#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 2.72 -0.29 6.12 1.04 -1.26 -5.04 113.70 116.99 2jps s SER 2 Ca 0.00 -0.43 0.08 0.00 0.48 0.00 0.00 55.95 56.08 2jps s SER 2 Cb 0.00 -0.47 0.46 0.00 0.10 0.00 0.00 66.02 66.11 2jps s SER 2 CO 0.00 0.26 1.18 0.00 0.98 0.00 0.00 173.24 175.66 2jps n GLN 3 N 2.70 3.48 -0.28 4.02 3.00 -1.26 -4.82 117.38 124.21 2jps n GLN 3 Ca -0.16 -4.13 0.03 0.00 -0.01 0.00 0.00 57.00 52.73 2jps n GLN 3 Cb 0.52 -2.23 0.24 0.00 0.00 0.00 0.00 30.24 28.77 2jps n GLN 3 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.06 177.99 2jps h GLU 4 N 2.22 1.01 -0.91 -1.09 5.08 -1.98 -1.04 114.58 117.86 2jps h GLU 4 Ca 0.33 -0.06 0.15 0.00 -1.00 0.00 0.00 59.36 58.79 2jps h GLU 4 Cb 1.51 -0.23 -0.08 0.00 0.50 0.00 0.00 28.75 30.46 2jps h GLU 4 CO 0.72 0.67 0.59 -0.56 -1.00 0.00 0.00 179.01 179.42 2jps h GLN 5 N 1.04 0.67 -0.06 2.33 3.07 -1.99 0.47 115.11 120.63 2jps h GLN 5 Ca 0.36 -0.04 -0.21 0.00 0.09 0.00 0.00 58.65 58.85 2jps h GLN 5 Cb 0.11 -0.15 0.00 0.00 0.08 0.00 0.00 27.48 27.52 2jps h GLN 5 CO -0.12 0.44 -0.83 1.88 0.09 0.00 0.00 178.83 180.29 2jps h TYR 6 N 0.69 0.65 -0.56 0.06 -1.99 -1.61 -2.02 116.97 112.19 2jps h TYR 6 Ca 0.47 -0.32 -0.09 0.00 2.00 0.00 0.00 58.73 60.79 2jps h TYR 6 Cb 0.78 -0.09 -0.02 0.00 2.00 0.00 0.00 36.73 39.40 2jps h TYR 6 CO -0.00 1.11 -0.02 1.15 -0.00 0.00 0.00 178.16 180.40 2jps h THR 7 N 0.30 1.27 -0.29 -2.88 2.02 0.09 0.88 112.91 114.30 2jps h THR 7 Ca -0.06 -1.15 -0.16 0.00 0.77 0.00 0.00 66.41 65.82 2jps h THR 7 Cb 1.43 0.88 -0.00 0.00 -1.74 0.00 0.00 68.15 68.72 2jps h THR 7 CO 0.15 0.41 -0.43 -0.33 0.37 0.00 0.00 175.52 175.69 2jps h GLU 8 N 0.89 0.81 -0.14 6.66 5.08 -0.25 -0.94 114.58 126.68 2jps h GLU 8 Ca 0.16 -0.48 -0.20 0.00 -1.00 0.00 0.00 59.36 57.84 2jps h GLU 8 Cb 0.57 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.86 2jps h GLU 8 CO 0.03 1.11 -0.72 -0.91 -1.00 0.00 0.00 179.01 177.52 2jps h ASN 9 N 0.57 0.78 -0.44 1.42 4.21 -1.25 -3.10 115.58 117.76 2jps h ASN 9 Ca 0.03 -0.49 -0.06 0.00 1.21 0.00 0.00 56.30 56.99 2jps h ASN 9 Cb 1.03 -0.23 -0.02 0.00 -1.12 0.00 0.00 38.32 37.98 2jps h ASN 9 CO 0.10 1.27 0.08 0.25 -1.29 0.00 0.00 177.43 177.84 2jps h LEU 10 N 0.46 0.75 -1.53 1.61 5.85 0.85 -2.40 115.31 120.90 2jps h LEU 10 Ca -0.03 -0.15 0.08 0.00 0.84 0.00 0.00 57.88 58.62 2jps h LEU 10 Cb 1.33 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 42.12 2jps h LEU 10 CO 0.14 0.77 0.42 0.11 -0.34 0.00 0.00 178.44 179.54 2jps h LYS 11 N 0.76 0.54 0.07 1.25 1.57 -1.09 0.14 116.57 119.80 2jps h LYS 11 Ca 0.16 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.91 2jps h LYS 11 Cb 0.35 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.54 2jps h LYS 11 CO 0.01 0.35 -0.03 0.28 -0.57 0.00 0.00 179.45 179.49 2jps h VAL 12 N 0.55 1.16 -0.77 0.50 2.07 -1.45 0.03 116.25 118.34 2jps h VAL 12 Ca 0.28 -0.80 -0.03 0.00 0.82 0.00 0.00 66.70 66.98 2jps h VAL 12 Cb 0.40 1.68 -0.04 0.00 -1.52 0.00 0.00 31.29 31.81 2jps h VAL 12 CO -0.09 0.20 0.37 0.40 0.02 0.00 0.00 177.57 178.47 2jps h ILE 13 N -0.45 1.24 -0.62 4.57 2.04 -1.35 -2.17 117.51 120.78 2jps h ILE 13 Ca -0.01 -0.69 -0.05 0.00 1.00 0.00 0.00 64.86 65.11 2jps h ILE 13 Cb 0.39 0.25 -0.03 0.00 -0.74 0.00 0.00 36.82 36.70 2jps h ILE 13 CO 0.01 0.29 0.18 0.58 0.00 0.00 0.00 178.15 179.21 2jps h VAL 14 N 1.10 1.25 -0.56 1.67 2.07 -0.65 -2.47 116.25 118.66 2jps h VAL 14 Ca 0.27 -0.87 0.01 0.00 0.82 0.00 0.00 66.70 66.92 2jps h VAL 14 Cb 0.11 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 30.49 2jps h VAL 14 CO -0.03 0.33 0.37 0.00 0.02 0.00 0.00 177.57 178.26 2jps h ALA 15 N 1.06 1.60 -0.87 1.67 0.00 -0.41 -1.87 119.26 120.43 2jps h ALA 15 Ca 0.20 -0.04 0.13 0.00 0.00 0.00 0.00 54.91 55.20 2jps h ALA 15 Cb 0.32 -0.23 -0.07 0.00 0.00 0.00 0.00 17.79 17.81 2jps h ALA 15 CO -0.00 0.37 0.56 1.49 0.00 0.00 0.00 179.25 181.67 2jps h GLU 16 N 0.75 0.71 0.05 0.00 4.81 -0.92 0.84 114.58 120.82 2jps h GLU 16 Ca 0.20 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.29 2jps h GLU 16 Cb -0.09 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.14 2jps h GLU 16 CO -0.04 0.47 -0.47 0.87 -0.73 0.00 0.00 179.01 179.10 2jps h LYS 17 N 0.73 0.10 -0.14 1.92 1.79 -1.40 -2.10 116.57 117.47 2jps h LYS 17 Ca 0.43 -0.17 -0.00 0.00 -2.18 0.00 0.00 60.65 58.72 2jps h LYS 17 Cb 0.62 0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 31.33 2jps h LYS 17 CO -0.19 1.08 0.07 -0.07 -1.08 0.00 0.00 179.45 179.27 2jps h LEU 18 N -0.77 0.18 -1.61 2.94 3.38 -1.06 0.63 115.31 119.00 2jps h LEU 18 Ca -0.10 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.72 2jps h LEU 18 Cb 1.27 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.97 2jps h LEU 18 CO 0.02 0.23 -0.21 0.00 0.09 0.00 0.00 178.44 178.57 2jps h ALA 19 N 0.96 1.37 0.06 1.53 0.00 0.56 -2.81 119.26 120.94 2jps h ALA 19 Ca 0.05 -0.19 -0.25 0.00 0.00 0.00 0.00 54.91 54.52 2jps h ALA 19 Cb 0.10 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.86 2jps h ALA 19 CO -0.01 0.26 -1.09 0.78 0.00 0.00 0.00 179.25 179.20 2jps h GLY 20 N 0.96 0.41 -6.90 0.00 0.00 -0.70 -3.44 103.07 93.41 2jps h GLY 20 Ca -0.00 -0.85 -0.63 0.00 0.00 0.00 0.00 47.33 45.85 2jps h GLY 20 CO 0.03 0.75 1.44 1.39 0.00 0.00 0.00 176.54 180.15 2jps n ILE 21 N -3.67 0.29 0.42 2.60 5.41 0.15 -4.81 119.36 119.76 2jps n ILE 21 Ca -0.08 -0.35 0.11 0.00 1.00 0.00 0.00 62.75 63.43 2jps n ILE 21 Cb 0.92 -2.13 0.46 0.00 -0.71 0.00 0.00 39.64 38.18 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 8.40 0.17 -1.23 0.38 -0.04 -1.26 -3.03 135.00 138.39 2jps n PRO 22 Ca 0.34 0.39 -0.23 0.00 -0.04 0.00 0.00 63.50 63.97 2jps n PRO 22 Cb 0.35 -1.81 0.15 0.00 -0.04 0.00 0.00 33.50 32.14 2jps n PRO 22 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2jps n ASN 23 N -2.13 4.60 -4.40 3.54 5.15 -1.26 -4.91 115.26 115.86 2jps n ASN 23 Ca 0.02 -3.71 -0.44 0.00 -0.60 0.00 0.00 54.58 49.85 2jps n ASN 23 Cb 0.23 -0.79 -0.07 0.00 -0.53 0.00 0.00 39.78 38.61 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 -3.46 3.20 -0.56 1.20 5.36 -1.17 -4.93 117.98 117.62 2jps s PHE 24 Ca 0.56 -0.87 0.01 0.00 -0.96 0.00 0.00 56.93 55.67 2jps s PHE 24 Cb 0.47 -3.28 0.45 0.00 -0.34 0.00 0.00 43.02 40.32 2jps s PHE 24 CO 0.05 -0.86 1.80 -1.71 -1.46 0.00 0.00 175.22 173.04 2jps n ASN 25 N 5.41 6.89 -1.46 6.13 5.15 -1.26 -4.98 115.26 131.14 2jps n ASN 25 Ca -0.11 -3.78 -0.04 0.00 -0.60 0.00 0.00 54.58 50.05 2jps n ASN 25 Cb 0.44 -0.80 -0.01 0.00 -0.53 0.00 0.00 39.78 38.87 2jps n ASN 25 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2jps n GLU 26 N -0.87 0.09 -1.80 1.20 1.02 -1.26 -5.11 120.64 113.92 2jps n GLU 26 Ca 0.58 -0.68 -0.42 0.00 -0.02 0.00 0.00 57.16 56.61 2jps n GLU 26 Cb 0.76 0.57 -0.03 0.00 -0.02 0.00 0.00 31.44 32.72 2jps n GLU 26 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2jps s ASP 27 N -1.48 6.46 -0.24 1.62 1.11 -1.26 -4.90 116.67 117.97 2jps s ASP 27 Ca 0.08 2.74 0.04 0.00 0.18 0.00 0.00 52.55 55.60 2jps s ASP 27 Cb 0.00 -2.59 -0.19 0.00 1.07 0.00 0.00 42.92 41.22 2jps s ASP 27 CO 0.06 -0.93 -0.15 0.00 1.18 0.00 0.00 175.17 175.32 2jps n ILE 28 N 4.21 1.49 0.07 0.77 0.00 -1.26 -3.47 119.36 121.16 2jps n ILE 28 Ca 0.16 -0.62 -0.18 0.00 0.00 0.00 0.00 62.75 62.11 2jps n ILE 28 Cb 0.37 -1.28 -0.10 0.00 0.00 0.00 0.00 39.64 38.64 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 0.53 -0.03 9.51 1.57 -1.98 -2.95 116.57 123.22 2jps h LYS 29 Ca -0.57 -0.64 -0.14 0.00 -1.87 0.00 0.00 60.65 57.43 2jps h LYS 29 Cb 1.96 0.20 -0.02 0.00 0.08 0.00 0.00 32.23 34.46 2jps h LYS 29 CO -0.06 1.26 -0.62 -0.92 -0.57 0.00 0.00 179.45 178.54 2jps h TYR 30 N 0.27 0.13 0.00 -1.35 3.20 -1.98 -3.07 116.97 114.16 2jps h TYR 30 Ca -0.13 -0.05 -0.12 0.00 3.14 0.00 0.00 58.73 61.57 2jps h TYR 30 Cb 1.76 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 39.99 2jps h TYR 30 CO 0.09 0.69 -0.57 -0.24 -1.64 0.00 0.00 178.16 176.48 2jps h VAL 31 N 0.07 1.30 -0.19 1.81 3.04 -1.59 -3.11 116.25 117.58 2jps h VAL 31 Ca -0.01 -2.03 -0.17 0.00 -1.01 0.00 0.00 66.70 63.48 2jps h VAL 31 Cb 1.10 2.12 -0.00 0.00 -2.01 0.00 0.00 31.29 32.51 2jps h VAL 31 CO 0.09 0.56 -0.58 0.00 -1.01 0.00 0.00 177.57 176.63 2jps h ALA 32 N 1.43 0.62 -0.62 3.17 0.00 -1.43 -2.20 119.26 120.22 2jps h ALA 32 Ca -0.01 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2jps h ALA 32 Cb 1.08 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.76 2jps h ALA 32 CO 0.07 0.69 0.40 0.93 0.00 0.00 0.00 179.25 181.35 2jps h GLU 33 N 0.47 0.83 -0.60 0.00 5.08 -1.48 0.28 114.58 119.16 2jps h GLU 33 Ca 0.00 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.22 2jps h GLU 33 Cb 1.14 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 30.19 2jps h GLU 33 CO 0.11 0.56 0.03 -0.92 -1.00 0.00 0.00 179.01 177.80 2jps h TYR 34 N 0.85 1.11 -0.17 4.33 3.20 -1.49 0.15 116.97 124.94 2jps h TYR 34 Ca 0.23 -0.17 0.01 0.00 3.14 0.00 0.00 58.73 61.93 2jps h TYR 34 Cb -0.07 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 37.89 2jps h TYR 34 CO -0.03 0.97 0.10 0.82 -1.64 0.00 0.00 178.16 178.38 2jps h ILE 35 N 0.95 1.02 -0.70 1.81 2.04 -0.71 0.11 117.51 122.03 2jps h ILE 35 Ca 0.18 -0.07 -0.05 0.00 1.00 0.00 0.00 64.86 65.91 2jps h ILE 35 Cb 0.51 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 37.35 2jps h ILE 35 CO 0.02 0.04 0.22 0.58 0.00 0.00 0.00 178.15 179.01 2jps h VAL 36 N 0.21 1.26 -0.76 1.67 2.07 -0.72 -0.87 116.25 119.10 2jps h VAL 36 Ca 0.07 -0.88 0.05 0.00 0.82 0.00 0.00 66.70 66.76 2jps h VAL 36 Cb -0.01 0.50 -0.06 0.00 -1.52 0.00 0.00 31.29 30.21 2jps h VAL 36 CO -0.03 0.34 0.46 0.25 0.02 0.00 0.00 177.57 178.61 2jps h LEU 37 N 1.02 0.71 -0.54 2.57 5.85 -0.02 0.44 115.31 125.34 2jps h LEU 37 Ca 0.23 0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.91 2jps h LEU 37 Cb 0.30 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.17 2jps h LEU 37 CO -0.01 0.47 0.13 -0.07 -0.34 0.00 0.00 178.44 178.62 2jps h LEU 38 N 0.85 0.83 -0.21 2.25 3.38 -0.32 0.71 115.31 122.80 2jps h LEU 38 Ca 0.33 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2jps h LEU 38 Cb 0.14 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 2jps h LEU 38 CO -0.16 0.85 0.13 0.40 0.09 0.00 0.00 178.44 179.75 2jps h ILE 39 N 0.77 1.07 -0.52 1.22 1.08 0.15 -2.07 117.51 119.22 2jps h ILE 39 Ca 0.17 -0.17 -0.03 0.00 -0.39 0.00 0.00 64.86 64.44 2jps h ILE 39 Cb 0.34 0.81 -0.03 0.00 -3.07 0.00 0.00 36.82 34.88 2jps h ILE 39 CO 0.00 0.07 0.20 0.58 -0.69 0.00 0.00 178.15 178.31 2jps h VAL 40 N 0.26 1.20 -0.79 1.67 2.07 0.06 -2.40 116.25 118.32 2jps h VAL 40 Ca 0.07 -0.62 0.03 0.00 0.82 0.00 0.00 66.70 67.00 2jps h VAL 40 Cb 0.00 0.59 -0.04 0.00 -1.52 0.00 0.00 31.29 30.31 2jps h VAL 40 CO -0.01 0.24 0.52 0.78 0.02 0.00 0.00 177.57 179.12 2jps h ASN 41 N 0.75 0.84 0.00 0.57 2.35 -0.17 -3.45 115.58 116.47 2jps h ASN 41 Ca 0.18 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 2jps h ASN 41 Cb 0.17 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.34 2jps h ASN 41 CO -0.02 0.58 0.00 0.61 -1.65 0.00 0.00 177.43 176.96 2jps n GLY 42 N -1.42 -1.72 0.00 2.83 0.00 -0.91 -5.08 105.19 98.88 2jps n GLY 42 Ca 0.10 0.46 0.00 0.00 0.00 0.00 0.00 46.02 46.58 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 -1.35 0.67 2.96 -0.02 0.00 -1.16 -4.97 105.19 101.33 2jps n GLY 43 Ca 0.00 -0.53 -0.30 0.00 0.00 0.00 0.00 46.02 45.19 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 -0.80 1.48 0.39 2.61 -4.23 -1.26 -5.01 115.64 108.83 2jps s THR 44 Ca 0.00 -0.93 0.15 0.00 -1.18 0.00 0.00 61.69 59.74 2jps s THR 44 Cb 0.00 -1.61 0.37 0.00 1.34 0.00 0.00 72.50 72.60 2jps s THR 44 CO 0.00 0.13 1.81 0.58 -0.54 0.00 0.00 174.62 176.60 2jps h VAL 45 N 6.42 0.64 0.39 2.29 2.07 -1.96 0.87 116.25 126.97 2jps h VAL 45 Ca -0.26 -0.16 -0.02 0.00 0.82 0.00 0.00 66.70 67.08 2jps h VAL 45 Cb 1.10 0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 2jps h VAL 45 CO 0.45 0.09 -0.19 -0.33 0.02 0.00 0.00 177.57 177.61 2jps h GLU 46 N 0.48 -0.50 -0.33 1.57 5.08 -1.97 0.82 114.58 119.73 2jps h GLU 46 Ca 0.53 0.03 -0.11 0.00 -1.00 0.00 0.00 59.36 58.81 2jps h GLU 46 Cb 1.22 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.57 2jps h GLU 46 CO -0.25 -0.20 -0.25 0.66 -1.00 0.00 0.00 179.01 177.97 2jps h SER 47 N -0.81 0.66 -0.12 1.42 4.64 -1.81 0.23 113.55 117.76 2jps h SER 47 Ca -0.05 -0.24 -0.15 0.00 -0.47 0.00 0.00 61.79 60.88 2jps h SER 47 Cb 0.53 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.43 2jps h SER 47 CO 0.09 0.89 -0.43 0.58 -0.87 0.00 0.00 176.83 177.09 2jps h VAL 48 N 0.57 1.30 0.06 0.95 2.07 0.81 0.31 116.25 122.31 2jps h VAL 48 Ca 0.08 -1.62 -0.26 0.00 0.82 0.00 0.00 66.70 65.72 2jps h VAL 48 Cb 0.73 1.56 0.01 0.00 -1.52 0.00 0.00 31.29 32.07 2jps h VAL 48 CO 0.06 0.52 -1.10 0.58 0.02 0.00 0.00 177.57 177.65 2jps h VAL 49 N 0.54 1.35 -0.20 2.57 2.07 0.86 -2.42 116.25 121.02 2jps h VAL 49 Ca 0.04 -2.49 -0.11 0.00 0.82 0.00 0.00 66.70 64.96 2jps h VAL 49 Cb 0.97 2.56 -0.01 0.00 -1.52 0.00 0.00 31.29 33.29 2jps h VAL 49 CO 0.09 0.75 -0.34 -0.78 0.02 0.00 0.00 177.57 177.31 2jps h ASP 50 N 0.26 0.43 -0.16 0.57 3.58 -0.48 0.18 116.42 120.80 2jps h ASP 50 Ca -0.13 -0.17 -0.19 0.00 0.42 0.00 0.00 57.03 56.96 2jps h ASP 50 Cb 1.76 -0.12 0.01 0.00 1.72 0.00 0.00 39.33 42.70 2jps h ASP 50 CO 0.20 0.75 -0.64 -0.33 -2.88 0.00 0.00 179.24 176.33 2jps h GLU 51 N 0.36 0.71 -0.16 0.28 5.08 -0.95 -0.34 114.58 119.57 2jps h GLU 51 Ca 0.04 -0.56 -0.18 0.00 -1.00 0.00 0.00 59.36 57.67 2jps h GLU 51 Cb 0.77 0.11 -0.00 0.00 0.50 0.00 0.00 28.75 30.13 2jps h GLU 51 CO 0.06 1.17 -0.64 -0.07 -1.00 0.00 0.00 179.01 178.54 2jps h LEU 52 N 0.41 0.66 -0.51 1.33 3.38 -1.34 -2.98 115.31 116.26 2jps h LEU 52 Ca -0.04 -0.39 -0.14 0.00 0.09 0.00 0.00 57.88 57.40 2jps h LEU 52 Cb 1.27 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 2jps h LEU 52 CO 0.13 1.13 -0.35 0.00 0.09 0.00 0.00 178.44 179.44 2jps h ALA 53 N 0.87 0.70 -0.57 1.53 0.00 -0.64 0.92 119.26 122.07 2jps h ALA 53 Ca -0.01 -0.44 0.03 0.00 0.00 0.00 0.00 54.91 54.50 2jps h ALA 53 Cb 1.21 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.84 2jps h ALA 53 CO 0.12 0.67 0.38 1.03 0.00 0.00 0.00 179.25 181.45 2jps h SER 54 N 0.69 0.57 0.05 0.00 0.87 -0.99 -2.37 113.55 112.38 2jps h SER 54 Ca 0.07 -0.01 -0.37 0.00 -1.23 0.00 0.00 61.79 60.25 2jps h SER 54 Cb 0.91 -0.13 -0.04 0.00 -0.44 0.00 0.00 62.40 62.70 2jps h SER 54 CO 0.08 0.40 -2.15 0.18 -0.53 0.00 0.00 176.83 174.81 2jps n LEU 55 N -4.47 2.61 -4.03 2.23 4.77 -1.12 -4.61 117.00 112.39 2jps n LEU 55 Ca 0.07 0.12 -0.38 0.00 -0.03 0.00 0.00 56.01 55.79 2jps n LEU 55 Cb 0.14 -1.00 -0.04 0.00 -2.33 0.00 0.00 43.42 40.19 2jps n LEU 55 CO 0.35 0.80 0.56 0.49 -1.33 0.00 0.00 177.39 178.25 2jps n PHE 56 N -3.58 3.91 -1.08 -1.77 3.72 0.32 -4.85 117.46 114.12 2jps n PHE 56 Ca -0.40 -3.77 -0.15 0.00 -0.05 0.00 0.00 57.45 53.09 2jps n PHE 56 Cb 0.97 -1.18 0.24 0.00 -0.94 0.00 0.00 39.48 38.57 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 1.95 4.29 -0.08 4.37 2.03 -0.90 -4.35 116.55 123.86 2jps n ASP 57 Ca 0.24 -3.38 -0.17 0.00 0.52 0.00 0.00 54.79 52.00 2jps n ASP 57 Cb 0.37 -0.79 -0.13 0.00 -0.72 0.00 0.00 41.12 39.85 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 -0.61 1.72 -4.90 1.67 2.88 -1.26 -4.95 113.62 108.17 2jps n SER 58 Ca 0.49 0.01 -0.29 0.00 -1.33 0.00 0.00 58.87 57.76 2jps n SER 58 Cb 1.52 -0.35 -0.03 0.00 -0.75 0.00 0.00 64.21 64.59 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 4.95 0.48 2.46 0.11 -1.26 -5.03 120.40 119.57 2jps s VAL 59 Ca -0.27 0.21 -0.23 0.00 -2.93 0.00 0.00 61.98 58.76 2jps s VAL 59 Cb 0.08 -3.75 -0.08 0.00 -1.53 0.00 0.00 36.38 31.10 2jps s VAL 59 CO 0.69 -0.44 1.16 -1.20 -3.33 0.00 0.00 175.10 171.98 2jps n SER 60 N -1.20 1.88 -0.07 3.54 7.64 -1.26 -4.85 113.62 119.30 2jps n SER 60 Ca -0.00 1.00 0.23 0.00 1.01 0.00 0.00 58.87 61.11 2jps n SER 60 Cb 0.54 -1.45 0.70 0.00 -1.01 0.00 0.00 64.21 62.98 2jps n SER 60 CO 0.00 0.00 0.00 0.08 -3.01 0.00 0.00 175.04 172.11 2jps h ARG 61 N 1.48 0.01 -0.94 1.43 -0.00 -1.96 -1.14 114.38 113.26 2jps h ARG 61 Ca -0.48 -0.00 0.05 0.00 -0.00 0.00 0.00 59.98 59.56 2jps h ARG 61 Cb 1.32 -0.00 -0.06 0.00 -0.00 0.00 0.00 29.97 31.23 2jps h ARG 61 CO 0.57 0.01 0.62 0.22 -0.00 0.00 0.00 179.97 181.38 2jps h ASP 62 N 0.01 0.99 -0.59 0.08 3.58 -1.98 0.18 116.42 118.68 2jps h ASP 62 Ca 0.32 0.00 -0.07 0.00 0.42 0.00 0.00 57.03 57.70 2jps h ASP 62 Cb 1.25 -0.21 -0.02 0.00 1.72 0.00 0.00 39.33 42.07 2jps h ASP 62 CO -0.01 0.65 0.10 0.74 -2.88 0.00 0.00 179.24 177.85 2jps h THR 63 N 1.13 1.26 -0.15 2.25 2.02 -1.55 0.90 112.91 118.77 2jps h THR 63 Ca 0.39 -0.97 -0.04 0.00 0.77 0.00 0.00 66.41 66.56 2jps h THR 63 Cb 0.12 0.75 -0.00 0.00 -1.74 0.00 0.00 68.15 67.27 2jps h THR 63 CO -0.14 0.36 -0.07 -0.07 0.37 0.00 0.00 175.52 175.96 2jps h LEU 64 N 0.87 0.32 -1.48 2.58 4.07 -1.37 -2.85 115.31 117.45 2jps h LEU 64 Ca 0.18 -0.42 -0.00 0.00 0.08 0.00 0.00 57.88 57.72 2jps h LEU 64 Cb 0.41 -0.09 -0.02 0.00 1.08 0.00 0.00 40.66 42.04 2jps h LEU 64 CO 0.01 0.67 0.30 0.00 -1.08 0.00 0.00 178.44 178.34 2jps h ALA 65 N 0.66 1.62 -0.49 1.53 0.00 -0.55 -1.17 119.26 120.86 2jps h ALA 65 Ca 0.03 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2jps h ALA 65 Cb 0.55 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 2jps h ALA 65 CO 0.02 0.34 0.28 -0.97 0.00 0.00 0.00 179.25 178.92 2jps h ASN 66 N 0.67 0.61 0.09 0.00 -0.73 -0.63 0.38 115.58 115.97 2jps h ASN 66 Ca 0.18 -0.09 -0.16 0.00 1.87 0.00 0.00 56.30 58.10 2jps h ASN 66 Cb -0.04 -0.16 -0.01 0.00 0.27 0.00 0.00 38.32 38.39 2jps h ASN 66 CO -0.03 0.52 -0.56 0.58 -0.37 0.00 0.00 177.43 177.57 2jps h VAL 67 N 0.66 1.33 -0.30 2.57 2.07 -1.21 -2.65 116.25 118.71 2jps h VAL 67 Ca 0.17 -1.83 -0.12 0.00 0.82 0.00 0.00 66.70 65.75 2jps h VAL 67 Cb 0.04 1.82 -0.01 0.00 -1.52 0.00 0.00 31.29 31.62 2jps h VAL 67 CO -0.03 0.56 -0.30 0.58 0.02 0.00 0.00 177.57 178.40 2jps h VAL 68 N 0.37 1.28 -0.23 2.57 2.07 -0.84 -2.72 116.25 118.75 2jps h VAL 68 Ca 0.00 -1.42 -0.01 0.00 0.82 0.00 0.00 66.70 66.09 2jps h VAL 68 Cb 1.09 1.38 -0.01 0.00 -1.52 0.00 0.00 31.29 32.23 2jps h VAL 68 CO 0.10 0.46 0.09 -0.61 0.02 0.00 0.00 177.57 177.63 2jps h GLN 69 N 0.54 0.34 -0.03 1.57 4.15 -0.10 -2.50 115.11 119.08 2jps h GLN 69 Ca 0.07 -0.06 -0.02 0.00 0.77 0.00 0.00 58.65 59.40 2jps h GLN 69 Cb 0.79 -0.05 -0.00 0.00 0.21 0.00 0.00 27.48 28.42 2jps h GLN 69 CO 0.06 0.40 -0.07 0.00 -1.93 0.00 0.00 178.83 177.29 2jps h THR 70 N 0.21 1.07 -0.63 2.39 1.03 -1.41 -1.82 112.91 113.75 2jps h THR 70 Ca 0.07 -0.32 -0.05 0.00 -0.01 0.00 0.00 66.41 66.10 2jps h THR 70 Cb 0.19 1.13 -0.03 0.00 -1.07 0.00 0.00 68.15 68.37 2jps h THR 70 CO -0.01 0.10 0.21 0.00 -0.01 0.00 0.00 175.52 175.81 2jps h ALA 71 N 1.89 0.82 0.12 0.00 0.00 -1.13 0.80 119.26 121.76 2jps h ALA 71 Ca 0.01 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 2jps h ALA 71 Cb 0.16 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2jps h ALA 71 CO 0.01 0.48 -0.06 0.74 0.00 0.00 0.00 179.25 180.42 2jps h PHE 72 N 0.89 -0.16 -0.98 0.00 0.04 -1.11 0.38 116.94 116.01 2jps h PHE 72 Ca 0.20 -0.00 0.02 0.00 2.80 0.00 0.00 57.97 60.99 2jps h PHE 72 Cb 0.27 0.05 -0.05 0.00 2.20 0.00 0.00 35.95 38.42 2jps h PHE 72 CO 0.02 0.14 0.65 0.35 -0.60 0.00 0.00 178.31 178.87 2jps h PHE 73 N -0.45 1.23 -0.81 -0.55 3.57 -1.21 -1.70 116.94 117.02 2jps h PHE 73 Ca -0.02 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 2jps h PHE 73 Cb 0.36 -0.41 -0.04 0.00 2.79 0.00 0.00 35.95 38.65 2jps h PHE 73 CO 0.02 0.75 0.39 0.00 -2.23 0.00 0.00 178.31 177.23 2jps h ALA 74 N 1.40 1.05 -0.92 2.41 0.00 0.86 -1.12 119.26 122.94 2jps h ALA 74 Ca 0.37 -0.16 0.06 0.00 0.00 0.00 0.00 54.91 55.18 2jps h ALA 74 Cb -0.10 -0.32 -0.06 0.00 0.00 0.00 0.00 17.79 17.31 2jps h ALA 74 CO -0.09 0.62 0.58 -0.07 0.00 0.00 0.00 179.25 180.29 2jps h LEU 75 N 1.15 0.92 -0.22 0.00 -0.00 0.01 0.83 115.31 118.01 2jps h LEU 75 Ca 0.28 0.01 -0.14 0.00 -0.00 0.00 0.00 57.88 58.03 2jps h LEU 75 Cb 0.13 -0.18 0.00 0.00 -0.00 0.00 0.00 40.66 40.60 2jps h LEU 75 CO -0.03 0.59 -0.40 -0.08 -0.00 0.00 0.00 178.44 178.51 2jps h GLU 76 N 1.06 0.66 -0.32 1.13 4.81 -1.14 -2.31 114.58 118.47 2jps h GLU 76 Ca 0.40 -0.42 -0.10 0.00 -0.13 0.00 0.00 59.36 59.11 2jps h GLU 76 Cb 0.17 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 2jps h GLU 76 CO -0.17 1.03 -0.22 0.00 -0.73 0.00 0.00 179.01 178.92 2jps h ALA 77 N 0.62 1.03 -0.63 2.92 0.00 -0.55 -2.86 119.26 119.80 2jps h ALA 77 Ca 0.01 -0.34 -0.08 0.00 0.00 0.00 0.00 54.91 54.50 2jps h ALA 77 Cb 1.00 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 2jps h ALA 77 CO 0.09 0.58 0.07 1.25 0.00 0.00 0.00 179.25 181.24 2jps h LEU 78 N 0.53 1.01 -1.20 0.00 5.85 0.73 -2.74 115.31 119.50 2jps h LEU 78 Ca 0.08 -0.25 0.03 0.00 0.84 0.00 0.00 57.88 58.58 2jps h LEU 78 Cb 0.67 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 41.38 2jps h LEU 78 CO 0.05 1.03 0.55 1.56 -0.34 0.00 0.00 178.44 181.28 2jps h GLN 79 N 0.98 1.01 -0.97 1.25 4.20 -1.19 -2.10 115.11 118.29 2jps h GLN 79 Ca 0.19 -0.06 0.02 0.00 0.06 0.00 0.00 58.65 58.86 2jps h GLN 79 Cb 0.47 -0.23 -0.05 0.00 0.30 0.00 0.00 27.48 27.97 2jps h GLN 79 CO 0.02 0.67 0.64 1.96 -0.67 0.00 0.00 178.83 181.44 2jps h GLN 80 N 1.04 1.24 0.00 1.46 1.08 -1.39 -3.47 115.11 115.07 2jps h GLN 80 Ca 0.33 -0.07 0.00 0.00 -1.45 0.00 0.00 58.65 57.46 2jps h GLN 80 Cb 0.03 -0.28 0.00 0.00 -0.05 0.00 0.00 27.48 27.18 2jps h GLN 80 CO -0.10 0.82 0.00 0.41 -0.95 0.00 0.00 178.83 179.01 2jps n GLY 81 N -1.36 0.54 2.09 3.46 0.00 -0.79 -5.16 105.19 103.97 2jps n GLY 81 Ca 0.12 -0.73 -0.17 0.00 0.00 0.00 0.00 46.02 45.24 2jps n GLY 81 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2jps n GLU 82 N 0.00 1.19 -5.09 1.61 1.02 -1.26 -5.08 120.64 113.04 2jps n GLU 82 Ca 0.00 -2.03 -0.32 0.00 -0.02 0.00 0.00 57.16 54.79 2jps n GLU 82 Cb 0.00 0.41 -0.15 0.00 -0.02 0.00 0.00 31.44 31.69 2jps n GLU 82 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2jps s SER 83 N -2.67 3.54 -0.19 1.62 0.01 -1.26 -5.01 113.70 109.74 2jps s SER 83 Ca 0.07 -0.34 0.09 0.00 1.31 0.00 0.00 55.95 57.08 2jps s SER 83 Cb -0.01 -0.66 -0.22 0.00 0.21 0.00 0.00 66.02 65.34 2jps s SER 83 CO 0.05 0.32 0.09 0.00 0.41 0.00 0.00 173.24 174.10 2jps n ALA 84 N 2.46 1.41 -0.28 1.44 0.00 -1.26 -4.35 120.51 119.93 2jps n ALA 84 Ca -0.17 -1.10 0.17 0.00 0.00 0.00 0.00 53.44 52.34 2jps n ALA 84 Cb 0.52 -0.30 0.45 0.00 0.00 0.00 0.00 19.45 20.11 2jps n ALA 84 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2jps h GLU 85 N 0.01 0.52 -0.87 0.00 5.08 -1.96 0.54 114.58 117.90 2jps h GLU 85 Ca -0.51 -0.03 0.05 0.00 -1.00 0.00 0.00 59.36 57.87 2jps h GLU 85 Cb 2.08 -0.12 -0.05 0.00 0.50 0.00 0.00 28.75 31.16 2jps h GLU 85 CO 0.00 0.34 0.57 -0.91 -1.00 0.00 0.00 179.01 178.02 2jps h ASN 86 N 0.53 0.89 -0.67 1.42 2.35 -2.02 -1.56 115.58 116.53 2jps h ASN 86 Ca 0.50 -0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 56.22 2jps h ASN 86 Cb 1.07 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 39.21 2jps h ASN 86 CO -0.24 0.59 0.29 0.40 -1.65 0.00 0.00 177.43 176.82 2jps h ILE 87 N 1.02 1.23 -0.71 2.81 2.04 -1.12 -2.47 117.51 120.31 2jps h ILE 87 Ca 0.36 -0.72 0.01 0.00 1.00 0.00 0.00 64.86 65.51 2jps h ILE 87 Cb 0.13 0.40 -0.04 0.00 -0.74 0.00 0.00 36.82 36.57 2jps h ILE 87 CO -0.12 0.29 0.47 0.58 0.00 0.00 0.00 178.15 179.37 2jps h VAL 88 N 0.99 1.18 -0.86 1.67 2.07 -1.24 -1.99 116.25 118.08 2jps h VAL 88 Ca 0.23 -0.34 0.09 0.00 0.82 0.00 0.00 66.70 67.50 2jps h VAL 88 Cb 0.17 0.14 -0.07 0.00 -1.52 0.00 0.00 31.29 30.01 2jps h VAL 88 CO -0.02 0.18 0.51 0.28 0.02 0.00 0.00 177.57 178.53 2jps h SER 89 N 0.97 0.75 0.10 0.57 0.02 -1.30 0.75 113.55 115.40 2jps h SER 89 Ca 0.26 0.04 -0.15 0.00 -0.84 0.00 0.00 61.79 61.10 2jps h SER 89 Cb -0.11 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.31 2jps h SER 89 CO -0.06 0.44 -0.53 0.11 -1.14 0.00 0.00 176.83 175.66 2jps h LYS 90 N 0.87 0.47 -0.24 3.45 1.57 -1.42 -2.37 116.57 118.90 2jps h LYS 90 Ca 0.40 -0.29 -0.19 0.00 -1.87 0.00 0.00 60.65 58.70 2jps h LYS 90 Cb 0.32 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.66 2jps h LYS 90 CO -0.23 0.89 -0.60 0.82 -0.57 0.00 0.00 179.45 179.76 2jps h ILE 91 N 0.37 1.28 -0.59 1.86 1.08 -0.49 -2.26 117.51 118.76 2jps h ILE 91 Ca 0.01 -1.80 -0.05 0.00 -0.39 0.00 0.00 64.86 62.63 2jps h ILE 91 Cb 1.05 1.73 -0.03 0.00 -3.07 0.00 0.00 36.82 36.51 2jps h ILE 91 CO 0.10 0.58 0.16 -0.09 -0.69 0.00 0.00 178.15 178.20 2jps h ARG 92 N 0.60 0.90 -0.33 2.37 9.65 0.51 0.50 114.38 128.58 2jps h ARG 92 Ca -0.00 -0.18 -0.17 0.00 -1.10 0.00 0.00 59.98 58.53 2jps h ARG 92 Cb 1.20 -0.14 -0.00 0.00 -1.39 0.00 0.00 29.97 29.64 2jps h ARG 92 CO 0.13 0.79 -0.46 1.98 2.80 0.00 0.00 179.97 185.21 2jps h MET 93 N 0.87 0.89 -0.15 0.20 4.05 -1.37 0.23 114.93 119.65 2jps h MET 93 Ca 0.19 -0.52 -0.22 0.00 -0.28 0.00 0.00 59.70 58.87 2jps h MET 93 Cb 0.29 0.04 0.01 0.00 -0.80 0.00 0.00 31.60 31.14 2jps h MET 93 CO -0.00 1.16 -0.76 0.52 0.23 0.00 0.00 176.91 178.06 2jps h MET 94 N 0.69 0.76 -0.14 0.39 2.86 -1.12 -1.70 114.93 116.67 2jps h MET 94 Ca 0.04 -0.61 -0.15 0.00 -2.06 0.00 0.00 59.70 56.92 2jps h MET 94 Cb 1.06 0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.84 2jps h MET 94 CO 0.11 1.22 -0.55 -0.91 1.06 0.00 0.00 176.91 177.84 2jps h ASN 95 N 0.52 0.45 -0.28 1.22 2.35 0.02 -2.43 115.58 117.43 2jps h ASN 95 Ca -0.05 -0.24 -0.17 0.00 -0.55 0.00 0.00 56.30 55.29 2jps h ASN 95 Cb 1.38 -0.13 -0.00 0.00 0.05 0.00 0.00 38.32 39.62 2jps h ASN 95 CO 0.15 0.91 -0.46 0.00 -1.65 0.00 0.00 177.43 176.38 2jps h ALA 96 N 1.10 0.57 -0.65 -0.83 0.00 -0.52 -3.06 119.26 115.87 2jps h ALA 96 Ca 0.01 -0.48 -0.07 0.00 0.00 0.00 0.00 54.91 54.36 2jps h ALA 96 Cb 1.06 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 2jps h ALA 96 CO 0.09 0.68 0.13 0.37 0.00 0.00 0.00 179.25 180.52 2jps h GLN 97 N 0.67 1.05 -0.57 0.00 4.15 -1.24 0.70 115.11 119.88 2jps h GLN 97 Ca 0.04 -0.26 0.04 0.00 0.77 0.00 0.00 58.65 59.23 2jps h GLN 97 Cb 1.05 -0.13 -0.03 0.00 0.21 0.00 0.00 27.48 28.58 2jps h GLN 97 CO 0.10 0.95 0.38 1.03 -1.93 0.00 0.00 178.83 179.36 2jps h SER 98 N 0.99 0.55 0.07 -0.69 0.87 -1.35 -3.11 113.55 110.89 2jps h SER 98 Ca 0.20 -0.01 -0.38 0.00 -1.23 0.00 0.00 61.79 60.38 2jps h SER 98 Cb 0.40 -0.12 -0.04 0.00 -0.44 0.00 0.00 62.40 62.19 2jps h SER 98 CO 0.01 0.37 -2.22 0.18 -0.53 0.00 0.00 176.83 174.64 2jps n LEU 99 N -4.47 2.75 -0.50 2.23 4.32 -0.98 -5.06 117.00 115.28 2jps n LEU 99 Ca 0.07 0.05 0.00 0.00 -0.02 0.00 0.00 56.01 56.11 2jps n LEU 99 Cb 0.16 -0.99 0.00 0.00 -1.62 0.00 0.00 43.42 40.97 2jps n LEU 99 CO 0.35 0.89 0.00 0.61 -1.22 0.00 0.00 177.39 178.01 2jps n GLY 100 N 2.11 0.33 3.24 -0.72 0.00 0.24 -5.09 105.19 105.29 2jps n GLY 100 Ca -0.38 -0.51 -0.33 0.00 0.00 0.00 0.00 46.02 44.80 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 -1.58 3.17 -1.50 1.61 0.74 -1.22 -4.68 119.66 116.21 2jps s GLN 101 Ca 0.00 -0.76 -0.13 0.00 0.05 0.00 0.00 55.36 54.52 2jps s GLN 101 Cb 0.00 -2.63 0.08 0.00 1.10 0.00 0.00 33.01 31.56 2jps s GLN 101 CO 0.00 -0.04 0.85 0.45 -0.55 0.00 0.00 175.29 176.00 2jps n SER 102 N 4.22 -4.69 0.04 6.67 2.88 -1.26 -4.85 113.62 116.62 2jps n SER 102 Ca -0.19 -0.67 0.00 0.00 -1.33 0.00 0.00 58.87 56.68 2jps n SER 102 Cb 0.51 -3.77 0.00 0.00 -0.75 0.00 0.00 64.21 60.20 2jps n SER 102 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2jps n ASP 103 N -2.69 0.73 -0.02 -3.46 -0.08 -1.26 -5.00 116.55 104.77 2jps n ASP 103 Ca 0.02 0.11 -0.06 0.00 -1.51 0.00 0.00 54.79 53.35 2jps n ASP 103 Cb 0.53 -0.21 -0.02 0.00 2.34 0.00 0.00 41.12 43.77 2jps n ASP 103 CO 0.00 0.00 0.00 -0.38 0.12 0.00 0.00 177.20 176.94 2jps n ILE 104 N -3.34 1.03 -1.09 5.18 5.41 -1.26 -5.21 119.36 120.08 2jps n ILE 104 Ca 0.00 0.14 0.00 0.00 1.00 0.00 0.00 62.75 63.89 2jps n ILE 104 Cb 0.15 -1.78 0.00 0.00 -0.71 0.00 0.00 39.64 37.30 2jps n ILE 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55