#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 1.73 -3.45 6.12 7.64 -1.26 -5.10 113.62 119.29 2jps n SER 2 Ca 0.00 -0.68 -0.26 0.00 1.01 0.00 0.00 58.87 58.94 2jps n SER 2 Cb 0.00 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.11 2jps n SER 2 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jps n GLN 3 N -0.09 1.45 -0.07 1.43 1.13 -1.26 -4.90 117.38 115.06 2jps n GLN 3 Ca 0.00 -3.96 -0.19 0.00 -1.94 0.00 0.00 57.00 50.92 2jps n GLN 3 Cb 0.00 -1.87 -0.13 0.00 0.11 0.00 0.00 30.24 28.35 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 1.60 0.69 -0.27 -1.09 2.13 -1.26 -3.51 120.64 118.94 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 0.44 -1.60 0.35 0.00 0.27 0.00 0.00 31.44 30.91 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 0.73 -0.06 5.31 3.07 -1.99 0.40 115.11 122.59 2jps h GLN 5 Ca -0.51 -0.04 -0.21 0.00 0.09 0.00 0.00 58.65 57.98 2jps h GLN 5 Cb 1.97 -0.17 0.00 0.00 0.08 0.00 0.00 27.48 29.37 2jps h GLN 5 CO -0.01 0.48 -0.83 1.88 0.09 0.00 0.00 178.83 180.44 2jps h TYR 6 N 0.75 0.67 -0.59 0.06 -1.99 -1.97 -2.30 116.97 111.60 2jps h TYR 6 Ca 0.43 -0.32 -0.09 0.00 2.00 0.00 0.00 58.73 60.75 2jps h TYR 6 Cb 0.60 -0.09 -0.02 0.00 2.00 0.00 0.00 36.73 39.22 2jps h TYR 6 CO -0.00 1.12 0.01 1.15 -0.00 0.00 0.00 178.16 180.44 2jps h THR 7 N 0.30 1.26 -0.37 -2.88 2.02 -0.91 0.91 112.91 113.24 2jps h THR 7 Ca -0.06 -1.12 -0.14 0.00 0.77 0.00 0.00 66.41 65.87 2jps h THR 7 Cb 1.44 0.82 -0.01 0.00 -1.74 0.00 0.00 68.15 68.66 2jps h THR 7 CO 0.15 0.41 -0.31 -0.33 0.37 0.00 0.00 175.52 175.81 2jps h GLU 8 N 0.92 0.87 -0.05 6.66 3.07 -0.34 0.13 114.58 125.84 2jps h GLU 8 Ca 0.17 -0.43 -0.23 0.00 -0.50 0.00 0.00 59.36 58.36 2jps h GLU 8 Cb 0.53 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 28.46 2jps h GLU 8 CO 0.03 1.08 -0.91 -0.91 -1.40 0.00 0.00 179.01 176.90 2jps h ASN 9 N 0.67 0.76 -0.29 1.42 4.21 -1.29 -3.17 115.58 117.90 2jps h ASN 9 Ca 0.07 -0.57 -0.09 0.00 1.21 0.00 0.00 56.30 56.92 2jps h ASN 9 Cb 0.89 -0.23 -0.02 0.00 -1.12 0.00 0.00 38.32 37.84 2jps h ASN 9 CO 0.08 1.36 -0.14 0.25 -1.29 0.00 0.00 177.43 177.69 2jps h LEU 10 N 0.37 0.71 -1.63 1.61 5.85 0.92 -2.58 115.31 120.56 2jps h LEU 10 Ca -0.08 -0.22 0.04 0.00 0.84 0.00 0.00 57.88 58.46 2jps h LEU 10 Cb 1.54 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 42.35 2jps h LEU 10 CO 0.17 0.86 0.31 0.50 -0.34 0.00 0.00 178.44 179.95 2jps h LYS 11 N 0.65 0.46 -0.04 1.25 3.11 -0.72 0.36 116.57 121.64 2jps h LYS 11 Ca 0.11 -0.03 -0.14 0.00 -2.81 0.00 0.00 60.65 57.78 2jps h LYS 11 Cb 0.60 -0.10 0.01 0.00 -1.00 0.00 0.00 32.23 31.74 2jps h LYS 11 CO 0.04 0.30 -0.54 0.28 -2.81 0.00 0.00 179.45 176.73 2jps h VAL 12 N 0.47 1.41 -0.33 2.00 2.07 -1.46 -2.36 116.25 118.06 2jps h VAL 12 Ca 0.20 -1.97 -0.08 0.00 0.82 0.00 0.00 66.70 65.67 2jps h VAL 12 Cb 0.19 2.46 -0.02 0.00 -1.52 0.00 0.00 31.29 32.40 2jps h VAL 12 CO -0.05 0.58 -0.13 0.40 0.02 0.00 0.00 177.57 178.39 2jps h ILE 13 N -0.06 1.24 -0.45 4.57 2.04 -1.05 -2.43 117.51 121.37 2jps h ILE 13 Ca -0.06 -1.08 -0.08 0.00 1.00 0.00 0.00 64.86 64.64 2jps h ILE 13 Cb 1.23 1.13 -0.02 0.00 -0.74 0.00 0.00 36.82 38.43 2jps h ILE 13 CO 0.11 0.36 -0.04 0.58 0.00 0.00 0.00 178.15 179.15 2jps h VAL 14 N 0.52 1.27 -0.51 1.67 2.07 -0.31 -2.75 116.25 118.21 2jps h VAL 14 Ca 0.09 -1.12 -0.01 0.00 0.82 0.00 0.00 66.70 66.49 2jps h VAL 14 Cb 0.53 1.09 -0.03 0.00 -1.52 0.00 0.00 31.29 31.37 2jps h VAL 14 CO 0.03 0.38 0.29 0.00 0.02 0.00 0.00 177.57 178.30 2jps h ALA 15 N 0.89 1.57 -0.89 1.67 0.00 -1.15 -1.93 119.26 119.41 2jps h ALA 15 Ca 0.12 -0.07 0.15 0.00 0.00 0.00 0.00 54.91 55.11 2jps h ALA 15 Cb 0.56 -0.21 -0.07 0.00 0.00 0.00 0.00 17.79 18.07 2jps h ALA 15 CO 0.03 0.37 0.58 1.49 0.00 0.00 0.00 179.25 181.72 2jps h GLU 16 N 0.70 0.67 0.17 0.00 4.81 -1.13 0.83 114.58 120.63 2jps h GLU 16 Ca 0.18 -0.04 -0.29 0.00 -0.13 0.00 0.00 59.36 59.08 2jps h GLU 16 Cb -0.01 -0.15 0.01 0.00 0.63 0.00 0.00 28.75 29.23 2jps h GLU 16 CO -0.03 0.44 -1.41 -0.22 -0.73 0.00 0.00 179.01 177.06 2jps h LYS 17 N 0.69 0.35 0.39 1.92 1.63 -1.43 -2.66 116.57 117.47 2jps h LYS 17 Ca 0.45 -0.61 -0.02 0.00 -0.85 0.00 0.00 60.65 59.63 2jps h LYS 17 Cb 0.73 0.23 0.00 0.00 -0.60 0.00 0.00 32.23 32.59 2jps h LYS 17 CO -0.21 1.29 -0.19 -0.07 -3.45 0.00 0.00 179.45 176.82 2jps h LEU 18 N -0.12 -0.44 -2.50 5.20 3.38 -0.80 -0.96 115.31 119.07 2jps h LEU 18 Ca -0.28 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.57 2jps h LEU 18 Cb 1.91 0.11 -0.00 0.00 0.09 0.00 0.00 40.66 42.78 2jps h LEU 18 CO 0.15 -0.10 -0.01 0.00 0.09 0.00 0.00 178.44 178.57 2jps h ALA 19 N -0.36 1.44 0.14 1.53 0.00 0.51 -2.35 119.26 120.17 2jps h ALA 19 Ca -0.05 -0.01 -0.28 0.00 0.00 0.00 0.00 54.91 54.57 2jps h ALA 19 Cb 0.54 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.33 2jps h ALA 19 CO 0.09 0.01 -1.28 0.78 0.00 0.00 0.00 179.25 178.84 2jps h GLY 20 N 0.06 0.35 -5.51 0.00 0.00 -1.18 -3.46 103.07 93.33 2jps h GLY 20 Ca -0.00 -0.89 -0.63 0.00 0.00 0.00 0.00 47.33 45.81 2jps h GLY 20 CO 0.00 0.78 0.85 1.39 0.00 0.00 0.00 176.54 179.56 2jps n ILE 21 N -3.55 0.24 0.37 2.60 5.41 -0.39 -4.85 119.36 119.19 2jps n ILE 21 Ca -0.10 -0.04 0.14 0.00 1.00 0.00 0.00 62.75 63.75 2jps n ILE 21 Cb 1.03 -1.48 0.51 0.00 -0.71 0.00 0.00 39.64 39.00 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 6.97 0.00 -0.85 0.38 0.13 -1.88 -3.14 132.00 133.61 2jps h PRO 22 Ca -0.47 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.17 2jps h PRO 22 Cb 1.28 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 32.14 2jps h PRO 22 CO 0.90 0.00 0.46 -1.71 -0.23 0.00 0.00 178.00 177.42 2jps n ASN 23 N -2.61 4.50 -4.22 1.44 5.15 -1.26 -4.91 115.26 113.36 2jps n ASN 23 Ca 0.02 -3.70 -0.35 0.00 -0.60 0.00 0.00 54.58 49.95 2jps n ASN 23 Cb 0.31 -0.80 -0.14 0.00 -0.53 0.00 0.00 39.78 38.63 2jps n ASN 23 CO 0.00 0.00 0.00 0.12 1.40 0.00 0.00 177.26 178.78 2jps s PHE 24 N -3.44 3.16 -0.19 1.20 2.19 -1.19 -5.04 117.98 114.67 2jps s PHE 24 Ca 0.56 -1.57 -0.03 0.00 0.33 0.00 0.00 56.93 56.22 2jps s PHE 24 Cb 0.47 -2.12 -0.01 0.00 -1.31 0.00 0.00 43.02 40.05 2jps s PHE 24 CO 0.05 -0.73 -0.08 1.21 1.83 0.00 0.00 175.22 177.50 2jps s ASN 25 N 1.33 4.20 0.27 6.13 2.47 -1.26 -5.01 114.94 123.08 2jps s ASN 25 Ca -0.02 -0.36 0.00 0.00 0.42 0.00 0.00 52.86 52.90 2jps s ASN 25 Cb -0.18 -1.69 0.00 0.00 -1.45 0.00 0.00 41.25 37.93 2jps s ASN 25 CO -0.02 0.05 0.00 -0.62 -3.72 0.00 0.00 177.10 172.79 2jps n GLU 26 N 4.31 -2.14 -3.46 0.43 -0.58 -1.26 -4.78 120.64 113.15 2jps n GLU 26 Ca -0.18 1.47 -0.25 0.00 -0.42 0.00 0.00 57.16 57.78 2jps n GLU 26 Cb 0.51 -2.64 0.00 0.00 -0.57 0.00 0.00 31.44 28.75 2jps n GLU 26 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2jps n ASP 27 N -4.33 -4.21 -0.11 1.62 8.00 -1.26 -4.86 116.55 111.40 2jps n ASP 27 Ca -0.00 -0.48 -0.13 0.00 0.71 0.00 0.00 54.79 54.89 2jps n ASP 27 Cb 0.62 -3.44 -0.14 0.00 -0.02 0.00 0.00 41.12 38.14 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 -4.16 1.43 0.09 0.53 0.00 -1.26 -3.50 119.36 112.48 2jps n ILE 28 Ca -0.01 -0.74 -0.19 0.00 0.00 0.00 0.00 62.75 61.81 2jps n ILE 28 Cb 0.55 -0.85 -0.15 0.00 0.00 0.00 0.00 39.64 39.19 2jps n ILE 28 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 2jps h LYS 29 N 0.00 0.32 0.00 9.51 3.64 -1.99 -3.22 116.57 124.83 2jps h LYS 29 Ca -0.56 -0.54 -0.12 0.00 -1.27 0.00 0.00 60.65 58.15 2jps h LYS 29 Cb 2.10 0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 34.11 2jps h LYS 29 CO -0.02 1.21 -0.58 1.88 -2.27 0.00 0.00 179.45 179.67 2jps h TYR 30 N 0.09 0.00 0.00 1.91 0.05 -1.97 -3.08 116.97 113.97 2jps h TYR 30 Ca -0.24 0.00 -0.11 0.00 0.05 0.00 0.00 58.73 58.44 2jps h TYR 30 Cb 2.04 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 39.77 2jps h TYR 30 CO 0.08 0.58 -0.51 -0.24 -1.05 0.00 0.00 178.16 177.02 2jps h VAL 31 N 0.00 1.25 -0.31 -2.88 3.04 -1.64 -3.08 116.25 112.63 2jps h VAL 31 Ca -0.01 -1.82 -0.16 0.00 -1.01 0.00 0.00 66.70 63.70 2jps h VAL 31 Cb 1.10 2.01 -0.00 0.00 -2.01 0.00 0.00 31.29 32.39 2jps h VAL 31 CO 0.08 0.50 -0.46 0.00 -1.01 0.00 0.00 177.57 176.68 2jps h ALA 32 N 1.49 0.60 -0.48 3.17 0.00 -1.54 -1.97 119.26 120.53 2jps h ALA 32 Ca -0.01 -0.48 0.01 0.00 0.00 0.00 0.00 54.91 54.44 2jps h ALA 32 Cb 0.97 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.63 2jps h ALA 32 CO 0.07 0.68 0.31 0.93 0.00 0.00 0.00 179.25 181.23 2jps h GLU 33 N 0.65 0.60 -0.71 0.00 5.08 -1.54 0.86 114.58 119.52 2jps h GLU 33 Ca 0.04 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 2jps h GLU 33 Cb 1.04 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 30.12 2jps h GLU 33 CO 0.10 0.40 0.19 -0.92 -1.00 0.00 0.00 179.01 177.78 2jps h TYR 34 N 0.62 1.17 -0.19 4.33 3.20 -1.48 0.97 116.97 125.59 2jps h TYR 34 Ca 0.18 -0.13 0.00 0.00 3.14 0.00 0.00 58.73 61.93 2jps h TYR 34 Cb -0.04 -0.33 -0.01 0.00 1.54 0.00 0.00 36.73 37.89 2jps h TYR 34 CO -0.05 0.94 0.12 0.82 -1.64 0.00 0.00 178.16 178.35 2jps h ILE 35 N 1.07 1.06 -0.69 1.81 2.04 -0.56 0.22 117.51 122.46 2jps h ILE 35 Ca 0.23 -0.14 -0.03 0.00 1.00 0.00 0.00 64.86 65.91 2jps h ILE 35 Cb 0.35 0.83 -0.03 0.00 -0.74 0.00 0.00 36.82 37.22 2jps h ILE 35 CO -0.00 0.06 0.31 0.58 0.00 0.00 0.00 178.15 179.10 2jps h VAL 36 N 0.24 1.24 -0.72 1.67 2.07 -0.56 -0.21 116.25 119.98 2jps h VAL 36 Ca 0.07 -0.71 0.06 0.00 0.82 0.00 0.00 66.70 66.94 2jps h VAL 36 Cb -0.00 0.41 -0.06 0.00 -1.52 0.00 0.00 31.29 30.12 2jps h VAL 36 CO -0.01 0.29 0.41 0.25 0.02 0.00 0.00 177.57 178.53 2jps h LEU 37 N 0.98 0.62 -0.56 2.57 5.85 -0.25 0.43 115.31 124.94 2jps h LEU 37 Ca 0.24 0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.92 2jps h LEU 37 Cb 0.16 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 2jps h LEU 37 CO -0.02 0.40 0.11 -0.07 -0.34 0.00 0.00 178.44 178.51 2jps h LEU 38 N 0.76 0.88 -0.24 2.25 3.38 -0.40 -1.20 115.31 120.74 2jps h LEU 38 Ca 0.32 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 2jps h LEU 38 Cb 0.20 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2jps h LEU 38 CO -0.18 0.91 0.15 0.40 0.09 0.00 0.00 178.44 179.80 2jps h ILE 39 N 0.82 1.09 -0.70 1.22 1.08 0.44 -2.27 117.51 119.20 2jps h ILE 39 Ca 0.17 -0.23 -0.00 0.00 -0.39 0.00 0.00 64.86 64.41 2jps h ILE 39 Cb 0.39 0.80 -0.03 0.00 -3.07 0.00 0.00 36.82 34.91 2jps h ILE 39 CO 0.01 0.09 0.42 0.58 -0.69 0.00 0.00 178.15 178.56 2jps h VAL 40 N 0.30 1.19 -0.83 1.67 2.07 -0.01 -2.11 116.25 118.54 2jps h VAL 40 Ca 0.09 -0.42 0.09 0.00 0.82 0.00 0.00 66.70 67.27 2jps h VAL 40 Cb 0.02 0.21 -0.06 0.00 -1.52 0.00 0.00 31.29 29.94 2jps h VAL 40 CO -0.02 0.20 0.54 0.78 0.02 0.00 0.00 177.57 179.10 2jps h ASN 41 N 0.96 0.73 0.00 0.57 2.35 -0.62 -3.45 115.58 116.13 2jps h ASN 41 Ca 0.25 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 56.02 2jps h ASN 41 Cb -0.04 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.19 2jps h ASN 41 CO -0.05 0.45 0.00 0.61 -1.65 0.00 0.00 177.43 176.79 2jps n GLY 42 N -1.43 -0.51 0.00 2.83 0.00 -0.81 -5.06 105.19 100.21 2jps n GLY 42 Ca 0.13 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.29 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 -1.15 0.69 3.19 -0.02 0.00 -1.13 -4.98 105.19 101.79 2jps n GLY 43 Ca 0.00 -0.30 -0.36 0.00 0.00 0.00 0.00 46.02 45.35 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 -0.93 3.39 0.38 2.61 -4.23 -1.26 -4.98 115.64 110.62 2jps s THR 44 Ca 0.00 -1.56 0.15 0.00 -1.18 0.00 0.00 61.69 59.10 2jps s THR 44 Cb 0.00 -3.08 0.37 0.00 1.34 0.00 0.00 72.50 71.12 2jps s THR 44 CO 0.00 -0.36 1.80 0.58 -0.54 0.00 0.00 174.62 176.10 2jps h VAL 45 N 6.33 0.62 0.30 2.29 2.07 -1.96 0.93 116.25 126.83 2jps h VAL 45 Ca -0.19 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 67.15 2jps h VAL 45 Cb 1.06 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.92 2jps h VAL 45 CO 0.63 0.09 -0.15 -0.08 0.02 0.00 0.00 177.57 178.08 2jps h GLU 46 N 0.49 -0.39 -0.26 1.57 4.57 -1.98 0.60 114.58 119.18 2jps h GLU 46 Ca 0.55 0.03 -0.11 0.00 -1.18 0.00 0.00 59.36 58.64 2jps h GLU 46 Cb 1.25 0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 29.91 2jps h GLU 46 CO -0.28 -0.08 -0.31 1.03 -1.18 0.00 0.00 179.01 178.19 2jps h SER 47 N -0.72 0.56 0.04 1.04 0.87 -1.79 0.72 113.55 114.26 2jps h SER 47 Ca -0.04 -0.22 -0.16 0.00 -1.23 0.00 0.00 61.79 60.15 2jps h SER 47 Cb 0.49 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.29 2jps h SER 47 CO 0.07 0.84 -0.53 0.58 -0.53 0.00 0.00 176.83 177.26 2jps h VAL 48 N 0.47 1.32 0.06 2.23 2.07 0.92 0.40 116.25 123.72 2jps h VAL 48 Ca 0.06 -1.78 -0.27 0.00 0.82 0.00 0.00 66.70 65.53 2jps h VAL 48 Cb 0.77 1.75 0.02 0.00 -1.52 0.00 0.00 31.29 32.32 2jps h VAL 48 CO 0.06 0.55 -1.12 0.58 0.02 0.00 0.00 177.57 177.66 2jps h VAL 49 N 0.42 1.33 -0.28 2.57 2.07 0.39 -2.74 116.25 120.00 2jps h VAL 49 Ca 0.01 -2.45 -0.12 0.00 0.82 0.00 0.00 66.70 64.96 2jps h VAL 49 Cb 1.07 2.56 -0.01 0.00 -1.52 0.00 0.00 31.29 33.39 2jps h VAL 49 CO 0.10 0.74 -0.31 0.44 0.02 0.00 0.00 177.57 178.56 2jps h ASP 50 N 0.28 0.61 -0.51 0.57 3.32 -0.82 -1.63 116.42 118.25 2jps h ASP 50 Ca -0.14 -0.24 -0.12 0.00 0.02 0.00 0.00 57.03 56.55 2jps h ASP 50 Cb 1.78 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 41.15 2jps h ASP 50 CO 0.21 0.88 -0.15 -0.33 -1.72 0.00 0.00 179.24 178.13 2jps h GLU 51 N 0.51 1.01 -0.38 3.56 3.07 -0.94 -1.59 114.58 119.82 2jps h GLU 51 Ca 0.06 -0.40 -0.14 0.00 -0.50 0.00 0.00 59.36 58.38 2jps h GLU 51 Cb 0.79 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.64 2jps h GLU 51 CO 0.06 1.08 -0.32 -0.07 -1.40 0.00 0.00 179.01 178.36 2jps h LEU 52 N 0.89 0.94 -0.95 1.33 3.38 -1.36 -2.99 115.31 116.55 2jps h LEU 52 Ca 0.13 -0.45 -0.03 0.00 0.09 0.00 0.00 57.88 57.62 2jps h LEU 52 Cb 0.73 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.18 2jps h LEU 52 CO 0.06 1.20 0.38 0.00 0.09 0.00 0.00 178.44 180.16 2jps h ALA 53 N 0.77 1.18 -0.70 1.53 0.00 -1.18 0.90 119.26 121.78 2jps h ALA 53 Ca 0.07 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 54.88 2jps h ALA 53 Cb 0.91 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 18.34 2jps h ALA 53 CO 0.08 0.62 0.46 1.03 0.00 0.00 0.00 179.25 181.45 2jps h SER 54 N 1.12 0.65 0.09 0.00 0.87 -1.14 -2.34 113.55 112.80 2jps h SER 54 Ca 0.27 0.00 -0.37 0.00 -1.23 0.00 0.00 61.79 60.46 2jps h SER 54 Cb 0.11 -0.14 -0.03 0.00 -0.44 0.00 0.00 62.40 61.90 2jps h SER 54 CO -0.04 0.43 -2.13 0.18 -0.53 0.00 0.00 176.83 174.75 2jps n LEU 55 N -4.47 2.72 -3.91 2.23 4.77 -0.86 -4.55 117.00 112.93 2jps n LEU 55 Ca 0.10 0.12 -0.38 0.00 -0.03 0.00 0.00 56.01 55.82 2jps n LEU 55 Cb 0.20 -1.06 -0.03 0.00 -2.33 0.00 0.00 43.42 40.21 2jps n LEU 55 CO 0.34 0.87 0.69 0.49 -1.33 0.00 0.00 177.39 178.45 2jps n PHE 56 N -3.44 3.28 1.11 -1.77 3.72 0.31 -4.85 117.46 115.82 2jps n PHE 56 Ca -0.36 -3.40 0.12 0.00 -0.05 0.00 0.00 57.45 53.75 2jps n PHE 56 Cb 1.03 -1.10 0.59 0.00 -0.94 0.00 0.00 39.48 39.06 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 1.52 0.00 -1.96 4.37 2.03 -0.89 -3.35 116.55 118.27 2jps n ASP 57 Ca 0.26 -0.03 -0.06 0.00 0.52 0.00 0.00 54.79 55.48 2jps n ASP 57 Cb 0.36 -0.29 0.29 0.00 -0.72 0.00 0.00 41.12 40.76 2jps n ASP 57 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 2jps n SER 58 N -1.29 4.69 -4.29 1.67 2.88 -1.26 -4.92 113.62 111.09 2jps n SER 58 Ca 0.11 -3.15 -0.29 0.00 -1.33 0.00 0.00 58.87 54.21 2jps n SER 58 Cb 0.19 -0.74 -0.15 0.00 -0.75 0.00 0.00 64.21 62.76 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 -2.84 1.93 0.39 2.46 1.01 -1.21 -5.11 120.40 117.02 2jps s VAL 59 Ca 0.52 -1.17 -0.28 0.00 0.00 0.00 0.00 61.98 61.06 2jps s VAL 59 Cb 0.42 -1.63 -0.10 0.00 0.00 0.00 0.00 36.38 35.06 2jps s VAL 59 CO 0.13 0.43 1.45 -0.44 0.00 0.00 0.00 175.10 176.67 2jps s SER 60 N -0.88 6.31 0.41 3.32 0.01 -1.26 -4.86 113.70 116.75 2jps s SER 60 Ca 0.10 2.98 0.17 0.00 1.31 0.00 0.00 55.95 60.50 2jps s SER 60 Cb -0.09 -2.66 1.06 0.00 0.21 0.00 0.00 66.02 64.53 2jps s SER 60 CO 0.00 -0.89 1.85 0.03 0.41 0.00 0.00 173.24 174.64 2jps h ARG 61 N 2.92 0.42 -0.26 12.44 2.47 -1.98 0.99 114.38 131.38 2jps h ARG 61 Ca -0.51 -0.03 -0.07 0.00 -1.26 0.00 0.00 59.98 58.12 2jps h ARG 61 Cb 1.24 -0.10 -0.01 0.00 -1.65 0.00 0.00 29.97 29.45 2jps h ARG 61 CO 0.64 0.28 -0.13 0.22 0.56 0.00 0.00 179.97 181.54 2jps h ASP 62 N 0.43 0.41 -0.41 7.04 3.58 -1.99 -1.12 116.42 124.38 2jps h ASP 62 Ca 0.48 -0.10 -0.14 0.00 0.42 0.00 0.00 57.03 57.69 2jps h ASP 62 Cb 1.16 -0.11 -0.01 0.00 1.72 0.00 0.00 39.33 42.09 2jps h ASP 62 CO -0.19 0.58 -0.30 0.74 -2.88 0.00 0.00 179.24 177.18 2jps h THR 63 N 0.40 1.27 -0.30 2.25 2.02 -1.15 0.42 112.91 117.82 2jps h THR 63 Ca 0.08 -1.47 -0.12 0.00 0.77 0.00 0.00 66.41 65.67 2jps h THR 63 Cb 0.47 1.31 -0.01 0.00 -1.74 0.00 0.00 68.15 68.19 2jps h THR 63 CO 0.03 0.49 -0.27 -0.07 0.37 0.00 0.00 175.52 176.07 2jps h LEU 64 N 0.75 0.75 -0.91 2.58 4.07 -1.28 -2.81 115.31 118.46 2jps h LEU 64 Ca 0.08 -0.46 -0.08 0.00 0.08 0.00 0.00 57.88 57.49 2jps h LEU 64 Cb 0.88 -0.21 -0.02 0.00 1.08 0.00 0.00 40.66 42.40 2jps h LEU 64 CO 0.08 1.05 -0.10 0.00 -1.08 0.00 0.00 178.44 178.39 2jps h ALA 65 N 0.72 1.08 -0.98 1.53 0.00 -1.16 -1.73 119.26 118.71 2jps h ALA 65 Ca 0.05 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2jps h ALA 65 Cb 0.83 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.41 2jps h ALA 65 CO 0.07 0.57 0.62 -0.91 0.00 0.00 0.00 179.25 179.60 2jps h ASN 66 N 0.63 1.15 0.20 0.00 -0.26 -0.79 0.74 115.58 117.26 2jps h ASN 66 Ca 0.11 -0.05 -0.21 0.00 -0.56 0.00 0.00 56.30 55.59 2jps h ASN 66 Cb 0.55 -0.29 0.00 0.00 -1.06 0.00 0.00 38.32 37.52 2jps h ASN 66 CO 0.03 0.86 -0.84 0.58 -1.06 0.00 0.00 177.43 177.00 2jps h VAL 67 N 1.34 1.36 -0.11 2.81 2.07 -1.23 -2.70 116.25 119.79 2jps h VAL 67 Ca 0.36 -2.24 -0.16 0.00 0.82 0.00 0.00 66.70 65.49 2jps h VAL 67 Cb -0.11 2.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.87 2jps h VAL 67 CO -0.07 0.68 -0.60 0.58 0.02 0.00 0.00 177.57 178.17 2jps h VAL 68 N 0.31 1.36 -0.63 2.57 2.07 -0.82 -2.74 116.25 118.37 2jps h VAL 68 Ca -0.06 -1.93 -0.04 0.00 0.82 0.00 0.00 66.70 65.49 2jps h VAL 68 Cb 1.45 1.94 -0.03 0.00 -1.52 0.00 0.00 31.29 33.13 2jps h VAL 68 CO 0.15 0.58 0.23 -0.61 0.02 0.00 0.00 177.57 177.94 2jps h GLN 69 N 0.27 0.96 -0.00 1.57 4.15 0.53 -1.57 115.11 121.02 2jps h GLN 69 Ca -0.00 -0.19 -0.08 0.00 0.77 0.00 0.00 58.65 59.14 2jps h GLN 69 Cb 1.12 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 28.65 2jps h GLN 69 CO 0.10 0.83 -0.40 0.00 -1.93 0.00 0.00 178.83 177.43 2jps h THR 70 N 0.89 1.29 -0.24 2.39 1.03 -1.42 -1.79 112.91 115.05 2jps h THR 70 Ca 0.21 -1.36 -0.18 0.00 -0.01 0.00 0.00 66.41 65.07 2jps h THR 70 Cb 0.24 1.73 -0.00 0.00 -1.07 0.00 0.00 68.15 69.05 2jps h THR 70 CO -0.01 0.39 -0.55 0.00 -0.01 0.00 0.00 175.52 175.33 2jps h ALA 71 N 1.60 0.56 0.05 0.00 0.00 -1.13 0.22 119.26 120.57 2jps h ALA 71 Ca -0.00 -0.52 -0.00 0.00 0.00 0.00 0.00 54.91 54.39 2jps h ALA 71 Cb 0.70 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.42 2jps h ALA 71 CO 0.05 0.69 -0.03 0.74 0.00 0.00 0.00 179.25 180.70 2jps h PHE 72 N 0.56 -0.07 -0.90 0.00 -1.00 -1.02 -1.09 116.94 113.43 2jps h PHE 72 Ca 0.01 -0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.77 2jps h PHE 72 Cb 1.14 0.02 -0.04 0.00 3.61 0.00 0.00 35.95 40.68 2jps h PHE 72 CO 0.06 0.19 0.48 0.35 -1.61 0.00 0.00 178.31 177.79 2jps h PHE 73 N -0.33 1.24 -0.87 -0.55 3.57 -1.32 -2.17 116.94 116.51 2jps h PHE 73 Ca -0.01 -0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.49 2jps h PHE 73 Cb 0.29 -0.39 -0.05 0.00 2.79 0.00 0.00 35.95 38.59 2jps h PHE 73 CO 0.01 0.86 0.57 0.00 -2.23 0.00 0.00 178.31 177.52 2jps h ALA 74 N 1.27 1.43 -0.97 2.41 0.00 -0.31 -1.85 119.26 121.25 2jps h ALA 74 Ca 0.31 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.24 2jps h ALA 74 Cb 0.04 -0.32 -0.06 0.00 0.00 0.00 0.00 17.79 17.44 2jps h ALA 74 CO -0.05 0.49 0.62 -0.07 0.00 0.00 0.00 179.25 180.25 2jps h LEU 75 N 1.11 1.00 -0.36 0.00 -0.00 -0.52 0.31 115.31 116.85 2jps h LEU 75 Ca 0.34 0.01 -0.14 0.00 -0.00 0.00 0.00 57.88 58.08 2jps h LEU 75 Cb -0.02 -0.21 -0.01 0.00 -0.00 0.00 0.00 40.66 40.42 2jps h LEU 75 CO -0.09 0.64 -0.34 -0.33 -0.00 0.00 0.00 178.44 178.33 2jps h GLU 76 N 1.14 0.87 -0.55 1.13 5.08 -1.31 -2.44 114.58 118.50 2jps h GLU 76 Ca 0.42 -0.45 -0.10 0.00 -1.00 0.00 0.00 59.36 58.23 2jps h GLU 76 Cb 0.15 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 2jps h GLU 76 CO -0.17 1.09 -0.05 0.00 -1.00 0.00 0.00 179.01 178.89 2jps h ALA 77 N 0.76 0.87 -0.80 3.43 0.00 -0.71 -2.82 119.26 119.99 2jps h ALA 77 Ca 0.06 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 2jps h ALA 77 Cb 0.92 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.47 2jps h ALA 77 CO 0.08 0.65 0.39 -0.07 0.00 0.00 0.00 179.25 180.31 2jps h LEU 78 N 0.90 1.03 -1.70 0.00 3.38 -0.33 -1.78 115.31 116.81 2jps h LEU 78 Ca 0.15 -0.11 0.06 0.00 0.09 0.00 0.00 57.88 58.07 2jps h LEU 78 Cb 0.59 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 2jps h LEU 78 CO 0.04 0.86 0.31 1.56 0.09 0.00 0.00 178.44 181.29 2jps h GLN 79 N 1.13 0.36 0.22 1.13 4.20 -1.17 -2.62 115.11 118.36 2jps h GLN 79 Ca 0.28 -0.02 -0.34 0.00 0.06 0.00 0.00 58.65 58.62 2jps h GLN 79 Cb 0.10 -0.08 0.03 0.00 0.30 0.00 0.00 27.48 27.82 2jps h GLN 79 CO -0.04 0.24 -1.60 1.96 -0.67 0.00 0.00 178.83 178.72 2jps h GLN 80 N 0.37 0.48 0.00 1.46 4.20 -1.36 -3.49 115.11 116.76 2jps h GLN 80 Ca 0.20 -0.81 0.00 0.00 0.06 0.00 0.00 58.65 58.10 2jps h GLN 80 Cb 0.32 0.30 0.00 0.00 0.30 0.00 0.00 27.48 28.40 2jps h GLN 80 CO -0.05 1.39 0.00 0.41 -0.67 0.00 0.00 178.83 179.91 2jps n GLY 81 N 1.78 0.62 3.78 3.46 0.00 -0.73 -5.15 105.19 108.96 2jps n GLY 81 Ca -0.21 -0.35 -0.30 0.00 0.00 0.00 0.00 46.02 45.16 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 2.19 -0.08 1.61 0.41 -1.23 -5.00 118.70 116.61 2jps s GLU 82 Ca 0.00 -2.21 0.03 0.00 -0.41 0.00 0.00 54.97 52.38 2jps s GLU 82 Cb 0.00 -1.74 -0.02 0.00 -1.78 0.00 0.00 34.13 30.59 2jps s GLU 82 CO 0.00 -0.36 -0.15 -1.12 -0.49 0.00 0.00 175.26 173.13 2jps s SER 83 N -3.97 3.92 -0.20 -0.19 0.01 -1.26 -4.97 113.70 107.04 2jps s SER 83 Ca 0.20 -0.27 0.13 0.00 1.31 0.00 0.00 55.95 57.32 2jps s SER 83 Cb 0.02 -1.09 -0.23 0.00 0.21 0.00 0.00 66.02 64.93 2jps s SER 83 CO 0.11 0.28 0.06 0.00 0.41 0.00 0.00 173.24 174.10 2jps n ALA 84 N 2.77 1.47 -0.27 1.44 0.00 -1.26 -4.42 120.51 120.24 2jps n ALA 84 Ca -0.17 -1.22 0.03 0.00 0.00 0.00 0.00 53.44 52.07 2jps n ALA 84 Cb 0.52 -0.23 0.25 0.00 0.00 0.00 0.00 19.45 19.99 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 0.98 -0.95 0.00 4.81 -1.95 -2.03 114.58 115.45 2jps h GLU 85 Ca -0.53 -0.06 0.05 0.00 -0.13 0.00 0.00 59.36 58.68 2jps h GLU 85 Cb 2.15 -0.22 -0.06 0.00 0.63 0.00 0.00 28.75 31.25 2jps h GLU 85 CO 0.01 0.65 0.62 -0.91 -0.73 0.00 0.00 179.01 178.65 2jps h ASN 86 N 1.01 1.01 -0.39 1.04 2.35 -2.02 -1.43 115.58 117.15 2jps h ASN 86 Ca 0.35 -0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 56.06 2jps h ASN 86 Cb 0.11 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.24 2jps h ASN 86 CO -0.12 0.67 0.13 0.40 -1.65 0.00 0.00 177.43 176.87 2jps h ILE 87 N 1.16 1.19 -0.90 2.81 2.04 -1.59 -2.45 117.51 119.76 2jps h ILE 87 Ca 0.39 -0.65 0.03 0.00 1.00 0.00 0.00 64.86 65.63 2jps h ILE 87 Cb 0.07 0.70 -0.05 0.00 -0.74 0.00 0.00 36.82 36.80 2jps h ILE 87 CO -0.13 0.24 0.59 0.58 0.00 0.00 0.00 178.15 179.44 2jps h VAL 88 N 0.65 1.18 -0.90 1.67 2.07 -1.19 -1.88 116.25 117.85 2jps h VAL 88 Ca 0.15 -0.40 0.07 0.00 0.82 0.00 0.00 66.70 67.34 2jps h VAL 88 Cb 0.21 -0.09 -0.07 0.00 -1.52 0.00 0.00 31.29 29.83 2jps h VAL 88 CO -0.01 0.21 0.56 -1.28 0.02 0.00 0.00 177.57 177.07 2jps h SER 89 N 1.16 0.87 0.03 0.57 0.87 -1.36 -0.01 113.55 115.68 2jps h SER 89 Ca 0.35 0.02 -0.09 0.00 -1.23 0.00 0.00 61.79 60.84 2jps h SER 89 Cb -0.04 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 61.75 2jps h SER 89 CO -0.09 0.54 -0.27 0.50 -0.53 0.00 0.00 176.83 176.98 2jps h LYS 90 N 1.00 0.38 -0.24 2.24 3.64 -1.38 -1.86 116.57 120.35 2jps h LYS 90 Ca 0.40 -0.14 -0.19 0.00 -1.27 0.00 0.00 60.65 59.45 2jps h LYS 90 Cb 0.22 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.01 2jps h LYS 90 CO -0.19 0.63 -0.60 0.82 -2.27 0.00 0.00 179.45 177.84 2jps h ILE 91 N 0.34 1.29 -0.39 2.00 1.08 -0.73 0.85 117.51 121.94 2jps h ILE 91 Ca 0.05 -1.80 -0.13 0.00 -0.39 0.00 0.00 64.86 62.59 2jps h ILE 91 Cb 0.66 1.73 -0.01 0.00 -3.07 0.00 0.00 36.82 36.13 2jps h ILE 91 CO 0.05 0.58 -0.26 -0.09 -0.69 0.00 0.00 178.15 177.73 2jps h ARG 92 N 0.59 0.81 -0.01 2.37 2.43 -0.90 0.57 114.38 120.25 2jps h ARG 92 Ca -0.00 -0.35 -0.26 0.00 -0.81 0.00 0.00 59.98 58.56 2jps h ARG 92 Cb 1.20 -0.02 0.02 0.00 -0.42 0.00 0.00 29.97 30.74 2jps h ARG 92 CO 0.13 0.98 -1.02 0.52 -1.51 0.00 0.00 179.97 179.07 2jps h MET 93 N 0.70 0.67 -0.07 0.20 2.86 -1.31 -1.81 114.93 116.17 2jps h MET 93 Ca 0.09 -0.71 -0.18 0.00 -2.06 0.00 0.00 59.70 56.84 2jps h MET 93 Cb 0.80 0.20 -0.01 0.00 0.06 0.00 0.00 31.60 32.65 2jps h MET 93 CO 0.07 1.29 -0.73 1.98 1.06 0.00 0.00 176.91 180.58 2jps h MET 94 N 0.38 0.37 -0.08 1.72 1.85 -0.75 -2.53 114.93 115.87 2jps h MET 94 Ca -0.12 -0.30 -0.16 0.00 -0.61 0.00 0.00 59.70 58.51 2jps h MET 94 Cb 1.67 0.06 -0.01 0.00 0.43 0.00 0.00 31.60 33.75 2jps h MET 94 CO 0.20 0.94 -0.65 -0.91 -0.40 0.00 0.00 176.91 176.10 2jps h ASN 95 N 0.25 0.38 -0.29 1.39 4.21 0.11 -2.55 115.58 119.08 2jps h ASN 95 Ca -0.03 -0.23 -0.16 0.00 1.21 0.00 0.00 56.30 57.09 2jps h ASN 95 Cb 1.30 -0.11 -0.01 0.00 -1.12 0.00 0.00 38.32 38.38 2jps h ASN 95 CO 0.12 0.92 -0.41 0.00 -1.29 0.00 0.00 177.43 176.77 2jps h ALA 96 N 1.08 0.62 -0.65 -0.83 0.00 -1.29 -2.99 119.26 115.20 2jps h ALA 96 Ca -0.01 -0.46 -0.08 0.00 0.00 0.00 0.00 54.91 54.35 2jps h ALA 96 Cb 1.18 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.83 2jps h ALA 96 CO 0.11 0.67 0.08 0.37 0.00 0.00 0.00 179.25 180.48 2jps h GLN 97 N 0.69 1.10 -0.52 0.00 5.75 -1.41 0.68 115.11 121.39 2jps h GLN 97 Ca 0.05 -0.31 0.03 0.00 -0.15 0.00 0.00 58.65 58.28 2jps h GLN 97 Cb 0.99 -0.12 -0.03 0.00 1.07 0.00 0.00 27.48 29.39 2jps h GLN 97 CO 0.10 1.02 0.35 1.03 -2.65 0.00 0.00 178.83 178.67 2jps h SER 98 N 1.01 0.51 0.08 -0.69 0.87 -1.37 -3.09 113.55 110.87 2jps h SER 98 Ca 0.19 -0.01 -0.37 0.00 -1.23 0.00 0.00 61.79 60.37 2jps h SER 98 Cb 0.47 -0.12 -0.04 0.00 -0.44 0.00 0.00 62.40 62.28 2jps h SER 98 CO 0.02 0.35 -2.18 0.18 -0.53 0.00 0.00 176.83 174.67 2jps n LEU 99 N -4.47 2.76 -1.33 2.23 4.32 -1.02 -5.09 117.00 114.41 2jps n LEU 99 Ca 0.06 0.08 0.00 0.00 -0.02 0.00 0.00 56.01 56.13 2jps n LEU 99 Cb 0.15 -1.04 0.00 0.00 -1.62 0.00 0.00 43.42 40.91 2jps n LEU 99 CO 0.35 0.88 0.00 0.61 -1.22 0.00 0.00 177.39 178.01 2jps n GLY 100 N 2.09 -2.88 3.43 -0.72 0.00 0.24 -5.05 105.19 102.28 2jps n GLY 100 Ca -0.37 -0.46 -0.33 0.00 0.00 0.00 0.00 46.02 44.86 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 -1.34 3.22 -1.38 1.61 0.74 -1.26 -4.66 119.66 116.60 2jps s GLN 101 Ca 0.00 -0.65 -0.04 0.00 0.05 0.00 0.00 55.36 54.72 2jps s GLN 101 Cb 0.00 -2.63 0.02 0.00 1.10 0.00 0.00 33.01 31.51 2jps s GLN 101 CO 0.00 0.33 0.74 0.43 -0.55 0.00 0.00 175.29 176.24 2jps n SER 102 N 3.20 -1.99 0.04 6.67 7.64 -1.26 -4.90 113.62 123.01 2jps n SER 102 Ca -0.18 -0.83 -0.01 0.00 1.01 0.00 0.00 58.87 58.86 2jps n SER 102 Cb 0.53 -3.88 -0.00 0.00 -1.01 0.00 0.00 64.21 59.84 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 -2.99 1.13 -3.84 6.43 9.92 -1.26 -4.92 116.55 121.02 2jps n ASP 103 Ca -0.21 0.15 -0.31 0.00 -0.53 0.00 0.00 54.79 53.89 2jps n ASP 103 Cb 0.64 -0.35 -0.09 0.00 -0.64 0.00 0.00 41.12 40.68 2jps n ASP 103 CO 0.00 0.00 0.00 -0.38 0.13 0.00 0.00 177.20 176.95 2jps n ILE 104 N -3.55 2.47 -1.11 0.53 5.41 -1.26 -5.25 119.36 116.61 2jps n ILE 104 Ca -0.01 -5.11 0.00 0.00 1.00 0.00 0.00 62.75 58.63 2jps n ILE 104 Cb 0.06 -2.21 0.00 0.00 -0.71 0.00 0.00 39.64 36.78 2jps n ILE 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55