#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 4.69 -0.56 7.83 1.04 -1.26 -4.99 113.70 120.45 2jps s SER 2 Ca 0.00 -2.78 0.06 0.00 0.48 0.00 0.00 55.95 53.72 2jps s SER 2 Cb 0.00 -1.71 0.24 0.00 0.10 0.00 0.00 66.02 64.65 2jps s SER 2 CO 0.00 -0.31 0.63 0.00 0.98 0.00 0.00 173.24 174.54 2jps n GLN 3 N 3.48 1.80 -0.05 4.02 1.13 -1.26 -4.89 117.38 121.61 2jps n GLN 3 Ca 0.05 -4.15 -0.20 0.00 -1.94 0.00 0.00 57.00 50.76 2jps n GLN 3 Cb 0.36 -1.92 -0.13 0.00 0.11 0.00 0.00 30.24 28.65 2jps n GLN 3 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 2jps n GLU 4 N 1.23 0.71 -0.27 -1.09 1.02 -1.26 -3.36 120.64 117.62 2jps n GLU 4 Ca 0.26 0.23 0.11 0.00 -0.02 0.00 0.00 57.16 57.74 2jps n GLU 4 Cb 0.44 -1.63 0.37 0.00 -0.02 0.00 0.00 31.44 30.60 2jps n GLU 4 CO 0.00 0.00 0.00 -0.56 1.18 0.00 0.00 177.13 177.75 2jps h GLN 5 N -0.01 0.69 -0.12 3.49 3.07 -2.00 0.31 115.11 120.55 2jps h GLN 5 Ca -0.49 -0.04 -0.21 0.00 0.09 0.00 0.00 58.65 58.00 2jps h GLN 5 Cb 1.95 -0.16 0.00 0.00 0.08 0.00 0.00 27.48 29.36 2jps h GLN 5 CO -0.00 0.46 -0.76 1.88 0.09 0.00 0.00 178.83 180.49 2jps h TYR 6 N 0.71 0.84 -0.68 0.06 0.05 -1.97 -2.37 116.97 113.62 2jps h TYR 6 Ca 0.44 -0.38 -0.05 0.00 0.05 0.00 0.00 58.73 58.80 2jps h TYR 6 Cb 0.68 -0.13 -0.03 0.00 1.01 0.00 0.00 36.73 38.26 2jps h TYR 6 CO -0.00 1.18 0.23 1.15 -1.05 0.00 0.00 178.16 179.66 2jps h THR 7 N 0.42 1.25 -0.41 -2.88 2.02 -0.80 0.88 112.91 113.40 2jps h THR 7 Ca -0.04 -0.84 -0.11 0.00 0.77 0.00 0.00 66.41 66.18 2jps h THR 7 Cb 1.37 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 68.29 2jps h THR 7 CO 0.15 0.33 -0.19 -0.33 0.37 0.00 0.00 175.52 175.84 2jps h GLU 8 N 0.98 0.85 -0.14 6.66 3.07 -0.51 0.26 114.58 125.74 2jps h GLU 8 Ca 0.22 -0.37 -0.22 0.00 -0.50 0.00 0.00 59.36 58.50 2jps h GLU 8 Cb 0.27 -0.03 0.01 0.00 -0.84 0.00 0.00 28.75 28.17 2jps h GLU 8 CO -0.01 1.01 -0.77 -0.91 -1.40 0.00 0.00 179.01 176.93 2jps h ASN 9 N 0.66 0.87 -0.38 1.42 4.21 -1.22 -3.11 115.58 118.03 2jps h ASN 9 Ca 0.09 -0.57 -0.06 0.00 1.21 0.00 0.00 56.30 56.98 2jps h ASN 9 Cb 0.75 -0.26 -0.02 0.00 -1.12 0.00 0.00 38.32 37.67 2jps h ASN 9 CO 0.06 1.36 0.05 0.25 -1.29 0.00 0.00 177.43 177.86 2jps h LEU 10 N 0.50 0.68 -1.54 1.61 5.85 0.88 -2.41 115.31 120.89 2jps h LEU 10 Ca -0.05 -0.14 0.07 0.00 0.84 0.00 0.00 57.88 58.60 2jps h LEU 10 Cb 1.39 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 42.20 2jps h LEU 10 CO 0.15 0.72 0.40 0.50 -0.34 0.00 0.00 178.44 179.88 2jps h LYS 11 N 0.69 0.54 -0.07 1.25 3.11 -0.87 0.29 116.57 121.51 2jps h LYS 11 Ca 0.15 -0.03 -0.06 0.00 -2.81 0.00 0.00 60.65 57.89 2jps h LYS 11 Cb 0.36 -0.12 0.00 0.00 -1.00 0.00 0.00 32.23 31.46 2jps h LYS 11 CO 0.01 0.36 -0.19 0.28 -2.81 0.00 0.00 179.45 177.10 2jps h VAL 12 N 0.55 1.42 -0.41 2.00 2.07 -1.45 -1.94 116.25 118.49 2jps h VAL 12 Ca 0.27 -1.53 -0.06 0.00 0.82 0.00 0.00 66.70 66.20 2jps h VAL 12 Cb 0.34 2.23 -0.02 0.00 -1.52 0.00 0.00 31.29 32.32 2jps h VAL 12 CO -0.08 0.43 0.02 0.40 0.02 0.00 0.00 177.57 178.36 2jps h ILE 13 N -0.23 1.22 -0.46 4.57 2.04 -1.21 -2.33 117.51 121.10 2jps h ILE 13 Ca -0.00 -0.87 -0.08 0.00 1.00 0.00 0.00 64.86 64.92 2jps h ILE 13 Cb 0.79 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 37.74 2jps h ILE 13 CO 0.04 0.30 -0.01 0.58 0.00 0.00 0.00 178.15 179.06 2jps h VAL 14 N 0.62 1.26 -0.45 1.67 2.07 -0.41 -2.73 116.25 118.29 2jps h VAL 14 Ca 0.13 -1.07 -0.01 0.00 0.82 0.00 0.00 66.70 66.57 2jps h VAL 14 Cb 0.37 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 31.15 2jps h VAL 14 CO 0.01 0.37 0.23 0.00 0.02 0.00 0.00 177.57 178.20 2jps h ALA 15 N 0.91 1.56 -0.88 1.67 0.00 -1.00 -2.13 119.26 119.39 2jps h ALA 15 Ca 0.13 -0.09 0.15 0.00 0.00 0.00 0.00 54.91 55.10 2jps h ALA 15 Cb 0.52 -0.19 -0.07 0.00 0.00 0.00 0.00 17.79 18.05 2jps h ALA 15 CO 0.03 0.36 0.57 1.49 0.00 0.00 0.00 179.25 181.70 2jps h GLU 16 N 0.63 0.62 0.14 0.00 4.81 -1.10 0.69 114.58 120.38 2jps h GLU 16 Ca 0.16 -0.04 -0.27 0.00 -0.13 0.00 0.00 59.36 59.08 2jps h GLU 16 Cb 0.05 -0.14 0.01 0.00 0.63 0.00 0.00 28.75 29.30 2jps h GLU 16 CO -0.02 0.41 -1.31 -0.22 -0.73 0.00 0.00 179.01 177.14 2jps h LYS 17 N 0.64 0.30 0.24 1.92 3.11 -1.45 -2.88 116.57 118.46 2jps h LYS 17 Ca 0.44 -0.52 -0.01 0.00 -2.81 0.00 0.00 60.65 57.75 2jps h LYS 17 Cb 0.77 0.19 0.00 0.00 -1.00 0.00 0.00 32.23 32.20 2jps h LYS 17 CO -0.20 1.25 -0.11 -0.07 -2.81 0.00 0.00 179.45 177.51 2jps h LEU 18 N -0.23 -0.27 -2.33 5.20 3.38 -0.91 -1.66 115.31 118.49 2jps h LEU 18 Ca -0.26 -0.17 0.01 0.00 0.09 0.00 0.00 57.88 57.55 2jps h LEU 18 Cb 1.81 0.07 -0.00 0.00 0.09 0.00 0.00 40.66 42.63 2jps h LEU 18 CO 0.12 0.02 0.05 0.00 0.09 0.00 0.00 178.44 178.72 2jps h ALA 19 N 0.11 1.68 0.03 1.53 0.00 0.22 -1.94 119.26 120.89 2jps h ALA 19 Ca -0.03 -0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.65 2jps h ALA 19 Cb 0.42 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2jps h ALA 19 CO 0.05 -0.07 -0.99 0.78 0.00 0.00 0.00 179.25 179.02 2jps h GLY 20 N 0.00 0.27 -4.86 0.00 0.00 -1.23 -3.45 103.07 93.80 2jps h GLY 20 Ca 0.02 -0.54 -0.57 0.00 0.00 0.00 0.00 47.33 46.25 2jps h GLY 20 CO -0.00 0.48 0.85 1.39 0.00 0.00 0.00 176.54 179.25 2jps n ILE 21 N -3.62 0.08 0.23 2.60 5.41 -0.66 -4.87 119.36 118.53 2jps n ILE 21 Ca -0.05 -0.02 0.12 0.00 1.00 0.00 0.00 62.75 63.80 2jps n ILE 21 Cb 0.88 -1.66 0.44 0.00 -0.71 0.00 0.00 39.64 38.59 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 6.02 0.00 -0.78 0.38 0.13 -1.87 -3.18 132.00 132.69 2jps h PRO 22 Ca -0.44 0.00 -0.45 0.00 -0.87 0.00 0.00 66.00 64.23 2jps h PRO 22 Cb 1.24 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 32.12 2jps h PRO 22 CO 0.90 0.14 0.37 0.09 -0.23 0.00 0.00 178.00 179.27 2jps n ASN 23 N -3.24 4.23 -3.68 1.44 3.02 -1.26 -4.77 115.26 111.00 2jps n ASN 23 Ca 0.01 -3.72 -0.27 0.00 -0.03 0.00 0.00 54.58 50.57 2jps n ASN 23 Cb 0.43 -0.77 -0.11 0.00 -0.61 0.00 0.00 39.78 38.73 2jps n ASN 23 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 2jps n PHE 24 N -1.07 1.95 -1.74 3.10 -0.00 -1.20 -4.93 117.46 113.58 2jps n PHE 24 Ca 0.51 -3.98 -0.24 0.00 -0.00 0.00 0.00 57.45 53.74 2jps n PHE 24 Cb 1.23 -0.36 0.07 0.00 -0.00 0.00 0.00 39.48 40.42 2jps n PHE 24 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.76 176.85 2jps n ASN 25 N 2.07 5.33 -3.70 -2.13 3.02 -1.26 -4.78 115.26 113.80 2jps n ASN 25 Ca 0.24 -3.77 -0.13 0.00 -0.03 0.00 0.00 54.58 50.89 2jps n ASN 25 Cb 0.40 -0.57 -0.13 0.00 -0.61 0.00 0.00 39.78 38.87 2jps n ASN 25 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2jps s GLU 26 N -3.61 0.20 -1.34 3.52 2.02 -1.26 -4.89 118.70 113.34 2jps s GLU 26 Ca 0.54 0.64 -0.10 0.00 0.02 0.00 0.00 54.97 56.07 2jps s GLU 26 Cb 0.44 -0.07 0.07 0.00 0.10 0.00 0.00 34.13 34.67 2jps s GLU 26 CO 0.02 -0.21 0.54 -0.25 0.02 0.00 0.00 175.26 175.38 2jps n ASP 27 N 4.67 -3.92 0.07 -0.19 8.00 -1.26 -4.84 116.55 119.08 2jps n ASP 27 Ca -0.18 -0.44 -0.00 0.00 0.71 0.00 0.00 54.79 54.88 2jps n ASP 27 Cb 0.52 -3.22 0.30 0.00 -0.02 0.00 0.00 41.12 38.69 2jps n ASP 27 CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 2jps h ILE 28 N -1.09 1.23 0.16 0.53 -0.00 -1.90 0.60 117.51 117.03 2jps h ILE 28 Ca -0.45 -1.03 -0.32 0.00 -0.00 0.00 0.00 64.86 63.06 2jps h ILE 28 Cb 1.30 1.28 0.01 0.00 -0.00 0.00 0.00 36.82 39.40 2jps h ILE 28 CO 0.56 0.32 -1.53 0.11 -0.00 0.00 0.00 178.15 177.61 2jps h LYS 29 N 0.32 0.33 0.00 2.19 1.57 -1.98 -3.17 116.57 115.83 2jps h LYS 29 Ca 0.06 -0.57 -0.14 0.00 -1.87 0.00 0.00 60.65 58.13 2jps h LYS 29 Cb 0.51 0.21 -0.02 0.00 0.08 0.00 0.00 32.23 33.01 2jps h LYS 29 CO 0.03 1.23 -0.65 1.88 -0.57 0.00 0.00 179.45 181.37 2jps h TYR 30 N 0.09 0.00 -0.08 -1.35 0.05 -1.89 -3.13 116.97 110.65 2jps h TYR 30 Ca -0.25 0.00 -0.14 0.00 0.05 0.00 0.00 58.73 58.39 2jps h TYR 30 Cb 2.05 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 39.78 2jps h TYR 30 CO 0.08 0.65 -0.57 -0.24 -1.05 0.00 0.00 178.16 177.04 2jps h VAL 31 N 0.00 1.37 -0.51 -2.88 3.04 0.11 -3.05 116.25 114.33 2jps h VAL 31 Ca -0.01 -1.89 -0.11 0.00 -1.01 0.00 0.00 66.70 63.68 2jps h VAL 31 Cb 1.18 1.94 -0.02 0.00 -2.01 0.00 0.00 31.29 32.38 2jps h VAL 31 CO 0.08 0.56 -0.11 0.00 -1.01 0.00 0.00 177.57 177.09 2jps h ALA 32 N 1.22 0.84 -0.38 3.17 0.00 -1.51 -1.53 119.26 121.06 2jps h ALA 32 Ca -0.00 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2jps h ALA 32 Cb 1.05 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 2jps h ALA 32 CO 0.09 0.65 0.25 0.93 0.00 0.00 0.00 179.25 181.17 2jps h GLU 33 N 0.85 0.50 -0.77 0.00 5.08 -1.51 -0.54 114.58 118.19 2jps h GLU 33 Ca 0.13 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.41 2jps h GLU 33 Cb 0.66 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.76 2jps h GLU 33 CO 0.05 0.34 0.28 -0.92 -1.00 0.00 0.00 179.01 177.75 2jps h TYR 34 N 0.51 1.20 -0.50 4.33 3.20 -1.43 -0.56 116.97 123.72 2jps h TYR 34 Ca 0.14 -0.10 0.03 0.00 3.14 0.00 0.00 58.73 61.94 2jps h TYR 34 Cb -0.05 -0.35 -0.04 0.00 1.54 0.00 0.00 36.73 37.83 2jps h TYR 34 CO -0.05 0.92 0.28 0.82 -1.64 0.00 0.00 178.16 178.49 2jps h ILE 35 N 1.13 1.01 -0.71 1.81 2.04 -0.65 0.11 117.51 122.25 2jps h ILE 35 Ca 0.25 -0.19 -0.07 0.00 1.00 0.00 0.00 64.86 65.86 2jps h ILE 35 Cb 0.25 0.41 -0.03 0.00 -0.74 0.00 0.00 36.82 36.72 2jps h ILE 35 CO -0.02 0.10 0.19 0.58 0.00 0.00 0.00 178.15 179.00 2jps h VAL 36 N 0.55 1.26 -0.66 1.67 2.07 -0.70 -0.10 116.25 120.35 2jps h VAL 36 Ca 0.21 -0.95 0.00 0.00 0.82 0.00 0.00 66.70 66.78 2jps h VAL 36 Cb 0.07 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.32 2jps h VAL 36 CO -0.12 0.37 0.42 0.25 0.02 0.00 0.00 177.57 178.51 2jps h LEU 37 N 1.07 0.77 -0.57 2.57 5.85 -0.18 -0.11 115.31 124.72 2jps h LEU 37 Ca 0.23 -0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.87 2jps h LEU 37 Cb 0.35 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 2jps h LEU 37 CO -0.00 0.58 0.21 -0.07 -0.34 0.00 0.00 178.44 178.81 2jps h LEU 38 N 0.89 0.80 -0.84 2.25 3.38 -0.39 -2.60 115.31 118.79 2jps h LEU 38 Ca 0.24 -0.18 0.04 0.00 0.09 0.00 0.00 57.88 58.06 2jps h LEU 38 Cb -0.07 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.42 2jps h LEU 38 CO -0.05 0.77 0.53 0.40 0.09 0.00 0.00 178.44 180.18 2jps h ILE 39 N 0.78 1.10 0.00 1.22 1.08 -0.26 -1.57 117.51 119.86 2jps h ILE 39 Ca 0.19 -0.35 -0.04 0.00 -0.39 0.00 0.00 64.86 64.27 2jps h ILE 39 Cb 0.23 -0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 33.98 2jps h ILE 39 CO -0.01 0.19 -0.20 0.58 -0.69 0.00 0.00 178.15 178.01 2jps h VAL 40 N 1.02 0.87 0.00 1.67 2.07 -0.68 -2.94 116.25 118.26 2jps h VAL 40 Ca 0.34 -0.76 -0.22 0.00 0.82 0.00 0.00 66.70 66.88 2jps h VAL 40 Cb 0.06 1.45 -0.03 0.00 -1.52 0.00 0.00 31.29 31.24 2jps h VAL 40 CO -0.13 0.20 -1.17 0.78 0.02 0.00 0.00 177.57 177.27 2jps h ASN 41 N 0.00 0.00 0.00 0.57 2.35 -0.99 -3.49 115.58 114.02 2jps h ASN 41 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2jps h ASN 41 Cb 0.43 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.80 2jps h ASN 41 CO 0.03 0.93 0.00 0.61 -1.65 0.00 0.00 177.43 177.35 2jps n GLY 42 N 1.40 0.81 0.22 2.83 0.00 -0.86 -5.01 105.19 104.58 2jps n GLY 42 Ca -0.05 -0.82 0.15 0.00 0.00 0.00 0.00 46.02 45.31 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 0.00 -0.55 3.98 -0.02 0.00 -1.21 -4.92 105.19 102.46 2jps n GLY 43 Ca 0.00 -0.31 -0.32 0.00 0.00 0.00 0.00 46.02 45.39 2jps n GLY 43 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2jps n THR 44 N -0.48 -0.79 0.00 2.61 -2.24 -1.26 -0.08 114.28 112.05 2jps n THR 44 Ca 0.21 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.99 2jps n THR 44 Cb 0.22 -1.42 0.00 0.00 -2.10 0.00 0.00 70.33 67.03 2jps n THR 44 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2jps n VAL 45 N -4.12 0.00 -0.27 2.28 0.31 -1.26 -4.22 118.33 111.05 2jps n VAL 45 Ca 0.06 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.38 2jps n VAL 45 Cb 0.49 0.00 0.11 0.00 -0.91 0.00 0.00 33.84 33.53 2jps n VAL 45 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 2jps h GLU 46 N 0.00 0.82 -0.14 5.55 4.81 -1.99 0.92 114.58 124.55 2jps h GLU 46 Ca 0.00 -0.05 -0.19 0.00 -0.13 0.00 0.00 59.36 58.99 2jps h GLU 46 Cb 0.00 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 29.19 2jps h GLU 46 CO 0.00 0.54 -0.69 1.03 -0.73 0.00 0.00 179.01 179.16 2jps h SER 47 N 0.85 0.69 -0.29 1.04 0.87 -0.66 -2.28 113.55 113.76 2jps h SER 47 Ca 0.32 -0.43 -0.04 0.00 -1.23 0.00 0.00 61.79 60.41 2jps h SER 47 Cb 0.13 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 61.88 2jps h SER 47 CO -0.16 1.18 0.01 0.58 -0.53 0.00 0.00 176.83 177.92 2jps h VAL 48 N 0.42 1.25 -0.87 2.23 2.07 -0.98 -2.85 116.25 117.53 2jps h VAL 48 Ca -0.03 -0.90 -0.00 0.00 0.82 0.00 0.00 66.70 66.60 2jps h VAL 48 Cb 1.28 1.26 -0.04 0.00 -1.52 0.00 0.00 31.29 32.27 2jps h VAL 48 CO 0.13 0.29 0.53 0.58 0.02 0.00 0.00 177.57 179.12 2jps h VAL 49 N 0.31 1.24 -0.56 2.57 2.07 0.84 -1.67 116.25 121.05 2jps h VAL 49 Ca 0.08 -0.51 0.07 0.00 0.82 0.00 0.00 66.70 67.17 2jps h VAL 49 Cb 0.40 0.01 -0.03 0.00 -1.52 0.00 0.00 31.29 30.15 2jps h VAL 49 CO 0.01 0.25 0.37 -0.78 0.02 0.00 0.00 177.57 177.44 2jps h ASP 50 N 1.19 0.42 -0.17 0.57 3.58 -1.24 0.45 116.42 121.22 2jps h ASP 50 Ca 0.31 0.00 -0.21 0.00 0.42 0.00 0.00 57.03 57.56 2jps h ASP 50 Cb -0.06 -0.09 0.01 0.00 1.72 0.00 0.00 39.33 40.91 2jps h ASP 50 CO -0.06 0.27 -0.71 -0.33 -2.88 0.00 0.00 179.24 175.53 2jps h GLU 51 N 0.48 0.78 -0.06 0.28 3.07 -1.09 -1.24 114.58 116.80 2jps h GLU 51 Ca 0.25 -0.61 -0.19 0.00 -0.50 0.00 0.00 59.36 58.30 2jps h GLU 51 Cb 0.35 0.12 -0.00 0.00 -0.84 0.00 0.00 28.75 28.38 2jps h GLU 51 CO -0.07 1.23 -0.77 -0.07 -1.40 0.00 0.00 179.01 177.93 2jps h LEU 52 N 0.52 0.49 -0.68 1.33 -0.00 -0.90 -3.12 115.31 112.95 2jps h LEU 52 Ca -0.04 -0.34 -0.13 0.00 -0.00 0.00 0.00 57.88 57.38 2jps h LEU 52 Cb 1.34 -0.15 -0.01 0.00 -0.00 0.00 0.00 40.66 41.84 2jps h LEU 52 CO 0.15 1.09 -0.33 0.00 -0.00 0.00 0.00 178.44 179.35 2jps h ALA 53 N 0.90 0.86 -0.68 1.53 0.00 -0.13 1.13 119.26 122.86 2jps h ALA 53 Ca -0.04 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2jps h ALA 53 Cb 1.36 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.99 2jps h ALA 53 CO 0.13 0.63 0.44 0.77 0.00 0.00 0.00 179.25 181.22 2jps h SER 54 N 0.56 0.80 0.04 0.00 0.02 -1.18 -2.63 113.55 111.16 2jps h SER 54 Ca 0.06 -0.03 -0.38 0.00 -0.84 0.00 0.00 61.79 60.60 2jps h SER 54 Cb 0.83 -0.20 -0.05 0.00 0.14 0.00 0.00 62.40 63.12 2jps h SER 54 CO 0.07 0.59 -2.31 0.18 -1.14 0.00 0.00 176.83 174.22 2jps n LEU 55 N -4.42 2.79 -3.92 5.07 4.77 -1.12 -4.64 117.00 115.54 2jps n LEU 55 Ca 0.07 0.01 -0.36 0.00 -0.03 0.00 0.00 56.01 55.69 2jps n LEU 55 Cb 0.05 -0.97 -0.04 0.00 -2.33 0.00 0.00 43.42 40.13 2jps n LEU 55 CO 0.36 0.88 0.54 0.49 -1.33 0.00 0.00 177.39 178.33 2jps n PHE 56 N -3.41 3.57 -1.18 -1.77 3.72 0.39 -4.85 117.46 113.92 2jps n PHE 56 Ca -0.42 -3.67 -0.17 0.00 -0.05 0.00 0.00 57.45 53.14 2jps n PHE 56 Cb 0.99 -1.06 0.22 0.00 -0.94 0.00 0.00 39.48 38.70 2jps n PHE 56 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 2jps n ASP 57 N 1.66 4.04 -0.08 4.37 -0.08 -0.99 -4.31 116.55 121.16 2jps n ASP 57 Ca 0.25 -3.49 -0.14 0.00 -1.51 0.00 0.00 54.79 49.90 2jps n ASP 57 Cb 0.37 -0.80 -0.14 0.00 2.34 0.00 0.00 41.12 42.89 2jps n ASP 57 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 2jps n SER 58 N -0.83 1.08 -4.91 1.67 3.41 -1.26 -4.95 113.62 107.83 2jps n SER 58 Ca 0.53 0.07 -0.27 0.00 -0.26 0.00 0.00 58.87 58.94 2jps n SER 58 Cb 1.55 0.09 -0.03 0.00 -0.26 0.00 0.00 64.21 65.56 2jps n SER 58 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2jps s VAL 59 N -2.53 5.04 0.43 -3.33 0.11 -1.26 -5.04 120.40 113.83 2jps s VAL 59 Ca -0.18 -0.07 -0.24 0.00 -2.93 0.00 0.00 61.98 58.56 2jps s VAL 59 Cb 0.07 -3.77 -0.10 0.00 -1.53 0.00 0.00 36.38 31.05 2jps s VAL 59 CO 0.75 -0.40 1.02 -1.20 -3.33 0.00 0.00 175.10 171.95 2jps n SER 60 N -1.19 1.30 -0.19 3.54 7.64 -1.26 -4.84 113.62 118.63 2jps n SER 60 Ca -0.02 1.02 0.19 0.00 1.01 0.00 0.00 58.87 61.07 2jps n SER 60 Cb 0.54 -1.36 0.54 0.00 -1.01 0.00 0.00 64.21 62.92 2jps n SER 60 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 2jps h ARG 61 N 1.50 0.33 -0.79 1.43 -0.00 -1.96 -0.78 114.38 114.12 2jps h ARG 61 Ca -0.45 -0.02 0.10 0.00 -0.50 0.00 0.00 59.98 59.11 2jps h ARG 61 Cb 1.34 -0.07 -0.05 0.00 0.00 0.00 0.00 29.97 31.18 2jps h ARG 61 CO 0.57 0.22 0.52 0.22 0.00 0.00 0.00 179.97 181.49 2jps h ASP 62 N 0.34 0.66 -0.46 7.04 1.82 -1.99 0.14 116.42 123.97 2jps h ASP 62 Ca 0.41 0.02 -0.10 0.00 -0.39 0.00 0.00 57.03 56.97 2jps h ASP 62 Cb 1.08 -0.12 -0.01 0.00 0.68 0.00 0.00 39.33 40.95 2jps h ASP 62 CO -0.12 0.39 -0.09 0.74 -1.61 0.00 0.00 179.24 178.55 2jps h THR 63 N 0.73 1.27 -0.26 2.25 2.02 -1.47 -0.47 112.91 116.98 2jps h THR 63 Ca 0.37 -1.20 -0.10 0.00 0.77 0.00 0.00 66.41 66.24 2jps h THR 63 Cb 0.45 1.10 -0.00 0.00 -1.74 0.00 0.00 68.15 67.96 2jps h THR 63 CO -0.14 0.41 -0.23 -0.07 0.37 0.00 0.00 175.52 175.86 2jps h LEU 64 N 0.71 0.65 -1.42 2.58 4.07 -1.32 -2.93 115.31 117.66 2jps h LEU 64 Ca 0.12 -0.46 -0.01 0.00 0.08 0.00 0.00 57.88 57.60 2jps h LEU 64 Cb 0.63 -0.18 -0.02 0.00 1.08 0.00 0.00 40.66 42.16 2jps h LEU 64 CO 0.04 0.98 0.25 0.00 -1.08 0.00 0.00 178.44 178.63 2jps h ALA 65 N 0.69 1.56 -0.60 1.53 0.00 -0.67 -1.91 119.26 119.86 2jps h ALA 65 Ca 0.04 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2jps h ALA 65 Cb 0.79 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 2jps h ALA 65 CO 0.06 0.37 0.38 -0.97 0.00 0.00 0.00 179.25 179.09 2jps h ASN 66 N 0.65 0.71 0.01 0.00 -0.73 -0.90 0.38 115.58 115.70 2jps h ASN 66 Ca 0.17 -0.04 -0.14 0.00 1.87 0.00 0.00 56.30 58.16 2jps h ASN 66 Cb 0.03 -0.18 -0.01 0.00 0.27 0.00 0.00 38.32 38.43 2jps h ASN 66 CO -0.03 0.54 -0.45 0.58 -0.37 0.00 0.00 177.43 177.70 2jps h VAL 67 N 0.81 1.31 -0.14 2.57 2.07 -1.34 -2.21 116.25 119.32 2jps h VAL 67 Ca 0.22 -1.64 -0.16 0.00 0.82 0.00 0.00 66.70 65.94 2jps h VAL 67 Cb -0.06 1.63 -0.01 0.00 -1.52 0.00 0.00 31.29 31.34 2jps h VAL 67 CO -0.04 0.51 -0.57 0.58 0.02 0.00 0.00 177.57 178.07 2jps h VAL 68 N 0.43 1.34 -0.42 2.57 2.07 -0.85 -2.88 116.25 118.51 2jps h VAL 68 Ca 0.03 -1.86 -0.15 0.00 0.82 0.00 0.00 66.70 65.54 2jps h VAL 68 Cb 0.95 1.85 -0.01 0.00 -1.52 0.00 0.00 31.29 32.57 2jps h VAL 68 CO 0.08 0.57 -0.33 1.56 0.02 0.00 0.00 177.57 179.47 2jps h GLN 69 N 0.34 0.96 -0.03 1.57 4.20 -0.12 -2.94 115.11 119.10 2jps h GLN 69 Ca 0.00 -0.47 -0.06 0.00 0.06 0.00 0.00 58.65 58.18 2jps h GLN 69 Cb 1.10 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.87 2jps h GLN 69 CO 0.10 1.14 -0.27 0.00 -0.67 0.00 0.00 178.83 179.13 2jps h THR 70 N 0.80 1.20 -0.62 -0.54 1.03 -1.38 -1.99 112.91 111.42 2jps h THR 70 Ca 0.08 -0.97 -0.06 0.00 -0.01 0.00 0.00 66.41 65.45 2jps h THR 70 Cb 0.92 1.49 -0.02 0.00 -1.07 0.00 0.00 68.15 69.46 2jps h THR 70 CO 0.09 0.28 0.14 0.00 -0.01 0.00 0.00 175.52 176.02 2jps h ALA 71 N 1.69 0.81 -0.20 0.00 0.00 -1.33 0.81 119.26 121.05 2jps h ALA 71 Ca 0.01 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.62 2jps h ALA 71 Cb 0.50 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 2jps h ALA 71 CO 0.04 0.53 -0.12 0.74 0.00 0.00 0.00 179.25 180.44 2jps h PHE 72 N 0.91 0.50 -0.74 0.00 0.04 -1.41 -1.30 116.94 114.94 2jps h PHE 72 Ca 0.19 -0.13 -0.07 0.00 2.80 0.00 0.00 57.97 60.77 2jps h PHE 72 Cb 0.37 -0.11 -0.03 0.00 2.20 0.00 0.00 35.95 38.38 2jps h PHE 72 CO 0.03 0.74 0.20 0.74 -0.60 0.00 0.00 178.31 179.42 2jps h PHE 73 N 0.11 1.21 -0.96 -0.55 0.04 -1.20 -2.56 116.94 113.03 2jps h PHE 73 Ca 0.04 -0.13 0.00 0.00 2.80 0.00 0.00 57.97 60.68 2jps h PHE 73 Cb 0.62 -0.35 -0.05 0.00 2.20 0.00 0.00 35.95 38.38 2jps h PHE 73 CO 0.07 0.97 0.61 0.00 -0.60 0.00 0.00 178.31 179.35 2jps h ALA 74 N 1.11 1.22 -0.77 2.45 0.00 0.78 -1.90 119.26 122.15 2jps h ALA 74 Ca 0.23 -0.09 0.12 0.00 0.00 0.00 0.00 54.91 55.17 2jps h ALA 74 Cb 0.34 -0.39 -0.05 0.00 0.00 0.00 0.00 17.79 17.69 2jps h ALA 74 CO -0.00 0.65 0.50 -0.07 0.00 0.00 0.00 179.25 180.33 2jps h LEU 75 N 1.32 0.54 -0.04 0.00 3.38 -0.81 0.00 115.31 119.70 2jps h LEU 75 Ca 0.35 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.34 2jps h LEU 75 Cb -0.10 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.56 2jps h LEU 75 CO -0.07 0.30 0.02 -0.33 0.09 0.00 0.00 178.44 178.46 2jps h GLU 76 N 0.59 0.05 -0.71 1.13 5.08 -1.28 -1.25 114.58 118.18 2jps h GLU 76 Ca 0.36 -0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.66 2jps h GLU 76 Cb 0.61 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.82 2jps h GLU 76 CO -0.13 0.05 0.21 0.00 -1.00 0.00 0.00 179.01 178.13 2jps h ALA 77 N 1.00 1.01 -0.61 3.43 0.00 -1.32 -2.03 119.26 120.74 2jps h ALA 77 Ca 0.01 -0.23 0.10 0.00 0.00 0.00 0.00 54.91 54.80 2jps h ALA 77 Cb 0.01 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.49 2jps h ALA 77 CO -0.00 0.65 0.41 1.25 0.00 0.00 0.00 179.25 181.56 2jps h LEU 78 N 1.07 0.36 -3.80 0.00 7.12 -0.47 0.15 115.31 119.73 2jps h LEU 78 Ca 0.23 0.01 -0.28 0.00 0.13 0.00 0.00 57.88 57.96 2jps h LEU 78 Cb 0.32 -0.07 -0.17 0.00 -0.53 0.00 0.00 40.66 40.22 2jps h LEU 78 CO -0.00 0.21 0.36 0.00 -0.13 0.00 0.00 178.44 178.88 2jps n GLN 79 N -4.47 3.45 0.11 1.25 6.02 -0.52 -4.61 117.38 118.60 2jps n GLN 79 Ca 0.10 -3.09 0.00 0.00 -0.01 0.00 0.00 57.00 54.01 2jps n GLN 79 Cb 0.39 -2.22 0.00 0.00 1.02 0.00 0.00 30.24 29.43 2jps n GLN 79 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 2jps n GLN 80 N -0.36 0.00 0.00 -1.09 7.27 -0.02 -5.04 117.38 118.14 2jps n GLN 80 Ca 0.45 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.52 2jps n GLN 80 Cb 1.46 -0.20 0.00 0.00 2.41 0.00 0.00 30.24 33.92 2jps n GLN 80 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2jps n GLY 81 N 2.28 -1.76 0.00 1.69 0.00 -0.81 -5.10 105.19 101.49 2jps n GLY 81 Ca 0.00 0.75 0.00 0.00 0.00 0.00 0.00 46.02 46.77 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 0.00 0.32 -3.85 1.61 4.07 -1.23 -5.04 120.64 116.51 2jps n GLU 82 Ca 0.00 0.00 -0.12 0.00 -0.06 0.00 0.00 57.16 56.98 2jps n GLU 82 Cb 0.00 0.00 -0.11 0.00 -0.06 0.00 0.00 31.44 31.27 2jps n GLU 82 CO 0.00 0.00 0.00 -1.12 -0.06 0.00 0.00 177.13 175.95 2jps s SER 83 N -0.29 -0.04 -0.24 4.31 0.01 -1.26 -4.99 113.70 111.21 2jps s SER 83 Ca 0.00 -0.02 0.08 0.00 1.31 0.00 0.00 55.95 57.32 2jps s SER 83 Cb 0.00 0.25 -0.20 0.00 0.21 0.00 0.00 66.02 66.28 2jps s SER 83 CO 0.00 -0.26 -0.11 0.00 0.41 0.00 0.00 173.24 173.28 2jps n ALA 84 N 1.98 1.46 -0.35 1.44 0.00 -1.26 -4.39 120.51 119.40 2jps n ALA 84 Ca -0.19 -1.20 0.02 0.00 0.00 0.00 0.00 53.44 52.06 2jps n ALA 84 Cb 0.57 -0.13 0.16 0.00 0.00 0.00 0.00 19.45 20.04 2jps n ALA 84 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2jps h GLU 85 N 0.00 1.07 -0.71 0.00 4.81 -1.97 -1.53 114.58 116.26 2jps h GLU 85 Ca -0.57 -0.06 0.04 0.00 -0.13 0.00 0.00 59.36 58.64 2jps h GLU 85 Cb 2.04 -0.24 -0.04 0.00 0.63 0.00 0.00 28.75 31.14 2jps h GLU 85 CO -0.04 0.71 0.47 -0.91 -0.73 0.00 0.00 179.01 178.50 2jps h ASN 86 N 1.11 0.72 -0.48 1.04 2.35 -2.01 -1.52 115.58 116.78 2jps h ASN 86 Ca 0.41 -0.01 -0.05 0.00 -0.55 0.00 0.00 56.30 56.10 2jps h ASN 86 Cb 0.15 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.34 2jps h ASN 86 CO -0.17 0.49 0.12 0.40 -1.65 0.00 0.00 177.43 176.62 2jps h ILE 87 N 0.83 1.23 -0.80 2.81 1.08 -1.48 -2.54 117.51 118.63 2jps h ILE 87 Ca 0.29 -0.82 0.02 0.00 -0.39 0.00 0.00 64.86 63.95 2jps h ILE 87 Cb 0.11 0.69 -0.04 0.00 -3.07 0.00 0.00 36.82 34.50 2jps h ILE 87 CO -0.09 0.31 0.53 0.58 -0.69 0.00 0.00 178.15 178.79 2jps h VAL 88 N 0.79 1.18 -0.88 1.67 2.07 -1.16 -1.92 116.25 117.99 2jps h VAL 88 Ca 0.17 -0.36 0.10 0.00 0.82 0.00 0.00 66.70 67.43 2jps h VAL 88 Cb 0.30 0.04 -0.07 0.00 -1.52 0.00 0.00 31.29 30.04 2jps h VAL 88 CO -0.00 0.19 0.53 0.77 0.02 0.00 0.00 177.57 179.08 2jps h SER 89 N 1.04 0.77 -0.06 0.57 4.64 -1.37 0.24 113.55 119.39 2jps h SER 89 Ca 0.30 0.04 -0.12 0.00 -0.47 0.00 0.00 61.79 61.55 2jps h SER 89 Cb -0.07 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 61.90 2jps h SER 89 CO -0.07 0.44 -0.33 0.11 -0.87 0.00 0.00 176.83 176.11 2jps h LYS 90 N 0.88 0.54 -0.28 4.77 1.57 -1.40 -2.52 116.57 120.13 2jps h LYS 90 Ca 0.42 -0.24 -0.17 0.00 -1.87 0.00 0.00 60.65 58.79 2jps h LYS 90 Cb 0.36 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.66 2jps h LYS 90 CO -0.24 0.80 -0.51 0.82 -0.57 0.00 0.00 179.45 179.76 2jps h ILE 91 N 0.46 1.29 -0.77 1.86 1.08 -0.66 -1.15 117.51 119.61 2jps h ILE 91 Ca 0.05 -1.70 -0.03 0.00 -0.39 0.00 0.00 64.86 62.80 2jps h ILE 91 Cb 0.79 1.60 -0.04 0.00 -3.07 0.00 0.00 36.82 36.11 2jps h ILE 91 CO 0.06 0.55 0.37 -0.09 -0.69 0.00 0.00 178.15 178.35 2jps h ARG 92 N 0.62 1.10 -0.19 2.37 9.65 -0.46 0.82 114.38 128.30 2jps h ARG 92 Ca 0.02 -0.16 -0.21 0.00 -1.10 0.00 0.00 59.98 58.53 2jps h ARG 92 Cb 1.09 -0.20 0.01 0.00 -1.39 0.00 0.00 29.97 29.48 2jps h ARG 92 CO 0.11 0.85 -0.72 1.98 2.80 0.00 0.00 179.97 184.99 2jps h MET 93 N 1.09 0.83 -0.22 0.20 4.05 -1.35 -0.83 114.93 118.71 2jps h MET 93 Ca 0.27 -0.63 -0.17 0.00 -0.28 0.00 0.00 59.70 58.88 2jps h MET 93 Cb 0.11 0.12 -0.00 0.00 -0.80 0.00 0.00 31.60 31.03 2jps h MET 93 CO -0.03 1.25 -0.56 0.52 0.23 0.00 0.00 176.91 178.31 2jps h MET 94 N 0.58 0.67 -0.23 0.39 2.86 -0.83 -1.83 114.93 116.55 2jps h MET 94 Ca -0.03 -0.43 -0.15 0.00 -2.06 0.00 0.00 59.70 57.03 2jps h MET 94 Cb 1.34 0.05 -0.01 0.00 0.06 0.00 0.00 31.60 33.05 2jps h MET 94 CO 0.15 1.05 -0.47 -0.91 1.06 0.00 0.00 176.91 177.79 2jps h ASN 95 N 0.51 0.65 -0.41 1.22 2.35 0.67 -2.39 115.58 118.19 2jps h ASN 95 Ca 0.01 -0.32 -0.14 0.00 -0.55 0.00 0.00 56.30 55.30 2jps h ASN 95 Cb 1.13 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 39.30 2jps h ASN 95 CO 0.11 1.02 -0.29 0.00 -1.65 0.00 0.00 177.43 176.62 2jps h ALA 96 N 1.00 0.67 -0.76 -0.83 0.00 -1.08 -3.01 119.26 115.25 2jps h ALA 96 Ca 0.03 -0.42 -0.06 0.00 0.00 0.00 0.00 54.91 54.46 2jps h ALA 96 Cb 1.00 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 2jps h ALA 96 CO 0.09 0.67 0.26 0.37 0.00 0.00 0.00 179.25 180.64 2jps h GLN 97 N 0.79 1.17 -0.43 0.00 4.15 -1.25 0.71 115.11 120.25 2jps h GLN 97 Ca 0.09 -0.24 0.04 0.00 0.77 0.00 0.00 58.65 59.31 2jps h GLN 97 Cb 0.87 -0.17 -0.02 0.00 0.21 0.00 0.00 27.48 28.36 2jps h GLN 97 CO 0.08 0.98 0.29 0.66 -1.93 0.00 0.00 178.83 178.90 2jps h SER 98 N 1.12 0.35 0.24 -0.69 4.64 -1.30 -2.83 113.55 115.09 2jps h SER 98 Ca 0.25 -0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 61.22 2jps h SER 98 Cb 0.28 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 62.28 2jps h SER 98 CO -0.01 0.24 -1.85 0.25 -0.87 0.00 0.00 176.83 174.59 2jps h LEU 99 N 0.41 0.37 0.00 5.97 5.85 -1.34 -3.49 115.31 123.07 2jps h LEU 99 Ca 0.18 -0.73 0.00 0.00 0.84 0.00 0.00 57.88 58.17 2jps h LEU 99 Cb 0.21 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.12 2jps h LEU 99 CO -0.04 1.64 0.00 0.61 -0.34 0.00 0.00 178.44 180.31 2jps n GLY 100 N 1.85 2.19 2.61 3.75 0.00 0.20 -5.13 105.19 110.66 2jps n GLY 100 Ca -0.26 0.05 -0.23 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.40 0.63 -1.11 1.61 -0.44 -1.24 -4.80 119.66 113.91 2jps s GLN 101 Ca 0.00 -1.17 -0.16 0.00 -2.50 0.00 0.00 55.36 51.53 2jps s GLN 101 Cb 0.00 -1.01 -0.03 0.00 -1.64 0.00 0.00 33.01 30.34 2jps s GLN 101 CO 0.00 -1.22 0.84 0.45 0.50 0.00 0.00 175.29 175.85 2jps n SER 102 N 4.01 -5.77 -4.17 6.67 2.88 -1.26 -4.90 113.62 111.08 2jps n SER 102 Ca 0.13 -0.92 -0.34 0.00 -1.33 0.00 0.00 58.87 56.41 2jps n SER 102 Cb 0.42 -3.96 -0.15 0.00 -0.75 0.00 0.00 64.21 59.78 2jps n SER 102 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 2jps s ASP 103 N -3.44 3.99 -0.02 -3.46 1.11 -1.26 -5.10 116.67 108.49 2jps s ASP 103 Ca 0.47 -0.83 -0.06 0.00 0.18 0.00 0.00 52.55 52.32 2jps s ASP 103 Cb -0.14 -1.60 0.00 0.00 1.07 0.00 0.00 42.92 42.25 2jps s ASP 103 CO 0.82 -0.09 0.12 -0.51 1.18 0.00 0.00 175.17 176.70 2jps s ILE 104 N 1.30 0.05 0.00 0.77 2.07 -1.26 -5.18 121.20 118.96 2jps s ILE 104 Ca 0.01 -0.42 0.00 0.00 -1.41 0.00 0.00 60.65 58.83 2jps s ILE 104 Cb -0.16 -0.32 0.00 0.00 0.13 0.00 0.00 42.46 42.11 2jps s ILE 104 CO -0.07 -0.23 0.15 0.00 -1.91 0.00 0.00 174.94 172.88