.24 -1.26 -3.03 118.33 113.79 1jop n VAL 135 Ca -0.06 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.24 1jop n VAL 135 Cb 0.60 -0.33 0.00 0.00 -1.47 0.00 0.00 33.84 32.64 1jop n VAL 135 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 1jop n ILE 143 N -2.84 0.00 -4.29 1.34 5.41 -1.26 -5.00 119.36 112.72 1jop n ILE 143 Ca 0.00 0.00 -0.20 0.00 1.00 0.00 0.00 62.75 63.55 1jop n ILE 143 Cb 0.00 0.00 -0.11 0.00 -0.71 0.00 0.00 39.64 38.82 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 -2.34 1.15 0.05 0.38 2.20 0.06 -4.10 119.74 117.13 1jop s LYS 144 Ca 0.00 -1.32 -0.27 0.00 -0.36 0.00 0.00 55.97 54.02 1jop s LYS 144 Cb 0.00 -1.12 0.10 0.00 -1.51 0.00 0.00 37.83 35.30 1jop s LYS 144 CO 0.00 0.22 1.20 -1.59 -0.36 0.00 0.00 175.35 174.82 1jop s LYS 145 N -2.73 0.68 0.21 4.03 -2.85 -1.19 -0.57 119.74 117.32 1jop s LYS 145 Ca 0.12 -0.42 -0.10 0.00 -1.00 0.00 0.00 55.97 54.58 1jop s LYS 145 Cb -0.05 0.21 -0.01 0.00 -2.06 0.00 0.00 37.83 35.91 1jop s LYS 145 CO 0.05 -0.32 0.36 -0.48 0.10 0.00 0.00 175.35 175.05 1jop s LEU 146 N -3.37 0.67 -0.12 2.77 2.34 -0.58 -2.16 118.68 118.23 1jop s LEU 146 Ca 0.21 -0.97 -0.05 0.00 0.06 0.00 0.00 54.13 53.39 1jop s LEU 146 Cb 0.01 1.35 0.06 0.00 -0.56 0.00 0.00 46.19 47.05 1jop s LEU 146 CO -0.00 -1.00 0.24 -0.69 -1.06 0.00 0.00 176.35 173.84 1jop s VAL 147 N -4.02 -0.39 -0.21 1.48 1.01 -0.21 -1.74 120.40 116.33 1jop s VAL 147 Ca 0.23 0.29 -0.10 0.00 0.00 0.00 0.00 61.98 62.40 1jop s VAL 147 Cb 0.02 -0.42 -0.05 0.00 0.00 0.00 0.00 36.38 35.93 1jop s VAL 147 CO 0.06 0.12 0.13 -0.69 0.00 0.00 0.00 175.10 174.72 1jop s VAL 148 N 2.39 5.30 -0.27 2.92 1.01 0.29 -2.04 120.40 130.00 1jop s VAL 148 Ca 0.02 0.15 -0.14 0.00 0.00 0.00 0.00 61.98 62.01 1jop s VAL 148 Cb -0.12 -3.43 -0.04 0.00 0.00 0.00 0.00 36.38 32.79 1jop s VAL 148 CO -0.08 0.42 0.31 -0.54 0.00 0.00 0.00 175.10 175.21 1jop s LYS 149 N 0.57 4.01 -0.17 2.72 -0.14 0.25 -2.11 119.74 124.87 1jop s LYS 149 Ca 0.07 -0.07 0.01 0.00 -1.36 0.00 0.00 55.97 54.62 1jop s LYS 149 Cb -0.12 -3.65 0.03 0.00 -1.68 0.00 0.00 37.83 32.41 1jop s LYS 149 CO 0.00 -0.22 -0.15 0.08 -0.76 0.00 0.00 175.35 174.30 1jop s VAL 150 N 1.90 1.77 0.17 3.17 1.01 -1.16 -3.56 120.40 123.69 1jop s VAL 150 Ca 0.12 -0.85 -0.31 0.00 0.00 0.00 0.00 61.98 60.95 1jop s VAL 150 Cb -0.16 -1.68 -0.09 0.00 0.00 0.00 0.00 36.38 34.45 1jop s VAL 150 CO 0.10 0.41 1.47 -2.16 0.00 0.00 0.00 175.10 174.92 1jop s PRO 151 N 1.39 4.27 0.58 2.72 0.04 -1.26 0.26 135.00 142.99 1jop s PRO 151 Ca 0.03 2.25 0.29 0.00 0.04 0.00 0.00 61.00 63.61 1jop s PRO 151 Cb -0.14 -3.17 1.44 0.00 0.04 0.00 0.00 34.50 32.67 1jop s PRO 151 CO -0.11 -0.50 1.84 0.28 0.04 0.00 0.00 177.00 178.56 1jop h VAL 152 N 3.97 0.37 0.00 -0.36 2.07 -1.46 0.12 116.25 120.96 1jop h VAL 152 Ca -0.43 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.05 1jop h VAL 152 Cb 1.21 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 31.52 1jop h VAL 152 CO 0.86 0.00 -0.20 0.11 0.02 0.00 0.00 177.57 178.36 1jop h LYS 153 N 0.00 0.00 -0.02 1.57 1.79 -1.88 -2.36 116.57 115.67 1jop h LYS 153 Ca 0.29 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.76 1jop h LYS 153 Cb 1.46 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.11 1jop h LYS 153 CO -0.00 0.20 0.00 1.28 -1.08 0.00 0.00 179.45 179.85 1jop n LEU 154 N -3.69 0.02 0.00 2.94 4.77 0.41 -5.24 117.00 116.22 1jop n LEU 154 Ca -0.01 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 1jop n LEU 154 Cb 0.32 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 1jop n LEU 154 CO 0.33 0.01 0.12 -0.38 -1.33 0.00 0.00 177.39 176.14