#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jps n SER 2 N 0.00 1.70 -3.71 6.12 2.88 -1.26 -5.09 113.62 114.26 2jps n SER 2 Ca 0.00 -0.72 -0.29 0.00 -1.33 0.00 0.00 58.87 56.53 2jps n SER 2 Cb 0.00 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.37 2jps n SER 2 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2jps n GLN 3 N 0.00 2.34 -0.09 -1.46 1.13 -1.26 -4.86 117.38 113.19 2jps n GLN 3 Ca 0.00 -4.58 -0.18 0.00 -1.94 0.00 0.00 57.00 50.30 2jps n GLN 3 Cb 0.00 -2.30 -0.13 0.00 0.11 0.00 0.00 30.24 27.92 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 1.45 0.68 -0.28 -1.09 1.02 -1.26 -3.52 120.64 117.64 2jps n GLU 4 Ca 0.25 0.18 0.11 0.00 -0.02 0.00 0.00 57.16 57.68 2jps n GLU 4 Cb 0.38 -1.58 0.36 0.00 -0.02 0.00 0.00 31.44 30.58 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 0.02 0.71 -0.04 3.49 3.07 -1.99 0.73 115.11 121.10 2jps h GLN 5 Ca -0.53 -0.04 -0.23 0.00 0.09 0.00 0.00 58.65 57.95 2jps h GLN 5 Cb 1.96 -0.16 0.01 0.00 0.08 0.00 0.00 27.48 29.37 2jps h GLN 5 CO -0.03 0.47 -0.90 1.88 0.09 0.00 0.00 178.83 180.35 2jps h TYR 6 N 0.73 0.77 -0.54 0.06 -1.99 -1.97 -2.12 116.97 111.92 2jps h TYR 6 Ca 0.45 -0.39 -0.11 0.00 2.00 0.00 0.00 58.73 60.67 2jps h TYR 6 Cb 0.67 -0.10 -0.02 0.00 2.00 0.00 0.00 36.73 39.28 2jps h TYR 6 CO -0.00 1.20 -0.10 1.15 -0.00 0.00 0.00 178.16 180.41 2jps h THR 7 N 0.33 1.27 -0.37 -2.88 2.02 -0.92 0.87 112.91 113.23 2jps h THR 7 Ca -0.08 -1.26 -0.16 0.00 0.77 0.00 0.00 66.41 65.68 2jps h THR 7 Cb 1.52 0.97 -0.01 0.00 -1.74 0.00 0.00 68.15 68.90 2jps h THR 7 CO 0.16 0.45 -0.41 -0.33 0.37 0.00 0.00 175.52 175.76 2jps h GLU 8 N 0.90 0.91 0.05 6.66 4.39 0.33 0.25 114.58 128.08 2jps h GLU 8 Ca 0.14 -0.49 -0.27 0.00 0.34 0.00 0.00 59.36 59.08 2jps h GLU 8 Cb 0.67 0.02 0.02 0.00 -0.10 0.00 0.00 28.75 29.36 2jps h GLU 8 CO 0.05 1.14 -1.10 -0.91 -1.16 0.00 0.00 179.01 177.03 2jps h ASN 9 N 0.74 0.74 -0.18 1.42 4.21 -1.28 -3.18 115.58 118.04 2jps h ASN 9 Ca 0.05 -0.64 -0.12 0.00 1.21 0.00 0.00 56.30 56.81 2jps h ASN 9 Cb 1.00 -0.23 -0.01 0.00 -1.12 0.00 0.00 38.32 37.96 2jps h ASN 9 CO 0.10 1.45 -0.28 0.25 -1.29 0.00 0.00 177.43 177.66 2jps h LEU 10 N 0.28 0.68 -1.62 1.61 5.85 0.82 -2.78 115.31 120.15 2jps h LEU 10 Ca -0.13 -0.26 0.05 0.00 0.84 0.00 0.00 57.88 58.37 2jps h LEU 10 Cb 1.76 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 42.57 2jps h LEU 10 CO 0.20 0.93 0.33 0.50 -0.34 0.00 0.00 178.44 180.06 2jps h LYS 11 N 0.57 0.47 0.20 1.25 3.64 -0.50 0.34 116.57 122.54 2jps h LYS 11 Ca 0.07 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.42 2jps h LYS 11 Cb 0.77 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.48 2jps h LYS 11 CO 0.06 0.31 -0.09 0.28 -2.27 0.00 0.00 179.45 177.74 2jps h VAL 12 N 0.49 0.90 -0.71 2.00 2.07 -1.48 0.01 116.25 119.53 2jps h VAL 12 Ca 0.20 -0.60 -0.02 0.00 0.82 0.00 0.00 66.70 67.10 2jps h VAL 12 Cb 0.20 1.25 -0.03 0.00 -1.52 0.00 0.00 31.29 31.19 2jps h VAL 12 CO -0.05 0.13 0.35 0.40 0.02 0.00 0.00 177.57 178.42 2jps h ILE 13 N -0.57 1.22 -0.58 4.57 2.04 -1.44 -2.04 117.51 120.71 2jps h ILE 13 Ca -0.03 -0.62 -0.04 0.00 1.00 0.00 0.00 64.86 65.17 2jps h ILE 13 Cb 0.42 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.79 2jps h ILE 13 CO 0.04 0.26 0.20 0.58 0.00 0.00 0.00 178.15 179.24 2jps h VAL 14 N 1.00 1.23 -0.35 1.67 2.07 -0.83 -2.24 116.25 118.80 2jps h VAL 14 Ca 0.25 -0.77 -0.01 0.00 0.82 0.00 0.00 66.70 66.99 2jps h VAL 14 Cb 0.09 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 30.49 2jps h VAL 14 CO -0.03 0.29 0.19 0.00 0.02 0.00 0.00 177.57 178.03 2jps h ALA 15 N 1.06 1.67 -0.98 1.67 0.00 -0.38 -2.16 119.26 120.14 2jps h ALA 15 Ca 0.19 -0.06 0.17 0.00 0.00 0.00 0.00 54.91 55.21 2jps h ALA 15 Cb 0.25 -0.14 -0.09 0.00 0.00 0.00 0.00 17.79 17.80 2jps h ALA 15 CO -0.01 0.28 0.61 1.49 0.00 0.00 0.00 179.25 181.62 2jps h GLU 16 N 0.48 0.72 0.00 0.00 4.81 -0.75 0.70 114.58 120.54 2jps h GLU 16 Ca 0.13 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.30 2jps h GLU 16 Cb 0.02 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.24 2jps h GLU 16 CO -0.02 0.47 -0.07 0.87 -0.73 0.00 0.00 179.01 179.53 2jps h LYS 17 N 0.74 0.00 -0.98 1.92 1.79 -1.45 -2.27 116.57 116.32 2jps h LYS 17 Ca 0.53 0.00 0.11 0.00 -2.18 0.00 0.00 60.65 59.11 2jps h LYS 17 Cb 0.85 0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 31.42 2jps h LYS 17 CO -0.30 0.71 0.62 -0.07 -1.08 0.00 0.00 179.45 179.32 2jps h LEU 18 N -1.00 0.92 -0.64 2.94 4.07 -1.14 0.94 115.31 121.40 2jps h LEU 18 Ca -0.02 0.04 -0.08 0.00 0.08 0.00 0.00 57.88 57.90 2jps h LEU 18 Cb 0.73 -0.14 -0.01 0.00 1.08 0.00 0.00 40.66 42.32 2jps h LEU 18 CO -0.01 0.51 -0.40 0.00 -1.08 0.00 0.00 178.44 177.46 2jps h ALA 19 N 1.51 0.88 0.00 1.53 0.00 0.30 -3.27 119.26 120.21 2jps h ALA 19 Ca 0.47 -0.36 -0.23 0.00 0.00 0.00 0.00 54.91 54.80 2jps h ALA 19 Cb 0.42 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 2jps h ALA 19 CO -0.25 0.50 -1.79 0.41 0.00 0.00 0.00 179.25 178.13 2jps n GLY 20 N 0.57 -1.09 3.61 0.00 0.00 -0.13 -4.93 105.19 103.23 2jps n GLY 20 Ca 0.01 -0.20 -0.47 0.00 0.00 0.00 0.00 46.02 45.35 2jps n GLY 20 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2jps n ILE 21 N -2.81 0.90 0.25 -0.61 5.41 0.31 -4.86 119.36 117.95 2jps n ILE 21 Ca -0.16 -0.23 0.12 0.00 1.00 0.00 0.00 62.75 63.48 2jps n ILE 21 Cb 0.93 -1.08 0.66 0.00 -0.71 0.00 0.00 39.64 39.44 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 3.71 0.00 -0.92 0.38 0.13 -1.91 -2.85 132.00 130.54 2jps h PRO 22 Ca -0.44 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.18 2jps h PRO 22 Cb 1.32 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 32.16 2jps h PRO 22 CO 0.72 0.15 0.58 0.09 -0.23 0.00 0.00 178.00 179.31 2jps n ASN 23 N -3.54 4.32 -2.51 1.44 4.13 -1.26 -4.48 115.26 113.37 2jps n ASN 23 Ca -0.01 -3.67 -0.15 0.00 1.68 0.00 0.00 54.58 52.43 2jps n ASN 23 Cb 0.29 -0.83 0.03 0.00 -1.54 0.00 0.00 39.78 37.72 2jps n ASN 23 CO 0.00 0.00 0.00 0.33 0.28 0.00 0.00 177.26 177.87 2jps n PHE 24 N -1.10 2.13 -0.31 3.10 -0.00 -1.07 -4.89 117.46 115.30 2jps n PHE 24 Ca 0.57 -2.57 0.13 0.00 -0.00 0.00 0.00 57.45 55.58 2jps n PHE 24 Cb 1.41 -0.26 0.36 0.00 -0.00 0.00 0.00 39.48 40.99 2jps n PHE 24 CO 0.00 0.00 0.00 -0.91 -0.00 0.00 0.00 176.76 175.85 2jps h ASN 25 N 2.60 0.71 -1.14 -2.13 4.21 -1.80 -3.43 115.58 114.60 2jps h ASN 25 Ca 0.10 0.06 -0.65 0.00 1.21 0.00 0.00 56.30 57.03 2jps h ASN 25 Cb 1.22 -0.07 -0.13 0.00 -1.12 0.00 0.00 38.32 38.22 2jps h ASN 25 CO 0.57 0.31 -0.52 -0.70 -1.29 0.00 0.00 177.43 175.79 2jps s GLU 26 N -5.75 2.11 -0.15 0.81 2.12 -1.26 -4.98 118.70 111.60 2jps s GLU 26 Ca -0.10 -2.32 -0.05 0.00 0.36 0.00 0.00 54.97 52.85 2jps s GLU 26 Cb 0.23 -1.32 0.02 0.00 0.26 0.00 0.00 34.13 33.32 2jps s GLU 26 CO 0.80 -0.36 0.11 -0.25 -0.54 0.00 0.00 175.26 175.02 2jps n ASP 27 N -1.24 -4.54 0.11 -1.70 9.92 -1.26 -5.02 116.55 112.83 2jps n ASP 27 Ca -0.15 1.17 0.00 0.00 -0.53 0.00 0.00 54.79 55.28 2jps n ASP 27 Cb 0.67 -3.98 0.00 0.00 -0.64 0.00 0.00 41.12 37.16 2jps n ASP 27 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2jps n ILE 28 N 1.62 0.36 -0.17 0.53 0.13 -1.26 -4.66 119.36 115.92 2jps n ILE 28 Ca -0.18 0.12 0.04 0.00 -1.10 0.00 0.00 62.75 61.63 2jps n ILE 28 Cb 0.34 -0.80 0.32 0.00 -0.84 0.00 0.00 39.64 38.66 2jps n ILE 28 CO 0.00 0.00 0.00 0.50 2.80 0.00 0.00 176.55 179.85 2jps h LYS 29 N 0.00 0.81 -0.34 9.51 3.11 -1.95 -1.06 116.57 126.64 2jps h LYS 29 Ca 0.00 -0.05 -0.15 0.00 -2.81 0.00 0.00 60.65 57.64 2jps h LYS 29 Cb 0.00 -0.18 -0.01 0.00 -1.00 0.00 0.00 32.23 31.04 2jps h LYS 29 CO 0.00 0.53 -0.38 1.88 -2.81 0.00 0.00 179.45 178.68 2jps h TYR 30 N 0.83 0.96 -0.42 1.91 0.05 -2.00 -2.58 116.97 115.72 2jps h TYR 30 Ca 0.27 -0.28 -0.14 0.00 0.05 0.00 0.00 58.73 58.64 2jps h TYR 30 Cb 0.06 -0.20 -0.01 0.00 1.01 0.00 0.00 36.73 37.58 2jps h TYR 30 CO -0.00 1.06 -0.29 0.28 -1.05 0.00 0.00 178.16 178.16 2jps h VAL 31 N 0.66 1.27 -0.91 -2.88 2.07 -1.66 -2.97 116.25 111.84 2jps h VAL 31 Ca 0.06 -1.45 -0.01 0.00 0.82 0.00 0.00 66.70 66.12 2jps h VAL 31 Cb 0.94 1.26 -0.04 0.00 -1.52 0.00 0.00 31.29 31.92 2jps h VAL 31 CO 0.09 0.49 0.52 0.00 0.02 0.00 0.00 177.57 178.68 2jps h ALA 32 N 0.90 1.19 -0.44 1.67 0.00 -1.13 -0.81 119.26 120.64 2jps h ALA 32 Ca 0.09 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.89 2jps h ALA 32 Cb 0.85 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 2jps h ALA 32 CO 0.08 0.66 0.26 0.93 0.00 0.00 0.00 179.25 181.18 2jps h GLU 33 N 1.27 0.52 -0.72 0.00 5.08 -1.31 0.54 114.58 119.95 2jps h GLU 33 Ca 0.32 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.60 2jps h GLU 33 Cb -0.00 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.10 2jps h GLU 33 CO -0.05 0.34 0.26 -0.92 -1.00 0.00 0.00 179.01 177.64 2jps h TYR 34 N 0.53 1.13 0.06 4.33 3.20 -1.31 0.63 116.97 125.54 2jps h TYR 34 Ca 0.18 -0.10 -0.00 0.00 3.14 0.00 0.00 58.73 61.95 2jps h TYR 34 Cb 0.01 -0.33 0.00 0.00 1.54 0.00 0.00 36.73 37.94 2jps h TYR 34 CO -0.07 0.88 -0.03 0.82 -1.64 0.00 0.00 178.16 178.13 2jps h ILE 35 N 1.05 1.07 -0.85 1.81 2.04 -0.33 -0.37 117.51 121.94 2jps h ILE 35 Ca 0.24 -0.42 -0.02 0.00 1.00 0.00 0.00 64.86 65.66 2jps h ILE 35 Cb 0.25 1.35 -0.04 0.00 -0.74 0.00 0.00 36.82 37.64 2jps h ILE 35 CO -0.01 0.11 0.44 0.58 0.00 0.00 0.00 178.15 179.26 2jps h VAL 36 N -0.26 1.25 -1.01 1.67 2.07 0.28 -0.59 116.25 119.66 2jps h VAL 36 Ca -0.01 -0.67 0.06 0.00 0.82 0.00 0.00 66.70 66.90 2jps h VAL 36 Cb 0.23 0.13 -0.06 0.00 -1.52 0.00 0.00 31.29 30.07 2jps h VAL 36 CO 0.01 0.29 0.65 0.25 0.02 0.00 0.00 177.57 178.80 2jps h LEU 37 N 1.20 1.06 -0.64 2.57 5.85 0.57 0.60 115.31 126.52 2jps h LEU 37 Ca 0.30 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.91 2jps h LEU 37 Cb 0.07 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.85 2jps h LEU 37 CO -0.04 0.69 -0.16 -0.07 -0.34 0.00 0.00 178.44 178.52 2jps h LEU 38 N 1.21 0.91 0.16 2.25 3.38 -0.22 -0.54 115.31 122.46 2jps h LEU 38 Ca 0.42 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 2jps h LEU 38 Cb 0.12 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.62 2jps h LEU 38 CO -0.16 1.06 -0.08 0.40 0.09 0.00 0.00 178.44 179.75 2jps h ILE 39 N 0.79 0.95 -0.43 1.22 1.08 0.55 -2.76 117.51 118.90 2jps h ILE 39 Ca 0.12 -0.53 0.00 0.00 -0.39 0.00 0.00 64.86 64.06 2jps h ILE 39 Cb 0.70 1.27 -0.02 0.00 -3.07 0.00 0.00 36.82 35.70 2jps h ILE 39 CO 0.05 0.12 0.27 1.62 -0.69 0.00 0.00 178.15 179.53 2jps h VAL 40 N -0.47 1.12 -0.75 1.67 3.04 0.15 -1.92 116.25 119.09 2jps h VAL 40 Ca -0.02 -0.25 0.01 0.00 -1.01 0.00 0.00 66.70 65.43 2jps h VAL 40 Cb 0.37 0.50 -0.04 0.00 -2.01 0.00 0.00 31.29 30.11 2jps h VAL 40 CO 0.04 0.12 0.49 0.78 -1.01 0.00 0.00 177.57 177.99 2jps h ASN 41 N 0.59 0.86 0.00 3.17 2.35 -0.88 -3.45 115.58 118.23 2jps h ASN 41 Ca 0.16 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 2jps h ASN 41 Cb -0.04 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 38.11 2jps h ASN 41 CO -0.03 0.63 0.00 0.61 -1.65 0.00 0.00 177.43 176.99 2jps n GLY 42 N -1.41 -0.92 0.00 2.83 0.00 -0.75 -5.07 105.19 99.87 2jps n GLY 42 Ca 0.08 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.32 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 -1.29 0.64 3.13 -0.02 0.00 -1.07 -4.97 105.19 101.62 2jps n GLY 43 Ca 0.00 -0.12 -0.34 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.90 2.88 0.38 2.61 -4.23 -1.26 -4.99 115.64 110.13 2jps s THR 44 Ca 0.00 -1.67 0.16 0.00 -1.18 0.00 0.00 61.69 59.01 2jps s THR 44 Cb 0.00 -2.78 0.37 0.00 1.34 0.00 0.00 72.50 71.44 2jps s THR 44 CO 0.00 -0.28 1.78 0.58 -0.54 0.00 0.00 174.62 176.16 2jps h VAL 45 N 6.50 0.56 0.26 2.29 2.07 -1.96 0.96 116.25 126.93 2jps h VAL 45 Ca -0.17 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.18 2jps h VAL 45 Cb 1.05 0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.90 2jps h VAL 45 CO 0.56 0.08 -0.12 -0.08 0.02 0.00 0.00 177.57 178.03 2jps h GLU 46 N 0.45 -0.33 -0.23 1.57 4.22 -1.98 0.73 114.58 119.01 2jps h GLU 46 Ca 0.58 0.02 -0.13 0.00 0.08 0.00 0.00 59.36 59.92 2jps h GLU 46 Cb 1.38 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.70 2jps h GLU 46 CO -0.31 -0.04 -0.39 0.77 -2.18 0.00 0.00 179.01 176.86 2jps h SER 47 N -0.62 0.55 0.01 1.04 0.02 -1.72 -0.07 113.55 112.75 2jps h SER 47 Ca -0.04 -0.24 -0.15 0.00 -0.84 0.00 0.00 61.79 60.52 2jps h SER 47 Cb 0.45 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.82 2jps h SER 47 CO 0.06 0.88 -0.51 0.58 -1.14 0.00 0.00 176.83 176.70 2jps h VAL 48 N 0.43 1.32 -0.02 2.27 2.07 0.10 0.20 116.25 122.61 2jps h VAL 48 Ca 0.04 -1.74 -0.26 0.00 0.82 0.00 0.00 66.70 65.56 2jps h VAL 48 Cb 0.87 1.72 0.02 0.00 -1.52 0.00 0.00 31.29 32.37 2jps h VAL 48 CO 0.07 0.54 -0.99 0.58 0.02 0.00 0.00 177.57 177.80 2jps h VAL 49 N 0.44 1.29 -0.34 2.57 2.07 0.62 -2.18 116.25 120.72 2jps h VAL 49 Ca 0.02 -2.23 -0.11 0.00 0.82 0.00 0.00 66.70 65.20 2jps h VAL 49 Cb 1.05 2.32 -0.01 0.00 -1.52 0.00 0.00 31.29 33.12 2jps h VAL 49 CO 0.10 0.69 -0.23 -0.78 0.02 0.00 0.00 177.57 177.36 2jps h ASP 50 N 0.40 0.66 -0.31 0.57 1.82 -0.96 0.17 116.42 118.77 2jps h ASP 50 Ca -0.11 -0.23 -0.11 0.00 -0.39 0.00 0.00 57.03 56.19 2jps h ASP 50 Cb 1.64 -0.18 -0.01 0.00 0.68 0.00 0.00 39.33 41.46 2jps h ASP 50 CO 0.19 0.88 -0.23 -0.33 -1.61 0.00 0.00 179.24 178.14 2jps h GLU 51 N 0.58 0.71 -0.35 0.28 4.39 -0.95 -0.14 114.58 119.10 2jps h GLU 51 Ca 0.08 -0.34 -0.17 0.00 0.34 0.00 0.00 59.36 59.27 2jps h GLU 51 Cb 0.70 -0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.35 2jps h GLU 51 CO 0.05 0.95 -0.45 -0.07 -1.16 0.00 0.00 179.01 178.34 2jps h LEU 52 N 0.46 1.00 -0.86 1.33 3.38 -1.27 -3.01 115.31 116.34 2jps h LEU 52 Ca 0.06 -0.49 -0.06 0.00 0.09 0.00 0.00 57.88 57.48 2jps h LEU 52 Cb 0.79 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 2jps h LEU 52 CO 0.06 1.29 0.19 0.00 0.09 0.00 0.00 178.44 180.08 2jps h ALA 53 N 0.73 1.08 -0.50 1.53 0.00 -0.61 0.92 119.26 122.40 2jps h ALA 53 Ca 0.04 -0.22 0.05 0.00 0.00 0.00 0.00 54.91 54.79 2jps h ALA 53 Cb 1.05 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 2jps h ALA 53 CO 0.11 0.62 0.33 0.77 0.00 0.00 0.00 179.25 181.08 2jps h SER 54 N 0.99 0.40 0.02 0.00 0.02 -0.88 -2.67 113.55 111.43 2jps h SER 54 Ca 0.22 -0.00 -0.39 0.00 -0.84 0.00 0.00 61.79 60.78 2jps h SER 54 Cb 0.31 -0.09 -0.06 0.00 0.14 0.00 0.00 62.40 62.70 2jps h SER 54 CO -0.00 0.26 -2.27 0.18 -1.14 0.00 0.00 176.83 173.86 2jps n LEU 55 N -4.47 2.50 -4.10 5.07 4.77 -0.91 -4.64 117.00 115.22 2jps n LEU 55 Ca 0.07 0.12 -0.40 0.00 -0.03 0.00 0.00 56.01 55.77 2jps n LEU 55 Cb 0.23 -0.93 -0.02 0.00 -2.33 0.00 0.00 43.42 40.37 2jps n LEU 55 CO 0.34 0.75 0.71 0.49 -1.33 0.00 0.00 177.39 178.35 2jps n PHE 56 N -3.71 3.98 -1.12 -1.77 3.72 0.31 -4.84 117.46 114.03 2jps n PHE 56 Ca -0.44 -3.61 -0.14 0.00 -0.05 0.00 0.00 57.45 53.21 2jps n PHE 56 Cb 0.94 -1.32 0.25 0.00 -0.94 0.00 0.00 39.48 38.41 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 2.01 4.39 -0.09 4.37 5.68 -1.01 -4.41 116.55 127.49 2jps n ASP 57 Ca 0.25 -3.39 -0.18 0.00 -0.50 0.00 0.00 54.79 50.96 2jps n ASP 57 Cb 0.37 -0.79 -0.13 0.00 -1.14 0.00 0.00 41.12 39.43 2jps n ASP 57 CO 0.00 0.00 0.00 -0.24 -1.33 0.00 0.00 177.20 175.63 2jps n SER 58 N -0.59 1.77 -4.89 -1.12 2.88 -1.26 -4.96 113.62 105.46 2jps n SER 58 Ca 0.50 -0.02 -0.29 0.00 -1.33 0.00 0.00 58.87 57.72 2jps n SER 58 Cb 1.53 -0.36 -0.02 0.00 -0.75 0.00 0.00 64.21 64.61 2jps n SER 58 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2jps s VAL 59 N -2.53 4.86 0.31 2.46 0.11 -1.26 -5.01 120.40 119.34 2jps s VAL 59 Ca -0.28 0.40 -0.28 0.00 -2.93 0.00 0.00 61.98 58.88 2jps s VAL 59 Cb 0.08 -3.79 -0.13 0.00 -1.53 0.00 0.00 36.38 31.01 2jps s VAL 59 CO 0.67 -0.64 1.16 -1.20 -3.33 0.00 0.00 175.10 171.76 2jps n SER 60 N -1.65 2.03 -0.23 3.54 7.64 -1.26 -4.85 113.62 118.85 2jps n SER 60 Ca 0.01 1.19 0.16 0.00 1.01 0.00 0.00 58.87 61.24 2jps n SER 60 Cb 0.54 -1.38 0.47 0.00 -1.01 0.00 0.00 64.21 62.83 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 2.36 0.48 -0.99 1.43 -0.00 -1.95 -0.90 114.38 114.82 2jps h ARG 61 Ca -0.43 -0.03 0.05 0.00 -0.50 0.00 0.00 59.98 59.07 2jps h ARG 61 Cb 1.31 -0.11 -0.06 0.00 0.00 0.00 0.00 29.97 31.11 2jps h ARG 61 CO 0.62 0.32 0.64 -0.44 0.00 0.00 0.00 179.97 181.11 2jps h ASP 62 N 0.50 1.05 -0.79 7.04 5.19 -2.00 -1.22 116.42 126.19 2jps h ASP 62 Ca 0.43 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.83 2jps h ASP 62 Cb 0.94 -0.23 -0.04 0.00 0.18 0.00 0.00 39.33 40.18 2jps h ASP 62 CO -0.17 0.69 0.43 0.74 -3.12 0.00 0.00 179.24 177.82 2jps h THR 63 N 1.20 1.24 0.02 0.35 2.02 -1.50 -1.26 112.91 114.98 2jps h THR 63 Ca 0.41 -0.59 -0.00 0.00 0.77 0.00 0.00 66.41 67.00 2jps h THR 63 Cb 0.08 0.18 0.00 0.00 -1.74 0.00 0.00 68.15 66.68 2jps h THR 63 CO -0.15 0.26 -0.01 -0.07 0.37 0.00 0.00 175.52 175.92 2jps h LEU 64 N 1.10 -0.02 -1.58 2.58 4.07 -1.30 -2.59 115.31 117.56 2jps h LEU 64 Ca 0.28 -0.21 0.13 0.00 0.08 0.00 0.00 57.88 58.16 2jps h LEU 64 Cb 0.03 0.01 -0.05 0.00 1.08 0.00 0.00 40.66 41.73 2jps h LEU 64 CO -0.04 0.19 0.48 0.00 -1.08 0.00 0.00 178.44 177.99 2jps h ALA 65 N 0.74 2.07 -0.74 1.53 0.00 -1.00 -1.21 119.26 120.65 2jps h ALA 65 Ca -0.00 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.91 2jps h ALA 65 Cb 0.23 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 2jps h ALA 65 CO 0.00 -0.25 0.49 -0.91 0.00 0.00 0.00 179.25 178.58 2jps h ASN 66 N 0.43 0.84 -0.24 0.00 2.35 -0.83 0.80 115.58 118.93 2jps h ASN 66 Ca 0.35 -0.02 -0.14 0.00 -0.55 0.00 0.00 56.30 55.94 2jps h ASN 66 Cb 0.75 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.91 2jps h ASN 66 CO -0.11 0.60 -0.34 0.58 -1.65 0.00 0.00 177.43 176.51 2jps h VAL 67 N 0.99 1.28 -0.35 2.81 2.07 -1.14 -2.71 116.25 119.20 2jps h VAL 67 Ca 0.27 -1.50 -0.08 0.00 0.82 0.00 0.00 66.70 66.21 2jps h VAL 67 Cb -0.10 1.39 -0.02 0.00 -1.52 0.00 0.00 31.29 31.04 2jps h VAL 67 CO -0.07 0.49 -0.13 0.58 0.02 0.00 0.00 177.57 178.47 2jps h VAL 68 N 0.64 1.25 -0.42 2.57 2.07 -0.97 -2.55 116.25 118.83 2jps h VAL 68 Ca 0.06 -1.11 -0.02 0.00 0.82 0.00 0.00 66.70 66.45 2jps h VAL 68 Cb 0.88 1.12 -0.02 0.00 -1.52 0.00 0.00 31.29 31.75 2jps h VAL 68 CO 0.08 0.37 0.17 1.56 0.02 0.00 0.00 177.57 179.77 2jps h GLN 69 N 0.57 0.63 -0.02 1.57 1.08 -0.62 -1.76 115.11 116.55 2jps h GLN 69 Ca 0.10 -0.11 -0.06 0.00 -1.45 0.00 0.00 58.65 57.12 2jps h GLN 69 Cb 0.55 -0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 27.87 2jps h GLN 69 CO 0.03 0.58 -0.28 0.00 -0.95 0.00 0.00 178.83 178.22 2jps h THR 70 N 0.54 1.21 -0.20 -0.54 1.03 -1.32 -1.56 112.91 112.07 2jps h THR 70 Ca 0.14 -1.00 -0.17 0.00 -0.01 0.00 0.00 66.41 65.38 2jps h THR 70 Cb 0.19 1.51 -0.00 0.00 -1.07 0.00 0.00 68.15 68.77 2jps h THR 70 CO -0.01 0.29 -0.55 0.00 -0.01 0.00 0.00 175.52 175.24 2jps h ALA 71 N 1.69 0.65 0.06 0.00 0.00 -1.05 0.44 119.26 121.05 2jps h ALA 71 Ca 0.00 -0.51 -0.00 0.00 0.00 0.00 0.00 54.91 54.40 2jps h ALA 71 Cb 0.51 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2jps h ALA 71 CO 0.04 0.69 -0.03 0.74 0.00 0.00 0.00 179.25 180.69 2jps h PHE 72 N 0.47 -0.07 -0.87 0.00 -1.00 -0.88 -1.85 116.94 112.73 2jps h PHE 72 Ca 0.01 -0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.78 2jps h PHE 72 Cb 1.11 0.02 -0.04 0.00 3.61 0.00 0.00 35.95 40.65 2jps h PHE 72 CO 0.05 0.29 0.52 0.74 -1.61 0.00 0.00 178.31 178.30 2jps h PHE 73 N -0.45 1.15 -0.99 -0.55 0.04 -1.31 -2.07 116.94 112.77 2jps h PHE 73 Ca -0.01 -0.00 0.02 0.00 2.80 0.00 0.00 57.97 60.78 2jps h PHE 73 Cb 0.40 -0.38 -0.05 0.00 2.20 0.00 0.00 35.95 38.12 2jps h PHE 73 CO 0.05 0.77 0.65 0.00 -0.60 0.00 0.00 178.31 179.18 2jps h ALA 74 N 1.37 1.33 -0.88 2.45 0.00 -0.77 -0.87 119.26 121.89 2jps h ALA 74 Ca 0.31 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.20 2jps h ALA 74 Cb -0.04 -0.38 -0.05 0.00 0.00 0.00 0.00 17.79 17.32 2jps h ALA 74 CO -0.06 0.60 0.57 -0.07 0.00 0.00 0.00 179.25 180.29 2jps h LEU 75 N 1.29 0.93 -0.31 0.00 -0.00 -0.60 0.79 115.31 117.41 2jps h LEU 75 Ca 0.38 -0.00 -0.16 0.00 -0.00 0.00 0.00 57.88 58.09 2jps h LEU 75 Cb -0.07 -0.21 -0.00 0.00 -0.00 0.00 0.00 40.66 40.38 2jps h LEU 75 CO -0.10 0.64 -0.43 -0.08 -0.00 0.00 0.00 178.44 178.46 2jps h GLU 76 N 1.09 0.84 -0.40 1.13 4.81 -1.25 -1.13 114.58 119.66 2jps h GLU 76 Ca 0.35 -0.49 -0.14 0.00 -0.13 0.00 0.00 59.36 58.95 2jps h GLU 76 Cb 0.02 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 2jps h GLU 76 CO -0.12 1.13 -0.31 0.00 -0.73 0.00 0.00 179.01 178.98 2jps h ALA 77 N 0.70 0.70 -0.50 2.92 0.00 -0.57 -2.87 119.26 119.65 2jps h ALA 77 Ca 0.03 -0.42 -0.11 0.00 0.00 0.00 0.00 54.91 54.42 2jps h ALA 77 Cb 1.03 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 2jps h ALA 77 CO 0.10 0.67 -0.12 1.25 0.00 0.00 0.00 179.25 181.15 2jps h LEU 78 N 0.74 0.93 -1.82 0.00 5.85 0.63 -0.60 115.31 121.03 2jps h LEU 78 Ca 0.08 -0.30 -0.01 0.00 0.84 0.00 0.00 57.88 58.49 2jps h LEU 78 Cb 0.87 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.64 2jps h LEU 78 CO 0.08 1.05 -0.02 -0.61 -0.34 0.00 0.00 178.44 178.60 2jps h GLN 79 N 0.83 0.08 0.14 1.25 4.15 -1.06 -2.97 115.11 117.53 2jps h GLN 79 Ca 0.13 -0.01 -0.35 0.00 0.77 0.00 0.00 58.65 59.19 2jps h GLN 79 Cb 0.66 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.32 2jps h GLN 79 CO 0.05 0.12 -1.85 1.96 -1.93 0.00 0.00 178.83 177.17 2jps h GLN 80 N 0.08 0.30 0.00 1.69 4.20 -1.26 -3.49 115.11 116.63 2jps h GLN 80 Ca 0.02 -0.51 0.00 0.00 0.06 0.00 0.00 58.65 58.22 2jps h GLN 80 Cb 0.10 0.19 0.00 0.00 0.30 0.00 0.00 27.48 28.07 2jps h GLN 80 CO 0.00 1.21 0.00 0.41 -0.67 0.00 0.00 178.83 179.78 2jps n GLY 81 N 1.90 -0.03 3.47 3.46 0.00 -0.26 -5.13 105.19 108.61 2jps n GLY 81 Ca -0.27 0.08 -0.23 0.00 0.00 0.00 0.00 46.02 45.60 2jps n GLY 81 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2jps s GLU 82 N 0.00 1.66 -0.08 1.61 2.12 -1.06 -4.93 118.70 118.01 2jps s GLU 82 Ca 0.00 -1.85 0.02 0.00 0.36 0.00 0.00 54.97 53.50 2jps s GLU 82 Cb 0.00 -1.37 -0.02 0.00 0.26 0.00 0.00 34.13 33.00 2jps s GLU 82 CO 0.00 0.08 -0.13 -1.12 -0.54 0.00 0.00 175.26 173.55 2jps s SER 83 N -3.51 4.12 -0.19 -1.70 0.01 -1.26 -4.87 113.70 106.29 2jps s SER 83 Ca 0.31 -0.22 0.12 0.00 1.31 0.00 0.00 55.95 57.47 2jps s SER 83 Cb 0.03 -1.18 -0.23 0.00 0.21 0.00 0.00 66.02 64.85 2jps s SER 83 CO 0.14 0.28 0.07 0.00 0.41 0.00 0.00 173.24 174.14 2jps n ALA 84 N 2.76 1.46 -0.29 1.44 0.00 -1.26 -4.39 120.51 120.22 2jps n ALA 84 Ca -0.18 -1.19 0.09 0.00 0.00 0.00 0.00 53.44 52.17 2jps n ALA 84 Cb 0.52 -0.25 0.32 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 0.81 -0.67 0.00 4.22 -1.95 -0.73 114.58 116.26 2jps h GLU 85 Ca -0.52 -0.05 0.06 0.00 0.08 0.00 0.00 59.36 58.93 2jps h GLU 85 Cb 2.13 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 31.15 2jps h GLU 85 CO 0.01 0.53 0.44 -0.91 -2.18 0.00 0.00 179.01 176.90 2jps h ASN 86 N 0.83 0.59 -0.36 1.04 2.35 -2.02 -1.46 115.58 116.56 2jps h ASN 86 Ca 0.44 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 56.10 2jps h ASN 86 Cb 0.55 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.77 2jps h ASN 86 CO -0.21 0.38 -0.11 0.40 -1.65 0.00 0.00 177.43 176.25 2jps h ILE 87 N 0.68 1.26 -0.68 2.81 1.08 -1.36 -2.82 117.51 118.48 2jps h ILE 87 Ca 0.29 -1.17 0.00 0.00 -0.39 0.00 0.00 64.86 63.58 2jps h ILE 87 Cb 0.27 1.03 -0.03 0.00 -3.07 0.00 0.00 36.82 35.02 2jps h ILE 87 CO -0.09 0.40 0.42 0.58 -0.69 0.00 0.00 178.15 178.77 2jps h VAL 88 N 0.73 1.18 -0.89 1.67 2.07 -1.21 -2.08 116.25 117.73 2jps h VAL 88 Ca 0.12 -0.38 0.08 0.00 0.82 0.00 0.00 66.70 67.35 2jps h VAL 88 Cb 0.59 0.21 -0.07 0.00 -1.52 0.00 0.00 31.29 30.51 2jps h VAL 88 CO 0.04 0.19 0.54 0.77 0.02 0.00 0.00 177.57 179.12 2jps h SER 89 N 0.92 0.82 0.10 0.57 4.64 -1.35 0.44 113.55 119.70 2jps h SER 89 Ca 0.25 0.03 -0.14 0.00 -0.47 0.00 0.00 61.79 61.45 2jps h SER 89 Cb -0.06 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 61.88 2jps h SER 89 CO -0.05 0.49 -0.51 0.11 -0.87 0.00 0.00 176.83 176.00 2jps h LYS 90 N 0.93 0.46 -0.25 4.77 1.79 -1.45 -2.64 116.57 120.18 2jps h LYS 90 Ca 0.41 -0.27 -0.18 0.00 -2.18 0.00 0.00 60.65 58.43 2jps h LYS 90 Cb 0.29 0.02 -0.00 0.00 -1.58 0.00 0.00 32.23 30.96 2jps h LYS 90 CO -0.21 0.86 -0.56 0.82 -1.08 0.00 0.00 179.45 179.28 2jps h ILE 91 N 0.36 1.29 -0.76 1.86 1.08 -0.62 -1.48 117.51 119.24 2jps h ILE 91 Ca 0.01 -1.77 -0.03 0.00 -0.39 0.00 0.00 64.86 62.69 2jps h ILE 91 Cb 1.02 1.69 -0.04 0.00 -3.07 0.00 0.00 36.82 36.42 2jps h ILE 91 CO 0.09 0.57 0.37 -0.09 -0.69 0.00 0.00 178.15 178.40 2jps h ARG 92 N 0.59 1.08 -0.18 2.37 9.65 -0.10 0.80 114.38 128.58 2jps h ARG 92 Ca 0.01 -0.15 -0.21 0.00 -1.10 0.00 0.00 59.98 58.54 2jps h ARG 92 Cb 1.15 -0.20 0.01 0.00 -1.39 0.00 0.00 29.97 29.54 2jps h ARG 92 CO 0.12 0.83 -0.69 1.98 2.80 0.00 0.00 179.97 185.01 2jps h MET 93 N 1.07 0.79 -0.25 0.20 4.05 -1.39 -0.77 114.93 118.64 2jps h MET 93 Ca 0.26 -0.60 -0.16 0.00 -0.28 0.00 0.00 59.70 58.92 2jps h MET 93 Cb 0.10 0.11 -0.01 0.00 -0.80 0.00 0.00 31.60 31.01 2jps h MET 93 CO -0.03 1.22 -0.50 1.98 0.23 0.00 0.00 176.91 179.80 2jps h MET 94 N 0.53 0.69 -0.30 0.39 1.85 -0.90 -2.00 114.93 115.20 2jps h MET 94 Ca -0.03 -0.41 -0.15 0.00 -0.61 0.00 0.00 59.70 58.49 2jps h MET 94 Cb 1.31 0.04 -0.01 0.00 0.43 0.00 0.00 31.60 33.37 2jps h MET 94 CO 0.14 1.03 -0.42 -0.91 -0.40 0.00 0.00 176.91 176.36 2jps h ASN 95 N 0.54 0.79 -0.51 1.39 2.35 0.62 -2.89 115.58 117.87 2jps h ASN 95 Ca 0.02 -0.37 -0.10 0.00 -0.55 0.00 0.00 56.30 55.30 2jps h ASN 95 Cb 1.06 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 39.19 2jps h ASN 95 CO 0.10 1.10 -0.08 0.00 -1.65 0.00 0.00 177.43 176.91 2jps h ALA 96 N 0.93 0.85 -0.83 -0.83 0.00 -1.06 -2.83 119.26 115.49 2jps h ALA 96 Ca 0.04 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 54.63 2jps h ALA 96 Cb 0.97 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.52 2jps h ALA 96 CO 0.09 0.65 0.55 0.37 0.00 0.00 0.00 179.25 180.92 2jps h GLN 97 N 0.88 1.09 -0.82 0.00 4.15 -1.25 0.83 115.11 119.98 2jps h GLN 97 Ca 0.15 -0.07 0.08 0.00 0.77 0.00 0.00 58.65 59.58 2jps h GLN 97 Cb 0.62 -0.25 -0.06 0.00 0.21 0.00 0.00 27.48 28.01 2jps h GLN 97 CO 0.04 0.72 0.54 0.77 -1.93 0.00 0.00 178.83 178.96 2jps h SER 98 N 1.12 0.74 0.05 -0.69 0.02 -1.29 -3.10 113.55 110.40 2jps h SER 98 Ca 0.31 0.01 -0.38 0.00 -0.84 0.00 0.00 61.79 60.89 2jps h SER 98 Cb -0.11 -0.14 -0.05 0.00 0.14 0.00 0.00 62.40 62.24 2jps h SER 98 CO -0.07 0.46 -2.28 0.18 -1.14 0.00 0.00 176.83 173.98 2jps n LEU 99 N -4.50 2.83 0.00 5.07 4.77 -0.78 -5.04 117.00 119.36 2jps n LEU 99 Ca 0.13 0.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 2jps n LEU 99 Cb 0.27 -1.00 0.00 0.00 -2.33 0.00 0.00 43.42 40.36 2jps n LEU 99 CO 0.32 0.90 0.00 0.61 -1.33 0.00 0.00 177.39 177.90 2jps n GLY 100 N 2.15 3.02 1.51 -0.72 0.00 0.28 -5.05 105.19 106.37 2jps n GLY 100 Ca -0.40 -0.85 0.12 0.00 0.00 0.00 0.00 46.02 44.89 2jps n GLY 100 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2jps n GLN 101 N 0.00 -3.66 -3.66 1.61 0.00 -1.26 -4.75 117.38 105.66 2jps n GLN 101 Ca 0.00 2.95 -0.28 0.00 -0.00 0.00 0.00 57.00 59.67 2jps n GLN 101 Cb 0.00 -4.00 0.00 0.00 0.00 0.00 0.00 30.24 26.24 2jps n GLN 101 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.06 175.93 2jps n SER 102 N -3.79 -4.21 -2.80 1.69 3.41 -1.26 -4.85 113.62 101.81 2jps n SER 102 Ca -0.07 -0.61 -0.02 0.00 -0.26 0.00 0.00 58.87 57.92 2jps n SER 102 Cb 0.63 -3.42 0.05 0.00 -0.26 0.00 0.00 64.21 61.21 2jps n SER 102 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2jps n ASP 103 N -2.54 1.45 -4.00 4.04 -0.08 -1.26 -5.10 116.55 109.06 2jps n ASP 103 Ca 0.01 -2.15 -0.08 0.00 -1.51 0.00 0.00 54.79 51.06 2jps n ASP 103 Cb 0.53 -0.45 -0.09 0.00 2.34 0.00 0.00 41.12 43.45 2jps n ASP 103 CO 0.00 0.00 0.00 -0.51 0.12 0.00 0.00 177.20 176.81 2jps s ILE 104 N -3.56 0.19 0.00 5.18 2.07 -1.26 -5.17 121.20 118.65 2jps s ILE 104 Ca 0.27 -1.54 0.00 0.00 -1.41 0.00 0.00 60.65 57.96 2jps s ILE 104 Cb 0.35 -1.42 0.00 0.00 0.13 0.00 0.00 42.46 41.52 2jps s ILE 104 CO -0.03 -0.85 0.16 0.00 -1.91 0.00 0.00 174.94 172.31