#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jps s SER 2 N 0.00 4.08 -0.45 7.83 0.01 -1.26 -5.08 113.70 118.84 2jps s SER 2 Ca 0.00 -0.63 0.09 0.00 1.31 0.00 0.00 55.95 56.72 2jps s SER 2 Cb 0.00 -0.62 0.34 0.00 0.21 0.00 0.00 66.02 65.95 2jps s SER 2 CO 0.00 0.11 0.80 0.00 0.41 0.00 0.00 173.24 174.56 2jps n GLN 3 N 0.12 1.79 -0.03 12.44 1.13 -1.26 -4.88 117.38 126.68 2jps n GLN 3 Ca -0.11 -3.92 -0.21 0.00 -1.94 0.00 0.00 57.00 50.82 2jps n GLN 3 Cb 0.55 -1.89 -0.13 0.00 0.11 0.00 0.00 30.24 28.88 2jps n GLN 3 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71 2jps n GLU 4 N 0.12 0.73 -0.28 -1.09 2.13 -1.26 -3.30 120.64 117.69 2jps n GLU 4 Ca 0.27 0.23 0.13 0.00 0.66 0.00 0.00 57.16 58.45 2jps n GLU 4 Cb 0.56 -1.66 0.38 0.00 0.27 0.00 0.00 31.44 30.99 2jps n GLU 4 CO 0.00 0.00 0.00 -0.56 -0.41 0.00 0.00 177.13 176.16 2jps h GLN 5 N 0.04 0.66 -0.07 5.31 3.07 -2.00 0.31 115.11 122.42 2jps h GLN 5 Ca -0.47 -0.04 -0.20 0.00 0.09 0.00 0.00 58.65 58.04 2jps h GLN 5 Cb 1.99 -0.15 -0.00 0.00 0.08 0.00 0.00 27.48 29.40 2jps h GLN 5 CO 0.03 0.44 -0.77 1.88 0.09 0.00 0.00 178.83 180.50 2jps h TYR 6 N 0.68 0.62 -0.65 0.06 0.05 -1.96 -2.45 116.97 113.33 2jps h TYR 6 Ca 0.46 -0.28 -0.06 0.00 0.05 0.00 0.00 58.73 58.90 2jps h TYR 6 Cb 0.78 -0.09 -0.03 0.00 1.01 0.00 0.00 36.73 38.40 2jps h TYR 6 CO -0.00 1.06 0.19 1.15 -1.05 0.00 0.00 178.16 179.50 2jps h THR 7 N 0.30 1.25 -0.42 -2.88 2.02 -0.55 0.96 112.91 113.59 2jps h THR 7 Ca -0.04 -0.89 -0.11 0.00 0.77 0.00 0.00 66.41 66.14 2jps h THR 7 Cb 1.36 0.59 -0.01 0.00 -1.74 0.00 0.00 68.15 68.35 2jps h THR 7 CO 0.14 0.34 -0.18 -0.08 0.37 0.00 0.00 175.52 176.11 2jps h GLU 8 N 0.95 0.86 -0.13 6.66 4.57 -0.63 0.20 114.58 127.07 2jps h GLU 8 Ca 0.21 -0.37 -0.23 0.00 -1.18 0.00 0.00 59.36 57.79 2jps h GLU 8 Cb 0.32 -0.03 0.01 0.00 -0.16 0.00 0.00 28.75 28.89 2jps h GLU 8 CO -0.00 1.01 -0.81 -0.91 -1.18 0.00 0.00 179.01 177.11 2jps h ASN 9 N 0.68 0.94 -0.48 1.04 4.21 -1.24 -3.14 115.58 117.60 2jps h ASN 9 Ca 0.10 -0.65 -0.07 0.00 1.21 0.00 0.00 56.30 56.89 2jps h ASN 9 Cb 0.74 -0.28 -0.02 0.00 -1.12 0.00 0.00 38.32 37.63 2jps h ASN 9 CO 0.06 1.44 0.06 0.25 -1.29 0.00 0.00 177.43 177.95 2jps h LEU 10 N 0.51 0.83 -1.95 1.61 5.85 0.10 -2.21 115.31 120.06 2jps h LEU 10 Ca -0.06 -0.18 0.15 0.00 0.84 0.00 0.00 57.88 58.62 2jps h LEU 10 Cb 1.45 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 42.24 2jps h LEU 10 CO 0.17 0.85 0.39 0.50 -0.34 0.00 0.00 178.44 180.00 2jps h LYS 11 N 0.82 0.05 -0.03 1.25 3.64 -0.55 0.35 116.57 122.10 2jps h LYS 11 Ca 0.17 -0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 59.40 2jps h LYS 11 Cb 0.40 -0.01 0.01 0.00 -0.41 0.00 0.00 32.23 32.22 2jps h LYS 11 CO 0.01 0.03 -0.55 0.28 -2.27 0.00 0.00 179.45 176.95 2jps h VAL 12 N 0.05 1.41 -0.50 2.00 2.07 -1.42 -1.41 116.25 118.45 2jps h VAL 12 Ca 0.26 -1.99 -0.11 0.00 0.82 0.00 0.00 66.70 65.68 2jps h VAL 12 Cb 0.96 2.47 -0.02 0.00 -1.52 0.00 0.00 31.29 33.18 2jps h VAL 12 CO -0.02 0.58 -0.13 0.40 0.02 0.00 0.00 177.57 178.43 2jps h ILE 13 N -0.05 1.27 -0.50 4.57 2.04 -1.06 -1.77 117.51 122.01 2jps h ILE 13 Ca -0.06 -1.26 -0.07 0.00 1.00 0.00 0.00 64.86 64.47 2jps h ILE 13 Cb 1.24 1.02 -0.02 0.00 -0.74 0.00 0.00 36.82 38.33 2jps h ILE 13 CO 0.11 0.44 0.05 0.58 0.00 0.00 0.00 178.15 179.33 2jps h VAL 14 N 0.83 1.26 -0.42 1.67 2.07 -0.40 -2.53 116.25 118.73 2jps h VAL 14 Ca 0.13 -0.98 -0.01 0.00 0.82 0.00 0.00 66.70 66.65 2jps h VAL 14 Cb 0.67 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 31.35 2jps h VAL 14 CO 0.05 0.35 0.21 0.00 0.02 0.00 0.00 177.57 178.20 2jps h ALA 15 N 0.95 1.58 -0.90 1.67 0.00 -1.03 -2.03 119.26 119.50 2jps h ALA 15 Ca 0.15 -0.08 0.18 0.00 0.00 0.00 0.00 54.91 55.16 2jps h ALA 15 Cb 0.44 -0.17 -0.07 0.00 0.00 0.00 0.00 17.79 17.98 2jps h ALA 15 CO 0.02 0.34 0.59 1.49 0.00 0.00 0.00 179.25 181.69 2jps h GLU 16 N 0.58 0.51 0.00 0.00 4.22 -0.87 0.91 114.58 119.94 2jps h GLU 16 Ca 0.15 -0.03 -0.03 0.00 0.08 0.00 0.00 59.36 59.53 2jps h GLU 16 Cb 0.05 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.18 2jps h GLU 16 CO -0.02 0.34 -0.19 -0.22 -2.18 0.00 0.00 179.01 176.74 2jps h LYS 17 N 0.53 0.00 -0.18 1.92 1.63 -1.42 -1.04 116.57 118.01 2jps h LYS 17 Ca 0.47 0.00 0.02 0.00 -0.85 0.00 0.00 60.65 60.29 2jps h LYS 17 Cb 1.00 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.60 2jps h LYS 17 CO -0.21 0.84 0.03 -0.07 -3.45 0.00 0.00 179.45 176.60 2jps h LEU 18 N -1.00 0.01 -1.42 5.20 4.07 -1.10 0.87 115.31 121.94 2jps h LEU 18 Ca -0.05 0.03 -0.05 0.00 0.08 0.00 0.00 57.88 57.89 2jps h LEU 18 Cb 0.90 0.04 -0.01 0.00 1.08 0.00 0.00 40.66 42.67 2jps h LEU 18 CO -0.03 0.03 -0.22 0.00 -1.08 0.00 0.00 178.44 177.14 2jps h ALA 19 N 1.13 1.15 0.12 1.53 0.00 0.71 -3.10 119.26 120.79 2jps h ALA 19 Ca 0.08 -0.20 -0.31 0.00 0.00 0.00 0.00 54.91 54.48 2jps h ALA 19 Cb 0.07 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2jps h ALA 19 CO -0.11 0.27 -1.58 0.78 0.00 0.00 0.00 179.25 178.61 2jps h GLY 20 N 1.50 0.28 -4.92 0.00 0.00 0.10 -3.46 103.07 96.57 2jps h GLY 20 Ca -0.00 -0.72 -0.59 0.00 0.00 0.00 0.00 47.33 46.01 2jps h GLY 20 CO 0.03 0.63 0.71 1.39 0.00 0.00 0.00 176.54 179.30 2jps n ILE 21 N -3.44 0.28 0.31 2.60 5.41 0.29 -4.85 119.36 119.96 2jps n ILE 21 Ca -0.18 -0.07 0.13 0.00 1.00 0.00 0.00 62.75 63.63 2jps n ILE 21 Cb 1.05 -1.45 0.61 0.00 -0.71 0.00 0.00 39.64 39.14 2jps n ILE 21 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 176.55 178.10 2jps h PRO 22 N 5.28 0.00 -0.92 0.38 0.13 -1.89 -2.89 132.00 132.08 2jps h PRO 22 Ca -0.45 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.18 2jps h PRO 22 Cb 1.27 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 32.11 2jps h PRO 22 CO 0.84 0.00 0.58 0.09 -0.23 0.00 0.00 178.00 179.28 2jps n ASN 23 N -2.45 3.99 -3.79 1.44 4.13 -1.26 -4.80 115.26 112.52 2jps n ASN 23 Ca 0.00 -3.65 -0.30 0.00 1.68 0.00 0.00 54.58 52.32 2jps n ASN 23 Cb 0.18 -0.83 -0.14 0.00 -1.54 0.00 0.00 39.78 37.45 2jps n ASN 23 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 2jps s PHE 24 N -3.35 2.28 -0.24 3.10 2.19 -1.09 -4.96 117.98 115.92 2jps s PHE 24 Ca 0.56 -2.40 -0.09 0.00 0.33 0.00 0.00 56.93 55.33 2jps s PHE 24 Cb 0.47 -2.09 -0.11 0.00 -1.31 0.00 0.00 43.02 39.98 2jps s PHE 24 CO 0.08 -0.83 -0.29 0.09 1.83 0.00 0.00 175.22 176.11 2jps n ASN 25 N 3.95 1.79 -4.73 6.13 4.13 -1.26 -4.85 115.26 120.42 2jps n ASN 25 Ca 0.05 0.21 -0.24 0.00 1.68 0.00 0.00 54.58 56.28 2jps n ASN 25 Cb 0.37 -0.63 -0.07 0.00 -1.54 0.00 0.00 39.78 37.91 2jps n ASN 25 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 2jps s GLU 26 N -2.44 2.28 -1.32 3.52 2.02 -1.26 -4.72 118.70 116.78 2jps s GLU 26 Ca -0.33 -1.69 -0.01 0.00 0.02 0.00 0.00 54.97 52.96 2jps s GLU 26 Cb 0.12 -2.07 0.00 0.00 0.10 0.00 0.00 34.13 32.28 2jps s GLU 26 CO 0.44 0.01 0.70 -0.25 0.02 0.00 0.00 175.26 176.18 2jps n ASP 27 N -1.17 -1.26 -0.12 -0.19 8.00 -1.26 -4.92 116.55 115.63 2jps n ASP 27 Ca -0.02 -0.82 -0.17 0.00 0.71 0.00 0.00 54.79 54.48 2jps n ASP 27 Cb 0.63 -4.02 -0.12 0.00 -0.02 0.00 0.00 41.12 37.59 2jps n ASP 27 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jps n ILE 28 N -4.29 1.44 -0.10 0.53 0.00 -1.26 -3.77 119.36 111.91 2jps n ILE 28 Ca -0.29 -0.56 -0.14 0.00 0.00 0.00 0.00 62.75 61.76 2jps n ILE 28 Cb 0.67 -1.36 -0.04 0.00 0.00 0.00 0.00 39.64 38.92 2jps n ILE 28 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 2jps h LYS 29 N 0.00 0.89 -0.49 9.51 6.56 -1.97 -2.56 116.57 128.51 2jps h LYS 29 Ca -0.56 -0.52 -0.09 0.00 -1.06 0.00 0.00 60.65 58.42 2jps h LYS 29 Cb 1.88 0.04 -0.02 0.00 -0.57 0.00 0.00 32.23 33.57 2jps h LYS 29 CO -0.08 1.17 -0.06 1.88 -2.06 0.00 0.00 179.45 180.29 2jps h TYR 30 N 0.69 0.93 -0.72 -1.35 0.05 -1.98 -2.04 116.97 112.55 2jps h TYR 30 Ca 0.03 -0.16 -0.07 0.00 0.05 0.00 0.00 58.73 58.59 2jps h TYR 30 Cb 1.07 -0.24 -0.03 0.00 1.01 0.00 0.00 36.73 38.54 2jps h TYR 30 CO 0.07 0.88 0.18 0.28 -1.05 0.00 0.00 178.16 178.52 2jps h VAL 31 N 0.78 1.26 -0.51 -2.88 2.07 -1.63 -1.34 116.25 114.00 2jps h VAL 31 Ca 0.14 -0.97 -0.09 0.00 0.82 0.00 0.00 66.70 66.60 2jps h VAL 31 Cb 0.55 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.82 2jps h VAL 31 CO 0.03 0.38 -0.02 0.00 0.02 0.00 0.00 177.57 177.98 2jps h ALA 32 N 1.10 0.69 -0.46 1.67 0.00 -1.22 -0.32 119.26 120.72 2jps h ALA 32 Ca 0.23 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2jps h ALA 32 Cb 0.37 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2jps h ALA 32 CO 0.00 0.53 0.24 0.93 0.00 0.00 0.00 179.25 180.95 2jps h GLU 33 N 0.79 0.64 -0.74 0.00 4.39 -1.11 0.13 114.58 118.68 2jps h GLU 33 Ca 0.14 -0.08 -0.05 0.00 0.34 0.00 0.00 59.36 59.71 2jps h GLU 33 Cb 0.55 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 29.05 2jps h GLU 33 CO 0.03 0.52 0.25 -0.92 -1.16 0.00 0.00 179.01 177.73 2jps h TYR 34 N 0.60 1.18 -0.07 4.33 3.20 -1.09 0.39 116.97 125.49 2jps h TYR 34 Ca 0.16 -0.11 -0.00 0.00 3.14 0.00 0.00 58.73 61.92 2jps h TYR 34 Cb 0.07 -0.34 -0.00 0.00 1.54 0.00 0.00 36.73 37.99 2jps h TYR 34 CO -0.02 0.92 0.03 0.82 -1.64 0.00 0.00 178.16 178.28 2jps h ILE 35 N 1.09 1.12 -0.76 1.81 2.04 -0.53 -0.98 117.51 121.31 2jps h ILE 35 Ca 0.24 -0.36 -0.05 0.00 1.00 0.00 0.00 64.86 65.70 2jps h ILE 35 Cb 0.28 1.22 -0.03 0.00 -0.74 0.00 0.00 36.82 37.55 2jps h ILE 35 CO -0.01 0.10 0.27 0.58 0.00 0.00 0.00 178.15 179.10 2jps h VAL 36 N -0.01 1.26 -0.94 1.67 2.07 -0.50 -1.46 116.25 118.33 2jps h VAL 36 Ca 0.03 -0.85 0.10 0.00 0.82 0.00 0.00 66.70 66.79 2jps h VAL 36 Cb 0.14 0.38 -0.08 0.00 -1.52 0.00 0.00 31.29 30.21 2jps h VAL 36 CO -0.00 0.34 0.58 0.25 0.02 0.00 0.00 177.57 178.76 2jps h LEU 37 N 1.11 0.87 -0.59 2.57 5.85 0.18 0.80 115.31 126.10 2jps h LEU 37 Ca 0.25 0.04 -0.11 0.00 0.84 0.00 0.00 57.88 58.90 2jps h LEU 37 Cb 0.25 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.12 2jps h LEU 37 CO -0.02 0.50 -0.06 -0.07 -0.34 0.00 0.00 178.44 178.46 2jps h LEU 38 N 0.97 1.05 0.06 2.25 3.38 -0.53 -1.21 115.31 121.29 2jps h LEU 38 Ca 0.45 -0.33 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 2jps h LEU 38 Cb 0.36 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2jps h LEU 38 CO -0.23 1.13 -0.03 0.40 0.09 0.00 0.00 178.44 179.80 2jps h ILE 39 N 0.96 1.10 0.00 1.22 1.08 0.20 -2.42 117.51 119.65 2jps h ILE 39 Ca 0.16 -0.54 -0.01 0.00 -0.39 0.00 0.00 64.86 64.08 2jps h ILE 39 Cb 0.62 1.46 -0.00 0.00 -3.07 0.00 0.00 36.82 35.83 2jps h ILE 39 CO 0.04 0.13 -0.07 1.62 -0.69 0.00 0.00 178.15 179.19 2jps h VAL 40 N -0.32 0.61 0.01 1.67 3.04 0.55 -2.55 116.25 119.26 2jps h VAL 40 Ca -0.01 -0.29 -0.22 0.00 -1.01 0.00 0.00 66.70 65.17 2jps h VAL 40 Cb 0.28 1.18 0.00 0.00 -2.01 0.00 0.00 31.29 30.74 2jps h VAL 40 CO 0.01 0.07 -0.94 0.78 -1.01 0.00 0.00 177.57 176.48 2jps h ASN 41 N 0.00 0.49 0.00 3.17 2.35 -0.91 -3.47 115.58 117.21 2jps h ASN 41 Ca -0.00 -0.39 0.00 0.00 -0.55 0.00 0.00 56.30 55.36 2jps h ASN 41 Cb 0.17 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.40 2jps h ASN 41 CO 0.01 1.20 0.00 0.61 -1.65 0.00 0.00 177.43 177.60 2jps n GLY 42 N 0.96 -1.36 0.01 2.83 0.00 -0.94 -5.07 105.19 101.61 2jps n GLY 42 Ca -0.06 0.27 0.00 0.00 0.00 0.00 0.00 46.02 46.22 2jps n GLY 42 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jps n GLY 43 N -1.46 0.51 3.18 -0.02 0.00 -1.15 -4.96 105.19 101.29 2jps n GLY 43 Ca 0.00 -0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 2jps n GLY 43 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jps s THR 44 N -1.04 3.17 0.39 2.61 -4.23 -1.26 -4.98 115.64 110.30 2jps s THR 44 Ca 0.00 -1.48 0.17 0.00 -1.18 0.00 0.00 61.69 59.20 2jps s THR 44 Cb 0.00 -2.89 0.38 0.00 1.34 0.00 0.00 72.50 71.33 2jps s THR 44 CO 0.00 -0.23 1.78 0.58 -0.54 0.00 0.00 174.62 176.21 2jps h VAL 45 N 6.40 0.57 0.30 2.29 2.07 -1.96 0.90 116.25 126.82 2jps h VAL 45 Ca -0.20 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.16 2jps h VAL 45 Cb 1.06 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 2jps h VAL 45 CO 0.57 0.08 -0.14 -0.08 0.02 0.00 0.00 177.57 178.02 2jps h GLU 46 N 0.43 -0.39 -0.34 1.57 4.81 -1.98 0.22 114.58 118.90 2jps h GLU 46 Ca 0.57 0.03 -0.10 0.00 -0.13 0.00 0.00 59.36 59.73 2jps h GLU 46 Cb 1.39 0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.85 2jps h GLU 46 CO -0.29 -0.07 -0.20 1.03 -0.73 0.00 0.00 179.01 178.76 2jps h SER 47 N -0.76 0.65 -0.11 1.04 0.87 -1.77 -0.25 113.55 113.22 2jps h SER 47 Ca -0.04 -0.22 -0.11 0.00 -1.23 0.00 0.00 61.79 60.19 2jps h SER 47 Cb 0.50 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.27 2jps h SER 47 CO 0.07 0.85 -0.30 0.58 -0.53 0.00 0.00 176.83 177.51 2jps h VAL 48 N 0.58 1.28 0.04 2.23 2.07 0.84 0.15 116.25 123.43 2jps h VAL 48 Ca 0.09 -1.39 -0.28 0.00 0.82 0.00 0.00 66.70 65.94 2jps h VAL 48 Cb 0.67 1.39 0.02 0.00 -1.52 0.00 0.00 31.29 31.84 2jps h VAL 48 CO 0.05 0.45 -1.11 0.58 0.02 0.00 0.00 177.57 177.56 2jps h VAL 49 N 0.50 1.29 -0.25 2.57 2.07 -0.32 -2.37 116.25 119.74 2jps h VAL 49 Ca 0.06 -2.33 -0.12 0.00 0.82 0.00 0.00 66.70 65.13 2jps h VAL 49 Cb 0.77 2.49 -0.01 0.00 -1.52 0.00 0.00 31.29 33.01 2jps h VAL 49 CO 0.06 0.72 -0.34 -0.78 0.02 0.00 0.00 177.57 177.25 2jps h ASP 50 N 0.35 0.55 -0.33 0.57 3.58 -0.95 0.24 116.42 120.43 2jps h ASP 50 Ca -0.15 -0.22 -0.17 0.00 0.42 0.00 0.00 57.03 56.91 2jps h ASP 50 Cb 1.77 -0.15 -0.00 0.00 1.72 0.00 0.00 39.33 42.66 2jps h ASP 50 CO 0.21 0.85 -0.45 -0.33 -2.88 0.00 0.00 179.24 176.65 2jps h GLU 51 N 0.45 0.88 -0.24 0.28 3.07 -0.73 -0.81 114.58 117.48 2jps h GLU 51 Ca 0.05 -0.51 -0.19 0.00 -0.50 0.00 0.00 59.36 58.21 2jps h GLU 51 Cb 0.81 0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.76 2jps h GLU 51 CO 0.07 1.15 -0.61 -0.07 -1.40 0.00 0.00 179.01 178.15 2jps h LEU 52 N 0.68 0.91 -0.82 1.33 3.38 -1.33 -2.68 115.31 116.78 2jps h LEU 52 Ca 0.04 -0.52 -0.07 0.00 0.09 0.00 0.00 57.88 57.42 2jps h LEU 52 Cb 1.05 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.51 2jps h LEU 52 CO 0.11 1.31 0.09 0.00 0.09 0.00 0.00 178.44 180.03 2jps h ALA 53 N 0.70 1.03 -0.11 1.53 0.00 -0.91 0.75 119.26 122.25 2jps h ALA 53 Ca -0.00 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.59 2jps h ALA 53 Cb 1.22 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 2jps h ALA 53 CO 0.13 0.62 -0.22 0.77 0.00 0.00 0.00 179.25 180.55 2jps h SER 54 N 0.92 0.17 0.12 0.00 0.02 -1.07 -2.68 113.55 111.02 2jps h SER 54 Ca 0.19 -0.04 -0.36 0.00 -0.84 0.00 0.00 61.79 60.74 2jps h SER 54 Cb 0.41 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 62.89 2jps h SER 54 CO 0.01 0.41 -1.94 -0.11 -1.14 0.00 0.00 176.83 174.05 2jps n LEU 55 N -4.21 2.58 -3.84 5.07 7.94 -0.95 -4.51 117.00 119.07 2jps n LEU 55 Ca -0.01 0.23 -0.36 0.00 -1.11 0.00 0.00 56.01 54.76 2jps n LEU 55 Cb 0.32 -1.11 -0.04 0.00 0.53 0.00 0.00 43.42 43.12 2jps n LEU 55 CO 0.39 0.81 0.56 0.49 -1.11 0.00 0.00 177.39 178.53 2jps n PHE 56 N -3.56 3.33 0.70 1.96 3.72 0.26 -4.86 117.46 119.01 2jps n PHE 56 Ca -0.32 -3.56 0.09 0.00 -0.05 0.00 0.00 57.45 53.61 2jps n PHE 56 Cb 1.02 -1.00 0.43 0.00 -0.94 0.00 0.00 39.48 38.98 2jps n PHE 56 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 2jps n ASP 57 N 1.45 0.00 -0.05 4.37 5.75 -1.02 -3.64 116.55 123.41 2jps n ASP 57 Ca 0.26 0.45 -0.12 0.00 -0.01 0.00 0.00 54.79 55.37 2jps n ASP 57 Cb 0.37 -0.48 -0.11 0.00 -1.03 0.00 0.00 41.12 39.87 2jps n ASP 57 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 2jps h SER 58 N 0.00 -0.02 -4.12 -1.12 4.64 -1.89 -3.46 113.55 107.59 2jps h SER 58 Ca 0.00 -0.77 -0.54 0.00 -0.47 0.00 0.00 61.79 60.01 2jps h SER 58 Cb 0.32 0.00 0.19 0.00 -0.31 0.00 0.00 62.40 62.60 2jps h SER 58 CO 0.00 0.83 0.26 0.55 -0.87 0.00 0.00 176.83 177.60 2jps n VAL 59 N -4.68 1.87 -2.62 0.95 3.14 -1.24 -4.96 118.33 110.79 2jps n VAL 59 Ca -0.08 -0.21 -0.36 0.00 -2.96 0.00 0.00 64.34 60.73 2jps n VAL 59 Cb 0.38 -1.15 -0.05 0.00 -1.06 0.00 0.00 33.84 31.96 2jps n VAL 59 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 2jps s SER 60 N -2.11 6.92 0.37 6.55 1.04 -1.26 -4.94 113.70 120.28 2jps s SER 60 Ca 0.72 1.97 0.09 0.00 0.48 0.00 0.00 55.95 59.21 2jps s SER 60 Cb -0.29 -2.58 0.83 0.00 0.10 0.00 0.00 66.02 64.08 2jps s SER 60 CO 0.52 -0.37 1.91 0.03 0.98 0.00 0.00 173.24 176.30 2jps h ARG 61 N 2.63 0.65 -0.99 4.02 3.08 -1.93 -1.35 114.38 120.50 2jps h ARG 61 Ca -0.48 -0.04 0.03 0.00 0.07 0.00 0.00 59.98 59.56 2jps h ARG 61 Cb 1.21 -0.15 -0.06 0.00 0.08 0.00 0.00 29.97 31.05 2jps h ARG 61 CO 0.63 0.43 0.65 -0.44 -1.07 0.00 0.00 179.97 180.17 2jps h ASP 62 N 0.67 1.10 -0.70 7.04 3.32 -1.98 0.16 116.42 126.03 2jps h ASP 62 Ca 0.39 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.38 2jps h ASP 62 Cb 0.59 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.86 2jps h ASP 62 CO -0.16 0.76 0.26 0.74 -1.72 0.00 0.00 179.24 179.12 2jps h THR 63 N 1.27 1.25 0.01 0.35 2.02 -1.62 0.14 112.91 116.33 2jps h THR 63 Ca 0.39 -0.81 -0.00 0.00 0.77 0.00 0.00 66.41 66.76 2jps h THR 63 Cb -0.03 0.47 0.00 0.00 -1.74 0.00 0.00 68.15 66.85 2jps h THR 63 CO -0.11 0.32 -0.00 -0.07 0.37 0.00 0.00 175.52 176.02 2jps h LEU 64 N 1.00 -0.01 -1.69 2.58 3.38 -1.24 -2.70 115.31 116.63 2jps h LEU 64 Ca 0.23 -0.43 0.07 0.00 0.09 0.00 0.00 57.88 57.83 2jps h LEU 64 Cb 0.24 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 2jps h LEU 64 CO -0.01 0.43 0.32 0.00 0.09 0.00 0.00 178.44 179.27 2jps h ALA 65 N 0.53 1.96 -0.45 1.53 0.00 -0.57 -0.75 119.26 121.51 2jps h ALA 65 Ca -0.00 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 2jps h ALA 65 Cb 0.44 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2jps h ALA 65 CO 0.00 -0.05 -0.11 -0.97 0.00 0.00 0.00 179.25 178.11 2jps h ASN 66 N 0.38 0.88 -0.28 0.00 -0.73 -0.56 -1.49 115.58 113.78 2jps h ASN 66 Ca 0.21 -0.36 -0.17 0.00 1.87 0.00 0.00 56.30 57.85 2jps h ASN 66 Cb 0.35 -0.24 -0.00 0.00 0.27 0.00 0.00 38.32 38.70 2jps h ASN 66 CO -0.05 1.04 -0.49 0.58 -0.37 0.00 0.00 177.43 178.14 2jps h VAL 67 N 0.71 1.28 -0.85 2.57 2.07 -1.03 -2.83 116.25 118.17 2jps h VAL 67 Ca 0.11 -1.68 0.03 0.00 0.82 0.00 0.00 66.70 65.98 2jps h VAL 67 Cb 0.66 1.64 -0.05 0.00 -1.52 0.00 0.00 31.29 32.02 2jps h VAL 67 CO 0.05 0.55 0.56 0.58 0.02 0.00 0.00 177.57 179.32 2jps h VAL 68 N 0.61 1.15 -0.63 2.57 2.07 -1.08 -0.28 116.25 120.66 2jps h VAL 68 Ca 0.02 -0.37 -0.03 0.00 0.82 0.00 0.00 66.70 67.14 2jps h VAL 68 Cb 1.10 -0.02 -0.03 0.00 -1.52 0.00 0.00 31.29 30.82 2jps h VAL 68 CO 0.11 0.20 0.26 -0.61 0.02 0.00 0.00 177.57 177.55 2jps h GLN 69 N 1.07 0.91 -0.30 1.57 5.75 -1.10 -1.18 115.11 121.83 2jps h GLN 69 Ca 0.34 -0.14 -0.14 0.00 -0.15 0.00 0.00 58.65 58.56 2jps h GLN 69 Cb 0.01 -0.16 -0.00 0.00 1.07 0.00 0.00 27.48 28.40 2jps h GLN 69 CO -0.10 0.74 -0.37 1.79 -2.65 0.00 0.00 178.83 178.24 2jps h THR 70 N 0.90 1.29 -0.61 2.39 1.35 -0.96 -2.20 112.91 115.08 2jps h THR 70 Ca 0.21 -1.55 -0.02 0.00 -0.55 0.00 0.00 66.41 64.51 2jps h THR 70 Cb 0.16 1.58 -0.03 0.00 -1.73 0.00 0.00 68.15 68.12 2jps h THR 70 CO -0.02 0.50 0.30 0.00 -0.25 0.00 0.00 175.52 176.05 2jps h ALA 71 N 0.70 1.38 0.21 6.62 0.00 -0.67 1.09 119.26 128.60 2jps h ALA 71 Ca 0.04 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2jps h ALA 71 Cb 0.95 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2jps h ALA 71 CO 0.09 0.49 -0.10 0.74 0.00 0.00 0.00 179.25 180.47 2jps h PHE 72 N 0.85 -0.26 -0.66 0.00 -1.00 -1.09 0.14 116.94 114.92 2jps h PHE 72 Ca 0.21 -0.01 -0.04 0.00 2.81 0.00 0.00 57.97 60.94 2jps h PHE 72 Cb 0.08 0.09 -0.03 0.00 3.61 0.00 0.00 35.95 39.69 2jps h PHE 72 CO 0.01 0.07 0.24 0.35 -1.61 0.00 0.00 178.31 177.36 2jps h PHE 73 N -0.60 1.03 -0.39 -0.55 3.57 -1.16 -2.32 116.94 116.52 2jps h PHE 73 Ca -0.03 -0.09 -0.02 0.00 3.53 0.00 0.00 57.97 61.37 2jps h PHE 73 Cb 0.44 -0.30 -0.02 0.00 2.79 0.00 0.00 35.95 38.86 2jps h PHE 73 CO 0.03 0.82 0.17 0.00 -2.23 0.00 0.00 178.31 177.09 2jps h ALA 74 N 1.10 1.56 -0.57 2.41 0.00 0.13 0.39 119.26 124.29 2jps h ALA 74 Ca 0.22 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 2jps h ALA 74 Cb 0.24 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2jps h ALA 74 CO -0.01 0.35 0.09 1.25 0.00 0.00 0.00 179.25 180.92 2jps h LEU 75 N 0.55 0.91 0.11 0.00 6.46 -0.16 0.95 115.31 124.13 2jps h LEU 75 Ca 0.14 -0.26 -0.29 0.00 -0.12 0.00 0.00 57.88 57.35 2jps h LEU 75 Cb 0.10 -0.24 0.03 0.00 -0.73 0.00 0.00 40.66 39.81 2jps h LEU 75 CO -0.02 0.94 -1.20 -0.08 -0.62 0.00 0.00 178.44 177.47 2jps h GLU 76 N 0.84 0.61 -0.22 1.25 4.57 -1.21 -3.17 114.58 117.26 2jps h GLU 76 Ca 0.17 -0.81 -0.10 0.00 -1.18 0.00 0.00 59.36 57.44 2jps h GLU 76 Cb 0.42 0.27 -0.01 0.00 -0.16 0.00 0.00 28.75 29.27 2jps h GLU 76 CO 0.01 1.37 -0.30 0.00 -1.18 0.00 0.00 179.01 178.91 2jps h ALA 77 N 0.28 1.08 -0.84 2.92 0.00 -0.13 -2.74 119.26 119.83 2jps h ALA 77 Ca -0.18 -0.37 0.02 0.00 0.00 0.00 0.00 54.91 54.38 2jps h ALA 77 Cb 1.87 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 19.51 2jps h ALA 77 CO 0.23 0.57 0.56 1.25 0.00 0.00 0.00 179.25 181.86 2jps h LEU 78 N 0.38 0.94 -1.52 0.00 5.85 0.91 0.97 115.31 122.85 2jps h LEU 78 Ca 0.05 -0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.71 2jps h LEU 78 Cb 0.72 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 2jps h LEU 78 CO 0.06 0.67 -0.17 1.56 -0.34 0.00 0.00 178.44 180.21 2jps h GLN 79 N 1.11 0.00 -0.96 1.25 4.20 -1.46 -3.34 115.11 115.91 2jps h GLN 79 Ca 0.32 0.00 -0.35 0.00 0.06 0.00 0.00 58.65 58.68 2jps h GLN 79 Cb -0.07 0.00 -0.34 0.00 0.30 0.00 0.00 27.48 27.37 2jps h GLN 79 CO -0.08 0.17 -1.01 1.04 -0.67 0.00 0.00 178.83 178.28 2jps n GLN 80 N -3.48 1.11 0.00 1.46 1.13 -0.28 -5.00 117.38 112.32 2jps n GLN 80 Ca -0.01 -2.95 0.00 0.00 -1.94 0.00 0.00 57.00 52.10 2jps n GLN 80 Cb 0.34 -1.11 0.00 0.00 0.11 0.00 0.00 30.24 29.58 2jps n GLN 80 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2jps n GLY 81 N -0.07 -0.10 0.00 1.08 0.00 0.32 -4.88 105.19 101.54 2jps n GLY 81 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 2jps n GLY 81 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2jps n GLU 82 N -1.13 0.00 -2.52 1.61 2.13 -1.26 -5.06 120.64 114.41 2jps n GLU 82 Ca 0.00 0.00 -0.28 0.00 0.66 0.00 0.00 57.16 57.54 2jps n GLU 82 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 2jps n GLU 82 CO 0.00 0.00 0.00 -1.12 -0.41 0.00 0.00 177.13 175.60 2jps s SER 83 N 0.99 6.23 -0.19 4.31 0.01 -1.26 -4.87 113.70 118.92 2jps s SER 83 Ca 0.00 0.99 0.09 0.00 1.31 0.00 0.00 55.95 58.34 2jps s SER 83 Cb 0.00 -2.26 -0.22 0.00 0.21 0.00 0.00 66.02 63.75 2jps s SER 83 CO 0.00 -0.64 0.10 0.00 0.41 0.00 0.00 173.24 173.12 2jps n ALA 84 N -2.34 1.41 -0.29 1.44 0.00 -1.26 -4.34 120.51 115.14 2jps n ALA 84 Ca 0.01 -1.09 0.20 0.00 0.00 0.00 0.00 53.44 52.56 2jps n ALA 84 Cb 0.55 -0.32 0.49 0.00 0.00 0.00 0.00 19.45 20.17 2jps n ALA 84 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2jps h GLU 85 N 0.01 0.43 -0.91 0.00 5.08 -1.95 0.13 114.58 117.37 2jps h GLU 85 Ca -0.50 -0.03 0.05 0.00 -1.00 0.00 0.00 59.36 57.88 2jps h GLU 85 Cb 2.08 -0.10 -0.06 0.00 0.50 0.00 0.00 28.75 31.18 2jps h GLU 85 CO 0.01 0.29 0.59 -0.97 -1.00 0.00 0.00 179.01 177.93 2jps h ASN 86 N 0.45 0.95 -0.55 1.42 -0.73 -2.01 -1.24 115.58 113.87 2jps h ASN 86 Ca 0.53 -0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.69 2jps h ASN 86 Cb 1.26 -0.21 -0.03 0.00 0.27 0.00 0.00 38.32 39.61 2jps h ASN 86 CO -0.24 0.63 0.36 0.40 -0.37 0.00 0.00 177.43 178.21 2jps h ILE 87 N 1.09 1.15 -0.98 2.57 2.04 -0.97 -2.18 117.51 120.23 2jps h ILE 87 Ca 0.37 -0.29 0.06 0.00 1.00 0.00 0.00 64.86 66.00 2jps h ILE 87 Cb 0.10 0.34 -0.06 0.00 -0.74 0.00 0.00 36.82 36.45 2jps h ILE 87 CO -0.13 0.15 0.64 0.58 0.00 0.00 0.00 178.15 179.39 2jps h VAL 88 N 0.76 1.11 -0.81 1.67 2.07 -1.21 -1.59 116.25 118.24 2jps h VAL 88 Ca 0.20 -0.40 0.05 0.00 0.82 0.00 0.00 66.70 67.37 2jps h VAL 88 Cb -0.07 -0.16 -0.06 0.00 -1.52 0.00 0.00 31.29 29.48 2jps h VAL 88 CO -0.04 0.21 0.51 -1.28 0.02 0.00 0.00 177.57 176.99 2jps h SER 89 N 1.17 0.81 0.13 0.57 0.87 -1.40 0.32 113.55 116.03 2jps h SER 89 Ca 0.41 0.01 -0.10 0.00 -1.23 0.00 0.00 61.79 60.88 2jps h SER 89 Cb 0.12 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 61.90 2jps h SER 89 CO -0.15 0.53 -0.35 0.11 -0.53 0.00 0.00 176.83 176.45 2jps h LYS 90 N 0.95 0.31 -0.25 2.24 1.57 -1.34 -2.76 116.57 117.29 2jps h LYS 90 Ca 0.35 -0.13 -0.18 0.00 -1.87 0.00 0.00 60.65 58.81 2jps h LYS 90 Cb 0.11 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.41 2jps h LYS 90 CO -0.15 0.62 -0.56 0.82 -0.57 0.00 0.00 179.45 179.62 2jps h ILE 91 N 0.27 1.29 -0.80 1.86 1.08 -0.46 -0.83 117.51 119.91 2jps h ILE 91 Ca 0.03 -1.76 -0.03 0.00 -0.39 0.00 0.00 64.86 62.71 2jps h ILE 91 Cb 0.74 1.69 -0.04 0.00 -3.07 0.00 0.00 36.82 36.14 2jps h ILE 91 CO 0.06 0.57 0.39 -0.09 -0.69 0.00 0.00 178.15 178.38 2jps h ARG 92 N 0.59 1.15 -0.09 2.37 2.43 -0.83 0.87 114.38 120.86 2jps h ARG 92 Ca 0.01 -0.16 -0.22 0.00 -0.81 0.00 0.00 59.98 58.80 2jps h ARG 92 Cb 1.15 -0.21 0.01 0.00 -0.42 0.00 0.00 29.97 30.50 2jps h ARG 92 CO 0.12 0.88 -0.78 1.98 -1.51 0.00 0.00 179.97 180.65 2jps h MET 93 N 1.14 0.69 -0.33 0.20 4.05 -1.42 -2.33 114.93 116.93 2jps h MET 93 Ca 0.28 -0.62 -0.14 0.00 -0.28 0.00 0.00 59.70 58.94 2jps h MET 93 Cb 0.11 0.15 -0.01 0.00 -0.80 0.00 0.00 31.60 31.04 2jps h MET 93 CO -0.04 1.23 -0.35 1.98 0.23 0.00 0.00 176.91 179.97 2jps h MET 94 N 0.37 0.73 -0.44 0.39 4.05 -0.84 -2.94 114.93 116.26 2jps h MET 94 Ca -0.07 -0.35 -0.08 0.00 -0.28 0.00 0.00 59.70 58.91 2jps h MET 94 Cb 1.43 -0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 32.21 2jps h MET 94 CO 0.16 0.97 -0.05 -0.91 0.23 0.00 0.00 176.91 177.31 2jps h ASN 95 N 0.61 0.73 -0.96 1.39 -0.26 0.76 -2.77 115.58 115.09 2jps h ASN 95 Ca 0.06 -0.19 0.00 0.00 -0.56 0.00 0.00 56.30 55.61 2jps h ASN 95 Cb 0.88 -0.20 -0.05 0.00 -1.06 0.00 0.00 38.32 37.90 2jps h ASN 95 CO 0.08 0.83 0.62 0.00 -1.06 0.00 0.00 177.43 177.89 2jps h ALA 96 N 1.25 1.22 -0.80 -0.83 0.00 -1.25 -2.21 119.26 116.63 2jps h ALA 96 Ca 0.13 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 2jps h ALA 96 Cb 0.50 -0.39 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 2jps h ALA 96 CO 0.03 0.64 0.36 1.96 0.00 0.00 0.00 179.25 182.23 2jps h GLN 97 N 1.31 1.18 -0.69 0.00 1.08 -1.38 0.84 115.11 117.45 2jps h GLN 97 Ca 0.35 -0.19 0.06 0.00 -1.45 0.00 0.00 58.65 57.42 2jps h GLN 97 Cb -0.12 -0.20 -0.04 0.00 -0.05 0.00 0.00 27.48 27.07 2jps h GLN 97 CO -0.07 0.93 0.46 0.77 -0.95 0.00 0.00 178.83 179.96 2jps h SER 98 N 1.15 0.63 0.07 1.46 0.02 -1.23 -3.10 113.55 112.55 2jps h SER 98 Ca 0.27 0.00 -0.38 0.00 -0.84 0.00 0.00 61.79 60.85 2jps h SER 98 Cb 0.16 -0.13 -0.04 0.00 0.14 0.00 0.00 62.40 62.53 2jps h SER 98 CO -0.03 0.41 -2.23 0.18 -1.14 0.00 0.00 176.83 174.03 2jps n LEU 99 N -4.48 2.79 0.00 5.07 4.32 -0.94 -5.04 117.00 118.73 2jps n LEU 99 Ca 0.10 0.04 0.00 0.00 -0.02 0.00 0.00 56.01 56.13 2jps n LEU 99 Cb 0.22 -1.02 0.00 0.00 -1.62 0.00 0.00 43.42 41.00 2jps n LEU 99 CO 0.34 0.89 0.00 0.61 -1.22 0.00 0.00 177.39 178.01 2jps n GLY 100 N 2.12 0.53 3.19 -0.72 0.00 0.29 -5.09 105.19 105.50 2jps n GLY 100 Ca -0.39 -0.03 -0.35 0.00 0.00 0.00 0.00 46.02 45.25 2jps n GLY 100 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2jps s GLN 101 N 0.86 2.45 -0.40 1.61 -0.44 -1.11 -4.83 119.66 117.79 2jps s GLN 101 Ca 0.00 -1.27 -0.21 0.00 -2.50 0.00 0.00 55.36 51.39 2jps s GLN 101 Cb 0.00 -3.24 0.03 0.00 -1.64 0.00 0.00 33.01 28.15 2jps s GLN 101 CO 0.00 -0.64 0.53 0.43 0.50 0.00 0.00 175.29 176.11 2jps n SER 102 N 4.65 -7.19 -4.07 6.67 7.64 -1.26 -4.86 113.62 115.20 2jps n SER 102 Ca -0.13 0.42 -0.27 0.00 1.01 0.00 0.00 58.87 59.90 2jps n SER 102 Cb 0.43 -4.11 -0.08 0.00 -1.01 0.00 0.00 64.21 59.45 2jps n SER 102 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 2jps s ASP 103 N -2.10 2.97 0.07 6.43 -4.77 -1.26 -4.99 116.67 113.02 2jps s ASP 103 Ca 0.25 -1.73 -0.05 0.00 -3.30 0.00 0.00 52.55 47.72 2jps s ASP 103 Cb -0.05 0.61 -0.02 0.00 -1.09 0.00 0.00 42.92 42.37 2jps s ASP 103 CO 0.76 -0.99 0.08 -0.51 0.70 0.00 0.00 175.17 175.22 2jps s ILE 104 N -3.16 0.18 0.00 2.11 2.07 -1.26 -5.21 121.20 115.93 2jps s ILE 104 Ca 0.21 -1.48 0.00 0.00 -1.41 0.00 0.00 60.65 57.97 2jps s ILE 104 Cb 0.01 -1.42 0.00 0.00 0.13 0.00 0.00 42.46 41.19 2jps s ILE 104 CO 0.14 -0.82 0.12 0.00 -1.91 0.00 0.00 174.94 172.47