#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 3.59 -0.53 6.12 0.01 -1.26 -5.05 113.70 116.58 2jps s SER 2 Ca 0.00 -1.33 0.06 0.00 1.31 0.00 0.00 55.95 55.99 2jps s SER 2 Cb 0.00 -0.56 0.21 0.00 0.21 0.00 0.00 66.02 65.88 2jps s SER 2 CO 0.00 -0.41 0.52 0.00 0.41 0.00 0.00 173.24 173.76 2jps n GLN 3 N 5.08 1.28 -0.07 12.44 1.13 -1.26 -4.91 117.38 131.07 2jps n GLN 3 Ca -0.05 -3.86 -0.20 0.00 -1.94 0.00 0.00 57.00 50.96 2jps n GLN 3 Cb 0.43 -1.83 -0.13 0.00 0.11 0.00 0.00 30.24 28.82 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 1.77 0.70 -0.28 -1.09 -0.58 -1.26 -3.44 120.64 116.46 2jps n GLU 4 Ca 0.25 0.20 0.10 0.00 -0.42 0.00 0.00 57.16 57.29 2jps n GLU 4 Cb 0.45 -1.61 0.34 0.00 -0.57 0.00 0.00 31.44 30.05 2jps n GLU 4 CO 0.00 0.00 0.00 -0.56 -0.48 0.00 0.00 177.13 176.09 2jps h GLN 5 N 0.03 0.75 -0.15 3.49 3.07 -2.00 0.26 115.11 120.56 2jps h GLN 5 Ca -0.51 -0.04 -0.22 0.00 0.09 0.00 0.00 58.65 57.97 2jps h GLN 5 Cb 1.96 -0.17 0.01 0.00 0.08 0.00 0.00 27.48 29.36 2jps h GLN 5 CO -0.01 0.49 -0.77 1.88 0.09 0.00 0.00 178.83 180.52 2jps h TYR 6 N 0.77 1.04 -0.84 0.06 -1.99 -1.97 -2.53 116.97 111.51 2jps h TYR 6 Ca 0.44 -0.46 -0.01 0.00 2.00 0.00 0.00 58.73 60.70 2jps h TYR 6 Cb 0.60 -0.16 -0.04 0.00 2.00 0.00 0.00 36.73 39.12 2jps h TYR 6 CO -0.00 1.29 0.49 1.15 -0.00 0.00 0.00 178.16 181.09 2jps h THR 7 N 0.53 1.24 -0.46 -2.88 2.02 -0.99 0.87 112.91 113.24 2jps h THR 7 Ca -0.05 -0.55 -0.12 0.00 0.77 0.00 0.00 66.41 66.46 2jps h THR 7 Cb 1.40 0.08 -0.01 0.00 -1.74 0.00 0.00 68.15 67.87 2jps h THR 7 CO 0.16 0.26 -0.18 -0.08 0.37 0.00 0.00 175.52 176.04 2jps h GLU 8 N 1.16 0.94 -0.10 6.66 4.81 -0.57 0.24 114.58 127.71 2jps h GLU 8 Ca 0.30 -0.39 -0.23 0.00 -0.13 0.00 0.00 59.36 58.91 2jps h GLU 8 Cb -0.02 -0.04 0.01 0.00 0.63 0.00 0.00 28.75 29.33 2jps h GLU 8 CO -0.05 1.05 -0.84 -0.91 -0.73 0.00 0.00 179.01 177.53 2jps h ASN 9 N 0.78 0.84 -0.37 1.04 4.21 -1.09 -3.11 115.58 117.90 2jps h ASN 9 Ca 0.11 -0.59 -0.11 0.00 1.21 0.00 0.00 56.30 56.92 2jps h ASN 9 Cb 0.75 -0.25 -0.02 0.00 -1.12 0.00 0.00 38.32 37.68 2jps h ASN 9 CO 0.06 1.38 -0.16 0.25 -1.29 0.00 0.00 177.43 177.66 2jps h LEU 10 N 0.45 0.84 -1.58 1.61 5.85 0.85 -2.65 115.31 120.69 2jps h LEU 10 Ca -0.07 -0.28 0.05 0.00 0.84 0.00 0.00 57.88 58.42 2jps h LEU 10 Cb 1.46 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 42.24 2jps h LEU 10 CO 0.16 1.00 0.35 0.50 -0.34 0.00 0.00 178.44 180.11 2jps h LYS 11 N 0.74 0.51 -0.07 1.25 3.11 -0.50 0.28 116.57 121.90 2jps h LYS 11 Ca 0.11 -0.03 -0.09 0.00 -2.81 0.00 0.00 60.65 57.83 2jps h LYS 11 Cb 0.68 -0.12 0.00 0.00 -1.00 0.00 0.00 32.23 31.80 2jps h LYS 11 CO 0.05 0.34 -0.30 0.28 -2.81 0.00 0.00 179.45 177.01 2jps h VAL 12 N 0.53 1.42 -0.40 2.00 2.07 -1.42 -2.37 116.25 118.09 2jps h VAL 12 Ca 0.22 -1.69 -0.07 0.00 0.82 0.00 0.00 66.70 65.98 2jps h VAL 12 Cb 0.21 2.30 -0.02 0.00 -1.52 0.00 0.00 31.29 32.26 2jps h VAL 12 CO -0.06 0.49 -0.03 0.40 0.02 0.00 0.00 177.57 178.39 2jps h ILE 13 N -0.16 1.23 -0.55 4.57 2.04 -1.08 -2.35 117.51 121.20 2jps h ILE 13 Ca -0.02 -0.95 -0.05 0.00 1.00 0.00 0.00 64.86 64.83 2jps h ILE 13 Cb 0.94 0.96 -0.02 0.00 -0.74 0.00 0.00 36.82 37.95 2jps h ILE 13 CO 0.06 0.33 0.13 0.58 0.00 0.00 0.00 178.15 179.25 2jps h VAL 14 N 0.62 1.25 -0.27 1.67 2.07 -0.45 -2.48 116.25 118.65 2jps h VAL 14 Ca 0.12 -0.89 -0.03 0.00 0.82 0.00 0.00 66.70 66.73 2jps h VAL 14 Cb 0.43 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 2jps h VAL 14 CO 0.02 0.33 0.05 0.00 0.02 0.00 0.00 177.57 177.98 2jps h ALA 15 N 1.01 1.58 -0.90 1.67 0.00 -1.07 -2.28 119.26 119.27 2jps h ALA 15 Ca 0.17 -0.13 0.15 0.00 0.00 0.00 0.00 54.91 55.10 2jps h ALA 15 Cb 0.35 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 17.95 2jps h ALA 15 CO 0.00 0.32 0.58 1.49 0.00 0.00 0.00 179.25 181.64 2jps h GLU 16 N 0.39 0.66 0.14 0.00 4.81 -0.95 0.65 114.58 120.29 2jps h GLU 16 Ca 0.09 -0.04 -0.30 0.00 -0.13 0.00 0.00 59.36 58.99 2jps h GLU 16 Cb 0.19 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.42 2jps h GLU 16 CO -0.00 0.44 -1.48 0.87 -0.73 0.00 0.00 179.01 178.10 2jps h LYS 17 N 0.68 0.30 0.32 1.92 1.79 -1.49 -2.81 116.57 117.28 2jps h LYS 17 Ca 0.46 -0.52 -0.02 0.00 -2.18 0.00 0.00 60.65 58.39 2jps h LYS 17 Cb 0.76 0.19 0.00 0.00 -1.58 0.00 0.00 32.23 31.61 2jps h LYS 17 CO -0.22 1.25 -0.15 -0.07 -1.08 0.00 0.00 179.45 179.18 2jps h LEU 18 N -0.16 -0.36 -2.40 2.94 3.38 -0.94 -0.24 115.31 117.53 2jps h LEU 18 Ca -0.31 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.55 2jps h LEU 18 Cb 1.87 0.09 -0.00 0.00 0.09 0.00 0.00 40.66 42.71 2jps h LEU 18 CO 0.11 -0.10 -0.03 0.00 0.09 0.00 0.00 178.44 178.50 2jps h ALA 19 N 0.01 1.32 0.13 1.53 0.00 0.12 -2.46 119.26 119.90 2jps h ALA 19 Ca -0.04 -0.03 -0.28 0.00 0.00 0.00 0.00 54.91 54.56 2jps h ALA 19 Cb 0.44 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2jps h ALA 19 CO 0.07 0.04 -1.31 0.78 0.00 0.00 0.00 179.25 178.84 2jps h GLY 20 N 0.31 0.30 -5.03 0.00 0.00 -1.16 -3.46 103.07 94.04 2jps h GLY 20 Ca -0.00 -0.78 -0.62 0.00 0.00 0.00 0.00 47.33 45.94 2jps h GLY 20 CO 0.00 0.68 0.58 1.39 0.00 0.00 0.00 176.54 179.20 2jps n ILE 21 N -3.51 0.36 0.26 2.60 5.41 -0.15 -4.86 119.36 119.47 2jps n ILE 21 Ca -0.10 -0.09 0.14 0.00 1.00 0.00 0.00 62.75 63.70 2jps n ILE 21 Cb 1.03 -1.23 0.64 0.00 -0.71 0.00 0.00 39.64 39.37 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 4.77 0.00 -0.88 0.38 0.13 -1.88 -3.00 132.00 131.52 2jps h PRO 22 Ca -0.45 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.19 2jps h PRO 22 Cb 1.29 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 32.15 2jps h PRO 22 CO 0.80 0.09 0.52 0.09 -0.23 0.00 0.00 178.00 179.27 2jps n ASN 23 N -3.27 4.16 -3.83 1.44 3.02 -1.26 -4.82 115.26 110.70 2jps n ASN 23 Ca -0.00 -3.68 -0.30 0.00 -0.03 0.00 0.00 54.58 50.57 2jps n ASN 23 Cb 0.33 -0.81 -0.14 0.00 -0.61 0.00 0.00 39.78 38.54 2jps n ASN 23 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 2jps s PHE 24 N -3.38 2.54 -0.19 3.10 2.19 -1.14 -4.95 117.98 116.15 2jps s PHE 24 Ca 0.56 -2.57 -0.08 0.00 0.33 0.00 0.00 56.93 55.16 2jps s PHE 24 Cb 0.47 -2.27 -0.09 0.00 -1.31 0.00 0.00 43.02 39.83 2jps s PHE 24 CO 0.07 -0.82 -0.24 -1.71 1.83 0.00 0.00 175.22 174.35 2jps n ASN 25 N 3.84 1.49 -4.88 6.13 5.15 -1.26 -4.85 115.26 120.89 2jps n ASN 25 Ca 0.05 0.19 -0.21 0.00 -0.60 0.00 0.00 54.58 54.01 2jps n ASN 25 Cb 0.37 -0.53 -0.03 0.00 -0.53 0.00 0.00 39.78 39.06 2jps n ASN 25 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 2jps s GLU 26 N -2.35 2.67 -1.51 1.20 2.12 -1.26 -4.58 118.70 114.99 2jps s GLU 26 Ca -0.26 -1.38 -0.13 0.00 0.36 0.00 0.00 54.97 53.56 2jps s GLU 26 Cb 0.10 -2.47 0.08 0.00 0.26 0.00 0.00 34.13 32.10 2jps s GLU 26 CO 0.34 -0.05 0.92 -0.25 -0.54 0.00 0.00 175.26 175.68 2jps n ASP 27 N -1.49 -4.84 -0.11 -1.70 9.92 -1.26 -4.88 116.55 112.20 2jps n ASP 27 Ca 0.01 -0.71 -0.12 0.00 -0.53 0.00 0.00 54.79 53.44 2jps n ASP 27 Cb 0.60 -3.87 -0.14 0.00 -0.64 0.00 0.00 41.12 37.07 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 -4.61 1.36 0.08 0.53 0.00 -1.26 -3.51 119.36 111.96 2jps n ILE 28 Ca 0.03 -0.73 -0.19 0.00 0.00 0.00 0.00 62.75 61.85 2jps n ILE 28 Cb 0.53 -0.77 -0.15 0.00 0.00 0.00 0.00 39.64 39.25 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 0.33 0.00 9.51 3.11 -1.94 -3.18 116.57 124.39 2jps h LYS 29 Ca -0.54 -0.56 -0.12 0.00 -2.81 0.00 0.00 60.65 56.62 2jps h LYS 29 Cb 2.09 0.21 -0.02 0.00 -1.00 0.00 0.00 32.23 33.51 2jps h LYS 29 CO -0.01 1.22 -0.59 1.88 -2.81 0.00 0.00 179.45 179.14 2jps h TYR 30 N 0.09 0.00 -0.18 1.91 0.05 -1.98 -3.14 116.97 113.73 2jps h TYR 30 Ca -0.26 0.00 -0.15 0.00 0.05 0.00 0.00 58.73 58.37 2jps h TYR 30 Cb 2.06 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 39.79 2jps h TYR 30 CO 0.08 0.59 -0.51 -0.24 -1.05 0.00 0.00 178.16 177.03 2jps h VAL 31 N 0.00 1.32 -0.72 -2.88 3.04 -1.65 -3.03 116.25 112.34 2jps h VAL 31 Ca -0.01 -1.75 -0.07 0.00 -1.01 0.00 0.00 66.70 63.87 2jps h VAL 31 Cb 1.12 1.75 -0.03 0.00 -2.01 0.00 0.00 31.29 32.12 2jps h VAL 31 CO 0.08 0.54 0.19 0.00 -1.01 0.00 0.00 177.57 177.37 2jps h ALA 32 N 1.05 0.98 -0.36 3.17 0.00 -1.52 -1.26 119.26 121.32 2jps h ALA 32 Ca 0.01 -0.24 0.01 0.00 0.00 0.00 0.00 54.91 54.69 2jps h ALA 32 Cb 1.03 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 2jps h ALA 32 CO 0.09 0.67 0.22 0.93 0.00 0.00 0.00 179.25 181.16 2jps h GLU 33 N 1.08 0.44 -0.81 0.00 5.08 -1.51 0.31 114.58 119.17 2jps h GLU 33 Ca 0.23 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.52 2jps h GLU 33 Cb 0.35 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.46 2jps h GLU 33 CO -0.00 0.29 0.34 -0.92 -1.00 0.00 0.00 179.01 177.72 2jps h TYR 34 N 0.45 1.22 -0.32 4.33 3.20 -1.39 0.37 116.97 124.82 2jps h TYR 34 Ca 0.14 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 61.92 2jps h TYR 34 Cb -0.02 -0.37 -0.02 0.00 1.54 0.00 0.00 36.73 37.86 2jps h TYR 34 CO -0.06 0.91 0.21 0.82 -1.64 0.00 0.00 178.16 178.39 2jps h ILE 35 N 1.17 1.09 -0.74 1.81 2.04 -0.53 0.42 117.51 122.77 2jps h ILE 35 Ca 0.27 -0.18 -0.03 0.00 1.00 0.00 0.00 64.86 65.92 2jps h ILE 35 Cb 0.19 0.63 -0.03 0.00 -0.74 0.00 0.00 36.82 36.87 2jps h ILE 35 CO -0.03 0.09 0.34 0.58 0.00 0.00 0.00 178.15 179.13 2jps h VAL 36 N 0.43 1.24 -0.73 1.67 2.07 -0.55 0.03 116.25 120.42 2jps h VAL 36 Ca 0.12 -0.72 0.04 0.00 0.82 0.00 0.00 66.70 66.96 2jps h VAL 36 Cb -0.04 0.34 -0.05 0.00 -1.52 0.00 0.00 31.29 30.02 2jps h VAL 36 CO -0.02 0.30 0.45 0.25 0.02 0.00 0.00 177.57 178.56 2jps h LEU 37 N 1.05 0.71 -0.61 2.57 5.85 -0.23 0.36 115.31 125.01 2jps h LEU 37 Ca 0.25 0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.93 2jps h LEU 37 Cb 0.15 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 2jps h LEU 37 CO -0.03 0.48 0.18 -0.07 -0.34 0.00 0.00 178.44 178.66 2jps h LEU 38 N 0.85 0.90 -0.21 2.25 3.38 -0.30 -1.50 115.31 120.68 2jps h LEU 38 Ca 0.30 -0.21 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 2jps h LEU 38 Cb 0.08 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 2jps h LEU 38 CO -0.13 0.88 0.12 0.40 0.09 0.00 0.00 178.44 179.79 2jps h ILE 39 N 0.88 1.10 -0.57 1.22 1.08 0.30 -2.31 117.51 119.20 2jps h ILE 39 Ca 0.20 -0.27 0.02 0.00 -0.39 0.00 0.00 64.86 64.41 2jps h ILE 39 Cb 0.31 0.91 -0.03 0.00 -3.07 0.00 0.00 36.82 34.93 2jps h ILE 39 CO -0.00 0.10 0.38 0.58 -0.69 0.00 0.00 178.15 178.51 2jps h VAL 40 N 0.23 1.11 -0.80 1.67 2.07 -0.11 -1.97 116.25 118.46 2jps h VAL 40 Ca 0.07 -0.25 0.07 0.00 0.82 0.00 0.00 66.70 67.41 2jps h VAL 40 Cb 0.06 0.32 -0.05 0.00 -1.52 0.00 0.00 31.29 30.10 2jps h VAL 40 CO -0.01 0.13 0.52 0.78 0.02 0.00 0.00 177.57 179.01 2jps h ASN 41 N 0.73 0.75 0.00 0.57 2.35 -0.70 -3.45 115.58 115.83 2jps h ASN 41 Ca 0.22 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.97 2jps h ASN 41 Cb -0.01 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.20 2jps h ASN 41 CO -0.05 0.48 0.00 0.61 -1.65 0.00 0.00 177.43 176.82 2jps n GLY 42 N -1.43 -1.37 0.00 2.83 0.00 -0.75 -5.07 105.19 99.40 2jps n GLY 42 Ca 0.12 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.61 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 -1.16 0.67 3.09 -0.02 0.00 -1.18 -4.98 105.19 101.61 2jps n GLY 43 Ca 0.00 -0.44 -0.34 0.00 0.00 0.00 0.00 46.02 45.25 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 -0.33 2.81 0.46 2.61 -4.23 -1.26 -4.98 115.64 110.71 2jps s THR 44 Ca 0.00 -2.04 0.25 0.00 -1.18 0.00 0.00 61.69 58.72 2jps s THR 44 Cb 0.00 -2.91 0.45 0.00 1.34 0.00 0.00 72.50 71.37 2jps s THR 44 CO 0.00 -0.53 1.80 0.58 -0.54 0.00 0.00 174.62 175.93 2jps h VAL 45 N 6.49 0.51 0.28 2.29 2.07 -1.96 0.93 116.25 126.86 2jps h VAL 45 Ca -0.11 -0.08 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 2jps h VAL 45 Cb 1.04 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.06 2jps h VAL 45 CO 0.59 0.04 -0.14 -0.08 0.02 0.00 0.00 177.57 178.01 2jps h GLU 46 N 0.24 -0.37 -0.04 1.57 4.81 -1.98 0.28 114.58 119.09 2jps h GLU 46 Ca 0.55 0.03 -0.10 0.00 -0.13 0.00 0.00 59.36 59.71 2jps h GLU 46 Cb 1.71 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 31.16 2jps h GLU 46 CO -0.17 -0.03 -0.44 0.66 -0.73 0.00 0.00 179.01 178.30 2jps h SER 47 N -0.90 0.09 -0.16 1.04 4.64 -1.82 -1.58 113.55 114.85 2jps h SER 47 Ca -0.04 -0.04 -0.18 0.00 -0.47 0.00 0.00 61.79 61.06 2jps h SER 47 Cb 0.51 -0.02 0.01 0.00 -0.31 0.00 0.00 62.40 62.58 2jps h SER 47 CO 0.06 0.52 -0.60 0.58 -0.87 0.00 0.00 176.83 176.52 2jps h VAL 48 N 0.07 1.31 -0.43 0.95 2.07 0.85 -2.88 116.25 118.20 2jps h VAL 48 Ca 0.00 -1.84 -0.13 0.00 0.82 0.00 0.00 66.70 65.56 2jps h VAL 48 Cb 0.81 1.98 -0.01 0.00 -1.52 0.00 0.00 31.29 32.54 2jps h VAL 48 CO 0.06 0.58 -0.23 0.58 0.02 0.00 0.00 177.57 178.57 2jps h VAL 49 N 0.39 1.27 -0.61 2.57 2.07 -0.33 -2.68 116.25 118.94 2jps h VAL 49 Ca -0.03 -1.37 0.05 0.00 0.82 0.00 0.00 66.70 66.17 2jps h VAL 49 Cb 1.23 1.19 -0.04 0.00 -1.52 0.00 0.00 31.29 32.15 2jps h VAL 49 CO 0.13 0.47 0.40 -0.78 0.02 0.00 0.00 177.57 177.81 2jps h ASP 50 N 0.76 0.56 -0.46 0.57 1.82 -1.28 0.10 116.42 118.47 2jps h ASP 50 Ca 0.10 -0.00 -0.09 0.00 -0.39 0.00 0.00 57.03 56.65 2jps h ASP 50 Cb 0.78 -0.12 -0.02 0.00 0.68 0.00 0.00 39.33 40.65 2jps h ASP 50 CO 0.06 0.37 -0.06 -0.33 -1.61 0.00 0.00 179.24 177.68 2jps h GLU 51 N 0.64 0.86 -0.32 0.28 3.07 -1.25 -0.43 114.58 117.42 2jps h GLU 51 Ca 0.26 -0.30 -0.14 0.00 -0.50 0.00 0.00 59.36 58.67 2jps h GLU 51 Cb 0.21 -0.06 -0.00 0.00 -0.84 0.00 0.00 28.75 28.05 2jps h GLU 51 CO -0.07 0.93 -0.35 -0.07 -1.40 0.00 0.00 179.01 178.05 2jps h LEU 52 N 0.70 0.86 -0.99 1.33 -0.00 -1.23 -3.01 115.31 112.98 2jps h LEU 52 Ca 0.12 -0.48 -0.03 0.00 -0.00 0.00 0.00 57.88 57.50 2jps h LEU 52 Cb 0.58 -0.24 -0.04 0.00 -0.00 0.00 0.00 40.66 40.96 2jps h LEU 52 CO 0.03 1.17 0.36 0.00 -0.00 0.00 0.00 178.44 180.00 2jps h ALA 53 N 0.72 1.21 -0.53 1.53 0.00 -0.89 1.11 119.26 122.41 2jps h ALA 53 Ca 0.05 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 54.87 2jps h ALA 53 Cb 0.93 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 2jps h ALA 53 CO 0.08 0.60 0.35 0.77 0.00 0.00 0.00 179.25 181.06 2jps h SER 54 N 1.07 0.41 0.00 0.00 0.02 -0.94 -2.88 113.55 111.23 2jps h SER 54 Ca 0.26 0.00 -0.41 0.00 -0.84 0.00 0.00 61.79 60.80 2jps h SER 54 Cb 0.12 -0.09 -0.07 0.00 0.14 0.00 0.00 62.40 62.50 2jps h SER 54 CO -0.03 0.27 -2.48 0.18 -1.14 0.00 0.00 176.83 173.62 2jps n LEU 55 N -4.47 2.64 -4.10 5.07 4.32 -0.83 -4.69 117.00 114.93 2jps n LEU 55 Ca 0.07 0.03 -0.40 0.00 -0.02 0.00 0.00 56.01 55.69 2jps n LEU 55 Cb 0.25 -0.89 -0.03 0.00 -1.62 0.00 0.00 43.42 41.14 2jps n LEU 55 CO 0.34 0.82 0.65 0.49 -1.22 0.00 0.00 177.39 178.47 2jps n PHE 56 N -3.59 4.10 -1.17 -1.77 3.72 0.38 -4.84 117.46 114.28 2jps n PHE 56 Ca -0.48 -3.72 -0.18 0.00 -0.05 0.00 0.00 57.45 53.01 2jps n PHE 56 Cb 0.96 -1.30 0.22 0.00 -0.94 0.00 0.00 39.48 38.42 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 2.08 4.12 -0.10 4.37 5.75 -1.09 -4.37 116.55 127.30 2jps n ASP 57 Ca 0.24 -3.48 -0.17 0.00 -0.01 0.00 0.00 54.79 51.37 2jps n ASP 57 Cb 0.37 -0.81 -0.13 0.00 -1.03 0.00 0.00 41.12 39.52 2jps n ASP 57 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 2jps n SER 58 N -0.81 1.60 -4.90 -1.12 7.64 -1.26 -4.96 113.62 109.81 2jps n SER 58 Ca 0.53 -0.05 -0.28 0.00 1.01 0.00 0.00 58.87 60.08 2jps n SER 58 Cb 1.58 -0.20 -0.02 0.00 -1.01 0.00 0.00 64.21 64.55 2jps n SER 58 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2jps s VAL 59 N -2.52 4.94 0.44 0.44 0.11 -1.26 -5.03 120.40 117.52 2jps s VAL 59 Ca -0.28 0.20 -0.24 0.00 -2.93 0.00 0.00 61.98 58.73 2jps s VAL 59 Cb 0.08 -3.77 -0.10 0.00 -1.53 0.00 0.00 36.38 31.07 2jps s VAL 59 CO 0.67 -0.49 1.08 -1.20 -3.33 0.00 0.00 175.10 171.83 2jps n SER 60 N -1.35 1.56 -0.18 3.54 7.64 -1.26 -4.85 113.62 118.72 2jps n SER 60 Ca -0.00 1.03 0.19 0.00 1.01 0.00 0.00 58.87 61.09 2jps n SER 60 Cb 0.54 -1.40 0.55 0.00 -1.01 0.00 0.00 64.21 62.90 2jps n SER 60 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 2jps h ARG 61 N 1.56 0.31 -0.80 1.43 3.08 -1.95 -0.74 114.38 117.26 2jps h ARG 61 Ca -0.46 -0.02 0.09 0.00 0.07 0.00 0.00 59.98 59.67 2jps h ARG 61 Cb 1.33 -0.07 -0.06 0.00 0.08 0.00 0.00 29.97 31.25 2jps h ARG 61 CO 0.57 0.20 0.52 0.22 -1.07 0.00 0.00 179.97 180.42 2jps h ASP 62 N 0.32 0.67 -0.41 7.04 1.82 -1.99 0.15 116.42 124.02 2jps h ASP 62 Ca 0.41 0.02 -0.09 0.00 -0.39 0.00 0.00 57.03 56.98 2jps h ASP 62 Cb 1.10 -0.12 -0.01 0.00 0.68 0.00 0.00 39.33 40.98 2jps h ASP 62 CO -0.12 0.40 -0.08 0.74 -1.61 0.00 0.00 179.24 178.58 2jps h THR 63 N 0.75 1.27 -0.30 2.25 2.02 -1.47 -0.51 112.91 116.92 2jps h THR 63 Ca 0.37 -1.16 -0.09 0.00 0.77 0.00 0.00 66.41 66.31 2jps h THR 63 Cb 0.43 1.18 -0.01 0.00 -1.74 0.00 0.00 68.15 68.01 2jps h THR 63 CO -0.14 0.39 -0.15 -0.07 0.37 0.00 0.00 175.52 175.92 2jps h LEU 64 N 0.60 0.66 -1.34 2.58 4.07 -1.34 -2.90 115.31 117.64 2jps h LEU 64 Ca 0.11 -0.41 -0.01 0.00 0.08 0.00 0.00 57.88 57.65 2jps h LEU 64 Cb 0.59 -0.18 -0.03 0.00 1.08 0.00 0.00 40.66 42.12 2jps h LEU 64 CO 0.04 0.92 0.30 0.00 -1.08 0.00 0.00 178.44 178.62 2jps h ALA 65 N 0.76 1.50 -0.93 1.53 0.00 -0.66 -2.25 119.26 119.22 2jps h ALA 65 Ca 0.07 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.91 2jps h ALA 65 Cb 0.68 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.19 2jps h ALA 65 CO 0.05 0.42 0.61 -0.97 0.00 0.00 0.00 179.25 179.35 2jps h ASN 66 N 0.75 1.05 0.05 0.00 -0.73 -0.88 0.14 115.58 115.96 2jps h ASN 66 Ca 0.19 -0.02 -0.17 0.00 1.87 0.00 0.00 56.30 58.17 2jps h ASN 66 Cb 0.02 -0.26 -0.00 0.00 0.27 0.00 0.00 38.32 38.35 2jps h ASN 66 CO -0.03 0.75 -0.61 0.58 -0.37 0.00 0.00 177.43 177.75 2jps h VAL 67 N 1.23 1.33 -0.16 2.57 2.07 -1.33 -2.70 116.25 119.25 2jps h VAL 67 Ca 0.35 -1.89 -0.14 0.00 0.82 0.00 0.00 66.70 65.83 2jps h VAL 67 Cb -0.11 1.86 -0.01 0.00 -1.52 0.00 0.00 31.29 31.51 2jps h VAL 67 CO -0.08 0.58 -0.51 0.58 0.02 0.00 0.00 177.57 178.16 2jps h VAL 68 N 0.42 1.33 -0.76 2.57 2.07 -1.05 -2.81 116.25 118.01 2jps h VAL 68 Ca -0.01 -1.75 -0.06 0.00 0.82 0.00 0.00 66.70 65.71 2jps h VAL 68 Cb 1.17 1.76 -0.03 0.00 -1.52 0.00 0.00 31.29 32.67 2jps h VAL 68 CO 0.11 0.54 0.25 1.56 0.02 0.00 0.00 177.57 180.06 2jps h GLN 69 N 0.35 1.17 0.00 1.57 4.20 -0.64 -2.27 115.11 119.50 2jps h GLN 69 Ca 0.01 -0.24 -0.10 0.00 0.06 0.00 0.00 58.65 58.39 2jps h GLN 69 Cb 1.02 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.61 2jps h GLN 69 CO 0.09 0.98 -0.45 0.00 -0.67 0.00 0.00 178.83 178.78 2jps h THR 70 N 1.13 1.31 -0.13 -0.54 1.03 -1.40 -2.51 112.91 111.80 2jps h THR 70 Ca 0.25 -1.56 -0.14 0.00 -0.01 0.00 0.00 66.41 64.95 2jps h THR 70 Cb 0.29 1.84 -0.01 0.00 -1.07 0.00 0.00 68.15 69.20 2jps h THR 70 CO -0.01 0.44 -0.53 0.00 -0.01 0.00 0.00 175.52 175.41 2jps h ALA 71 N 1.55 0.85 0.02 0.00 0.00 -1.19 -0.37 119.26 120.11 2jps h ALA 71 Ca -0.00 -0.50 -0.00 0.00 0.00 0.00 0.00 54.91 54.40 2jps h ALA 71 Cb 0.81 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.51 2jps h ALA 71 CO 0.06 0.68 -0.01 0.74 0.00 0.00 0.00 179.25 180.72 2jps h PHE 72 N 0.28 -0.02 -0.95 0.00 -1.00 -1.16 -2.17 116.94 111.93 2jps h PHE 72 Ca 0.01 -0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.78 2jps h PHE 72 Cb 1.03 0.01 -0.05 0.00 3.61 0.00 0.00 35.95 40.55 2jps h PHE 72 CO 0.03 0.36 0.58 0.74 -1.61 0.00 0.00 178.31 178.42 2jps h PHE 73 N -0.41 1.24 -0.89 -0.55 0.04 -1.44 -1.90 116.94 113.04 2jps h PHE 73 Ca -0.00 0.00 0.06 0.00 2.80 0.00 0.00 57.97 60.83 2jps h PHE 73 Cb 0.39 -0.41 -0.06 0.00 2.20 0.00 0.00 35.95 38.07 2jps h PHE 73 CO 0.06 0.82 0.58 0.00 -0.60 0.00 0.00 178.31 179.16 2jps h ALA 74 N 1.33 1.52 -0.97 2.45 0.00 -0.92 -1.33 119.26 121.35 2jps h ALA 74 Ca 0.34 -0.02 0.12 0.00 0.00 0.00 0.00 54.91 55.34 2jps h ALA 74 Cb -0.07 -0.27 -0.08 0.00 0.00 0.00 0.00 17.79 17.37 2jps h ALA 74 CO -0.07 0.35 0.62 -0.07 0.00 0.00 0.00 179.25 180.08 2jps h LEU 75 N 1.01 0.88 -0.49 0.00 -0.00 -0.67 1.00 115.31 117.04 2jps h LEU 75 Ca 0.38 0.04 -0.12 0.00 -0.00 0.00 0.00 57.88 58.18 2jps h LEU 75 Cb 0.19 -0.14 -0.01 0.00 -0.00 0.00 0.00 40.66 40.70 2jps h LEU 75 CO -0.14 0.48 -0.15 -0.08 -0.00 0.00 0.00 178.44 178.55 2jps h GLU 76 N 0.95 0.96 -0.52 1.13 4.81 -1.25 -1.29 114.58 119.36 2jps h GLU 76 Ca 0.47 -0.38 -0.08 0.00 -0.13 0.00 0.00 59.36 59.24 2jps h GLU 76 Cb 0.48 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.80 2jps h GLU 76 CO -0.23 1.05 0.02 0.00 -0.73 0.00 0.00 179.01 179.12 2jps h ALA 77 N 0.88 0.70 -0.72 2.92 0.00 -0.91 -2.69 119.26 119.44 2jps h ALA 77 Ca 0.12 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 2jps h ALA 77 Cb 0.72 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 2jps h ALA 77 CO 0.05 0.49 0.18 -0.07 0.00 0.00 0.00 179.25 179.91 2jps h LEU 78 N 0.77 1.09 -1.93 0.00 -0.00 -0.75 0.25 115.31 114.74 2jps h LEU 78 Ca 0.15 -0.23 -0.01 0.00 -0.00 0.00 0.00 57.88 57.79 2jps h LEU 78 Cb 0.49 -0.29 -0.00 0.00 -0.00 0.00 0.00 40.66 40.87 2jps h LEU 78 CO 0.02 1.04 -0.06 -0.61 -0.00 0.00 0.00 178.44 178.83 2jps h GLN 79 N 1.09 0.00 0.05 1.13 4.15 -1.01 -3.17 115.11 117.35 2jps h GLN 79 Ca 0.23 0.00 -0.35 0.00 0.77 0.00 0.00 58.65 59.29 2jps h GLN 79 Cb 0.37 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 28.02 2jps h GLN 79 CO 0.00 0.06 -2.01 1.04 -1.93 0.00 0.00 178.83 175.99 2jps n GLN 80 N -4.38 0.66 0.00 1.69 3.00 -0.93 -5.04 117.38 112.38 2jps n GLN 80 Ca -0.03 0.32 0.00 0.00 -0.01 0.00 0.00 57.00 57.28 2jps n GLN 80 Cb 0.14 -1.64 0.00 0.00 0.00 0.00 0.00 30.24 28.74 2jps n GLN 80 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2jps n GLY 81 N 1.79 -0.03 3.60 1.08 0.00 0.84 -5.12 105.19 107.35 2jps n GLY 81 Ca -0.39 0.08 -0.27 0.00 0.00 0.00 0.00 46.02 45.44 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 1.93 -0.06 1.61 2.12 -0.91 -4.95 118.70 118.44 2jps s GLU 82 Ca 0.00 -2.04 0.02 0.00 0.36 0.00 0.00 54.97 53.31 2jps s GLU 82 Cb 0.00 -1.68 -0.03 0.00 0.26 0.00 0.00 34.13 32.68 2jps s GLU 82 CO 0.00 0.01 -0.11 -1.12 -0.54 0.00 0.00 175.26 173.49 2jps s SER 83 N -3.69 4.27 -0.21 -1.70 0.01 -1.26 -4.87 113.70 106.25 2jps s SER 83 Ca 0.35 -0.14 0.10 0.00 1.31 0.00 0.00 55.95 57.56 2jps s SER 83 Cb 0.07 -1.05 -0.22 0.00 0.21 0.00 0.00 66.02 65.04 2jps s SER 83 CO 0.18 0.33 -0.00 0.00 0.41 0.00 0.00 173.24 174.16 2jps n ALA 84 N 2.40 1.44 -0.37 1.44 0.00 -1.26 -4.41 120.51 119.75 2jps n ALA 84 Ca -0.18 -1.17 0.00 0.00 0.00 0.00 0.00 53.44 52.10 2jps n ALA 84 Cb 0.52 -0.22 0.15 0.00 0.00 0.00 0.00 19.45 19.91 2jps n ALA 84 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2jps h GLU 85 N 0.00 1.22 -0.76 0.00 4.57 -1.95 -1.75 114.58 115.91 2jps h GLU 85 Ca -0.54 -0.07 0.09 0.00 -1.18 0.00 0.00 59.36 57.66 2jps h GLU 85 Cb 2.08 -0.28 -0.05 0.00 -0.16 0.00 0.00 28.75 30.34 2jps h GLU 85 CO -0.01 0.81 0.50 -0.97 -1.18 0.00 0.00 179.01 178.15 2jps h ASN 86 N 1.26 0.62 -0.24 1.04 -1.24 -2.01 -0.75 115.58 114.26 2jps h ASN 86 Ca 0.40 0.01 -0.09 0.00 0.71 0.00 0.00 56.30 57.33 2jps h ASN 86 Cb 0.01 -0.12 -0.02 0.00 0.73 0.00 0.00 38.32 38.92 2jps h ASN 86 CO -0.12 0.38 -0.16 0.40 -1.29 0.00 0.00 177.43 176.63 2jps h ILE 87 N 0.69 1.26 -0.77 2.57 2.04 -1.53 -2.82 117.51 118.96 2jps h ILE 87 Ca 0.35 -1.20 0.01 0.00 1.00 0.00 0.00 64.86 65.02 2jps h ILE 87 Cb 0.44 1.16 -0.04 0.00 -0.74 0.00 0.00 36.82 37.63 2jps h ILE 87 CO -0.13 0.40 0.51 0.58 0.00 0.00 0.00 178.15 179.51 2jps h VAL 88 N 0.60 1.19 -0.89 1.67 2.07 -1.03 -2.03 116.25 117.83 2jps h VAL 88 Ca 0.10 -0.35 0.08 0.00 0.82 0.00 0.00 66.70 67.34 2jps h VAL 88 Cb 0.62 0.07 -0.07 0.00 -1.52 0.00 0.00 31.29 30.38 2jps h VAL 88 CO 0.04 0.19 0.55 -1.28 0.02 0.00 0.00 177.57 177.09 2jps h SER 89 N 1.03 0.84 0.12 0.57 0.87 -1.34 0.12 113.55 115.76 2jps h SER 89 Ca 0.28 0.03 -0.10 0.00 -1.23 0.00 0.00 61.79 60.77 2jps h SER 89 Cb -0.11 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 61.69 2jps h SER 89 CO -0.06 0.52 -0.36 0.11 -0.53 0.00 0.00 176.83 176.51 2jps h LYS 90 N 0.96 0.34 -0.21 2.24 1.57 -1.43 -1.84 116.57 118.20 2jps h LYS 90 Ca 0.40 -0.15 -0.21 0.00 -1.87 0.00 0.00 60.65 58.83 2jps h LYS 90 Cb 0.25 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 32.56 2jps h LYS 90 CO -0.20 0.65 -0.68 0.82 -0.57 0.00 0.00 179.45 179.47 2jps h ILE 91 N 0.29 1.28 -0.36 1.86 1.08 -0.74 -0.60 117.51 120.33 2jps h ILE 91 Ca 0.03 -1.87 -0.12 0.00 -0.39 0.00 0.00 64.86 62.51 2jps h ILE 91 Cb 0.77 1.83 -0.01 0.00 -3.07 0.00 0.00 36.82 36.34 2jps h ILE 91 CO 0.06 0.60 -0.26 0.03 -0.69 0.00 0.00 178.15 177.89 2jps h ARG 92 N 0.58 0.73 -0.06 2.37 3.08 -0.72 0.31 114.38 120.67 2jps h ARG 92 Ca -0.02 -0.31 -0.23 0.00 0.07 0.00 0.00 59.98 59.49 2jps h ARG 92 Cb 1.29 -0.03 0.01 0.00 0.08 0.00 0.00 29.97 31.33 2jps h ARG 92 CO 0.14 0.91 -0.90 0.52 -1.07 0.00 0.00 179.97 179.57 2jps h MET 93 N 0.63 0.63 -0.09 0.04 2.86 -1.32 -1.33 114.93 116.36 2jps h MET 93 Ca 0.08 -0.60 -0.19 0.00 -2.06 0.00 0.00 59.70 56.92 2jps h MET 93 Cb 0.76 0.15 -0.00 0.00 0.06 0.00 0.00 31.60 32.57 2jps h MET 93 CO 0.06 1.21 -0.75 0.52 1.06 0.00 0.00 176.91 179.01 2jps h MET 94 N 0.39 0.48 -0.08 1.72 2.86 -1.00 -2.43 114.93 116.87 2jps h MET 94 Ca -0.08 -0.40 -0.17 0.00 -2.06 0.00 0.00 59.70 56.99 2jps h MET 94 Cb 1.53 0.09 -0.01 0.00 0.06 0.00 0.00 31.60 33.27 2jps h MET 94 CO 0.17 1.04 -0.66 -0.91 1.06 0.00 0.00 176.91 177.60 2jps h ASN 95 N 0.33 0.40 -0.26 1.22 2.35 -0.41 -2.71 115.58 116.50 2jps h ASN 95 Ca -0.04 -0.25 -0.14 0.00 -0.55 0.00 0.00 56.30 55.32 2jps h ASN 95 Cb 1.34 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 39.59 2jps h ASN 95 CO 0.13 0.95 -0.36 0.00 -1.65 0.00 0.00 177.43 176.51 2jps h ALA 96 N 1.05 0.72 -0.64 -0.83 0.00 -1.21 -2.96 119.26 115.38 2jps h ALA 96 Ca -0.02 -0.43 -0.08 0.00 0.00 0.00 0.00 54.91 54.38 2jps h ALA 96 Cb 1.21 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.85 2jps h ALA 96 CO 0.11 0.66 0.11 1.96 0.00 0.00 0.00 179.25 182.09 2jps h GLN 97 N 0.66 1.06 -0.71 0.00 4.20 -1.39 0.54 115.11 119.48 2jps h GLN 97 Ca 0.06 -0.28 0.04 0.00 0.06 0.00 0.00 58.65 58.53 2jps h GLN 97 Cb 0.91 -0.12 -0.04 0.00 0.30 0.00 0.00 27.48 28.52 2jps h GLN 97 CO 0.08 0.98 0.47 0.66 -0.67 0.00 0.00 178.83 180.35 2jps h SER 98 N 0.98 0.71 -0.59 1.46 4.64 -1.37 -2.55 113.55 116.83 2jps h SER 98 Ca 0.19 -0.01 -0.40 0.00 -0.47 0.00 0.00 61.79 61.11 2jps h SER 98 Cb 0.43 -0.16 -0.27 0.00 -0.31 0.00 0.00 62.40 62.10 2jps h SER 98 CO 0.01 0.48 -0.30 0.18 -0.87 0.00 0.00 176.83 176.34 2jps n LEU 99 N -4.46 4.89 -3.09 5.97 4.32 -1.01 -4.74 117.00 118.87 2jps n LEU 99 Ca 0.09 -4.30 -0.17 0.00 -0.02 0.00 0.00 56.01 51.61 2jps n LEU 99 Cb 0.15 -0.55 -0.02 0.00 -1.62 0.00 0.00 43.42 41.38 2jps n LEU 99 CO 0.34 1.68 -0.19 0.61 -1.22 0.00 0.00 177.39 178.62 2jps n GLY 100 N -0.91 3.42 3.49 -0.72 0.00 0.15 -4.99 105.19 105.62 2jps n GLY 100 Ca 0.41 -1.69 -0.28 0.00 0.00 0.00 0.00 46.02 44.46 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 -2.59 1.77 -1.50 1.61 0.74 -1.26 -4.67 119.66 113.76 2jps s GLN 101 Ca 0.39 -1.31 -0.13 0.00 0.05 0.00 0.00 55.36 54.36 2jps s GLN 101 Cb 0.36 -2.04 0.08 0.00 1.10 0.00 0.00 33.01 32.51 2jps s GLN 101 CO -0.07 0.44 0.84 0.45 -0.55 0.00 0.00 175.29 176.40 2jps n SER 102 N 0.44 -4.62 -3.44 6.67 2.88 -1.26 -4.95 113.62 109.35 2jps n SER 102 Ca -0.14 -0.67 -0.21 0.00 -1.33 0.00 0.00 58.87 56.53 2jps n SER 102 Cb 0.54 -3.72 -0.11 0.00 -0.75 0.00 0.00 64.21 60.17 2jps n SER 102 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2jps s ASP 103 N -3.12 2.22 -0.01 -3.46 2.15 -1.26 -5.14 116.67 108.05 2jps s ASP 103 Ca 0.59 -1.01 0.06 0.00 0.43 0.00 0.00 52.55 52.61 2jps s ASP 103 Cb -0.30 0.24 -0.03 0.00 -0.30 0.00 0.00 42.92 42.53 2jps s ASP 103 CO 0.73 -0.39 -0.18 -0.63 -0.17 0.00 0.00 175.17 174.52 2jps s ILE 104 N 2.18 2.73 0.00 4.11 1.09 -1.26 -5.09 121.20 124.96 2jps s ILE 104 Ca 0.10 -1.00 0.00 0.00 -1.10 0.00 0.00 60.65 58.65 2jps s ILE 104 Cb -0.15 -2.08 0.00 0.00 -1.06 0.00 0.00 42.46 39.17 2jps s ILE 104 CO -0.31 0.48 0.45 0.00 -0.10 0.00 0.00 174.94 175.46