#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k88 n THR 57 N 0.00 0.17 0.82 3.45 -1.04 -1.26 -2.70 114.28 113.72 1k88 n THR 57 Ca 0.00 -0.17 0.09 0.00 -2.04 0.00 0.00 64.05 61.93 1k88 n THR 57 Cb 0.00 0.09 0.00 0.00 -1.82 0.00 0.00 70.33 68.60 1k88 n THR 57 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1k88 n TYR 58 N -0.12 0.00 -4.20 -1.42 0.53 -1.26 -4.96 117.16 105.72 1k88 n TYR 58 Ca 0.04 0.00 -0.19 0.00 -1.02 0.00 0.00 57.90 56.74 1k88 n TYR 58 Cb 0.11 0.00 -0.12 0.00 -1.03 0.00 0.00 39.34 38.30 1k88 n TYR 58 CO 0.00 0.00 0.00 1.14 -1.02 0.00 0.00 176.86 176.98 1k88 s GLN 59 N -2.08 0.91 0.34 -0.72 -2.07 -1.10 0.37 119.66 115.31 1k88 s GLN 59 Ca 0.16 -1.07 -0.29 0.00 -1.82 0.00 0.00 55.36 52.34 1k88 s GLN 59 Cb 0.15 -0.89 -0.10 0.00 -1.09 0.00 0.00 33.01 31.07 1k88 s GLN 59 CO 0.45 0.19 1.34 0.71 -1.32 0.00 0.00 175.29 176.67 1k88 s TYR 60 N -1.56 2.96 -0.49 9.60 2.02 -0.33 -4.79 117.35 124.75 1k88 s TYR 60 Ca 0.02 1.36 -0.28 0.00 -0.37 0.00 0.00 57.07 57.81 1k88 s TYR 60 Cb -0.08 -3.75 -0.01 0.00 -0.40 0.00 0.00 41.96 37.72 1k88 s TYR 60 CO 0.03 -2.09 1.65 1.21 -1.57 0.00 0.00 175.55 174.78 1k88 s ASN 61 N -0.41 5.84 -0.02 2.29 2.47 -1.26 -4.86 114.94 118.99 1k88 s ASN 61 Ca 0.50 0.65 0.12 0.00 0.42 0.00 0.00 52.86 54.55 1k88 s ASN 61 Cb -0.41 -2.53 0.37 0.00 -1.45 0.00 0.00 41.25 37.23 1k88 s ASN 61 CO 0.55 -1.87 1.28 0.23 -3.72 0.00 0.00 177.10 173.57 1k88 n MET 62 N 8.68 2.13 -2.61 0.43 2.81 -1.26 -4.76 117.12 122.54 1k88 n MET 62 Ca 0.18 -1.50 -0.43 0.00 -1.81 0.00 0.00 57.70 54.14 1k88 n MET 62 Cb 0.49 -1.41 0.00 0.00 -0.71 0.00 0.00 33.22 31.59 1k88 n MET 62 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 1k88 n ASN 63 N 0.63 4.96 -4.11 7.83 2.85 -1.26 -4.90 115.26 121.26 1k88 n ASN 63 Ca 0.14 -2.93 -0.11 0.00 -0.11 0.00 0.00 54.58 51.58 1k88 n ASN 63 Cb 0.41 -1.73 -0.08 0.00 1.24 0.00 0.00 39.78 39.62 1k88 n ASN 63 CO 0.00 0.00 0.00 -0.36 -2.11 0.00 0.00 177.26 174.79 1k88 s PHE 64 N 3.91 0.81 0.08 1.20 0.40 -1.26 -5.04 117.98 118.08 1k88 s PHE 64 Ca 0.53 -1.09 -0.23 0.00 -0.60 0.00 0.00 56.93 55.53 1k88 s PHE 64 Cb 0.03 -0.23 -0.15 0.00 0.51 0.00 0.00 43.02 43.18 1k88 s PHE 64 CO 0.07 -0.79 1.67 0.93 0.70 0.00 0.00 175.22 177.79 1k88 h GLU 65 N 2.46 0.04 -6.22 0.44 5.08 -1.89 -3.45 114.58 111.04 1k88 h GLU 65 Ca -0.32 -0.00 -0.60 0.00 -1.00 0.00 0.00 59.36 57.44 1k88 h GLU 65 Cb 1.25 -0.01 -0.13 0.00 0.50 0.00 0.00 28.75 30.36 1k88 h GLU 65 CO 0.45 0.11 -0.73 -1.59 -1.00 0.00 0.00 179.01 176.25 1k88 s LYS 66 N -5.87 1.85 0.04 2.33 -2.85 -0.94 -5.02 119.74 109.28 1k88 s LYS 66 Ca -0.13 -1.66 -0.19 0.00 -1.00 0.00 0.00 55.97 52.98 1k88 s LYS 66 Cb 0.06 -1.89 -0.16 0.00 -2.06 0.00 0.00 37.83 33.78 1k88 s LYS 66 CO 0.67 0.34 1.28 1.25 0.10 0.00 0.00 175.35 178.99 1k88 h LEU 67 N 2.20 0.48 0.00 2.77 6.46 -1.85 -2.93 115.31 122.43 1k88 h LEU 67 Ca -0.41 -0.57 0.00 0.00 -0.12 0.00 0.00 57.88 56.78 1k88 h LEU 67 Cb 1.25 -0.14 0.00 0.00 -0.73 0.00 0.00 40.66 41.05 1k88 h LEU 67 CO 0.60 0.95 0.00 0.61 -0.62 0.00 0.00 178.44 179.98 1k88 n GLY 68 N 0.45 0.88 3.80 3.75 0.00 -1.26 -1.71 105.19 111.11 1k88 n GLY 68 Ca -0.07 -1.93 -0.34 0.00 0.00 0.00 0.00 46.02 43.69 1k88 n GLY 68 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1k88 s LYS 69 N -1.06 4.07 -0.25 1.61 2.47 -1.26 -0.98 119.74 124.34 1k88 s LYS 69 Ca 0.00 1.27 -0.03 0.00 -1.56 0.00 0.00 55.97 55.65 1k88 s LYS 69 Cb 0.00 -2.22 0.10 0.00 -1.46 0.00 0.00 37.83 34.25 1k88 s LYS 69 CO 0.00 -0.19 0.18 0.00 0.16 0.00 0.00 175.35 175.50 1k88 s ILE 71 N 2.21 4.94 -0.27 0.00 1.01 -0.31 -1.98 121.20 126.80 1k88 s ILE 71 Ca 0.07 1.21 0.02 0.00 0.00 0.00 0.00 60.65 61.96 1k88 s ILE 71 Cb -0.15 -3.92 0.07 0.00 0.01 0.00 0.00 42.46 38.47 1k88 s ILE 71 CO -0.26 0.41 -0.04 -0.63 0.00 0.00 0.00 174.94 174.43 1k88 s ILE 72 N -0.14 1.82 -0.31 2.92 1.01 -0.32 -0.71 121.20 125.45 1k88 s ILE 72 Ca 0.31 -1.58 -0.21 0.00 0.00 0.00 0.00 60.65 59.17 1k88 s ILE 72 Cb -0.18 -2.11 -0.01 0.00 0.01 0.00 0.00 42.46 40.18 1k88 s ILE 72 CO 0.17 -0.22 0.66 -0.63 0.00 0.00 0.00 174.94 174.91 1k88 s ILE 73 N 1.23 4.90 -0.63 2.92 -1.09 -0.27 -0.28 121.20 127.98 1k88 s ILE 73 Ca -0.02 0.86 0.02 0.00 -2.23 0.00 0.00 60.65 59.27 1k88 s ILE 73 Cb -0.19 -4.04 0.16 0.00 -1.58 0.00 0.00 42.46 36.81 1k88 s ILE 73 CO -0.08 -0.19 0.42 0.21 -1.23 0.00 0.00 174.94 174.07 1k88 s ASN 74 N 1.67 4.87 -0.57 3.58 3.04 0.16 -1.51 114.94 126.19 1k88 s ASN 74 Ca 0.26 -3.23 -0.21 0.00 0.04 0.00 0.00 52.86 49.73 1k88 s ASN 74 Cb -0.15 -1.73 0.07 0.00 -1.54 0.00 0.00 41.25 37.90 1k88 s ASN 74 CO 0.12 -0.23 0.79 0.20 -3.04 0.00 0.00 177.10 174.94 1k88 s ASN 75 N -0.24 6.23 -0.24 -4.21 0.01 -0.91 -1.52 114.94 114.07 1k88 s ASN 75 Ca 0.20 -0.89 0.00 0.00 -0.71 0.00 0.00 52.86 51.46 1k88 s ASN 75 Cb -0.18 -2.36 -0.15 0.00 0.41 0.00 0.00 41.25 38.97 1k88 s ASN 75 CO -0.06 -1.14 -0.22 1.17 -1.51 0.00 0.00 177.10 175.34 1k88 n LYS 76 N 6.86 0.59 -4.47 -0.60 4.81 -1.26 -4.49 118.16 119.60 1k88 n LYS 76 Ca -0.05 0.15 -0.33 0.00 -0.87 0.00 0.00 58.31 57.21 1k88 n LYS 76 Cb 0.45 -1.47 -0.10 0.00 0.02 0.00 0.00 35.03 33.93 1k88 n LYS 76 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 1k88 s ASN 77 N -6.40 4.77 0.09 3.14 0.01 -1.26 -1.58 114.94 113.71 1k88 s ASN 77 Ca -0.32 -0.06 0.07 0.00 -0.71 0.00 0.00 52.86 51.83 1k88 s ASN 77 Cb 0.09 -1.18 -0.03 0.00 0.41 0.00 0.00 41.25 40.53 1k88 s ASN 77 CO 0.54 0.31 -0.17 -0.36 -1.51 0.00 0.00 177.10 175.91 1k88 s PHE 78 N -0.95 1.48 0.70 2.20 0.40 -1.26 -4.73 117.98 115.82 1k88 s PHE 78 Ca 0.16 -0.44 -0.16 0.00 -0.60 0.00 0.00 56.93 55.89 1k88 s PHE 78 Cb -0.11 -0.82 0.02 0.00 0.51 0.00 0.00 43.02 42.62 1k88 s PHE 78 CO 0.06 0.13 1.19 -0.51 0.70 0.00 0.00 175.22 176.78 1k88 s ASP 79 N -1.83 4.50 0.22 1.36 1.01 0.13 -4.92 116.67 117.15 1k88 s ASP 79 Ca 0.02 2.30 -0.08 0.00 0.71 0.00 0.00 52.55 55.50 1k88 s ASP 79 Cb -0.10 -2.58 0.23 0.00 1.01 0.00 0.00 42.92 41.48 1k88 s ASP 79 CO 0.03 -2.05 1.86 0.50 0.21 0.00 0.00 175.17 175.72 1k88 h LYS 80 N -0.06 0.92 0.00 8.23 1.63 -1.91 -2.95 116.57 122.42 1k88 h LYS 80 Ca -0.48 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.27 1k88 h LYS 80 Cb 1.29 -0.21 0.00 0.00 -0.60 0.00 0.00 32.23 32.71 1k88 h LYS 80 CO 0.51 0.61 0.00 0.28 -3.45 0.00 0.00 179.45 177.40 1k88 n VAL 81 N -4.62 0.00 0.21 2.00 0.31 -1.26 0.14 118.33 115.11 1k88 n VAL 81 Ca 0.09 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.44 1k88 n VAL 81 Cb 0.10 -0.89 -0.03 0.00 -0.91 0.00 0.00 33.84 32.11 1k88 n VAL 81 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1k88 n THR 82 N -0.71 0.00 -3.79 2.52 -2.24 -1.11 -4.92 114.28 104.03 1k88 n THR 82 Ca 0.00 -0.39 -0.28 0.00 -2.27 0.00 0.00 64.05 61.11 1k88 n THR 82 Cb 0.00 1.00 0.05 0.00 -2.10 0.00 0.00 70.33 69.28 1k88 n THR 82 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1k88 n GLY 83 N 1.11 -0.52 3.36 3.38 0.00 0.12 -4.99 105.19 107.66 1k88 n GLY 83 Ca 0.01 0.22 -0.27 0.00 0.00 0.00 0.00 46.02 45.98 1k88 n GLY 83 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1k88 s MET 84 N -6.50 1.33 0.27 1.61 -1.94 -1.26 -5.15 119.30 107.66 1k88 s MET 84 Ca 0.63 -1.32 0.08 0.00 -1.71 0.00 0.00 55.69 53.37 1k88 s MET 84 Cb -0.30 -1.72 -0.04 0.00 2.01 0.00 0.00 34.83 34.78 1k88 s MET 84 CO 0.79 0.40 0.17 0.20 -0.01 0.00 0.00 175.02 176.57 1k88 s GLY 85 N -2.13 1.52 0.22 -0.03 0.00 -1.26 -4.68 107.32 100.97 1k88 s GLY 85 Ca 0.13 -1.51 -0.30 0.00 0.00 0.00 0.00 44.72 43.04 1k88 s GLY 85 CO 0.06 -1.53 0.97 -0.62 0.00 0.00 0.00 173.10 171.97 1k88 n VAL 86 N -1.15 1.55 -3.33 1.40 0.31 -1.26 -4.86 118.33 110.99 1k88 n VAL 86 Ca -0.07 -0.39 -0.43 0.00 -0.01 0.00 0.00 64.34 63.44 1k88 n VAL 86 Cb 0.58 -0.71 -0.01 0.00 -0.91 0.00 0.00 33.84 32.79 1k88 n VAL 86 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1k88 n ARG 87 N 1.15 3.55 -1.96 5.55 1.74 -0.61 -5.04 116.66 121.04 1k88 n ARG 87 Ca 0.13 -4.48 -0.39 0.00 -0.77 0.00 0.00 57.85 52.34 1k88 n ARG 87 Cb 0.27 -2.52 0.01 0.00 -1.02 0.00 0.00 32.46 29.20 1k88 n ARG 87 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1k88 s ASN 88 N 0.53 6.02 0.00 0.55 0.01 -1.26 -2.47 114.94 118.32 1k88 s ASN 88 Ca 0.31 2.71 0.00 0.00 -0.71 0.00 0.00 52.86 55.17 1k88 s ASN 88 Cb -0.07 -2.64 0.00 0.00 0.41 0.00 0.00 41.25 38.95 1k88 s ASN 88 CO -0.06 -1.05 0.00 0.61 -1.51 0.00 0.00 177.10 175.09 1k88 n GLY 89 N 0.63 1.48 0.16 0.66 0.00 -1.26 -4.87 105.19 101.99 1k88 n GLY 89 Ca 0.05 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.21 1k88 n GLY 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k88 h THR 90 N 0.00 0.00 0.04 2.61 1.03 -1.87 -1.88 112.91 112.85 1k88 h THR 90 Ca 0.00 -0.49 -0.23 0.00 -0.01 0.00 0.00 66.41 65.69 1k88 h THR 90 Cb 0.00 1.40 -0.01 0.00 -1.07 0.00 0.00 68.15 68.47 1k88 h THR 90 CO 0.00 0.00 -1.03 0.44 -0.01 0.00 0.00 175.52 174.92 1k88 h ASP 91 N 0.00 0.25 -0.27 0.00 5.19 -1.89 0.35 116.42 120.05 1k88 h ASP 91 Ca 0.00 -0.24 -0.05 0.00 -0.62 0.00 0.00 57.03 56.12 1k88 h ASP 91 Cb 0.62 -0.08 -0.01 0.00 0.18 0.00 0.00 39.33 40.04 1k88 h ASP 91 CO 0.00 1.12 -0.03 0.11 -3.12 0.00 0.00 179.24 177.33 1k88 h LYS 92 N 0.07 0.49 0.73 3.56 1.79 -1.81 -1.80 116.57 119.59 1k88 h LYS 92 Ca -0.07 -0.17 -0.03 0.00 -2.18 0.00 0.00 60.65 58.20 1k88 h LYS 92 Cb 1.73 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 32.35 1k88 h LYS 92 CO 0.16 0.67 -0.39 -0.44 -1.08 0.00 0.00 179.45 178.36 1k88 h ASP 93 N 0.25 -0.96 -0.65 0.86 3.32 -1.29 -0.92 116.42 117.03 1k88 h ASP 93 Ca 0.07 0.04 0.13 0.00 0.02 0.00 0.00 57.03 57.30 1k88 h ASP 93 Cb 0.47 0.27 -0.10 0.00 0.22 0.00 0.00 39.33 40.18 1k88 h ASP 93 CO 0.02 -0.64 0.09 0.00 -1.72 0.00 0.00 179.24 176.98 1k88 h ALA 94 N -0.81 0.74 -0.20 3.45 0.00 -0.91 0.20 119.26 121.73 1k88 h ALA 94 Ca -0.10 0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1k88 h ALA 94 Cb 0.82 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 1k88 h ALA 94 CO 0.13 -0.36 -0.05 1.49 0.00 0.00 0.00 179.25 180.46 1k88 h GLU 95 N 0.20 0.40 -0.54 0.00 4.81 -1.25 -0.36 114.58 117.83 1k88 h GLU 95 Ca 0.35 -0.15 0.10 0.00 -0.13 0.00 0.00 59.36 59.53 1k88 h GLU 95 Cb 0.57 -0.02 -0.09 0.00 0.63 0.00 0.00 28.75 29.84 1k88 h GLU 95 CO -0.49 0.65 0.03 0.00 -0.73 0.00 0.00 179.01 178.47 1k88 h ALA 96 N 0.73 0.55 -0.84 2.92 0.00 -0.13 -1.03 119.26 121.46 1k88 h ALA 96 Ca 0.05 0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 1k88 h ALA 96 Cb 0.51 0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.51 1k88 h ALA 96 CO 0.02 -0.37 0.39 -0.07 0.00 0.00 0.00 179.25 179.23 1k88 h LEU 97 N 0.15 1.10 0.65 0.00 3.38 -0.46 -2.18 115.31 117.95 1k88 h LEU 97 Ca 0.28 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 1k88 h LEU 97 Cb 0.42 -0.28 0.01 0.00 0.09 0.00 0.00 40.66 40.89 1k88 h LEU 97 CO -0.43 0.93 -0.31 0.15 0.09 0.00 0.00 178.44 178.87 1k88 h PHE 98 N 1.19 -0.81 0.00 1.13 3.57 0.19 0.83 116.94 123.05 1k88 h PHE 98 Ca 0.29 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.73 1k88 h PHE 98 Cb 0.13 0.27 -0.00 0.00 2.79 0.00 0.00 35.95 39.13 1k88 h PHE 98 CO 0.02 -0.48 -0.16 1.57 -2.23 0.00 0.00 178.31 177.03 1k88 h LYS 99 N -0.97 0.00 0.38 1.11 2.10 -1.34 0.16 116.57 118.01 1k88 h LYS 99 Ca -0.09 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.54 1k88 h LYS 99 Cb 0.70 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.03 1k88 h LYS 99 CO 0.15 0.16 -0.18 0.00 -2.00 0.00 0.00 179.45 177.57 1k88 h PHE 101 N -1.12 0.47 -0.35 0.00 -1.00 -0.74 -1.44 116.94 112.76 1k88 h PHE 101 Ca -0.05 -0.05 -0.01 0.00 2.81 0.00 0.00 57.97 60.66 1k88 h PHE 101 Cb 0.42 -0.13 -0.02 0.00 3.61 0.00 0.00 35.95 39.83 1k88 h PHE 101 CO 0.01 0.51 0.17 -0.09 -1.61 0.00 0.00 178.31 177.30 1k88 h ARG 102 N 0.43 0.50 0.00 1.51 9.65 -0.77 -1.71 114.38 123.99 1k88 h ARG 102 Ca 0.09 -0.07 -0.03 0.00 -1.10 0.00 0.00 59.98 58.86 1k88 h ARG 102 Cb 0.38 -0.09 -0.00 0.00 -1.39 0.00 0.00 29.97 28.86 1k88 h ARG 102 CO 0.02 0.45 -0.15 1.03 2.80 0.00 0.00 179.97 184.12 1k88 h SER 103 N 0.43 0.00 0.28 -3.80 0.87 -0.59 -0.40 113.55 110.34 1k88 h SER 103 Ca 0.12 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.57 1k88 h SER 103 Cb 0.12 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.06 1k88 h SER 103 CO -0.02 0.15 -0.44 -0.07 -0.53 0.00 0.00 176.83 175.92 1k88 h LEU 104 N 0.00 0.22 0.00 2.23 3.38 -0.67 -3.47 115.31 117.00 1k88 h LEU 104 Ca -0.00 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1k88 h LEU 104 Cb 0.30 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1k88 h LEU 104 CO 0.02 0.63 0.00 0.61 0.09 0.00 0.00 178.44 179.79 1k88 n GLY 105 N -0.13 0.29 3.85 0.83 0.00 -0.16 -4.98 105.19 104.89 1k88 n GLY 105 Ca -0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 1k88 n GLY 105 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1k88 s PHE 106 N -1.11 3.53 -0.77 1.61 0.40 -0.70 -4.05 117.98 116.89 1k88 s PHE 106 Ca 0.00 1.38 -0.17 0.00 -0.60 0.00 0.00 56.93 57.55 1k88 s PHE 106 Cb 0.00 -2.75 0.16 0.00 0.51 0.00 0.00 43.02 40.94 1k88 s PHE 106 CO 0.00 -0.50 0.82 -0.51 0.70 0.00 0.00 175.22 175.74 1k88 s ASP 107 N -3.54 6.54 -0.07 1.36 1.01 -0.16 -4.42 116.67 117.40 1k88 s ASP 107 Ca 0.57 -2.14 -0.23 0.00 0.71 0.00 0.00 52.55 51.46 1k88 s ASP 107 Cb -0.10 -2.28 -0.04 0.00 1.01 0.00 0.00 42.92 41.51 1k88 s ASP 107 CO 0.41 -0.86 0.69 -0.69 0.21 0.00 0.00 175.17 174.93 1k88 s VAL 108 N 1.55 5.05 -0.06 -1.27 1.01 -1.26 -1.92 120.40 123.51 1k88 s VAL 108 Ca 0.19 1.42 0.01 0.00 0.00 0.00 0.00 61.98 63.60 1k88 s VAL 108 Cb -0.14 -4.03 0.02 0.00 0.00 0.00 0.00 36.38 32.23 1k88 s VAL 108 CO -0.04 0.26 -0.08 -0.63 0.00 0.00 0.00 175.10 174.61 1k88 s ILE 109 N 0.78 0.82 -0.11 2.22 1.01 -0.84 -5.00 121.20 120.09 1k88 s ILE 109 Ca 0.37 -0.27 -0.03 0.00 0.00 0.00 0.00 60.65 60.72 1k88 s ILE 109 Cb -0.18 -0.80 -0.03 0.00 0.01 0.00 0.00 42.46 41.46 1k88 s ILE 109 CO 0.18 0.29 0.01 -0.69 0.00 0.00 0.00 174.94 174.73 1k88 s VAL 110 N 0.93 4.34 -0.07 2.92 1.01 -1.26 -1.18 120.40 127.10 1k88 s VAL 110 Ca -0.10 -0.22 0.04 0.00 0.00 0.00 0.00 61.98 61.69 1k88 s VAL 110 Cb -0.15 -2.86 0.00 0.00 0.00 0.00 0.00 36.38 33.38 1k88 s VAL 110 CO 0.01 0.57 -0.19 -0.31 0.00 0.00 0.00 175.10 175.17 1k88 s TYR 111 N -0.49 2.01 0.16 5.22 1.51 0.62 -4.96 117.35 121.41 1k88 s TYR 111 Ca 0.09 -0.70 0.07 0.00 -1.01 0.00 0.00 57.07 55.51 1k88 s TYR 111 Cb -0.12 -1.36 -0.04 0.00 -0.11 0.00 0.00 41.96 40.33 1k88 s TYR 111 CO 0.02 -0.28 -0.01 -0.80 -1.11 0.00 0.00 175.55 173.38 1k88 s ASN 112 N 0.25 4.77 -0.76 2.29 -0.87 -1.26 0.40 114.94 119.77 1k88 s ASN 112 Ca -0.11 -0.37 -0.19 0.00 -1.57 0.00 0.00 52.86 50.62 1k88 s ASN 112 Cb -0.15 -1.02 0.03 0.00 -0.02 0.00 0.00 41.25 40.08 1k88 s ASN 112 CO 0.05 0.11 0.44 0.47 -2.57 0.00 0.00 177.10 175.60 1k88 n ASP 113 N 0.04 -2.81 -4.83 -1.22 8.00 -0.57 -4.88 116.55 110.28 1k88 n ASP 113 Ca -0.10 -0.83 -0.33 0.00 0.71 0.00 0.00 54.79 54.24 1k88 n ASP 113 Cb 0.54 -1.05 -0.06 0.00 -0.02 0.00 0.00 41.12 40.53 1k88 n ASP 113 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1k88 s SER 115 N -2.45 5.70 0.33 0.00 1.04 -1.26 0.25 113.70 117.30 1k88 s SER 115 Ca 0.61 0.56 0.01 0.00 0.48 0.00 0.00 55.95 57.60 1k88 s SER 115 Cb -0.09 -1.65 0.57 0.00 0.10 0.00 0.00 66.02 64.95 1k88 s SER 115 CO 0.19 -0.92 1.99 0.00 0.98 0.00 0.00 173.24 175.48 1k88 h ALA 117 N 1.56 0.55 0.10 0.00 0.00 -1.97 -1.80 119.26 117.69 1k88 h ALA 117 Ca 0.27 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1k88 h ALA 117 Cb -0.07 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1k88 h ALA 117 CO -0.06 0.18 -0.11 -0.22 0.00 0.00 0.00 179.25 179.04 1k88 h LYS 118 N 0.53 -0.22 -0.89 0.00 1.63 -1.58 -0.90 116.57 115.14 1k88 h LYS 118 Ca 0.14 0.02 -0.00 0.00 -0.85 0.00 0.00 60.65 59.95 1k88 h LYS 118 Cb 0.24 0.05 -0.04 0.00 -0.60 0.00 0.00 32.23 31.88 1k88 h LYS 118 CO -0.01 -0.15 0.56 0.52 -3.45 0.00 0.00 179.45 176.92 1k88 h MET 119 N -0.23 1.20 0.41 1.90 2.86 -1.08 0.38 114.93 120.37 1k88 h MET 119 Ca 0.01 -0.10 -0.02 0.00 -2.06 0.00 0.00 59.70 57.53 1k88 h MET 119 Cb 0.23 -0.26 0.00 0.00 0.06 0.00 0.00 31.60 31.63 1k88 h MET 119 CO -0.04 0.83 -0.19 1.96 1.06 0.00 0.00 176.91 180.53 1k88 h GLN 120 N 1.22 -0.52 -0.30 1.72 1.08 -1.07 -2.05 115.11 115.19 1k88 h GLN 120 Ca 0.32 0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.56 1k88 h GLN 120 Cb -0.08 0.12 -0.01 0.00 -0.05 0.00 0.00 27.48 27.45 1k88 h GLN 120 CO -0.06 -0.29 0.19 0.22 -0.95 0.00 0.00 178.83 177.94 1k88 h ASP 121 N -0.65 0.36 -0.56 1.46 3.58 -0.94 0.14 116.42 119.82 1k88 h ASP 121 Ca -0.06 -0.03 0.08 0.00 0.42 0.00 0.00 57.03 57.44 1k88 h ASP 121 Cb 0.48 -0.09 -0.10 0.00 1.72 0.00 0.00 39.33 41.33 1k88 h ASP 121 CO 0.09 0.28 -0.46 0.25 -2.88 0.00 0.00 179.24 176.52 1k88 h LEU 122 N 0.40 -1.58 -0.79 2.28 5.85 -0.19 0.25 115.31 121.54 1k88 h LEU 122 Ca 0.11 0.25 -0.11 0.00 0.84 0.00 0.00 57.88 58.97 1k88 h LEU 122 Cb -0.02 0.70 -0.02 0.00 0.37 0.00 0.00 40.66 41.70 1k88 h LEU 122 CO -0.02 -0.35 -0.50 -0.07 -0.34 0.00 0.00 178.44 177.16 1k88 h LEU 123 N -0.25 0.00 -0.42 2.25 4.07 -1.15 -2.51 115.31 117.31 1k88 h LEU 123 Ca 0.16 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 58.08 1k88 h LEU 123 Cb 0.56 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.29 1k88 h LEU 123 CO -0.68 0.50 0.10 0.50 -1.08 0.00 0.00 178.44 177.79 1k88 h LYS 124 N 0.00 0.68 -0.46 1.13 3.64 0.11 -2.25 116.57 119.41 1k88 h LYS 124 Ca -0.01 -0.16 -0.05 0.00 -1.27 0.00 0.00 60.65 59.16 1k88 h LYS 124 Cb 1.03 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.75 1k88 h LYS 124 CO 0.07 0.69 0.09 0.87 -2.27 0.00 0.00 179.45 178.89 1k88 h LYS 125 N 0.54 0.76 -0.27 1.90 1.57 -0.53 -2.43 116.57 118.11 1k88 h LYS 125 Ca 0.13 -0.20 0.06 0.00 -1.87 0.00 0.00 60.65 58.77 1k88 h LYS 125 Cb 0.32 -0.09 -0.06 0.00 0.08 0.00 0.00 32.23 32.48 1k88 h LYS 125 CO 0.00 0.77 -0.10 0.00 -0.57 0.00 0.00 179.45 179.55 1k88 h ALA 126 N 0.96 0.14 -0.56 3.86 0.00 -1.31 0.14 119.26 122.49 1k88 h ALA 126 Ca 0.14 0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.20 1k88 h ALA 126 Cb 0.37 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 1k88 h ALA 126 CO 0.01 -0.50 0.37 0.66 0.00 0.00 0.00 179.25 179.79 1k88 h SER 127 N -0.05 0.51 1.04 0.00 4.64 -1.30 -1.23 113.55 117.17 1k88 h SER 127 Ca 0.14 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1k88 h SER 127 Cb 0.25 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 1k88 h SER 127 CO -0.31 0.35 0.00 -0.62 -0.87 0.00 0.00 176.83 175.38 1k88 n GLU 128 N -4.47 0.18 -1.07 4.77 1.02 -0.04 -4.82 120.64 116.21 1k88 n GLU 128 Ca 0.07 0.28 -0.29 0.00 -0.02 0.00 0.00 57.16 57.19 1k88 n GLU 128 Cb 0.18 -1.77 0.22 0.00 -0.02 0.00 0.00 31.44 30.05 1k88 n GLU 128 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1k88 s GLU 129 N -3.17 -0.67 -0.36 3.49 2.02 -0.46 -5.00 118.70 114.55 1k88 s GLU 129 Ca 0.08 0.19 -0.12 0.00 0.02 0.00 0.00 54.97 55.13 1k88 s GLU 129 Cb 0.12 -1.64 0.00 0.00 0.10 0.00 0.00 34.13 32.71 1k88 s GLU 129 CO 0.48 -3.40 0.23 0.34 0.02 0.00 0.00 175.26 172.93 1k88 s ASP 130 N -3.65 5.92 -0.39 -0.19 2.15 -1.26 -4.96 116.67 114.31 1k88 s ASP 130 Ca 0.69 -0.65 0.07 0.00 0.43 0.00 0.00 52.55 53.08 1k88 s ASP 130 Cb -0.14 -2.10 0.66 0.00 -0.30 0.00 0.00 42.92 41.04 1k88 s ASP 130 CO 0.57 -0.31 1.81 1.41 -0.17 0.00 0.00 175.17 178.48 1k88 n HIS 131 N 5.08 2.55 -0.06 -5.34 8.25 -1.26 -4.59 115.22 119.85 1k88 n HIS 131 Ca -0.12 -1.62 0.02 0.00 -0.26 0.00 0.00 57.72 55.73 1k88 n HIS 131 Cb 0.48 -0.80 0.34 0.00 1.12 0.00 0.00 29.99 31.13 1k88 n HIS 131 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 1k88 h THR 132 N 1.45 1.16 -0.61 1.59 2.02 -1.94 -1.55 112.91 115.03 1k88 h THR 132 Ca 0.46 -0.41 0.00 0.00 0.77 0.00 0.00 66.41 67.23 1k88 h THR 132 Cb 2.51 0.52 0.00 0.00 -1.74 0.00 0.00 68.15 69.45 1k88 h THR 132 CO 0.88 0.17 0.00 0.59 0.37 0.00 0.00 175.52 177.53 1k88 n ASN 133 N -4.40 5.10 -4.71 4.18 3.02 -1.26 -4.92 115.26 112.27 1k88 n ASN 133 Ca 0.04 -2.63 -0.34 0.00 -0.03 0.00 0.00 54.58 51.62 1k88 n ASN 133 Cb 0.11 -0.62 -0.09 0.00 -0.61 0.00 0.00 39.78 38.57 1k88 n ASN 133 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1k88 s ALA 134 N -2.20 3.35 -0.10 5.41 0.00 -0.58 -2.23 121.76 125.42 1k88 s ALA 134 Ca 0.52 -0.86 0.15 0.00 0.00 0.00 0.00 51.96 51.77 1k88 s ALA 134 Cb 0.36 -1.47 -0.11 0.00 0.00 0.00 0.00 23.12 21.90 1k88 s ALA 134 CO 0.21 0.62 0.98 0.00 0.00 0.00 0.00 175.76 177.57 1k88 h ALA 135 N 4.71 0.65 -2.10 0.00 0.00 -1.20 -3.49 119.26 117.83 1k88 h ALA 135 Ca -0.50 -0.85 0.12 0.00 0.00 0.00 0.00 54.91 53.68 1k88 h ALA 135 Cb 1.19 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 19.14 1k88 h ALA 135 CO 0.57 0.98 0.40 0.00 0.00 0.00 0.00 179.25 181.19 1k88 s PHE 137 N -3.37 0.57 -0.16 0.00 5.36 -0.50 -4.07 117.98 115.81 1k88 s PHE 137 Ca 0.15 -0.64 -0.08 0.00 -0.96 0.00 0.00 56.93 55.40 1k88 s PHE 137 Cb -0.01 -0.36 0.06 0.00 -0.34 0.00 0.00 43.02 42.37 1k88 s PHE 137 CO 0.03 -0.16 0.37 0.00 -1.46 0.00 0.00 175.22 174.00 1k88 s ALA 138 N -2.06 -0.95 -0.07 11.12 0.00 -0.70 0.38 121.76 129.47 1k88 s ALA 138 Ca -0.06 1.40 0.04 0.00 0.00 0.00 0.00 51.96 53.34 1k88 s ALA 138 Cb -0.05 -0.95 -0.01 0.00 0.00 0.00 0.00 23.12 22.10 1k88 s ALA 138 CO -0.02 -0.36 -0.21 0.00 0.00 0.00 0.00 175.76 175.17 1k88 s ILE 140 N -0.11 1.63 -0.13 0.00 1.01 0.11 -0.84 121.20 122.86 1k88 s ILE 140 Ca -0.04 -0.72 0.01 0.00 0.00 0.00 0.00 60.65 59.89 1k88 s ILE 140 Cb -0.14 -1.47 -0.01 0.00 0.01 0.00 0.00 42.46 40.85 1k88 s ILE 140 CO 0.04 0.47 -0.15 -0.76 0.00 0.00 0.00 174.94 174.53 1k88 s LEU 141 N 0.92 2.56 -0.15 2.97 1.43 0.31 -1.11 118.68 125.61 1k88 s LEU 141 Ca -0.07 -0.40 0.01 0.00 -1.03 0.00 0.00 54.13 52.64 1k88 s LEU 141 Cb -0.15 -1.57 0.02 0.00 0.03 0.00 0.00 46.19 44.52 1k88 s LEU 141 CO -0.01 0.14 -0.18 -0.76 0.23 0.00 0.00 176.35 175.77 1k88 s LEU 142 N 0.47 1.94 0.00 1.79 1.43 -0.57 -0.48 118.68 123.26 1k88 s LEU 142 Ca -0.11 -0.55 0.00 0.00 -1.03 0.00 0.00 54.13 52.44 1k88 s LEU 142 Cb -0.16 -1.32 0.00 0.00 0.03 0.00 0.00 46.19 44.74 1k88 s LEU 142 CO 0.05 0.02 0.00 -0.24 0.23 0.00 0.00 176.35 176.40 1k88 n SER 143 N 4.39 0.00 -4.83 2.29 2.88 -0.45 -2.14 113.62 115.76 1k88 n SER 143 Ca -0.19 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.00 1k88 n SER 143 Cb 0.51 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.90 1k88 n SER 143 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 1k88 s HIS 144 N -3.04 3.44 0.20 0.66 3.76 -1.26 -3.34 115.29 115.71 1k88 s HIS 144 Ca 0.00 0.34 -0.04 0.00 -0.15 0.00 0.00 55.06 55.21 1k88 s HIS 144 Cb 0.00 -1.83 -0.03 0.00 1.11 0.00 0.00 32.58 31.83 1k88 s HIS 144 CO 0.00 0.63 0.21 0.20 -0.85 0.00 0.00 174.74 174.92 1k88 s GLY 145 N -1.48 1.14 0.16 -2.22 0.00 0.10 0.26 107.32 105.28 1k88 s GLY 145 Ca 0.21 -1.45 0.00 0.00 0.00 0.00 0.00 44.72 43.48 1k88 s GLY 145 CO 0.11 -1.19 0.00 1.18 0.00 0.00 0.00 173.10 173.20 1k88 n GLU 146 N -0.27 0.00 0.00 2.90 1.02 -1.00 -3.90 120.64 119.38 1k88 n GLU 146 Ca -0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1k88 n GLU 146 Cb 0.65 -0.09 0.00 0.00 -0.02 0.00 0.00 31.44 31.97 1k88 n GLU 146 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1k88 n GLU 147 N -3.14 0.00 0.00 3.49 4.07 -1.26 0.26 120.64 124.06 1k88 n GLU 147 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1k88 n GLU 147 Cb 0.04 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.42 1k88 n GLU 147 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1k88 n ASN 148 N 0.00 0.05 -4.07 4.31 4.13 -1.26 -4.62 115.26 113.79 1k88 n ASN 148 Ca 0.00 -0.16 -0.19 0.00 1.68 0.00 0.00 54.58 55.92 1k88 n ASN 148 Cb 0.00 -0.02 -0.14 0.00 -1.54 0.00 0.00 39.78 38.08 1k88 n ASN 148 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1k88 s VAL 149 N -1.40 0.86 0.32 2.41 0.11 -1.26 0.76 120.40 122.20 1k88 s VAL 149 Ca 0.00 -0.67 0.09 0.00 -2.93 0.00 0.00 61.98 58.47 1k88 s VAL 149 Cb 0.00 -0.76 -0.05 0.00 -1.53 0.00 0.00 36.38 34.04 1k88 s VAL 149 CO 0.00 0.09 -0.00 0.27 -3.33 0.00 0.00 175.10 172.12 1k88 s ILE 150 N -0.55 2.76 -0.17 7.04 -4.36 0.18 -2.39 121.20 123.72 1k88 s ILE 150 Ca 0.02 -1.99 -0.20 0.00 -0.26 0.00 0.00 60.65 58.22 1k88 s ILE 150 Cb -0.06 -2.77 -0.03 0.00 1.25 0.00 0.00 42.46 40.85 1k88 s ILE 150 CO 0.00 -0.24 0.57 -0.31 0.24 0.00 0.00 174.94 175.20 1k88 s TYR 151 N -2.48 3.42 0.79 1.37 1.51 0.14 -0.75 117.35 121.35 1k88 s TYR 151 Ca 0.34 0.90 -0.07 0.00 -1.01 0.00 0.00 57.07 57.23 1k88 s TYR 151 Cb -0.02 -2.71 0.13 0.00 -0.11 0.00 0.00 41.96 39.26 1k88 s TYR 151 CO 0.19 -0.05 1.10 0.20 -1.11 0.00 0.00 175.55 175.88 1k88 s GLY 152 N 1.02 1.75 0.06 0.71 0.00 0.19 -4.65 107.32 106.40 1k88 s GLY 152 Ca 0.27 -1.37 0.28 0.00 0.00 0.00 0.00 44.72 43.91 1k88 s GLY 152 CO 0.11 -0.78 1.86 0.58 0.00 0.00 0.00 173.10 174.87 1k88 n LYS 153 N -3.14 0.07 -1.76 2.90 2.85 0.14 -3.57 118.16 115.65 1k88 n LYS 153 Ca 0.13 0.06 -0.10 0.00 -1.05 0.00 0.00 58.31 57.35 1k88 n LYS 153 Cb 0.60 -1.58 0.07 0.00 -0.65 0.00 0.00 35.03 33.47 1k88 n LYS 153 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 1k88 n ASP 154 N -1.71 3.22 0.00 -5.58 5.75 -1.26 0.22 116.55 117.20 1k88 n ASP 154 Ca 0.06 -3.34 0.00 0.00 -0.01 0.00 0.00 54.79 51.50 1k88 n ASP 154 Cb 0.36 -0.41 0.00 0.00 -1.03 0.00 0.00 41.12 40.05 1k88 n ASP 154 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1k88 n GLY 155 N -0.69 0.80 3.26 6.12 0.00 -1.23 -4.84 105.19 108.60 1k88 n GLY 155 Ca 0.28 -1.85 -0.22 0.00 0.00 0.00 0.00 46.02 44.24 1k88 n GLY 155 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1k88 s VAL 156 N -2.73 1.52 -0.01 1.61 -7.23 -1.26 0.57 120.40 112.87 1k88 s VAL 156 Ca 0.00 -1.54 0.02 0.00 -1.81 0.00 0.00 61.98 58.64 1k88 s VAL 156 Cb 0.00 -1.46 -0.00 0.00 0.56 0.00 0.00 36.38 35.48 1k88 s VAL 156 CO 0.00 -0.17 -0.05 -0.89 -0.31 0.00 0.00 175.10 173.68 1k88 s THR 157 N -1.40 0.43 0.54 5.32 2.01 0.07 -4.85 115.64 117.75 1k88 s THR 157 Ca 0.06 -0.22 -0.15 0.00 0.31 0.00 0.00 61.69 61.69 1k88 s THR 157 Cb -0.09 -0.37 -0.07 0.00 0.01 0.00 0.00 72.50 71.99 1k88 s THR 157 CO 0.04 0.13 0.99 -2.16 -0.69 0.00 0.00 174.62 172.92 1k88 s PRO 158 N -0.06 3.84 0.10 4.92 0.04 -1.26 0.51 135.00 143.10 1k88 s PRO 158 Ca 0.01 0.87 -0.17 0.00 0.04 0.00 0.00 61.00 61.75 1k88 s PRO 158 Cb -0.03 -2.13 -0.05 0.00 0.04 0.00 0.00 34.50 32.32 1k88 s PRO 158 CO -0.00 -0.34 1.55 0.82 0.04 0.00 0.00 177.00 179.06 1k88 h ILE 159 N 0.57 1.26 -0.97 0.56 1.08 -0.00 -3.03 117.51 116.97 1k88 h ILE 159 Ca -0.46 -0.95 0.25 0.00 -0.39 0.00 0.00 64.86 63.31 1k88 h ILE 159 Cb 1.19 1.25 -0.06 0.00 -3.07 0.00 0.00 36.82 36.12 1k88 h ILE 159 CO 0.62 0.31 0.66 0.07 -0.69 0.00 0.00 178.15 179.12 1k88 h LYS 160 N 0.36 0.23 -0.43 2.37 2.10 -1.83 0.39 116.57 119.76 1k88 h LYS 160 Ca 0.09 -0.01 -0.11 0.00 -2.00 0.00 0.00 60.65 58.62 1k88 h LYS 160 Cb 0.44 -0.05 -0.02 0.00 -0.90 0.00 0.00 32.23 31.70 1k88 h LYS 160 CO 0.02 0.15 -0.17 -0.44 -2.00 0.00 0.00 179.45 177.01 1k88 h ASP 161 N 0.24 0.84 -0.52 7.07 3.32 -1.90 0.75 116.42 126.21 1k88 h ASP 161 Ca 0.50 -0.28 -0.07 0.00 0.02 0.00 0.00 57.03 57.20 1k88 h ASP 161 Cb 1.55 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 40.85 1k88 h ASP 161 CO -0.14 1.00 0.04 -0.07 -1.72 0.00 0.00 179.24 178.35 1k88 h LEU 162 N 0.74 0.87 0.00 1.55 3.38 -1.01 -2.90 115.31 117.94 1k88 h LEU 162 Ca 0.11 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.79 1k88 h LEU 162 Cb 0.69 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1k88 h LEU 162 CO 0.05 0.94 -0.50 0.35 0.09 0.00 0.00 178.44 179.38 1k88 n THR 163 N -4.33 0.25 -0.21 0.22 -2.24 -1.03 -4.35 114.28 102.58 1k88 n THR 163 Ca 0.01 -0.18 -0.01 0.00 -2.27 0.00 0.00 64.05 61.61 1k88 n THR 163 Cb 0.30 -0.09 0.06 0.00 -2.10 0.00 0.00 70.33 68.50 1k88 n THR 163 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1k88 h ALA 164 N 2.68 0.42 -0.11 6.98 0.00 0.74 -1.42 119.26 128.56 1k88 h ALA 164 Ca 0.00 0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1k88 h ALA 164 Cb 0.66 0.46 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1k88 h ALA 164 CO 0.00 -0.43 0.00 -2.39 0.00 0.00 0.00 179.25 176.43 1k88 n HIS 165 N -5.42 0.34 0.18 0.00 -0.00 -1.26 -3.19 115.22 105.86 1k88 n HIS 165 Ca 0.07 -0.12 0.03 0.00 -0.00 0.00 0.00 57.72 57.70 1k88 n HIS 165 Cb 0.32 -0.14 -0.03 0.00 -0.00 0.00 0.00 29.99 30.14 1k88 n HIS 165 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.34 177.53 1k88 n PHE 166 N 0.07 0.00 -1.25 -1.40 3.72 -0.54 -4.50 117.46 113.57 1k88 n PHE 166 Ca 0.05 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.07 1k88 n PHE 166 Cb 0.36 -0.04 0.03 0.00 -0.94 0.00 0.00 39.48 38.90 1k88 n PHE 166 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1k88 n ARG 167 N -1.29 0.15 0.00 -1.08 1.74 -1.19 -4.43 116.66 110.55 1k88 n ARG 167 Ca 0.00 0.06 0.00 0.00 -0.77 0.00 0.00 57.85 57.15 1k88 n ARG 167 Cb 0.10 -1.29 0.00 0.00 -1.02 0.00 0.00 32.46 30.26 1k88 n ARG 167 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1k88 n GLY 168 N 2.35 -1.56 0.27 -0.13 0.00 -1.26 -1.54 105.19 103.31 1k88 n GLY 168 Ca 0.08 0.30 -0.05 0.00 0.00 0.00 0.00 46.02 46.34 1k88 n GLY 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k88 h ALA 169 N -0.54 0.06 0.00 4.61 0.00 -2.00 -2.84 119.26 118.56 1k88 h ALA 169 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1k88 h ALA 169 Cb 0.00 0.52 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1k88 h ALA 169 CO 0.00 -0.59 0.00 0.54 0.00 0.00 0.00 179.25 179.20 1k88 n ARG 170 N -5.39 0.44 -2.72 0.00 1.74 -0.59 -3.87 116.66 106.27 1k88 n ARG 170 Ca 0.02 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 57.03 1k88 n ARG 170 Cb 0.30 -1.17 0.08 0.00 -1.02 0.00 0.00 32.46 30.65 1k88 n ARG 170 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1k88 h LYS 172 N 3.11 0.42 -0.59 0.00 1.57 -1.67 -0.05 116.57 119.35 1k88 h LYS 172 Ca -0.15 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.60 1k88 h LYS 172 Cb 1.11 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 33.29 1k88 h LYS 172 CO 0.14 0.28 0.34 1.79 -0.57 0.00 0.00 179.45 181.42 1k88 h THR 173 N 0.43 1.18 -0.01 -0.16 1.35 -1.92 -0.77 112.91 113.01 1k88 h THR 173 Ca 0.69 -0.42 0.00 0.00 -0.55 0.00 0.00 66.41 66.13 1k88 h THR 173 Cb 1.47 0.36 0.00 0.00 -1.73 0.00 0.00 68.15 68.25 1k88 h THR 173 CO -0.55 0.19 -0.05 0.18 -0.25 0.00 0.00 175.52 175.04 1k88 n LEU 174 N -4.40 1.32 -4.74 3.87 4.77 -0.09 -4.52 117.00 113.22 1k88 n LEU 174 Ca 0.06 -0.42 -0.37 0.00 -0.03 0.00 0.00 56.01 55.24 1k88 n LEU 174 Cb 0.09 -0.03 0.05 0.00 -2.33 0.00 0.00 43.42 41.21 1k88 n LEU 174 CO 0.37 0.22 0.91 -0.22 -1.33 0.00 0.00 177.39 177.35 1k88 s LEU 175 N -2.10 3.68 0.00 2.23 0.20 -0.30 -2.08 118.68 120.31 1k88 s LEU 175 Ca 0.36 2.61 0.00 0.00 0.69 0.00 0.00 54.13 57.79 1k88 s LEU 175 Cb 0.21 -4.51 0.00 0.00 -0.43 0.00 0.00 46.19 41.46 1k88 s LEU 175 CO 0.37 -1.79 0.00 -0.62 -0.29 0.00 0.00 176.35 174.03 1k88 n GLU 176 N -1.57 0.00 -4.19 1.98 -0.58 -1.26 -4.94 120.64 110.08 1k88 n GLU 176 Ca 0.14 0.00 -0.30 0.00 -0.42 0.00 0.00 57.16 56.58 1k88 n GLU 176 Cb 0.47 -3.23 -0.09 0.00 -0.57 0.00 0.00 31.44 28.03 1k88 n GLU 176 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1k88 s LYS 177 N -0.11 2.39 0.19 3.49 1.02 -0.88 -4.99 119.74 120.84 1k88 s LYS 177 Ca 0.00 -0.90 -0.30 0.00 0.02 0.00 0.00 55.97 54.79 1k88 s LYS 177 Cb 0.00 -2.45 -0.09 0.00 -0.52 0.00 0.00 37.83 34.77 1k88 s LYS 177 CO 0.00 0.53 1.38 -1.25 -0.92 0.00 0.00 175.35 175.09 1k88 s PRO 178 N -2.20 4.33 -0.35 -1.68 0.04 -1.26 -4.87 135.00 129.01 1k88 s PRO 178 Ca 0.23 2.15 -0.08 0.00 0.04 0.00 0.00 61.00 63.34 1k88 s PRO 178 Cb -0.11 -3.18 0.03 0.00 0.04 0.00 0.00 34.50 31.28 1k88 s PRO 178 CO 0.16 -0.36 0.14 0.15 0.04 0.00 0.00 177.00 177.13 1k88 s LYS 179 N 0.16 2.76 -0.14 4.56 3.01 0.19 -1.41 119.74 128.86 1k88 s LYS 179 Ca 0.60 -1.10 -0.13 0.00 -1.01 0.00 0.00 55.97 54.33 1k88 s LYS 179 Cb -0.39 -3.56 -0.05 0.00 -1.01 0.00 0.00 37.83 32.82 1k88 s LYS 179 CO 0.37 -0.66 0.28 -0.51 0.51 0.00 0.00 175.35 175.35 1k88 s LEU 180 N 1.48 4.28 -0.19 3.17 2.01 0.16 -2.24 118.68 127.34 1k88 s LEU 180 Ca 0.00 0.53 0.01 0.00 0.01 0.00 0.00 54.13 54.68 1k88 s LEU 180 Cb -0.19 -2.35 0.04 0.00 0.01 0.00 0.00 46.19 43.71 1k88 s LEU 180 CO 0.04 0.16 -0.09 -0.36 1.01 0.00 0.00 176.35 177.11 1k88 s PHE 181 N 0.15 2.29 -0.35 0.29 0.40 0.04 0.02 117.98 120.83 1k88 s PHE 181 Ca 0.16 -1.51 -0.08 0.00 -0.60 0.00 0.00 56.93 54.91 1k88 s PHE 181 Cb -0.13 -1.58 0.04 0.00 0.51 0.00 0.00 43.02 41.86 1k88 s PHE 181 CO 0.04 -0.72 0.13 -0.06 0.70 0.00 0.00 175.22 175.32 1k88 s PHE 182 N 1.44 3.25 -0.06 0.36 0.40 -0.02 -0.65 117.98 122.69 1k88 s PHE 182 Ca -0.01 -1.28 0.01 0.00 -0.60 0.00 0.00 56.93 55.04 1k88 s PHE 182 Cb -0.16 -2.32 -0.03 0.00 0.51 0.00 0.00 43.02 41.01 1k88 s PHE 182 CO -0.08 -0.70 -0.06 0.42 0.70 0.00 0.00 175.22 175.50 1k88 s ILE 183 N 1.45 3.78 -0.47 0.64 1.01 -0.16 -0.53 121.20 126.92 1k88 s ILE 183 Ca -0.01 -0.48 0.04 0.00 0.00 0.00 0.00 60.65 60.20 1k88 s ILE 183 Cb -0.19 -2.56 0.16 0.00 0.01 0.00 0.00 42.46 39.88 1k88 s ILE 183 CO 0.04 0.58 0.35 -1.58 0.00 0.00 0.00 174.94 174.33 1k88 s GLN 184 N -0.90 1.24 0.40 2.79 2.00 0.37 0.74 119.66 126.30 1k88 s GLN 184 Ca 0.13 -2.30 0.08 0.00 -2.00 0.00 0.00 55.36 51.27 1k88 s GLN 184 Cb -0.11 -1.92 -0.02 0.00 0.80 0.00 0.00 33.01 31.76 1k88 s GLN 184 CO 0.02 -1.33 0.40 0.00 -0.50 0.00 0.00 175.29 173.88 1k88 s ALA 185 N -0.15 4.11 0.25 1.58 0.00 -1.26 -1.34 121.76 124.95 1k88 s ALA 185 Ca 0.28 -1.78 -0.10 0.00 0.00 0.00 0.00 51.96 50.36 1k88 s ALA 185 Cb -0.03 -1.19 0.04 0.00 0.00 0.00 0.00 23.12 21.94 1k88 s ALA 185 CO -0.15 -0.18 0.52 0.00 0.00 0.00 0.00 175.76 175.95 1k88 n ALA 186 N -1.57 -1.18 0.00 0.00 0.00 -1.21 -4.61 120.51 111.94 1k88 n ALA 186 Ca 0.03 -0.82 0.00 0.00 0.00 0.00 0.00 53.44 52.66 1k88 n ALA 186 Cb 0.61 0.64 0.00 0.00 0.00 0.00 0.00 19.45 20.70 1k88 n ALA 186 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1k88 n ARG 187 N -0.35 0.00 0.00 0.00 5.12 -0.83 0.03 116.66 120.63 1k88 n ARG 187 Ca -0.06 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.86 1k88 n ARG 187 Cb 0.38 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.68 1k88 n ARG 187 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1k88 n GLY 188 N 0.00 -2.26 0.00 -0.13 0.00 -1.25 -3.34 105.19 98.21 1k88 n GLY 188 Ca 0.00 -1.48 0.00 0.00 0.00 0.00 0.00 46.02 44.54 1k88 n GLY 188 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1k88 n ARG 210 N -1.95 0.00 0.00 1.61 0.63 -1.26 -5.00 116.66 110.68 1k88 n ARG 210 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1k88 n ARG 210 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 1k88 n ARG 210 CO 0.00 0.00 0.00 2.48 -2.51 0.00 0.00 177.63 177.60 1k88 n TYR 211 N 0.00 0.00 -0.19 -0.14 0.18 -1.26 -4.97 117.16 110.78 1k88 n TYR 211 Ca 0.00 0.00 -0.08 0.00 1.88 0.00 0.00 57.90 59.70 1k88 n TYR 211 Cb 0.00 0.00 -0.01 0.00 -0.38 0.00 0.00 39.34 38.95 1k88 n TYR 211 CO 0.00 0.00 0.00 1.17 -2.08 0.00 0.00 176.86 175.95 1k88 n LYS 212 N 0.00 0.00 -3.38 -3.48 4.81 -1.26 -4.67 118.16 110.18 1k88 n LYS 212 Ca 0.00 0.00 -0.45 0.00 -0.87 0.00 0.00 58.31 56.99 1k88 n LYS 212 Cb 0.00 -0.19 -0.05 0.00 0.02 0.00 0.00 35.03 34.81 1k88 n LYS 212 CO 0.00 0.00 0.00 -1.50 1.17 0.00 0.00 177.40 177.07 1k88 s ILE 213 N 0.57 5.04 0.68 3.15 1.10 -1.26 -4.75 121.20 125.73 1k88 s ILE 213 Ca 0.14 -1.88 -0.17 0.00 -0.51 0.00 0.00 60.65 58.23 1k88 s ILE 213 Cb -0.19 -4.22 -0.12 0.00 0.15 0.00 0.00 42.46 38.09 1k88 s ILE 213 CO 0.09 -0.89 -0.94 -2.65 -2.11 0.00 0.00 174.94 168.44 1k88 n PRO 214 N 4.77 0.00 -3.64 3.50 -0.02 -1.26 -5.01 135.00 133.34 1k88 n PRO 214 Ca -0.05 0.00 -0.29 0.00 -2.02 0.00 0.00 63.50 61.14 1k88 n PRO 214 Cb 0.42 -0.77 -0.12 0.00 -0.02 0.00 0.00 33.50 33.01 1k88 n PRO 214 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1k88 s VAL 215 N -1.54 1.15 0.21 -1.45 1.01 -1.26 -5.12 120.40 113.40 1k88 s VAL 215 Ca 0.22 -2.56 0.05 0.00 0.00 0.00 0.00 61.98 59.68 1k88 s VAL 215 Cb 0.07 -1.80 -0.03 0.00 0.00 0.00 0.00 36.38 34.61 1k88 s VAL 215 CO 0.40 -0.97 0.29 -1.61 0.00 0.00 0.00 175.10 173.21 1k88 s GLU 216 N 0.29 3.29 0.41 2.72 0.41 -1.26 -5.08 118.70 119.48 1k88 s GLU 216 Ca 0.20 -0.79 -0.25 0.00 -0.41 0.00 0.00 54.97 53.72 1k88 s GLU 216 Cb -0.18 -2.82 -0.08 0.00 -1.78 0.00 0.00 34.13 29.26 1k88 s GLU 216 CO -0.04 0.45 1.18 0.00 -0.49 0.00 0.00 175.26 176.36 1k88 s ALA 217 N -1.94 3.13 -0.56 5.21 0.00 -1.26 -3.71 121.76 122.64 1k88 s ALA 217 Ca 0.34 0.99 0.00 0.00 0.00 0.00 0.00 51.96 53.29 1k88 s ALA 217 Cb -0.09 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 19.63 1k88 s ALA 217 CO 0.28 -0.59 0.00 -0.25 0.00 0.00 0.00 175.76 175.20 1k88 n ASP 218 N -0.02 -3.07 -4.58 0.00 8.00 0.61 -4.90 116.55 112.60 1k88 n ASP 218 Ca 0.05 0.07 -0.29 0.00 0.71 0.00 0.00 54.79 55.33 1k88 n ASP 218 Cb 0.46 -1.73 -0.10 0.00 -0.02 0.00 0.00 41.12 39.74 1k88 n ASP 218 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1k88 s PHE 219 N -2.25 2.72 -0.11 1.24 0.40 -1.24 -0.64 117.98 118.10 1k88 s PHE 219 Ca 0.00 -0.17 -0.06 0.00 -0.60 0.00 0.00 56.93 56.11 1k88 s PHE 219 Cb 0.00 -1.41 0.05 0.00 0.51 0.00 0.00 43.02 42.17 1k88 s PHE 219 CO 0.00 0.44 0.25 -1.17 0.70 0.00 0.00 175.22 175.44 1k88 s LEU 220 N -2.31 0.41 -0.00 -0.37 0.20 -0.95 -1.42 118.68 114.24 1k88 s LEU 220 Ca 0.22 0.54 0.06 0.00 0.69 0.00 0.00 54.13 55.64 1k88 s LEU 220 Cb -0.11 0.76 -0.03 0.00 -0.43 0.00 0.00 46.19 46.39 1k88 s LEU 220 CO 0.14 -0.16 -0.18 -0.36 -0.29 0.00 0.00 176.35 175.50 1k88 s PHE 221 N 1.23 2.58 -0.39 5.38 0.40 0.07 -0.78 117.98 126.47 1k88 s PHE 221 Ca -0.09 -0.25 0.01 0.00 -0.60 0.00 0.00 56.93 56.00 1k88 s PHE 221 Cb -0.10 -1.53 0.12 0.00 0.51 0.00 0.00 43.02 42.02 1k88 s PHE 221 CO -0.08 0.18 0.18 0.00 0.70 0.00 0.00 175.22 176.20 1k88 s ALA 222 N -0.80 1.92 0.09 5.36 0.00 0.18 -1.11 121.76 127.40 1k88 s ALA 222 Ca 0.13 -2.26 -0.30 0.00 0.00 0.00 0.00 51.96 49.53 1k88 s ALA 222 Cb -0.10 -1.79 -0.05 0.00 0.00 0.00 0.00 23.12 21.17 1k88 s ALA 222 CO 0.02 -1.93 0.97 0.71 0.00 0.00 0.00 175.76 175.53 1k88 s TYR 223 N 0.82 3.79 0.14 0.00 2.02 -0.52 -0.99 117.35 122.61 1k88 s TYR 223 Ca 0.15 1.78 -0.16 0.00 -0.37 0.00 0.00 57.07 58.47 1k88 s TYR 223 Cb -0.22 -3.07 -0.00 0.00 -0.40 0.00 0.00 41.96 38.27 1k88 s TYR 223 CO -0.08 0.17 1.72 1.03 -1.57 0.00 0.00 175.55 176.82 1k88 h SER 224 N 5.77 0.51 0.00 2.29 0.87 0.02 -2.52 113.55 120.49 1k88 h SER 224 Ca -0.43 -0.12 0.00 0.00 -1.23 0.00 0.00 61.79 60.02 1k88 h SER 224 Cb 1.21 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 63.04 1k88 h SER 224 CO 0.72 0.48 -0.03 0.35 -0.53 0.00 0.00 176.83 177.83 1k88 n THR 225 N -4.71 0.31 0.00 2.23 -2.24 -1.26 -3.86 114.28 104.75 1k88 n THR 225 Ca -0.00 0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.92 1k88 n THR 225 Cb 0.10 -1.21 0.00 0.00 -2.10 0.00 0.00 70.33 67.12 1k88 n THR 225 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1k88 n VAL 226 N -2.77 0.00 0.00 2.28 0.31 -1.26 -4.27 118.33 112.62 1k88 n VAL 226 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1k88 n VAL 226 Cb 0.02 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.95 1k88 n VAL 226 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1k88 n PRO 227 N 0.00 0.00 0.00 5.55 -0.02 -1.26 -2.18 135.00 137.09 1k88 n PRO 227 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1k88 n PRO 227 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 1k88 n PRO 227 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1k88 n GLY 228 N 0.00 0.95 0.00 -1.23 0.00 0.14 -4.57 105.19 100.48 1k88 n GLY 228 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1k88 n GLY 228 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1k88 n TYR 229 N 0.00 0.00 -4.22 1.61 9.36 -0.92 -4.74 117.16 118.25 1k88 n TYR 229 Ca 0.00 0.00 -0.24 0.00 3.32 0.00 0.00 57.90 60.98 1k88 n TYR 229 Cb 0.00 0.00 -0.07 0.00 -0.63 0.00 0.00 39.34 38.64 1k88 n TYR 229 CO 0.00 0.00 0.00 0.71 0.22 0.00 0.00 176.86 177.79 1k88 s TYR 230 N -0.79 2.62 -0.28 2.98 1.51 -1.26 -1.97 117.35 120.17 1k88 s TYR 230 Ca 0.00 -0.42 -0.16 0.00 -1.01 0.00 0.00 57.07 55.48 1k88 s TYR 230 Cb 0.00 -1.57 0.08 0.00 -0.11 0.00 0.00 41.96 40.36 1k88 s TYR 230 CO 0.00 0.40 0.70 0.45 -1.11 0.00 0.00 175.55 175.99 1k88 s SER 231 N -3.78 -0.93 0.14 2.29 0.15 -1.26 -4.67 113.70 105.64 1k88 s SER 231 Ca 0.36 1.50 0.03 0.00 0.70 0.00 0.00 55.95 58.54 1k88 s SER 231 Cb -0.01 1.39 -0.01 0.00 -1.71 0.00 0.00 66.02 65.68 1k88 s SER 231 CO 0.21 -0.24 0.10 1.87 1.20 0.00 0.00 173.24 176.38 1k88 n TRP 232 N 4.22 -0.20 0.00 3.44 -0.00 -1.26 -5.02 117.44 118.62 1k88 n TRP 232 Ca -0.20 -1.12 0.00 0.00 -0.00 0.00 0.00 57.50 56.19 1k88 n TRP 232 Cb 0.59 0.08 0.00 0.00 -0.00 0.00 0.00 31.31 31.98 1k88 n TRP 232 CO 0.00 0.00 0.00 2.89 -0.00 0.00 0.00 177.69 180.58 1k88 n ARG 233 N -0.29 0.00 -3.72 5.87 0.00 -1.26 -2.64 116.66 114.61 1k88 n ARG 233 Ca 0.01 0.00 -0.15 0.00 -0.00 0.00 0.00 57.85 57.72 1k88 n ARG 233 Cb 0.25 0.00 -0.15 0.00 -0.00 0.00 0.00 32.46 32.56 1k88 n ARG 233 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 1k88 s SER 234 N 1.98 0.15 0.12 2.89 0.01 -1.24 -5.01 113.70 112.60 1k88 s SER 234 Ca 0.00 0.30 0.00 0.00 1.31 0.00 0.00 55.95 57.57 1k88 s SER 234 Cb 0.00 0.21 0.28 0.00 0.21 0.00 0.00 66.02 66.72 1k88 s SER 234 CO 0.00 -0.18 0.59 -2.65 0.41 0.00 0.00 173.24 171.42 1k88 n PRO 235 N 4.54 -0.03 0.06 12.44 -0.02 -1.26 0.22 135.00 150.96 1k88 n PRO 235 Ca -0.20 0.57 0.12 0.00 -2.02 0.00 0.00 63.50 61.97 1k88 n PRO 235 Cb 0.51 -0.90 0.25 0.00 -0.02 0.00 0.00 33.50 33.34 1k88 n PRO 235 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1k88 n GLY 236 N -1.19 -1.46 3.37 -1.23 0.00 -1.26 -4.66 105.19 98.75 1k88 n GLY 236 Ca 0.09 -0.20 -0.22 0.00 0.00 0.00 0.00 46.02 45.68 1k88 n GLY 236 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1k88 s ARG 237 N -3.13 1.40 0.52 1.61 1.70 0.13 -4.99 118.95 116.20 1k88 s ARG 237 Ca 0.08 -1.53 -0.09 0.00 -0.47 0.00 0.00 55.73 53.72 1k88 s ARG 237 Cb 0.14 -1.44 0.13 0.00 -0.57 0.00 0.00 34.95 33.21 1k88 s ARG 237 CO 0.68 0.28 0.33 0.41 -1.08 0.00 0.00 175.30 175.92 1k88 n GLY 238 N -0.03 -3.62 3.74 3.88 0.00 -1.26 -3.72 105.19 104.18 1k88 n GLY 238 Ca -0.10 -1.29 -0.38 0.00 0.00 0.00 0.00 46.02 44.25 1k88 n GLY 238 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1k88 n SER 239 N -3.98 2.39 -0.23 1.61 3.41 -1.26 -4.41 113.62 111.15 1k88 n SER 239 Ca 0.05 0.90 -0.01 0.00 -0.26 0.00 0.00 58.87 59.55 1k88 n SER 239 Cb 0.22 -1.57 0.10 0.00 -0.26 0.00 0.00 64.21 62.70 1k88 n SER 239 CO 0.00 0.00 0.00 -0.50 -0.16 0.00 0.00 175.04 174.38 1k88 h TRP 240 N 0.97 0.65 0.05 7.33 6.55 -1.87 -1.10 115.95 128.53 1k88 h TRP 240 Ca -0.51 0.03 0.00 0.00 0.95 0.00 0.00 58.89 59.36 1k88 h TRP 240 Cb 1.32 -0.20 -0.02 0.00 -0.86 0.00 0.00 29.16 29.41 1k88 h TRP 240 CO 0.43 0.30 -0.20 0.35 -1.05 0.00 0.00 178.44 178.27 1k88 h PHE 241 N 0.65 -0.59 -0.46 0.49 3.57 -1.91 0.12 116.94 118.82 1k88 h PHE 241 Ca 0.30 0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.91 1k88 h PHE 241 Cb 0.22 0.25 -0.09 0.00 2.79 0.00 0.00 35.95 39.12 1k88 h PHE 241 CO -0.09 -0.23 -0.16 0.28 -2.23 0.00 0.00 178.31 175.89 1k88 h VAL 242 N -0.29 0.46 -0.88 1.41 2.07 -1.89 0.49 116.25 117.63 1k88 h VAL 242 Ca -0.00 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.59 1k88 h VAL 242 Cb 0.29 0.46 -0.07 0.00 -1.52 0.00 0.00 31.29 30.46 1k88 h VAL 242 CO -0.11 0.00 0.54 -0.61 0.02 0.00 0.00 177.57 177.41 1k88 h GLN 243 N -0.05 0.94 -0.42 1.57 4.15 -1.02 0.24 115.11 120.53 1k88 h GLN 243 Ca 0.22 -0.06 -0.05 0.00 0.77 0.00 0.00 58.65 59.54 1k88 h GLN 243 Cb 0.39 -0.21 -0.02 0.00 0.21 0.00 0.00 27.48 27.85 1k88 h GLN 243 CO -0.50 0.62 0.07 0.00 -1.93 0.00 0.00 178.83 177.09 1k88 h ALA 244 N 1.43 0.55 -0.37 3.38 0.00 0.99 -0.77 119.26 124.47 1k88 h ALA 244 Ca 0.39 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 1k88 h ALA 244 Cb 0.22 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1k88 h ALA 244 CO -0.19 0.27 0.11 1.25 0.00 0.00 0.00 179.25 180.68 1k88 h LEU 245 N 0.54 0.55 -0.24 0.00 5.85 -0.22 -0.72 115.31 121.08 1k88 h LEU 245 Ca 0.13 -0.21 -0.04 0.00 0.84 0.00 0.00 57.88 58.60 1k88 h LEU 245 Cb 0.37 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 1k88 h LEU 245 CO 0.01 0.62 0.00 0.00 -0.34 0.00 0.00 178.44 178.73 1k88 h SER 247 N 0.19 0.20 -0.11 0.00 0.87 -1.04 0.66 113.55 114.33 1k88 h SER 247 Ca 0.07 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.63 1k88 h SER 247 Cb 0.40 -0.03 -0.00 0.00 -0.44 0.00 0.00 62.40 62.33 1k88 h SER 247 CO 0.01 0.15 0.03 0.40 -0.53 0.00 0.00 176.83 176.89 1k88 h ILE 248 N 0.28 1.19 -0.62 2.23 1.08 -1.08 -3.05 117.51 117.54 1k88 h ILE 248 Ca 0.11 -0.59 -0.01 0.00 -0.39 0.00 0.00 64.86 63.98 1k88 h ILE 248 Cb 0.03 1.38 -0.03 0.00 -3.07 0.00 0.00 36.82 35.13 1k88 h ILE 248 CO -0.07 0.17 0.34 -0.07 -0.69 0.00 0.00 178.15 177.83 1k88 h LEU 249 N -0.03 0.78 -2.77 1.44 3.38 -0.68 0.12 115.31 117.54 1k88 h LEU 249 Ca 0.03 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1k88 h LEU 249 Cb 0.24 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1k88 h LEU 249 CO 0.00 0.64 0.00 1.21 0.09 0.00 0.00 178.44 180.38 1k88 n GLU 250 N -4.56 0.79 0.00 1.13 4.07 0.23 -1.03 120.64 121.27 1k88 n GLU 250 Ca 0.04 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.14 1k88 n GLU 250 Cb 0.08 -1.10 0.00 0.00 -0.06 0.00 0.00 31.44 30.36 1k88 n GLU 250 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 1k88 n GLU 251 N 1.24 0.00 0.00 5.31 -0.58 -0.74 -4.94 120.64 120.94 1k88 n GLU 251 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1k88 n GLU 251 Cb 0.40 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.27 1k88 n GLU 251 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 1k88 n HIS 252 N -1.24 0.00 -0.40 -0.32 8.25 0.33 -4.79 115.22 117.05 1k88 n HIS 252 Ca 0.00 -0.03 0.39 0.00 -0.26 0.00 0.00 57.72 57.82 1k88 n HIS 252 Cb 0.00 -0.00 0.73 0.00 1.12 0.00 0.00 29.99 31.84 1k88 n HIS 252 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1k88 h GLY 253 N 0.00 0.00 -1.47 -1.41 0.00 -1.12 0.27 103.07 99.34 1k88 h GLY 253 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1k88 h GLY 253 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.82 1k88 n LYS 254 N -3.93 1.56 0.00 4.80 5.02 -1.26 -4.24 118.16 120.11 1k88 n LYS 254 Ca 0.30 -1.62 0.00 0.00 -2.02 0.00 0.00 58.31 54.97 1k88 n LYS 254 Cb 1.48 -1.34 0.00 0.00 -0.02 0.00 0.00 35.03 35.15 1k88 n LYS 254 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1k88 n ASP 255 N 1.00 1.17 -4.67 4.39 5.75 0.76 -4.57 116.55 120.39 1k88 n ASP 255 Ca 0.11 -0.23 -0.31 0.00 -0.01 0.00 0.00 54.79 54.35 1k88 n ASP 255 Cb 0.45 0.70 -0.08 0.00 -1.03 0.00 0.00 41.12 41.16 1k88 n ASP 255 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1k88 s LEU 256 N -1.64 3.42 0.44 -2.12 1.43 -0.08 -5.10 118.68 115.03 1k88 s LEU 256 Ca 0.00 -0.15 -0.23 0.00 -1.03 0.00 0.00 54.13 52.72 1k88 s LEU 256 Cb 0.00 -2.10 -0.08 0.00 0.03 0.00 0.00 46.19 44.03 1k88 s LEU 256 CO 0.00 0.21 1.09 -0.70 0.23 0.00 0.00 176.35 177.18 1k88 s GLU 257 N -2.06 3.93 0.27 1.70 -6.30 -1.26 -4.74 118.70 110.23 1k88 s GLU 257 Ca 0.23 1.58 -0.05 0.00 -2.50 0.00 0.00 54.97 54.24 1k88 s GLU 257 Cb -0.12 -2.40 0.52 0.00 0.00 0.00 0.00 34.13 32.14 1k88 s GLU 257 CO 0.15 -0.36 1.60 0.97 0.02 0.00 0.00 175.26 177.64 1k88 h ILE 258 N 1.93 0.17 -0.69 -3.70 6.09 -1.11 0.19 117.51 120.40 1k88 h ILE 258 Ca -0.49 -0.02 -0.00 0.00 -1.37 0.00 0.00 64.86 62.98 1k88 h ILE 258 Cb 1.23 0.12 -0.03 0.00 0.47 0.00 0.00 36.82 38.61 1k88 h ILE 258 CO 0.61 0.01 0.41 0.24 -3.07 0.00 0.00 178.15 176.35 1k88 h MET 259 N 0.05 0.94 0.27 2.19 2.86 -1.92 -1.31 114.93 118.00 1k88 h MET 259 Ca 0.48 -0.08 -0.01 0.00 -2.06 0.00 0.00 59.70 58.02 1k88 h MET 259 Cb 0.86 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 32.33 1k88 h MET 259 CO -0.82 0.66 -0.13 1.96 1.06 0.00 0.00 176.91 179.64 1k88 h GLN 260 N 0.95 -0.35 -0.24 1.72 4.20 -1.34 0.18 115.11 120.24 1k88 h GLN 260 Ca 0.25 0.02 0.04 0.00 0.06 0.00 0.00 58.65 59.03 1k88 h GLN 260 Cb -0.03 0.08 -0.07 0.00 0.30 0.00 0.00 27.48 27.75 1k88 h GLN 260 CO -0.05 -0.16 -0.50 0.82 -0.67 0.00 0.00 178.83 178.27 1k88 h ILE 261 N -0.46 0.05 -0.61 2.54 1.08 -1.03 -1.25 117.51 117.82 1k88 h ILE 261 Ca -0.04 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.46 1k88 h ILE 261 Cb 0.35 0.05 -0.03 0.00 -3.07 0.00 0.00 36.82 34.12 1k88 h ILE 261 CO 0.06 0.00 0.40 -0.07 -0.69 0.00 0.00 178.15 177.85 1k88 h LEU 262 N -0.48 0.63 -0.20 1.44 3.38 -1.16 -1.62 115.31 117.30 1k88 h LEU 262 Ca 0.07 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1k88 h LEU 262 Cb 0.64 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 1k88 h LEU 262 CO -0.49 0.44 0.08 0.74 0.09 0.00 0.00 178.44 179.30 1k88 h THR 263 N 0.73 1.15 -0.38 0.22 2.02 0.02 0.19 112.91 116.86 1k88 h THR 263 Ca 0.24 -0.45 0.02 0.00 0.77 0.00 0.00 66.41 67.00 1k88 h THR 263 Cb 0.06 1.09 -0.02 0.00 -1.74 0.00 0.00 68.15 67.53 1k88 h THR 263 CO -0.06 0.15 0.26 0.03 0.37 0.00 0.00 175.52 176.26 1k88 h ARG 264 N 0.17 0.42 -0.30 6.66 3.08 -0.68 0.14 114.38 123.88 1k88 h ARG 264 Ca 0.07 -0.03 -0.07 0.00 0.07 0.00 0.00 59.98 60.02 1k88 h ARG 264 Cb 0.15 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 1k88 h ARG 264 CO -0.01 0.28 -0.09 0.28 -1.07 0.00 0.00 179.97 179.36 1k88 h VAL 265 N 0.43 1.28 -0.76 2.04 2.07 -0.58 0.14 116.25 120.88 1k88 h VAL 265 Ca 0.15 -1.14 0.11 0.00 0.82 0.00 0.00 66.70 66.64 1k88 h VAL 265 Cb 0.08 1.41 -0.08 0.00 -1.52 0.00 0.00 31.29 31.18 1k88 h VAL 265 CO -0.04 0.37 0.37 0.78 0.02 0.00 0.00 177.57 179.07 1k88 h ASN 266 N 0.35 0.46 -0.32 0.57 2.35 0.19 -1.36 115.58 117.81 1k88 h ASN 266 Ca 0.07 0.07 -0.16 0.00 -0.55 0.00 0.00 56.30 55.74 1k88 h ASN 266 Cb 0.59 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.95 1k88 h ASN 266 CO 0.03 0.24 -0.42 -0.78 -1.65 0.00 0.00 177.43 174.85 1k88 h ASP 267 N 0.59 0.95 -0.17 5.81 3.58 -0.54 -2.75 116.42 123.88 1k88 h ASP 267 Ca 0.39 -0.45 0.01 0.00 0.42 0.00 0.00 57.03 57.40 1k88 h ASP 267 Cb 0.47 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 41.24 1k88 h ASP 267 CO -0.31 1.23 0.08 -0.09 -2.88 0.00 0.00 179.24 177.27 1k88 h ARG 268 N 0.71 0.17 0.00 0.28 9.65 0.34 -1.91 114.38 123.63 1k88 h ARG 268 Ca 0.05 -0.01 -0.06 0.00 -1.10 0.00 0.00 59.98 58.86 1k88 h ARG 268 Cb 1.00 -0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 29.53 1k88 h ARG 268 CO 0.10 0.12 -0.29 -0.24 2.80 0.00 0.00 179.97 182.45 1k88 h VAL 269 N 0.18 0.68 0.87 0.20 3.04 -1.44 -3.15 116.25 116.64 1k88 h VAL 269 Ca 0.07 -1.34 -0.04 0.00 -1.01 0.00 0.00 66.70 64.38 1k88 h VAL 269 Cb 0.02 1.87 0.01 0.00 -2.01 0.00 0.00 31.29 31.18 1k88 h VAL 269 CO -0.05 0.29 -0.42 0.00 -1.01 0.00 0.00 177.57 176.38 1k88 h ALA 270 N 1.71 -1.25 -1.21 3.17 0.00 -1.08 -2.60 119.26 118.00 1k88 h ALA 270 Ca -0.00 -0.26 0.38 0.00 0.00 0.00 0.00 54.91 55.03 1k88 h ALA 270 Cb 0.85 0.45 -0.12 0.00 0.00 0.00 0.00 17.79 18.97 1k88 h ALA 270 CO 0.04 -1.17 0.77 0.00 0.00 0.00 0.00 179.25 178.89 1k88 h ARG 271 N -1.23 0.18 0.00 0.00 3.08 -1.33 1.55 114.38 116.63 1k88 h ARG 271 Ca -0.12 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.92 1k88 h ARG 271 Cb 0.90 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.91 1k88 h ARG 271 CO 0.20 0.12 0.00 0.72 -1.07 0.00 0.00 179.97 179.93 1k88 n HIS 272 N -4.71 0.29 -3.91 3.04 8.25 -0.98 -4.89 115.22 112.30 1k88 n HIS 272 Ca 0.33 0.13 -0.22 0.00 -0.26 0.00 0.00 57.72 57.70 1k88 n HIS 272 Cb 1.24 -0.72 -0.05 0.00 1.12 0.00 0.00 29.99 31.58 1k88 n HIS 272 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 1k88 s PHE 273 N -3.17 2.72 0.00 4.41 2.19 0.53 -4.76 117.98 119.90 1k88 s PHE 273 Ca 0.02 -0.44 0.00 0.00 0.33 0.00 0.00 56.93 56.85 1k88 s PHE 273 Cb 0.06 -1.87 0.00 0.00 -1.31 0.00 0.00 43.02 39.89 1k88 s PHE 273 CO 0.18 0.16 0.00 0.39 1.83 0.00 0.00 175.22 177.78 1k88 n GLU 274 N -1.31 0.00 -0.51 10.12 1.02 -1.26 -5.08 120.64 123.62 1k88 n GLU 274 Ca -0.01 0.32 -0.31 0.00 -0.02 0.00 0.00 57.16 57.15 1k88 n GLU 274 Cb 0.62 -1.25 0.28 0.00 -0.02 0.00 0.00 31.44 31.07 1k88 n GLU 274 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1k88 s SER 275 N -2.20 -0.76 -0.13 1.62 1.04 -1.26 -5.09 113.70 106.92 1k88 s SER 275 Ca 0.00 0.79 -0.01 0.00 0.48 0.00 0.00 55.95 57.21 1k88 s SER 275 Cb 0.00 -1.11 -0.02 0.00 0.10 0.00 0.00 66.02 64.99 1k88 s SER 275 CO 0.00 -5.17 -0.09 -1.10 0.98 0.00 0.00 173.24 167.86 1k88 s GLN 276 N -5.16 3.39 0.00 4.02 -0.21 -1.26 -5.08 119.66 115.37 1k88 s GLN 276 Ca 0.69 -0.61 0.00 0.00 0.02 0.00 0.00 55.36 55.46 1k88 s GLN 276 Cb -0.12 -2.72 0.00 0.00 1.00 0.00 0.00 33.01 31.17 1k88 s GLN 276 CO 0.57 0.29 0.00 0.45 -2.12 0.00 0.00 175.29 174.48 1k88 n SER 277 N 3.34 0.00 -0.48 5.90 2.88 -1.26 -5.10 113.62 118.90 1k88 n SER 277 Ca -0.18 -0.07 0.00 0.00 -1.33 0.00 0.00 58.87 57.30 1k88 n SER 277 Cb 0.53 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.99 1k88 n SER 277 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1k88 n ASP 278 N -0.17 0.00 -3.43 -3.46 8.00 -1.26 -4.87 116.55 111.36 1k88 n ASP 278 Ca 0.00 -1.28 -0.28 0.00 0.71 0.00 0.00 54.79 53.94 1k88 n ASP 278 Cb 0.00 -0.06 -0.07 0.00 -0.02 0.00 0.00 41.12 40.97 1k88 n ASP 278 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1k88 n ASP 279 N 0.00 3.98 0.00 -2.24 8.00 -1.26 -4.88 116.55 120.16 1k88 n ASP 279 Ca 0.00 -3.46 0.00 0.00 0.71 0.00 0.00 54.79 52.04 1k88 n ASP 279 Cb 0.56 -0.70 0.00 0.00 -0.02 0.00 0.00 41.12 40.96 1k88 n ASP 279 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 1k88 n PRO 280 N 0.81 0.00 -1.88 -0.24 -0.02 -1.26 0.37 135.00 132.78 1k88 n PRO 280 Ca 0.30 0.25 -0.32 0.00 -2.02 0.00 0.00 63.50 61.71 1k88 n PRO 280 Cb 0.40 -1.65 0.04 0.00 -0.02 0.00 0.00 33.50 32.28 1k88 n PRO 280 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1k88 n HIS 281 N -1.22 3.10 0.00 6.00 8.25 -1.26 -4.49 115.22 125.60 1k88 n HIS 281 Ca 0.00 -2.68 0.00 0.00 -0.26 0.00 0.00 57.72 54.78 1k88 n HIS 281 Cb 0.15 -0.86 0.00 0.00 1.12 0.00 0.00 29.99 30.40 1k88 n HIS 281 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1k88 n PHE 282 N -0.68 -0.14 -2.07 4.41 3.72 0.16 -5.10 117.46 117.76 1k88 n PHE 282 Ca 0.51 0.00 -0.36 0.00 -0.05 0.00 0.00 57.45 57.56 1k88 n PHE 282 Cb 0.61 0.03 -0.04 0.00 -0.94 0.00 0.00 39.48 39.14 1k88 n PHE 282 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 1k88 s HIS 283 N -1.14 1.73 0.01 1.38 2.46 -0.77 -4.70 115.29 114.27 1k88 s HIS 283 Ca 0.00 0.70 -0.03 0.00 0.47 0.00 0.00 55.06 56.20 1k88 s HIS 283 Cb 0.00 -4.11 -0.01 0.00 -0.13 0.00 0.00 32.58 28.33 1k88 s HIS 283 CO 0.00 -2.16 -0.05 0.39 -2.47 0.00 0.00 174.74 170.45 1k88 n GLU 284 N 9.11 0.08 0.00 2.88 -0.58 -1.26 -4.96 120.64 125.91 1k88 n GLU 284 Ca 0.25 0.03 0.00 0.00 -0.42 0.00 0.00 57.16 57.02 1k88 n GLU 284 Cb 0.51 -0.46 0.00 0.00 -0.57 0.00 0.00 31.44 30.92 1k88 n GLU 284 CO 0.00 0.00 0.00 0.36 -0.48 0.00 0.00 177.13 177.01 1k88 n LYS 285 N -3.16 0.00 -3.00 3.49 2.85 -1.26 -4.97 118.16 112.10 1k88 n LYS 285 Ca -0.02 0.00 -0.11 0.00 -1.05 0.00 0.00 58.31 57.13 1k88 n LYS 285 Cb 0.07 0.00 -0.03 0.00 -0.65 0.00 0.00 35.03 34.43 1k88 n LYS 285 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 1k88 n LYS 286 N 0.00 1.01 -3.65 -1.58 5.02 -1.26 -4.91 118.16 112.80 1k88 n LYS 286 Ca 0.00 -1.42 -0.02 0.00 -2.02 0.00 0.00 58.31 54.85 1k88 n LYS 286 Cb 0.00 0.65 -0.06 0.00 -0.02 0.00 0.00 35.03 35.59 1k88 n LYS 286 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 1k88 s GLN 287 N -2.66 0.29 -0.17 1.97 0.74 -1.26 -4.25 119.66 114.31 1k88 s GLN 287 Ca 0.06 0.47 -0.04 0.00 0.05 0.00 0.00 55.36 55.90 1k88 s GLN 287 Cb 0.00 0.07 0.08 0.00 1.10 0.00 0.00 33.01 34.27 1k88 s GLN 287 CO 0.04 -0.06 0.24 -1.50 -0.55 0.00 0.00 175.29 173.46 1k88 s ILE 288 N 1.10 -0.36 0.93 -2.34 1.10 -1.26 -4.72 121.20 115.65 1k88 s ILE 288 Ca -0.07 0.04 -0.11 0.00 -0.51 0.00 0.00 60.65 60.00 1k88 s ILE 288 Cb -0.03 -0.59 0.15 0.00 0.15 0.00 0.00 42.46 42.14 1k88 s ILE 288 CO -0.13 -0.08 1.12 -2.84 -2.11 0.00 0.00 174.94 170.90 1k88 s PRO 289 N 2.36 0.93 -0.01 3.50 0.02 -1.25 -4.63 135.00 135.92 1k88 s PRO 289 Ca 0.05 1.33 -0.04 0.00 0.02 0.00 0.00 61.00 62.36 1k88 s PRO 289 Cb -0.14 -1.73 0.00 0.00 0.02 0.00 0.00 34.50 32.65 1k88 s PRO 289 CO -0.11 -2.62 0.09 0.00 -0.33 0.00 0.00 177.00 174.03 1k88 s VAL 291 N -0.73 2.80 -0.21 0.00 1.01 -1.26 -1.44 120.40 120.57 1k88 s VAL 291 Ca -0.08 -1.15 -0.15 0.00 0.00 0.00 0.00 61.98 60.60 1k88 s VAL 291 Cb -0.05 -2.47 -0.04 0.00 0.00 0.00 0.00 36.38 33.82 1k88 s VAL 291 CO 0.00 0.13 0.37 -0.69 0.00 0.00 0.00 175.10 174.91 1k88 s VAL 292 N 1.29 5.22 -0.08 2.92 1.01 -0.27 -4.96 120.40 125.53 1k88 s VAL 292 Ca -0.02 0.63 0.04 0.00 0.00 0.00 0.00 61.98 62.63 1k88 s VAL 292 Cb -0.17 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.51 1k88 s VAL 292 CO -0.04 0.25 -0.19 -0.55 0.00 0.00 0.00 175.10 174.57 1k88 s SER 293 N 1.11 2.51 -0.07 3.32 0.15 -1.26 -0.75 113.70 118.71 1k88 s SER 293 Ca 0.17 -0.44 0.11 0.00 0.70 0.00 0.00 55.95 56.49 1k88 s SER 293 Cb -0.15 -1.05 0.17 0.00 -1.71 0.00 0.00 66.02 63.28 1k88 s SER 293 CO 0.08 0.12 1.08 0.23 1.20 0.00 0.00 173.24 175.95 1k88 n MET 294 N 3.51 0.82 -2.05 5.44 2.81 -0.51 -5.04 117.12 122.11 1k88 n MET 294 Ca -0.20 -1.91 -0.36 0.00 -1.81 0.00 0.00 57.70 53.42 1k88 n MET 294 Cb 0.52 -1.09 0.03 0.00 -0.71 0.00 0.00 33.22 31.97 1k88 n MET 294 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1k88 s LEU 295 N -1.67 3.74 0.00 4.03 1.43 -1.22 -0.28 118.68 124.70 1k88 s LEU 295 Ca 0.18 2.40 0.10 0.00 -1.03 0.00 0.00 54.13 55.78 1k88 s LEU 295 Cb 0.16 -4.52 0.07 0.00 0.03 0.00 0.00 46.19 41.94 1k88 s LEU 295 CO 0.02 -1.46 0.79 0.35 0.23 0.00 0.00 176.35 176.28 1k88 n THR 296 N -1.35 0.00 -4.04 5.49 -2.24 -1.26 -4.82 114.28 106.07 1k88 n THR 296 Ca 0.12 -0.49 -0.10 0.00 -2.27 0.00 0.00 64.05 61.31 1k88 n THR 296 Cb 0.49 1.20 -0.06 0.00 -2.10 0.00 0.00 70.33 69.85 1k88 n THR 296 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1k88 s LYS 297 N -0.86 1.44 0.49 -0.78 -0.14 -1.26 -4.97 119.74 113.65 1k88 s LYS 297 Ca 0.11 -1.33 -0.18 0.00 -1.36 0.00 0.00 55.97 53.21 1k88 s LYS 297 Cb 0.08 0.42 -0.09 0.00 -1.68 0.00 0.00 37.83 36.56 1k88 s LYS 297 CO 0.13 -0.57 0.98 -1.21 -0.76 0.00 0.00 175.35 173.93 1k88 s GLU 298 N -4.04 3.98 -0.10 1.68 2.02 0.16 -4.74 118.70 117.66 1k88 s GLU 298 Ca 0.26 1.08 0.04 0.00 0.02 0.00 0.00 54.97 56.36 1k88 s GLU 298 Cb 0.01 -2.14 0.00 0.00 0.10 0.00 0.00 34.13 32.10 1k88 s GLU 298 CO 0.09 -0.24 -0.24 -1.17 0.02 0.00 0.00 175.26 173.72 1k88 s LEU 299 N -3.73 2.08 0.02 1.80 2.96 -1.26 -1.19 118.68 119.36 1k88 s LEU 299 Ca 0.61 -0.55 0.02 0.00 -0.22 0.00 0.00 54.13 53.99 1k88 s LEU 299 Cb -0.11 -1.40 -0.01 0.00 0.50 0.00 0.00 46.19 45.18 1k88 s LEU 299 CO 0.24 0.16 -0.06 -0.31 -1.32 0.00 0.00 176.35 175.05 1k88 s TYR 300 N 0.34 0.57 -2.55 5.38 2.02 -1.26 -0.38 117.35 121.47 1k88 s TYR 300 Ca -0.19 -0.27 0.24 0.00 -0.37 0.00 0.00 57.07 56.49 1k88 s TYR 300 Cb -0.18 -0.35 0.64 0.00 -0.40 0.00 0.00 41.96 41.67 1k88 s TYR 300 CO 0.09 -0.04 1.51 1.19 -1.57 0.00 0.00 175.55 176.73 1k88 n PHE 301 N 2.31 0.16 -3.11 2.71 3.72 -1.26 -4.90 117.46 117.09 1k88 n PHE 301 Ca -0.17 -0.08 -0.19 0.00 -0.05 0.00 0.00 57.45 56.96 1k88 n PHE 301 Cb 0.57 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 39.14 1k88 n PHE 301 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1k88 s SER 302 N -1.77 5.23 0.00 4.37 1.04 -1.26 -5.00 113.70 116.30 1k88 s SER 302 Ca 0.34 -0.75 0.00 0.00 0.48 0.00 0.00 55.95 56.03 1k88 s SER 302 Cb 0.20 -0.01 0.00 0.00 0.10 0.00 0.00 66.02 66.31 1k88 s SER 302 CO 0.30 -1.13 0.00 0.00 0.98 0.00 0.00 173.24 173.40