#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 3.55 -0.52 7.83 1.04 -1.26 -5.10 113.70 119.24 2jps s SER 2 Ca 0.00 -1.12 0.06 0.00 0.48 0.00 0.00 55.95 55.37 2jps s SER 2 Cb 0.00 -0.31 0.22 0.00 0.10 0.00 0.00 66.02 66.03 2jps s SER 2 CO 0.00 -0.10 0.53 0.00 0.98 0.00 0.00 173.24 174.65 2jps n GLN 3 N -0.68 1.29 -0.07 4.02 1.13 -1.26 -4.91 117.38 116.89 2jps n GLN 3 Ca -0.05 -3.84 -0.19 0.00 -1.94 0.00 0.00 57.00 50.98 2jps n GLN 3 Cb 0.62 -1.80 -0.13 0.00 0.11 0.00 0.00 30.24 29.04 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 1.69 0.69 -0.28 -1.09 2.13 -1.26 -3.48 120.64 119.04 2jps n GLU 4 Ca 0.25 0.19 0.10 0.00 0.66 0.00 0.00 57.16 58.37 2jps n GLU 4 Cb 0.45 -1.60 0.34 0.00 0.27 0.00 0.00 31.44 30.90 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 0.03 0.75 -0.14 5.31 3.07 -2.00 0.43 115.11 122.56 2jps h GLN 5 Ca -0.51 -0.04 -0.23 0.00 0.09 0.00 0.00 58.65 57.96 2jps h GLN 5 Cb 1.98 -0.17 0.01 0.00 0.08 0.00 0.00 27.48 29.38 2jps h GLN 5 CO -0.01 0.49 -0.80 1.88 0.09 0.00 0.00 178.83 180.49 2jps h TYR 6 N 0.77 1.06 -0.76 0.06 -1.99 -1.97 -2.64 116.97 111.50 2jps h TYR 6 Ca 0.45 -0.48 -0.02 0.00 2.00 0.00 0.00 58.73 60.68 2jps h TYR 6 Cb 0.63 -0.16 -0.03 0.00 2.00 0.00 0.00 36.73 39.16 2jps h TYR 6 CO -0.00 1.31 0.38 1.15 -0.00 0.00 0.00 178.16 181.00 2jps h THR 7 N 0.53 1.24 -0.50 -2.88 2.02 -0.99 0.85 112.91 113.18 2jps h THR 7 Ca -0.06 -0.65 -0.07 0.00 0.77 0.00 0.00 66.41 66.41 2jps h THR 7 Cb 1.43 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 68.09 2jps h THR 7 CO 0.16 0.28 0.06 -0.08 0.37 0.00 0.00 175.52 176.31 2jps h GLU 8 N 1.06 0.84 -0.19 6.66 4.81 -0.25 0.11 114.58 127.63 2jps h GLU 8 Ca 0.26 -0.24 -0.21 0.00 -0.13 0.00 0.00 59.36 59.05 2jps h GLU 8 Cb 0.09 -0.09 0.01 0.00 0.63 0.00 0.00 28.75 29.39 2jps h GLU 8 CO -0.04 0.85 -0.68 -0.91 -0.73 0.00 0.00 179.01 177.50 2jps h ASN 9 N 0.72 0.93 -0.76 1.04 4.21 -1.16 -3.10 115.58 117.45 2jps h ASN 9 Ca 0.15 -0.60 -0.01 0.00 1.21 0.00 0.00 56.30 57.05 2jps h ASN 9 Cb 0.43 -0.27 -0.04 0.00 -1.12 0.00 0.00 38.32 37.32 2jps h ASN 9 CO 0.01 1.37 0.46 -0.07 -1.29 0.00 0.00 177.43 177.91 2jps h LEU 10 N 0.54 0.92 -2.02 1.61 3.38 0.91 -1.60 115.31 119.05 2jps h LEU 10 Ca -0.03 -0.05 0.13 0.00 0.09 0.00 0.00 57.88 58.01 2jps h LEU 10 Cb 1.31 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.81 2jps h LEU 10 CO 0.14 0.71 0.33 0.50 0.09 0.00 0.00 178.44 180.22 2jps h LYS 11 N 1.06 0.00 0.15 1.13 3.64 -0.70 0.85 116.57 122.71 2jps h LYS 11 Ca 0.28 0.00 -0.22 0.00 -1.27 0.00 0.00 60.65 59.44 2jps h LYS 11 Cb -0.04 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 31.80 2jps h LYS 11 CO -0.05 0.00 -1.01 0.28 -2.27 0.00 0.00 179.45 176.40 2jps h VAL 12 N 0.00 1.39 -0.08 2.00 2.07 -1.36 -2.02 116.25 118.25 2jps h VAL 12 Ca 0.21 -2.53 -0.11 0.00 0.82 0.00 0.00 66.70 65.09 2jps h VAL 12 Cb 0.87 3.09 -0.01 0.00 -1.52 0.00 0.00 31.29 33.71 2jps h VAL 12 CO -0.00 0.73 -0.45 0.40 0.02 0.00 0.00 177.57 178.27 2jps h ILE 13 N -0.30 1.33 0.01 4.57 2.04 -0.96 -0.65 117.51 123.54 2jps h ILE 13 Ca -0.19 -1.60 -0.26 0.00 1.00 0.00 0.00 64.86 63.81 2jps h ILE 13 Cb 1.73 1.76 0.02 0.00 -0.74 0.00 0.00 36.82 39.59 2jps h ILE 13 CO 0.15 0.47 -1.03 0.58 0.00 0.00 0.00 178.15 178.32 2jps h VAL 14 N 0.16 1.32 -0.03 1.67 2.07 0.60 -3.24 116.25 118.80 2jps h VAL 14 Ca 0.01 -2.32 -0.13 0.00 0.82 0.00 0.00 66.70 65.07 2jps h VAL 14 Cb 0.86 2.41 -0.02 0.00 -1.52 0.00 0.00 31.29 33.02 2jps h VAL 14 CO 0.07 0.71 -0.59 0.00 0.02 0.00 0.00 177.57 177.77 2jps h ALA 15 N 0.49 0.96 -0.87 1.67 0.00 -1.26 -2.92 119.26 117.33 2jps h ALA 15 Ca -0.12 -0.54 0.17 0.00 0.00 0.00 0.00 54.91 54.42 2jps h ALA 15 Cb 1.68 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 19.31 2jps h ALA 15 CO 0.20 0.73 0.57 1.49 0.00 0.00 0.00 179.25 182.24 2jps h GLU 16 N 0.07 0.52 0.14 0.00 4.81 -1.13 0.48 114.58 119.47 2jps h GLU 16 Ca -0.01 -0.03 -0.30 0.00 -0.13 0.00 0.00 59.36 58.89 2jps h GLU 16 Cb 1.07 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.33 2jps h GLU 16 CO 0.08 0.34 -1.53 0.87 -0.73 0.00 0.00 179.01 178.05 2jps h LYS 17 N 0.53 0.31 0.04 1.92 1.79 -1.65 -2.90 116.57 116.61 2jps h LYS 17 Ca 0.45 -0.52 -0.00 0.00 -2.18 0.00 0.00 60.65 58.39 2jps h LYS 17 Cb 0.92 0.20 0.00 0.00 -1.58 0.00 0.00 32.23 31.77 2jps h LYS 17 CO -0.19 1.25 -0.02 -0.07 -1.08 0.00 0.00 179.45 179.35 2jps h LEU 18 N -0.14 -0.04 -1.88 2.94 3.38 -1.23 0.09 115.31 118.42 2jps h LEU 18 Ca -0.32 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.50 2jps h LEU 18 Cb 1.89 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 42.65 2jps h LEU 18 CO 0.11 0.10 -0.11 0.00 0.09 0.00 0.00 178.44 178.63 2jps h ALA 19 N 0.77 1.66 0.05 1.53 0.00 -0.23 -2.60 119.26 120.44 2jps h ALA 19 Ca -0.01 -0.10 -0.26 0.00 0.00 0.00 0.00 54.91 54.55 2jps h ALA 19 Cb 0.17 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 17.95 2jps h ALA 19 CO 0.01 0.14 -1.07 0.78 0.00 0.00 0.00 179.25 179.10 2jps h GLY 20 N 0.41 0.52 -7.00 0.00 0.00 -1.21 -3.44 103.07 92.35 2jps h GLY 20 Ca -0.00 -1.01 -0.64 0.00 0.00 0.00 0.00 47.33 45.68 2jps h GLY 20 CO 0.01 0.89 1.45 1.39 0.00 0.00 0.00 176.54 180.29 2jps n ILE 21 N -3.73 0.23 0.42 2.60 5.41 -0.03 -4.81 119.36 119.45 2jps n ILE 21 Ca -0.09 -0.34 0.11 0.00 1.00 0.00 0.00 62.75 63.43 2jps n ILE 21 Cb 0.91 -1.97 0.47 0.00 -0.71 0.00 0.00 39.64 38.33 2jps n ILE 21 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 2jps n PRO 22 N 8.42 0.17 -1.24 0.38 -0.04 -1.26 -3.04 135.00 138.38 2jps n PRO 22 Ca 0.38 0.39 -0.23 0.00 -0.04 0.00 0.00 63.50 64.00 2jps n PRO 22 Cb 0.31 -1.82 0.14 0.00 -0.04 0.00 0.00 33.50 32.08 2jps n PRO 22 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2jps n ASN 23 N -2.15 4.74 -4.42 3.54 4.13 -1.26 -4.92 115.26 114.92 2jps n ASN 23 Ca 0.02 -3.72 -0.44 0.00 1.68 0.00 0.00 54.58 52.12 2jps n ASN 23 Cb 0.23 -0.78 -0.09 0.00 -1.54 0.00 0.00 39.78 37.60 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 -3.48 3.24 -0.52 3.10 5.36 -1.17 -4.94 117.98 119.57 2jps s PHE 24 Ca 0.56 -0.76 0.02 0.00 -0.96 0.00 0.00 56.93 55.78 2jps s PHE 24 Cb 0.46 -2.85 0.45 0.00 -0.34 0.00 0.00 43.02 40.75 2jps s PHE 24 CO 0.04 -0.69 1.70 0.09 -1.46 0.00 0.00 175.22 174.90 2jps n ASN 25 N 5.17 6.61 -1.52 6.13 4.13 -1.26 -4.99 115.26 129.53 2jps n ASN 25 Ca -0.12 -3.77 -0.04 0.00 1.68 0.00 0.00 54.58 52.33 2jps n ASN 25 Cb 0.45 -0.73 -0.02 0.00 -1.54 0.00 0.00 39.78 37.95 2jps n ASN 25 CO 0.00 0.00 0.00 -1.84 0.28 0.00 0.00 177.26 175.70 2jps n GLU 26 N -0.83 0.18 -1.84 3.52 0.00 -1.26 -5.10 120.64 115.30 2jps n GLU 26 Ca 0.55 -0.68 -0.42 0.00 0.00 0.00 0.00 57.16 56.61 2jps n GLU 26 Cb 0.78 0.54 -0.03 0.00 0.00 0.00 0.00 31.44 32.73 2jps n GLU 26 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 2jps s ASP 27 N -1.48 6.51 -0.22 -1.84 1.01 -1.26 -4.90 116.67 114.50 2jps s ASP 27 Ca 0.08 2.67 0.13 0.00 0.71 0.00 0.00 52.55 56.13 2jps s ASP 27 Cb 0.00 -2.58 -0.22 0.00 1.01 0.00 0.00 42.92 41.13 2jps s ASP 27 CO 0.05 -0.91 -0.03 0.00 0.21 0.00 0.00 175.17 174.50 2jps n ILE 28 N 4.32 1.41 0.10 0.77 0.00 -1.26 -3.40 119.36 121.30 2jps n ILE 28 Ca 0.16 -0.76 -0.20 0.00 0.00 0.00 0.00 62.75 61.94 2jps n ILE 28 Cb 0.38 -0.77 -0.15 0.00 0.00 0.00 0.00 39.64 39.10 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 0.38 -0.05 9.51 1.57 -1.99 -3.02 116.57 122.97 2jps h LYS 29 Ca -0.55 -0.65 -0.15 0.00 -1.87 0.00 0.00 60.65 57.43 2jps h LYS 29 Cb 2.13 0.24 -0.01 0.00 0.08 0.00 0.00 32.23 34.67 2jps h LYS 29 CO -0.01 1.29 -0.64 -0.92 -0.57 0.00 0.00 179.45 178.60 2jps h TYR 30 N 0.10 0.27 -0.28 -1.35 3.20 -1.98 -2.92 116.97 114.02 2jps h TYR 30 Ca -0.24 -0.11 -0.15 0.00 3.14 0.00 0.00 58.73 61.37 2jps h TYR 30 Cb 2.07 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 40.29 2jps h TYR 30 CO 0.09 0.79 -0.42 -0.24 -1.64 0.00 0.00 178.16 176.74 2jps h VAL 31 N 0.15 1.29 -0.63 1.81 3.04 -1.64 -2.76 116.25 117.52 2jps h VAL 31 Ca -0.01 -1.60 -0.08 0.00 -1.01 0.00 0.00 66.70 63.99 2jps h VAL 31 Cb 1.16 1.53 -0.02 0.00 -2.01 0.00 0.00 31.29 31.94 2jps h VAL 31 CO 0.10 0.51 0.06 0.00 -1.01 0.00 0.00 177.57 177.23 2jps h ALA 32 N 0.98 0.84 -0.53 3.17 0.00 -1.48 -1.05 119.26 121.18 2jps h ALA 32 Ca 0.04 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2jps h ALA 32 Cb 0.96 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.49 2jps h ALA 32 CO 0.09 0.63 0.35 0.93 0.00 0.00 0.00 179.25 181.25 2jps h GLU 33 N 0.97 0.71 -0.71 0.00 5.08 -1.42 0.45 114.58 119.66 2jps h GLU 33 Ca 0.18 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.44 2jps h GLU 33 Cb 0.49 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 2jps h GLU 33 CO 0.02 0.48 0.23 -0.92 -1.00 0.00 0.00 179.01 177.82 2jps h TYR 34 N 0.72 1.13 -0.26 4.33 3.20 -1.27 0.59 116.97 125.40 2jps h TYR 34 Ca 0.20 -0.11 0.00 0.00 3.14 0.00 0.00 58.73 61.96 2jps h TYR 34 Cb -0.07 -0.33 -0.01 0.00 1.54 0.00 0.00 36.73 37.86 2jps h TYR 34 CO -0.04 0.90 0.18 0.82 -1.64 0.00 0.00 178.16 178.38 2jps h ILE 35 N 1.03 1.07 -0.78 1.81 2.04 -0.50 0.78 117.51 122.96 2jps h ILE 35 Ca 0.23 -0.12 -0.02 0.00 1.00 0.00 0.00 64.86 65.95 2jps h ILE 35 Cb 0.29 0.68 -0.04 0.00 -0.74 0.00 0.00 36.82 37.01 2jps h ILE 35 CO -0.01 0.07 0.42 0.58 0.00 0.00 0.00 178.15 179.21 2jps h VAL 36 N 0.36 1.24 -0.91 1.67 2.07 -0.60 0.29 116.25 120.36 2jps h VAL 36 Ca 0.10 -0.60 0.02 0.00 0.82 0.00 0.00 66.70 67.04 2jps h VAL 36 Cb -0.04 0.20 -0.05 0.00 -1.52 0.00 0.00 31.29 29.88 2jps h VAL 36 CO -0.02 0.26 0.60 0.25 0.02 0.00 0.00 177.57 178.68 2jps h LEU 37 N 1.08 1.01 -0.57 2.57 5.85 -0.14 0.45 115.31 125.57 2jps h LEU 37 Ca 0.27 -0.02 -0.12 0.00 0.84 0.00 0.00 57.88 58.85 2jps h LEU 37 Cb 0.04 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.82 2jps h LEU 37 CO -0.04 0.71 -0.18 -0.07 -0.34 0.00 0.00 178.44 178.52 2jps h LEU 38 N 1.18 0.97 0.14 2.25 3.38 0.03 -1.47 115.31 121.79 2jps h LEU 38 Ca 0.35 -0.35 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2jps h LEU 38 Cb -0.06 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.42 2jps h LEU 38 CO -0.09 1.12 -0.07 0.40 0.09 0.00 0.00 178.44 179.89 2jps h ILE 39 N 0.83 0.98 -0.16 1.22 1.08 0.54 -2.77 117.51 119.23 2jps h ILE 39 Ca 0.12 -0.49 0.01 0.00 -0.39 0.00 0.00 64.86 64.10 2jps h ILE 39 Cb 0.74 1.28 -0.01 0.00 -3.07 0.00 0.00 36.82 35.76 2jps h ILE 39 CO 0.06 0.12 0.11 1.62 -0.69 0.00 0.00 178.15 179.36 2jps h VAL 40 N -0.42 1.03 -0.64 1.67 3.04 -0.12 -2.04 116.25 118.77 2jps h VAL 40 Ca -0.02 -0.07 -0.04 0.00 -1.01 0.00 0.00 66.70 65.56 2jps h VAL 40 Cb 0.33 0.81 -0.03 0.00 -2.01 0.00 0.00 31.29 30.39 2jps h VAL 40 CO 0.03 0.04 0.23 0.78 -1.01 0.00 0.00 177.57 177.64 2jps h ASN 41 N 0.21 0.87 0.00 3.17 2.35 -0.99 -3.46 115.58 117.73 2jps h ASN 41 Ca 0.06 -0.13 0.00 0.00 -0.55 0.00 0.00 56.30 55.68 2jps h ASN 41 Cb -0.00 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.14 2jps h ASN 41 CO -0.01 0.80 0.00 0.61 -1.65 0.00 0.00 177.43 177.18 2jps n GLY 42 N -0.94 -1.77 0.00 2.83 0.00 -0.77 -5.08 105.19 99.45 2jps n GLY 42 Ca 0.05 0.48 0.00 0.00 0.00 0.00 0.00 46.02 46.55 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 -1.38 0.70 3.08 -0.02 0.00 -1.18 -4.97 105.19 101.42 2jps n GLY 43 Ca 0.00 -0.38 -0.33 0.00 0.00 0.00 0.00 46.02 45.31 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 -0.39 2.71 0.44 2.61 -4.23 -1.26 -4.98 115.64 110.53 2jps s THR 44 Ca 0.00 -2.03 0.23 0.00 -1.18 0.00 0.00 61.69 58.71 2jps s THR 44 Cb 0.00 -2.84 0.43 0.00 1.34 0.00 0.00 72.50 71.44 2jps s THR 44 CO 0.00 -0.49 1.77 0.58 -0.54 0.00 0.00 174.62 175.94 2jps h VAL 45 N 6.52 0.47 0.30 2.29 2.07 -1.96 0.92 116.25 126.86 2jps h VAL 45 Ca -0.11 -0.10 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 2jps h VAL 45 Cb 1.04 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 2jps h VAL 45 CO 0.57 0.05 -0.14 -0.33 0.02 0.00 0.00 177.57 177.74 2jps h GLU 46 N 0.28 -0.39 -0.17 1.57 4.39 -1.98 0.23 114.58 118.51 2jps h GLU 46 Ca 0.60 0.03 -0.10 0.00 0.34 0.00 0.00 59.36 60.22 2jps h GLU 46 Cb 1.74 0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 30.47 2jps h GLU 46 CO -0.24 -0.05 -0.33 1.03 -1.16 0.00 0.00 179.01 178.27 2jps h SER 47 N -0.89 0.36 -0.32 1.42 0.87 -1.80 -1.39 113.55 111.80 2jps h SER 47 Ca -0.04 -0.13 -0.12 0.00 -1.23 0.00 0.00 61.79 60.26 2jps h SER 47 Cb 0.52 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.37 2jps h SER 47 CO 0.07 0.67 -0.28 0.58 -0.53 0.00 0.00 176.83 177.34 2jps h VAL 48 N 0.30 1.29 -0.42 2.23 2.07 0.84 -2.56 116.25 120.00 2jps h VAL 48 Ca 0.04 -1.44 -0.14 0.00 0.82 0.00 0.00 66.70 65.98 2jps h VAL 48 Cb 0.73 1.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.99 2jps h VAL 48 CO 0.06 0.47 -0.28 0.58 0.02 0.00 0.00 177.57 178.42 2jps h VAL 49 N 0.52 1.27 -0.54 2.57 2.07 -0.39 -2.77 116.25 118.97 2jps h VAL 49 Ca 0.06 -1.43 0.03 0.00 0.82 0.00 0.00 66.70 66.17 2jps h VAL 49 Cb 0.85 1.24 -0.03 0.00 -1.52 0.00 0.00 31.29 31.83 2jps h VAL 49 CO 0.07 0.49 0.36 0.44 0.02 0.00 0.00 177.57 178.94 2jps h ASP 50 N 0.77 0.53 -0.55 0.57 5.19 -1.19 -0.92 116.42 120.82 2jps h ASP 50 Ca 0.09 -0.01 -0.09 0.00 -0.62 0.00 0.00 57.03 56.40 2jps h ASP 50 Cb 0.84 -0.12 -0.02 0.00 0.18 0.00 0.00 39.33 40.21 2jps h ASP 50 CO 0.07 0.36 -0.01 -0.33 -3.12 0.00 0.00 179.24 176.21 2jps h GLU 51 N 0.61 0.97 -0.29 3.56 3.07 -1.17 -0.99 114.58 120.34 2jps h GLU 51 Ca 0.22 -0.32 -0.13 0.00 -0.50 0.00 0.00 59.36 58.63 2jps h GLU 51 Cb 0.10 -0.08 -0.00 0.00 -0.84 0.00 0.00 28.75 27.93 2jps h GLU 51 CO -0.06 0.98 -0.32 -0.07 -1.40 0.00 0.00 179.01 178.15 2jps h LEU 52 N 0.85 0.79 -1.16 1.33 -0.00 -1.29 -3.01 115.31 112.82 2jps h LEU 52 Ca 0.15 -0.48 -0.00 0.00 -0.00 0.00 0.00 57.88 57.55 2jps h LEU 52 Cb 0.55 -0.22 -0.04 0.00 -0.00 0.00 0.00 40.66 40.95 2jps h LEU 52 CO 0.03 1.11 0.47 0.00 -0.00 0.00 0.00 178.44 180.05 2jps h ALA 53 N 0.70 1.37 -0.73 1.53 0.00 -1.07 1.02 119.26 122.09 2jps h ALA 53 Ca 0.04 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 54.91 2jps h ALA 53 Cb 0.90 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 2jps h ALA 53 CO 0.08 0.55 0.48 1.03 0.00 0.00 0.00 179.25 181.38 2jps h SER 54 N 1.06 0.76 0.07 0.00 0.87 -1.04 -2.66 113.55 112.61 2jps h SER 54 Ca 0.28 -0.01 -0.38 0.00 -1.23 0.00 0.00 61.79 60.45 2jps h SER 54 Cb -0.05 -0.17 -0.04 0.00 -0.44 0.00 0.00 62.40 61.69 2jps h SER 54 CO -0.05 0.52 -2.23 0.18 -0.53 0.00 0.00 176.83 174.71 2jps n LEU 55 N -4.46 2.76 -3.91 2.23 4.77 -0.80 -4.58 117.00 113.01 2jps n LEU 55 Ca 0.09 0.04 -0.39 0.00 -0.03 0.00 0.00 56.01 55.73 2jps n LEU 55 Cb 0.13 -0.99 -0.02 0.00 -2.33 0.00 0.00 43.42 40.21 2jps n LEU 55 CO 0.35 0.89 0.77 0.49 -1.33 0.00 0.00 177.39 178.56 2jps n PHE 56 N -3.36 3.07 1.38 -1.77 3.72 0.35 -4.83 117.46 116.00 2jps n PHE 56 Ca -0.39 -3.24 0.13 0.00 -0.05 0.00 0.00 57.45 53.91 2jps n PHE 56 Cb 1.02 -1.12 0.71 0.00 -0.94 0.00 0.00 39.48 39.16 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 1.43 0.00 -2.02 4.37 -0.08 -1.01 -3.47 116.55 115.77 2jps n ASP 57 Ca 0.26 -0.27 -0.08 0.00 -1.51 0.00 0.00 54.79 53.19 2jps n ASP 57 Cb 0.36 -0.22 0.29 0.00 2.34 0.00 0.00 41.12 43.89 2jps n ASP 57 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08 2jps n SER 58 N -1.22 4.73 -4.31 1.67 2.88 -1.26 -4.93 113.62 111.17 2jps n SER 58 Ca 0.15 -3.22 -0.28 0.00 -1.33 0.00 0.00 58.87 54.18 2jps n SER 58 Cb 0.19 -0.75 -0.14 0.00 -0.75 0.00 0.00 64.21 62.75 2jps n SER 58 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2jps s VAL 59 N -2.96 1.97 0.42 2.46 1.01 -1.23 -5.02 120.40 117.06 2jps s VAL 59 Ca 0.54 -1.33 -0.26 0.00 0.00 0.00 0.00 61.98 60.93 2jps s VAL 59 Cb 0.44 -1.69 -0.09 0.00 0.00 0.00 0.00 36.38 35.03 2jps s VAL 59 CO 0.13 0.30 1.44 -0.44 0.00 0.00 0.00 175.10 176.53 2jps s SER 60 N -1.24 6.07 0.40 3.32 0.01 -1.26 -4.85 113.70 116.15 2jps s SER 60 Ca 0.10 2.95 0.15 0.00 1.31 0.00 0.00 55.95 60.45 2jps s SER 60 Cb -0.10 -2.66 1.00 0.00 0.21 0.00 0.00 66.02 64.48 2jps s SER 60 CO 0.02 -1.05 1.87 0.03 0.41 0.00 0.00 173.24 174.53 2jps h ARG 61 N 2.59 0.47 -0.15 12.44 -0.00 -1.98 0.30 114.38 128.05 2jps h ARG 61 Ca -0.51 -0.03 -0.07 0.00 -0.50 0.00 0.00 59.98 58.87 2jps h ARG 61 Cb 1.26 -0.11 -0.01 0.00 0.00 0.00 0.00 29.97 31.11 2jps h ARG 61 CO 0.62 0.31 -0.22 -0.44 0.00 0.00 0.00 179.97 180.25 2jps h ASP 62 N 0.49 0.26 -0.28 7.04 5.19 -1.98 -0.13 116.42 127.01 2jps h ASP 62 Ca 0.44 -0.07 -0.19 0.00 -0.62 0.00 0.00 57.03 56.59 2jps h ASP 62 Cb 0.96 -0.07 0.00 0.00 0.18 0.00 0.00 39.33 40.41 2jps h ASP 62 CO -0.17 0.49 -0.56 0.74 -3.12 0.00 0.00 179.24 176.62 2jps h THR 63 N 0.24 1.27 -0.15 0.35 2.02 -1.29 0.92 112.91 116.27 2jps h THR 63 Ca 0.04 -1.74 -0.21 0.00 0.77 0.00 0.00 66.41 65.28 2jps h THR 63 Cb 0.53 1.64 0.01 0.00 -1.74 0.00 0.00 68.15 68.58 2jps h THR 63 CO 0.04 0.57 -0.72 -0.07 0.37 0.00 0.00 175.52 175.70 2jps h LEU 64 N 0.67 0.89 -0.92 2.58 4.07 -1.32 -3.07 115.31 118.21 2jps h LEU 64 Ca 0.01 -0.63 -0.10 0.00 0.08 0.00 0.00 57.88 57.25 2jps h LEU 64 Cb 1.17 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 42.63 2jps h LEU 64 CO 0.12 1.37 -0.26 0.00 -1.08 0.00 0.00 178.44 178.60 2jps h ALA 65 N 0.54 1.09 -0.90 1.53 0.00 -1.02 -2.59 119.26 117.91 2jps h ALA 65 Ca -0.05 -0.35 0.01 0.00 0.00 0.00 0.00 54.91 54.53 2jps h ALA 65 Cb 1.35 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.98 2jps h ALA 65 CO 0.15 0.56 0.60 -0.91 0.00 0.00 0.00 179.25 179.65 2jps h ASN 66 N 0.42 1.02 0.05 0.00 2.35 -0.75 0.37 115.58 119.04 2jps h ASN 66 Ca 0.06 -0.02 -0.21 0.00 -0.55 0.00 0.00 56.30 55.58 2jps h ASN 66 Cb 0.68 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.80 2jps h ASN 66 CO 0.05 0.74 -0.78 0.58 -1.65 0.00 0.00 177.43 176.37 2jps h VAL 67 N 1.21 1.32 -0.17 2.81 2.07 -1.41 -2.71 116.25 119.37 2jps h VAL 67 Ca 0.34 -2.07 -0.13 0.00 0.82 0.00 0.00 66.70 65.65 2jps h VAL 67 Cb -0.11 2.07 -0.01 0.00 -1.52 0.00 0.00 31.29 31.71 2jps h VAL 67 CO -0.08 0.64 -0.45 0.58 0.02 0.00 0.00 177.57 178.28 2jps h VAL 68 N 0.41 1.32 -0.65 2.57 2.07 -1.04 -2.69 116.25 118.24 2jps h VAL 68 Ca -0.05 -1.64 -0.06 0.00 0.82 0.00 0.00 66.70 65.77 2jps h VAL 68 Cb 1.39 1.69 -0.03 0.00 -1.52 0.00 0.00 31.29 32.81 2jps h VAL 68 CO 0.15 0.50 0.17 1.56 0.02 0.00 0.00 177.57 179.97 2jps h GLN 69 N 0.34 1.03 0.00 1.57 4.20 -0.22 -2.14 115.11 119.89 2jps h GLN 69 Ca 0.02 -0.24 -0.09 0.00 0.06 0.00 0.00 58.65 58.40 2jps h GLN 69 Cb 0.93 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.56 2jps h GLN 69 CO 0.08 0.92 -0.44 0.00 -0.67 0.00 0.00 178.83 178.72 2jps h THR 70 N 0.95 1.29 -0.13 -0.54 1.03 -1.38 -2.63 112.91 111.51 2jps h THR 70 Ca 0.20 -1.51 -0.15 0.00 -0.01 0.00 0.00 66.41 64.94 2jps h THR 70 Cb 0.35 1.82 -0.01 0.00 -1.07 0.00 0.00 68.15 69.24 2jps h THR 70 CO 0.00 0.43 -0.57 0.00 -0.01 0.00 0.00 175.52 175.37 2jps h ALA 71 N 1.56 0.77 -0.14 0.00 0.00 -1.13 -1.43 119.26 118.90 2jps h ALA 71 Ca -0.00 -0.52 -0.02 0.00 0.00 0.00 0.00 54.91 54.36 2jps h ALA 71 Cb 0.78 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 2jps h ALA 71 CO 0.06 0.70 -0.00 0.74 0.00 0.00 0.00 179.25 180.74 2jps h PHE 72 N 0.31 0.27 -0.93 0.00 -1.00 -1.14 -2.29 116.94 112.15 2jps h PHE 72 Ca 0.00 -0.05 -0.01 0.00 2.81 0.00 0.00 57.97 60.72 2jps h PHE 72 Cb 1.10 -0.07 -0.04 0.00 3.61 0.00 0.00 35.95 40.54 2jps h PHE 72 CO 0.03 0.48 0.53 0.74 -1.61 0.00 0.00 178.31 178.49 2jps h PHE 73 N -0.02 1.25 -0.78 -0.55 0.04 -1.45 -1.90 116.94 113.52 2jps h PHE 73 Ca 0.04 -0.02 0.07 0.00 2.80 0.00 0.00 57.97 60.86 2jps h PHE 73 Cb 0.38 -0.40 -0.05 0.00 2.20 0.00 0.00 35.95 38.08 2jps h PHE 73 CO 0.04 0.84 0.51 0.00 -0.60 0.00 0.00 178.31 179.10 2jps h ALA 74 N 1.30 1.65 -0.94 2.45 0.00 -1.04 -1.37 119.26 121.32 2jps h ALA 74 Ca 0.33 -0.02 0.11 0.00 0.00 0.00 0.00 54.91 55.33 2jps h ALA 74 Cb -0.01 -0.21 -0.08 0.00 0.00 0.00 0.00 17.79 17.48 2jps h ALA 74 CO -0.06 0.23 0.57 -0.07 0.00 0.00 0.00 179.25 179.92 2jps h LEU 75 N 0.83 0.84 -0.16 0.00 -0.00 -0.76 0.86 115.31 116.91 2jps h LEU 75 Ca 0.34 0.05 -0.22 0.00 -0.00 0.00 0.00 57.88 58.05 2jps h LEU 75 Cb 0.25 -0.12 0.01 0.00 -0.00 0.00 0.00 40.66 40.80 2jps h LEU 75 CO -0.12 0.46 -0.74 -0.08 -0.00 0.00 0.00 178.44 177.96 2jps h GLU 76 N 0.93 0.79 -0.25 1.13 4.81 -1.31 -2.44 114.58 118.25 2jps h GLU 76 Ca 0.46 -0.63 -0.10 0.00 -0.13 0.00 0.00 59.36 58.95 2jps h GLU 76 Cb 0.42 0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.92 2jps h GLU 76 CO -0.25 1.24 -0.28 0.00 -0.73 0.00 0.00 179.01 178.99 2jps h ALA 77 N 0.56 1.06 -0.38 2.92 0.00 -0.48 -2.64 119.26 120.29 2jps h ALA 77 Ca -0.05 -0.36 -0.15 0.00 0.00 0.00 0.00 54.91 54.36 2jps h ALA 77 Cb 1.37 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 2jps h ALA 77 CO 0.15 0.57 -0.34 -0.07 0.00 0.00 0.00 179.25 179.56 2jps h LEU 78 N 0.43 0.92 -1.19 0.00 3.38 0.72 -2.13 115.31 117.44 2jps h LEU 78 Ca 0.06 -0.40 -0.06 0.00 0.09 0.00 0.00 57.88 57.57 2jps h LEU 78 Cb 0.71 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 2jps h LEU 78 CO 0.05 1.17 -0.09 1.56 0.09 0.00 0.00 178.44 181.22 2jps h GLN 79 N 0.73 0.45 -0.03 1.13 4.20 -1.26 -3.01 115.11 117.31 2jps h GLN 79 Ca 0.07 -0.11 -0.25 0.00 0.06 0.00 0.00 58.65 58.41 2jps h GLN 79 Cb 0.92 -0.06 0.02 0.00 0.30 0.00 0.00 27.48 28.66 2jps h GLN 79 CO 0.08 0.55 -0.97 1.96 -0.67 0.00 0.00 178.83 179.78 2jps h GLN 80 N 0.42 0.70 0.00 1.46 4.20 -1.33 -3.49 115.11 117.08 2jps h GLN 80 Ca 0.08 -0.72 0.00 0.00 0.06 0.00 0.00 58.65 58.07 2jps h GLN 80 Cb 0.43 0.20 0.00 0.00 0.30 0.00 0.00 27.48 28.40 2jps h GLN 80 CO 0.02 1.30 0.00 0.41 -0.67 0.00 0.00 178.83 179.90 2jps n GLY 81 N 1.02 0.63 3.80 3.46 0.00 -0.82 -5.13 105.19 108.16 2jps n GLY 81 Ca -0.10 -0.48 -0.32 0.00 0.00 0.00 0.00 46.02 45.11 2jps n GLY 81 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jps s GLU 82 N 0.00 2.22 -0.07 1.61 0.41 -1.13 -5.02 118.70 116.72 2jps s GLU 82 Ca 0.00 -2.37 0.04 0.00 -0.41 0.00 0.00 54.97 52.23 2jps s GLU 82 Cb 0.00 -1.61 -0.02 0.00 -1.78 0.00 0.00 34.13 30.72 2jps s GLU 82 CO 0.00 -0.43 -0.18 -1.12 -0.49 0.00 0.00 175.26 173.04 2jps s SER 83 N -3.96 3.67 -0.18 -0.19 0.01 -1.26 -4.97 113.70 106.82 2jps s SER 83 Ca 0.08 -0.35 0.11 0.00 1.31 0.00 0.00 55.95 57.10 2jps s SER 83 Cb 0.00 -1.03 -0.23 0.00 0.21 0.00 0.00 66.02 64.97 2jps s SER 83 CO 0.05 0.26 0.13 0.00 0.41 0.00 0.00 173.24 174.09 2jps n ALA 84 N 2.85 1.43 -0.27 1.44 0.00 -1.26 -4.35 120.51 120.36 2jps n ALA 84 Ca -0.17 -1.11 0.16 0.00 0.00 0.00 0.00 53.44 52.31 2jps n ALA 84 Cb 0.52 -0.32 0.44 0.00 0.00 0.00 0.00 19.45 20.09 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 0.01 0.54 -0.95 0.00 4.57 -1.95 -0.18 114.58 116.61 2jps h GLU 85 Ca -0.50 -0.03 0.05 0.00 -1.18 0.00 0.00 59.36 57.70 2jps h GLU 85 Cb 2.10 -0.12 -0.06 0.00 -0.16 0.00 0.00 28.75 30.51 2jps h GLU 85 CO 0.01 0.36 0.62 -0.91 -1.18 0.00 0.00 179.01 177.91 2jps h ASN 86 N 0.55 1.00 -0.39 1.04 2.35 -2.02 -1.42 115.58 116.70 2jps h ASN 86 Ca 0.48 -0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 56.16 2jps h ASN 86 Cb 0.97 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 39.10 2jps h ASN 86 CO -0.22 0.67 0.04 0.40 -1.65 0.00 0.00 177.43 176.68 2jps h ILE 87 N 1.15 1.23 -0.77 2.81 2.04 -1.26 -2.61 117.51 120.10 2jps h ILE 87 Ca 0.39 -0.89 0.01 0.00 1.00 0.00 0.00 64.86 65.37 2jps h ILE 87 Cb 0.09 0.82 -0.04 0.00 -0.74 0.00 0.00 36.82 36.95 2jps h ILE 87 CO -0.13 0.32 0.51 0.58 0.00 0.00 0.00 178.15 179.42 2jps h VAL 88 N 0.70 1.20 -0.85 1.67 2.07 -1.16 -1.96 116.25 117.92 2jps h VAL 88 Ca 0.15 -0.36 0.07 0.00 0.82 0.00 0.00 66.70 67.38 2jps h VAL 88 Cb 0.37 0.07 -0.07 0.00 -1.52 0.00 0.00 31.29 30.14 2jps h VAL 88 CO 0.01 0.19 0.52 -1.28 0.02 0.00 0.00 177.57 177.03 2jps h SER 89 N 1.04 0.80 0.11 0.57 0.87 -1.29 0.37 113.55 116.03 2jps h SER 89 Ca 0.28 0.03 -0.13 0.00 -1.23 0.00 0.00 61.79 60.74 2jps h SER 89 Cb -0.12 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 61.69 2jps h SER 89 CO -0.06 0.49 -0.46 0.11 -0.53 0.00 0.00 176.83 176.38 2jps h LYS 90 N 0.92 0.42 -0.25 2.24 1.57 -1.41 -2.41 116.57 117.65 2jps h LYS 90 Ca 0.38 -0.23 -0.19 0.00 -1.87 0.00 0.00 60.65 58.75 2jps h LYS 90 Cb 0.23 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.55 2jps h LYS 90 CO -0.19 0.80 -0.59 0.82 -0.57 0.00 0.00 179.45 179.71 2jps h ILE 91 N 0.34 1.28 -0.67 1.86 1.08 -0.51 -1.02 117.51 119.87 2jps h ILE 91 Ca 0.02 -1.79 -0.05 0.00 -0.39 0.00 0.00 64.86 62.65 2jps h ILE 91 Cb 0.94 1.72 -0.03 0.00 -3.07 0.00 0.00 36.82 36.38 2jps h ILE 91 CO 0.08 0.58 0.20 -0.09 -0.69 0.00 0.00 178.15 178.23 2jps h ARG 92 N 0.60 1.04 -0.17 2.37 2.43 -0.22 0.65 114.38 121.07 2jps h ARG 92 Ca 0.00 -0.21 -0.22 0.00 -0.81 0.00 0.00 59.98 58.74 2jps h ARG 92 Cb 1.19 -0.15 0.01 0.00 -0.42 0.00 0.00 29.97 30.60 2jps h ARG 92 CO 0.13 0.89 -0.75 1.98 -1.51 0.00 0.00 179.97 180.71 2jps h MET 93 N 1.00 0.80 -0.21 0.20 4.05 -1.37 -1.38 114.93 118.01 2jps h MET 93 Ca 0.22 -0.64 -0.16 0.00 -0.28 0.00 0.00 59.70 58.84 2jps h MET 93 Cb 0.29 0.13 -0.01 0.00 -0.80 0.00 0.00 31.60 31.22 2jps h MET 93 CO -0.01 1.25 -0.53 0.52 0.23 0.00 0.00 176.91 178.37 2jps h MET 94 N 0.54 0.62 -0.25 0.39 2.86 -0.93 -2.29 114.93 115.87 2jps h MET 94 Ca -0.05 -0.38 -0.14 0.00 -2.06 0.00 0.00 59.70 57.07 2jps h MET 94 Cb 1.38 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 33.07 2jps h MET 94 CO 0.16 0.99 -0.43 -0.91 1.06 0.00 0.00 176.91 177.78 2jps h ASN 95 N 0.48 0.67 -0.49 1.22 2.35 0.31 -2.73 115.58 117.38 2jps h ASN 95 Ca 0.01 -0.31 -0.12 0.00 -0.55 0.00 0.00 56.30 55.33 2jps h ASN 95 Cb 1.08 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 39.25 2jps h ASN 95 CO 0.10 1.01 -0.15 0.00 -1.65 0.00 0.00 177.43 176.74 2jps h ALA 96 N 1.02 0.76 -0.80 -0.83 0.00 -1.17 -2.92 119.26 115.32 2jps h ALA 96 Ca 0.04 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.55 2jps h ALA 96 Cb 0.96 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.53 2jps h ALA 96 CO 0.09 0.67 0.40 1.96 0.00 0.00 0.00 179.25 182.36 2jps h GLN 97 N 0.87 1.14 -0.70 0.00 4.20 -1.31 0.84 115.11 120.14 2jps h GLN 97 Ca 0.13 -0.15 0.05 0.00 0.06 0.00 0.00 58.65 58.73 2jps h GLN 97 Cb 0.72 -0.21 -0.04 0.00 0.30 0.00 0.00 27.48 28.24 2jps h GLN 97 CO 0.06 0.87 0.46 1.03 -0.67 0.00 0.00 178.83 180.57 2jps h SER 98 N 1.14 0.67 0.06 1.46 0.87 -1.29 -3.13 113.55 113.32 2jps h SER 98 Ca 0.28 -0.00 -0.38 0.00 -1.23 0.00 0.00 61.79 60.46 2jps h SER 98 Cb 0.09 -0.15 -0.05 0.00 -0.44 0.00 0.00 62.40 61.86 2jps h SER 98 CO -0.04 0.45 -2.26 -0.11 -0.53 0.00 0.00 176.83 174.34 2jps n LEU 99 N -4.47 2.80 -0.26 2.23 -0.00 -0.90 -5.08 117.00 111.32 2jps n LEU 99 Ca 0.10 0.02 0.00 0.00 -0.00 0.00 0.00 56.01 56.13 2jps n LEU 99 Cb 0.19 -0.99 0.00 0.00 -0.00 0.00 0.00 43.42 42.62 2jps n LEU 99 CO 0.34 0.90 0.00 0.61 -0.00 0.00 0.00 177.39 179.24 2jps n GLY 100 N 2.14 -0.65 2.82 -3.96 0.00 0.29 -5.07 105.19 100.76 2jps n GLY 100 Ca -0.39 -0.67 -0.29 0.00 0.00 0.00 0.00 46.02 44.67 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 -0.02 1.81 -1.47 1.61 0.74 -1.24 -4.84 119.66 116.25 2jps s GLN 101 Ca 0.00 -2.58 -0.09 0.00 0.05 0.00 0.00 55.36 52.74 2jps s GLN 101 Cb 0.00 -2.90 0.06 0.00 1.10 0.00 0.00 33.01 31.27 2jps s GLN 101 CO 0.00 -1.19 0.86 0.43 -0.55 0.00 0.00 175.29 174.84 2jps n SER 102 N 2.93 -3.47 -3.41 6.67 7.64 -1.26 -4.93 113.62 117.78 2jps n SER 102 Ca 0.12 -0.81 -0.26 0.00 1.01 0.00 0.00 58.87 58.92 2jps n SER 102 Cb 0.35 -3.84 -0.09 0.00 -1.01 0.00 0.00 64.21 59.62 2jps n SER 102 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2jps n ASP 103 N -2.90 1.61 -3.86 6.43 9.92 -1.26 -5.08 116.55 121.40 2jps n ASP 103 Ca -0.07 -2.95 -0.12 0.00 -0.53 0.00 0.00 54.79 51.13 2jps n ASP 103 Cb 0.58 -0.65 -0.12 0.00 -0.64 0.00 0.00 41.12 40.28 2jps n ASP 103 CO 0.00 0.00 0.00 -0.51 0.13 0.00 0.00 177.20 176.82 2jps s ILE 104 N -1.39 0.03 0.00 0.53 2.07 -1.26 -5.05 121.20 116.13 2jps s ILE 104 Ca 0.34 -0.29 0.00 0.00 -1.41 0.00 0.00 60.65 59.30 2jps s ILE 104 Cb 0.10 -0.24 0.00 0.00 0.13 0.00 0.00 42.46 42.46 2jps s ILE 104 CO -0.11 -0.16 0.00 0.00 -1.91 0.00 0.00 174.94 172.77