#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kw5 s TRP 2 N 0.00 3.48 0.11 2.03 0.52 -1.26 -5.10 118.94 118.72 2kw5 s TRP 2 Ca 0.00 0.57 -0.08 0.00 0.02 0.00 0.00 56.10 56.61 2kw5 s TRP 2 Cb 0.00 -2.04 -0.06 0.00 -1.15 0.00 0.00 33.47 30.22 2kw5 s TRP 2 CO 0.00 0.24 0.40 -0.51 0.02 0.00 0.00 176.95 177.10 2kw5 s ASP 3 N -3.10 6.58 -0.29 2.95 1.11 -1.26 -5.08 116.67 117.59 2kw5 s ASP 3 Ca 0.43 0.72 -0.20 0.00 0.18 0.00 0.00 52.55 53.67 2kw5 s ASP 3 Cb -0.11 -2.15 -0.01 0.00 1.07 0.00 0.00 42.92 41.72 2kw5 s ASP 3 CO 0.29 0.11 0.63 -1.61 1.18 0.00 0.00 175.17 175.77 2kw5 s GLU 4 N -2.23 3.98 -0.41 8.23 0.41 -1.26 -5.02 118.70 122.39 2kw5 s GLU 4 Ca 0.37 0.39 -0.28 0.00 -0.41 0.00 0.00 54.97 55.03 2kw5 s GLU 4 Cb -0.13 -3.70 -0.02 0.00 -1.78 0.00 0.00 34.13 28.50 2kw5 s GLU 4 CO 0.20 -0.51 1.84 0.50 -0.49 0.00 0.00 175.26 176.81 2kw5 s ARG 5 N 2.57 3.09 -0.25 1.61 3.52 -1.26 -4.97 118.95 123.26 2kw5 s ARG 5 Ca 0.25 1.21 -0.29 0.00 -0.13 0.00 0.00 55.73 56.78 2kw5 s ARG 5 Cb -0.15 -4.26 0.00 0.00 -1.56 0.00 0.00 34.95 28.98 2kw5 s ARG 5 CO 0.11 -2.15 1.18 0.12 -0.81 0.00 0.00 175.30 173.74 2kw5 s PHE 6 N 7.72 2.99 0.64 5.12 5.36 -1.26 -5.03 117.98 133.51 2kw5 s PHE 6 Ca 0.77 1.12 -0.16 0.00 -0.96 0.00 0.00 56.93 57.70 2kw5 s PHE 6 Cb -0.20 -3.60 -0.01 0.00 -0.34 0.00 0.00 43.02 38.88 2kw5 s PHE 6 CO 0.30 -1.22 1.16 0.45 -1.46 0.00 0.00 175.22 174.45 2kw5 s SER 7 N 1.93 5.00 -0.01 6.13 0.15 -1.26 -5.06 113.70 120.58 2kw5 s SER 7 Ca 0.51 2.19 0.05 0.00 0.70 0.00 0.00 55.95 59.40 2kw5 s SER 7 Cb -0.17 -2.57 -0.03 0.00 -1.71 0.00 0.00 66.02 61.54 2kw5 s SER 7 CO 0.15 -1.71 -0.14 -1.58 1.20 0.00 0.00 173.24 171.16 2kw5 s GLN 8 N -3.76 2.37 -0.42 5.44 2.00 -1.26 -5.10 119.66 118.93 2kw5 s GLN 8 Ca 0.72 -0.80 0.05 0.00 -2.00 0.00 0.00 55.36 53.33 2kw5 s GLN 8 Cb -0.25 -2.34 0.17 0.00 0.80 0.00 0.00 33.01 31.39 2kw5 s GLN 8 CO 0.38 0.59 0.48 0.45 -0.50 0.00 0.00 175.29 176.69 2kw5 s SER 9 N -1.11 0.27 -0.41 6.67 0.15 -1.26 -5.09 113.70 112.92 2kw5 s SER 9 Ca 0.14 -1.83 0.04 0.00 0.70 0.00 0.00 55.95 55.00 2kw5 s SER 9 Cb -0.11 0.84 0.11 0.00 -1.71 0.00 0.00 66.02 65.16 2kw5 s SER 9 CO 0.04 -0.18 0.14 -1.61 1.20 0.00 0.00 173.24 172.83 2kw5 s GLU 10 N 1.07 1.62 -1.49 5.44 2.02 -1.26 -5.02 118.70 121.08 2kw5 s GLU 10 Ca 0.23 -2.13 -0.13 0.00 0.02 0.00 0.00 54.97 52.96 2kw5 s GLU 10 Cb -0.07 -3.14 0.02 0.00 0.10 0.00 0.00 34.13 31.04 2kw5 s GLU 10 CO -0.07 -1.02 2.38 0.98 0.02 0.00 0.00 175.26 177.55 2kw5 n TYR 11 N 3.80 3.26 -2.48 1.61 9.36 -1.26 -4.95 117.16 126.51 2kw5 n TYR 11 Ca 0.04 -3.00 -0.43 0.00 3.32 0.00 0.00 57.90 57.84 2kw5 n TYR 11 Cb 0.38 -2.52 -0.02 0.00 -0.63 0.00 0.00 39.34 36.55 2kw5 n TYR 11 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 2kw5 s VAL 12 N 2.83 4.16 -0.39 2.97 0.11 -1.26 -4.92 120.40 123.90 2kw5 s VAL 12 Ca 0.52 1.27 0.04 0.00 -2.93 0.00 0.00 61.98 60.87 2kw5 s VAL 12 Cb 0.15 -4.30 0.18 0.00 -1.53 0.00 0.00 36.38 30.88 2kw5 s VAL 12 CO -0.08 -0.64 0.73 -0.47 -3.33 0.00 0.00 175.10 171.31 2kw5 s TYR 13 N 4.50 -1.40 -1.07 1.54 5.04 -1.26 -5.09 117.35 119.61 2kw5 s TYR 13 Ca 0.54 0.19 -0.07 0.00 -2.44 0.00 0.00 57.07 55.29 2kw5 s TYR 13 Cb -0.13 0.26 0.28 0.00 0.35 0.00 0.00 41.96 42.71 2kw5 s TYR 13 CO 0.26 -0.95 1.13 0.41 -1.34 0.00 0.00 175.55 175.05 2kw5 n GLY 14 N 4.20 4.38 2.59 8.97 0.00 -1.26 -4.97 105.19 119.10 2kw5 n GLY 14 Ca 0.10 -2.61 -0.28 0.00 0.00 0.00 0.00 46.02 43.23 2kw5 n GLY 14 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kw5 s THR 15 N -1.60 -0.03 -0.45 2.61 2.01 -1.26 -5.05 115.64 111.87 2kw5 s THR 15 Ca 0.31 -0.49 0.07 0.00 0.31 0.00 0.00 61.69 61.88 2kw5 s THR 15 Cb -0.07 -0.81 0.23 0.00 0.01 0.00 0.00 72.50 71.87 2kw5 s THR 15 CO -0.05 -0.50 0.71 1.21 -0.69 0.00 0.00 174.62 175.30 2kw5 n GLU 16 N 5.24 0.68 -2.29 4.92 4.07 -1.26 -5.14 120.64 126.86 2kw5 n GLU 16 Ca -0.06 -2.37 -0.29 0.00 -0.06 0.00 0.00 57.16 54.38 2kw5 n GLU 16 Cb 0.45 -1.40 0.01 0.00 -0.06 0.00 0.00 31.44 30.45 2kw5 n GLU 16 CO 0.00 0.00 0.00 -1.25 -0.06 0.00 0.00 177.13 175.82 2kw5 s PRO 17 N 0.05 3.40 -0.83 5.31 0.05 -1.26 -5.06 135.00 136.66 2kw5 s PRO 17 Ca 0.33 0.36 0.01 0.00 0.05 0.00 0.00 61.00 61.75 2kw5 s PRO 17 Cb 0.17 -2.24 0.21 0.00 0.05 0.00 0.00 34.50 32.70 2kw5 s PRO 17 CO -0.18 -0.47 0.73 -1.71 0.05 0.00 0.00 177.00 175.42 2kw5 n ASN 18 N -2.53 3.92 -4.43 6.66 5.15 -1.26 -4.91 115.26 117.87 2kw5 n ASN 18 Ca 0.03 -3.20 -0.21 0.00 -0.60 0.00 0.00 54.58 50.60 2kw5 n ASN 18 Cb 0.55 -0.94 -0.10 0.00 -0.53 0.00 0.00 39.78 38.76 2kw5 n ASN 18 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 2kw5 s ASP 19 N -0.86 2.92 0.30 1.20 1.01 -1.26 -5.03 116.67 114.95 2kw5 s ASP 19 Ca 0.28 -1.13 0.03 0.00 0.71 0.00 0.00 52.55 52.44 2kw5 s ASP 19 Cb -0.03 -0.20 0.48 0.00 1.01 0.00 0.00 42.92 44.18 2kw5 s ASP 19 CO -0.12 -0.25 1.77 0.15 0.21 0.00 0.00 175.17 176.94 2kw5 h PHE 20 N 2.31 0.54 0.00 4.23 3.57 -2.01 -3.13 116.94 122.45 2kw5 h PHE 20 Ca -0.40 -0.09 -0.01 0.00 3.53 0.00 0.00 57.97 61.00 2kw5 h PHE 20 Cb 1.24 -0.14 -0.00 0.00 2.79 0.00 0.00 35.95 39.83 2kw5 h PHE 20 CO 0.71 0.64 -0.06 1.25 -2.23 0.00 0.00 178.31 178.62 2kw5 h LEU 21 N 0.45 0.00 0.00 0.59 5.85 -1.99 -2.54 115.31 117.67 2kw5 h LEU 21 Ca 0.08 0.00 -0.23 0.00 0.84 0.00 0.00 57.88 58.57 2kw5 h LEU 21 Cb 0.55 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.54 2kw5 h LEU 21 CO 0.04 0.06 -1.36 -0.37 -0.34 0.00 0.00 178.44 176.46 2kw5 h VAL 22 N 0.00 1.04 -0.04 1.05 -1.51 -1.89 -2.47 116.25 112.43 2kw5 h VAL 22 Ca -0.00 -2.75 -0.13 0.00 -1.23 0.00 0.00 66.70 62.58 2kw5 h VAL 22 Cb 0.47 2.48 0.01 0.00 -2.13 0.00 0.00 31.29 32.12 2kw5 h VAL 22 CO 0.01 0.59 -0.50 -1.28 -1.23 0.00 0.00 177.57 175.16 2kw5 h SER 23 N 0.00 0.50 -0.46 4.19 0.87 -1.56 -0.26 113.55 116.83 2kw5 h SER 23 Ca -0.16 -0.71 -0.06 0.00 -1.23 0.00 0.00 61.79 59.62 2kw5 h SER 23 Cb 1.82 -0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 63.61 2kw5 h SER 23 CO 0.09 1.14 0.09 -0.37 -0.53 0.00 0.00 176.83 177.25 2kw5 h VAL 24 N -0.10 1.23 0.00 2.23 -1.51 -1.59 -2.55 116.25 113.96 2kw5 h VAL 24 Ca -0.05 -0.87 -0.04 0.00 -1.23 0.00 0.00 66.70 64.51 2kw5 h VAL 24 Cb 1.19 0.73 -0.01 0.00 -2.13 0.00 0.00 31.29 31.07 2kw5 h VAL 24 CO 0.10 0.32 -0.18 0.00 -1.23 0.00 0.00 177.57 176.57 2kw5 h ALA 25 N 1.32 1.30 0.00 5.19 0.00 -1.35 -0.08 119.26 125.64 2kw5 h ALA 25 Ca 0.17 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 2kw5 h ALA 25 Cb 0.34 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2kw5 h ALA 25 CO 0.00 0.23 -0.27 -0.97 0.00 0.00 0.00 179.25 178.25 2kw5 h ASN 26 N 0.00 0.00 0.79 0.00 -1.24 -0.62 -2.96 115.58 111.55 2kw5 h ASN 26 Ca -0.00 0.00 -0.17 0.00 0.71 0.00 0.00 56.30 56.84 2kw5 h ASN 26 Cb 0.45 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 39.47 2kw5 h ASN 26 CO 0.02 0.27 -1.31 1.56 -1.29 0.00 0.00 177.43 176.68 2kw5 h GLN 27 N 0.00 0.00 -6.50 6.67 1.08 -1.03 -3.46 115.11 111.87 2kw5 h GLN 27 Ca -0.00 0.00 -0.53 0.00 -1.45 0.00 0.00 58.65 56.66 2kw5 h GLN 27 Cb 0.62 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.05 2kw5 h GLN 27 CO 0.04 0.34 0.57 0.42 -0.95 0.00 0.00 178.83 179.24 2kw5 s ILE 28 N -2.91 3.95 0.15 2.54 1.01 -0.16 -5.00 121.20 120.78 2kw5 s ILE 28 Ca -0.02 1.41 -0.34 0.00 0.00 0.00 0.00 60.65 61.70 2kw5 s ILE 28 Cb 0.09 -3.90 -0.16 0.00 0.01 0.00 0.00 42.46 38.49 2kw5 s ILE 28 CO 0.80 0.12 1.26 -2.65 0.00 0.00 0.00 174.94 174.47 2kw5 n PRO 29 N 3.86 1.28 0.00 2.79 -0.02 -1.26 -4.88 135.00 136.77 2kw5 n PRO 29 Ca 0.09 0.46 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 2kw5 n PRO 29 Cb 0.46 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 31.91 2kw5 n PRO 29 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2kw5 n GLN 30 N 2.09 0.73 0.00 -0.52 6.02 -1.26 -4.65 117.38 119.79 2kw5 n GLN 30 Ca 0.16 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.15 2kw5 n GLN 30 Cb 0.24 -1.18 0.00 0.00 1.02 0.00 0.00 30.24 30.31 2kw5 n GLN 30 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2kw5 n GLY 31 N 0.53 3.00 3.62 1.08 0.00 -1.26 -4.80 105.19 107.35 2kw5 n GLY 31 Ca 0.00 -0.80 -0.43 0.00 0.00 0.00 0.00 46.02 44.79 2kw5 n GLY 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kw5 s LYS 32 N 4.49 3.93 0.11 1.61 1.02 -1.26 -3.45 119.74 126.19 2kw5 s LYS 32 Ca 0.00 0.78 0.05 0.00 0.02 0.00 0.00 55.97 56.82 2kw5 s LYS 32 Cb 0.00 -3.78 -0.04 0.00 -0.52 0.00 0.00 37.83 33.49 2kw5 s LYS 32 CO 0.00 -0.96 0.02 0.42 -0.92 0.00 0.00 175.35 173.91 2kw5 s ILE 33 N 3.62 4.03 -0.18 2.17 1.01 -0.51 -1.48 121.20 129.87 2kw5 s ILE 33 Ca 0.42 -1.06 0.01 0.00 0.00 0.00 0.00 60.65 60.02 2kw5 s ILE 33 Cb -0.12 -2.95 0.02 0.00 0.01 0.00 0.00 42.46 39.42 2kw5 s ILE 33 CO 0.18 0.06 -0.19 -0.22 0.00 0.00 0.00 174.94 174.77 2kw5 s LEU 34 N -2.49 2.17 -0.18 2.97 2.96 -0.70 -0.95 118.68 122.46 2kw5 s LEU 34 Ca 0.27 -0.63 -0.05 0.00 -0.22 0.00 0.00 54.13 53.50 2kw5 s LEU 34 Cb -0.11 -1.49 -0.03 0.00 0.50 0.00 0.00 46.19 45.06 2kw5 s LEU 34 CO 0.19 0.01 -0.01 0.00 -1.32 0.00 0.00 176.35 175.21 2kw5 n LEU 36 N 3.97 0.00 -4.49 0.00 4.77 -1.15 -0.62 117.00 119.47 2kw5 n LEU 36 Ca -0.17 -0.32 -0.16 0.00 -0.03 0.00 0.00 56.01 55.33 2kw5 n LEU 36 Cb 0.52 -0.25 -0.15 0.00 -2.33 0.00 0.00 43.42 41.21 2kw5 n LEU 36 CO 0.32 -1.07 1.61 0.00 -1.33 0.00 0.00 177.39 176.92 2kw5 n ALA 37 N -3.36 0.73 -1.45 -1.18 0.00 -0.92 -4.10 120.51 110.23 2kw5 n ALA 37 Ca -0.05 -1.14 -0.33 0.00 0.00 0.00 0.00 53.44 51.92 2kw5 n ALA 37 Cb 0.14 -2.66 0.06 0.00 0.00 0.00 0.00 19.45 17.00 2kw5 n ALA 37 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2kw5 s GLU 38 N 7.69 2.54 0.60 0.00 0.41 -1.26 -4.72 118.70 123.97 2kw5 s GLU 38 Ca 1.04 1.53 0.31 0.00 -0.41 0.00 0.00 54.97 57.44 2kw5 s GLU 38 Cb -0.47 -1.91 1.81 0.00 -1.78 0.00 0.00 34.13 31.79 2kw5 s GLU 38 CO 0.32 -1.48 2.17 0.78 -0.49 0.00 0.00 175.26 176.57 2kw5 h GLY 39 N -0.10 0.00 -4.80 -1.39 0.00 -1.89 -3.42 103.07 91.47 2kw5 h GLY 39 Ca -0.47 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 46.74 2kw5 h GLY 39 CO 0.52 0.00 -0.25 1.85 0.00 0.00 0.00 176.54 178.66 2kw5 s GLU 40 N -4.54 0.59 0.58 4.80 2.12 -1.26 -5.06 118.70 115.93 2kw5 s GLU 40 Ca -0.05 0.12 0.33 0.00 0.36 0.00 0.00 54.97 55.74 2kw5 s GLU 40 Cb 0.14 0.27 1.77 0.00 0.26 0.00 0.00 34.13 36.58 2kw5 s GLU 40 CO 0.51 -0.14 2.17 0.78 -0.54 0.00 0.00 175.26 178.05 2kw5 h GLY 41 N 4.52 0.00 1.50 -1.50 0.00 -1.86 -2.44 103.07 103.29 2kw5 h GLY 41 Ca -0.28 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.02 2kw5 h GLY 41 CO 0.35 0.00 0.19 3.21 0.00 0.00 0.00 176.54 180.28 2kw5 h ARG 42 N 0.00 0.64 -0.00 4.80 3.08 -1.95 -3.28 114.38 117.68 2kw5 h ARG 42 Ca -0.00 -0.08 0.02 0.00 0.07 0.00 0.00 59.98 59.99 2kw5 h ARG 42 Cb 0.21 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.11 2kw5 h ARG 42 CO 0.01 0.53 -0.15 -0.91 -1.07 0.00 0.00 179.97 178.37 2kw5 h ASN 43 N 0.64 -0.45 0.25 7.04 2.35 -1.86 -0.08 115.58 123.47 2kw5 h ASN 43 Ca 0.16 0.07 0.00 0.00 -0.55 0.00 0.00 56.30 55.98 2kw5 h ASN 43 Cb 0.12 0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.67 2kw5 h ASN 43 CO -0.02 -0.21 -0.23 0.00 -1.65 0.00 0.00 177.43 175.32 2kw5 h ALA 44 N 0.68 -0.48 0.00 -0.83 0.00 -1.75 -1.66 119.26 115.23 2kw5 h ALA 44 Ca 0.05 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 2kw5 h ALA 44 Cb 0.32 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2kw5 h ALA 44 CO -0.15 -0.80 -0.35 0.00 0.00 0.00 0.00 179.25 177.95 2kw5 h PHE 46 N 0.00 0.97 -0.40 0.00 3.57 -0.62 -1.42 116.94 119.04 2kw5 h PHE 46 Ca -0.00 -0.18 -0.07 0.00 3.53 0.00 0.00 57.97 61.25 2kw5 h PHE 46 Cb 0.67 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 39.14 2kw5 h PHE 46 CO 0.00 0.93 -0.03 -0.07 -2.23 0.00 0.00 178.31 176.91 2kw5 h LEU 47 N 0.74 0.63 -0.57 0.59 3.38 -1.13 -2.45 115.31 116.50 2kw5 h LEU 47 Ca 0.13 -0.15 -0.15 0.00 0.09 0.00 0.00 57.88 57.80 2kw5 h LEU 47 Cb 0.57 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 2kw5 h LEU 47 CO 0.03 0.73 -0.69 0.00 0.09 0.00 0.00 178.44 178.59 2kw5 h ALA 48 N 1.35 0.80 0.00 1.53 0.00 -1.37 -2.79 119.26 118.77 2kw5 h ALA 48 Ca 0.12 -0.62 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 2kw5 h ALA 48 Cb 0.44 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 2kw5 h ALA 48 CO 0.02 0.82 -0.03 0.77 0.00 0.00 0.00 179.25 180.84 2kw5 h SER 49 N 0.08 0.00 0.00 0.00 0.02 -0.80 -1.37 113.55 111.48 2kw5 h SER 49 Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2kw5 h SER 49 Cb 1.23 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.77 2kw5 h SER 49 CO 0.10 0.03 0.00 0.18 -1.14 0.00 0.00 176.83 176.00 2kw5 n LEU 50 N -3.50 0.22 0.00 5.07 4.77 -1.02 -4.82 117.00 117.72 2kw5 n LEU 50 Ca -0.03 -0.11 0.00 0.00 -0.03 0.00 0.00 56.01 55.85 2kw5 n LEU 50 Cb 0.13 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 2kw5 n LEU 50 CO 0.25 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.98 2kw5 n GLY 51 N 0.32 0.64 3.85 -0.72 0.00 -0.54 -5.06 105.19 103.69 2kw5 n GLY 51 Ca 0.00 -0.25 -0.28 0.00 0.00 0.00 0.00 46.02 45.49 2kw5 n GLY 51 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2kw5 s TYR 52 N -2.00 3.30 -0.89 1.61 2.02 -1.10 -5.02 117.35 115.26 2kw5 s TYR 52 Ca 0.00 0.08 -0.18 0.00 -0.37 0.00 0.00 57.07 56.59 2kw5 s TYR 52 Cb 0.00 -1.61 0.14 0.00 -0.40 0.00 0.00 41.96 40.08 2kw5 s TYR 52 CO 0.00 0.53 1.05 -1.21 -1.57 0.00 0.00 175.55 174.35 2kw5 s GLU 53 N -2.87 3.55 -0.22 -0.62 2.02 -1.22 -4.34 118.70 114.99 2kw5 s GLU 53 Ca 0.32 -1.77 -0.11 0.00 0.02 0.00 0.00 54.97 53.42 2kw5 s GLU 53 Cb -0.11 -4.79 -0.05 0.00 0.10 0.00 0.00 34.13 29.28 2kw5 s GLU 53 CO 0.25 -1.71 0.20 0.08 0.02 0.00 0.00 175.26 174.10 2kw5 s VAL 54 N 2.45 5.35 -0.39 2.63 1.01 -1.25 -1.42 120.40 128.78 2kw5 s VAL 54 Ca 0.29 0.29 -0.14 0.00 0.00 0.00 0.00 61.98 62.42 2kw5 s VAL 54 Cb -0.07 -3.53 0.01 0.00 0.00 0.00 0.00 36.38 32.78 2kw5 s VAL 54 CO -0.08 0.36 0.29 -0.89 0.00 0.00 0.00 175.10 174.79 2kw5 s THR 55 N 0.83 5.26 -0.07 3.92 2.01 -0.12 -1.48 115.64 126.00 2kw5 s THR 55 Ca 0.10 -0.50 -0.11 0.00 0.31 0.00 0.00 61.69 61.49 2kw5 s THR 55 Cb -0.13 -3.87 -0.05 0.00 0.01 0.00 0.00 72.50 68.46 2kw5 s THR 55 CO 0.03 -0.22 0.27 0.00 -0.69 0.00 0.00 174.62 174.01 2kw5 s ALA 56 N 1.72 3.78 0.13 7.40 0.00 -0.12 -0.93 121.76 133.74 2kw5 s ALA 56 Ca 0.06 -0.43 0.10 0.00 0.00 0.00 0.00 51.96 51.69 2kw5 s ALA 56 Cb -0.18 -2.18 -0.04 0.00 0.00 0.00 0.00 23.12 20.71 2kw5 s ALA 56 CO 0.10 0.53 -0.23 0.08 0.00 0.00 0.00 175.76 176.25 2kw5 s VAL 57 N -0.98 2.53 -0.15 0.00 1.01 0.21 0.01 120.40 123.03 2kw5 s VAL 57 Ca 0.19 -1.65 -0.25 0.00 0.00 0.00 0.00 61.98 60.27 2kw5 s VAL 57 Cb -0.14 -2.14 0.06 0.00 0.00 0.00 0.00 36.38 34.16 2kw5 s VAL 57 CO 0.08 0.09 0.63 -0.62 0.00 0.00 0.00 175.10 175.28 2kw5 s ASP 58 N -2.11 -0.63 0.59 3.32 2.15 -1.20 -2.17 116.67 116.62 2kw5 s ASP 58 Ca 0.16 0.98 0.37 0.00 0.43 0.00 0.00 52.55 54.49 2kw5 s ASP 58 Cb -0.10 0.94 1.74 0.00 -0.30 0.00 0.00 42.92 45.20 2kw5 s ASP 58 CO 0.08 -0.39 2.12 0.06 -0.17 0.00 0.00 175.17 176.88 2kw5 h GLN 59 N 4.22 0.00 -6.08 4.34 3.07 -1.92 -2.96 115.11 115.78 2kw5 h GLN 59 Ca -0.28 0.00 -0.68 0.00 0.09 0.00 0.00 58.65 57.78 2kw5 h GLN 59 Cb 1.16 0.00 -0.17 0.00 0.08 0.00 0.00 27.48 28.55 2kw5 h GLN 59 CO 0.23 0.01 -0.66 -1.12 0.09 0.00 0.00 178.83 177.38 2kw5 s SER 60 N -5.55 4.90 0.35 0.06 0.01 -1.26 -4.86 113.70 107.34 2kw5 s SER 60 Ca -0.01 0.04 0.14 0.00 1.31 0.00 0.00 55.95 57.43 2kw5 s SER 60 Cb 0.11 -1.29 0.64 0.00 0.21 0.00 0.00 66.02 65.68 2kw5 s SER 60 CO 0.50 0.36 1.76 0.28 0.41 0.00 0.00 173.24 176.56 2kw5 h SER 61 N 5.15 0.00 -0.44 2.44 0.02 -2.00 -3.23 113.55 115.49 2kw5 h SER 61 Ca -0.50 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.44 2kw5 h SER 61 Cb 1.18 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.70 2kw5 h SER 61 CO 0.53 0.44 0.22 -0.37 -1.14 0.00 0.00 176.83 176.51 2kw5 h VAL 62 N 0.00 1.17 0.07 2.27 -1.51 -1.97 -0.89 116.25 115.38 2kw5 h VAL 62 Ca -0.00 -0.48 -0.25 0.00 -1.23 0.00 0.00 66.70 64.73 2kw5 h VAL 62 Cb 0.81 0.57 0.00 0.00 -2.13 0.00 0.00 31.29 30.54 2kw5 h VAL 62 CO 0.06 0.19 -1.10 1.23 -1.23 0.00 0.00 177.57 176.72 2kw5 h GLY 63 N 0.78 0.38 0.71 5.19 0.00 -1.95 -1.12 103.07 107.06 2kw5 h GLY 63 Ca 0.17 -0.81 -0.00 0.00 0.00 0.00 0.00 47.33 46.69 2kw5 h GLY 63 CO -0.02 0.71 -0.03 1.41 0.00 0.00 0.00 176.54 178.61 2kw5 h LEU 64 N 0.15 -0.08 -1.39 3.11 3.38 -1.55 -1.88 115.31 117.04 2kw5 h LEU 64 Ca -0.11 -0.26 0.01 0.00 0.09 0.00 0.00 57.88 57.61 2kw5 h LEU 64 Cb 1.78 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 42.52 2kw5 h LEU 64 CO 0.19 0.22 0.41 0.00 0.09 0.00 0.00 178.44 179.35 2kw5 h ALA 65 N 0.52 1.56 -0.51 1.53 0.00 -1.24 -1.17 119.26 119.95 2kw5 h ALA 65 Ca -0.01 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2kw5 h ALA 65 Cb 0.34 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2kw5 h ALA 65 CO 0.02 0.41 0.22 -0.22 0.00 0.00 0.00 179.25 179.67 2kw5 h LYS 66 N 0.84 0.75 -0.31 0.00 1.63 -1.14 -1.29 116.57 117.04 2kw5 h LYS 66 Ca 0.23 -0.13 -0.02 0.00 -0.85 0.00 0.00 60.65 59.88 2kw5 h LYS 66 Cb -0.09 -0.13 -0.01 0.00 -0.60 0.00 0.00 32.23 31.40 2kw5 h LYS 66 CO -0.05 0.65 0.11 0.00 -3.45 0.00 0.00 179.45 176.71 2kw5 h ALA 67 N 1.06 0.41 -0.39 5.00 0.00 -0.89 -2.33 119.26 122.12 2kw5 h ALA 67 Ca 0.17 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 2kw5 h ALA 67 Cb 0.17 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2kw5 h ALA 67 CO -0.02 0.02 -0.08 -0.22 0.00 0.00 0.00 179.25 178.96 2kw5 h LYS 68 N 0.35 0.74 0.13 0.00 3.64 -1.16 -1.14 116.57 119.13 2kw5 h LYS 68 Ca 0.10 -0.28 0.02 0.00 -1.27 0.00 0.00 60.65 59.22 2kw5 h LYS 68 Cb 0.21 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.96 2kw5 h LYS 68 CO -0.01 0.87 -0.26 0.37 -2.27 0.00 0.00 179.45 178.15 2kw5 h GLN 69 N 0.55 -0.46 0.00 1.90 4.15 -1.24 -2.09 115.11 117.92 2kw5 h GLN 69 Ca 0.10 0.03 -0.06 0.00 0.77 0.00 0.00 58.65 59.50 2kw5 h GLN 69 Cb 0.59 0.10 -0.01 0.00 0.21 0.00 0.00 27.48 28.38 2kw5 h GLN 69 CO 0.04 -0.31 -0.26 1.25 -1.93 0.00 0.00 178.83 177.62 2kw5 h LEU 70 N -0.48 0.00 0.58 -2.39 5.85 -1.36 -1.87 115.31 115.64 2kw5 h LEU 70 Ca 0.03 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.72 2kw5 h LEU 70 Cb 0.50 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.54 2kw5 h LEU 70 CO -0.14 0.26 -0.28 0.00 -0.34 0.00 0.00 178.44 177.94 2kw5 h ALA 71 N 1.74 -1.02 0.00 1.25 0.00 -0.95 -1.41 119.26 118.86 2kw5 h ALA 71 Ca -0.00 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.70 2kw5 h ALA 71 Cb 0.50 0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 2kw5 h ALA 71 CO 0.03 -0.97 -0.16 -0.56 0.00 0.00 0.00 179.25 177.60 2kw5 h GLN 72 N -0.92 0.00 0.27 0.00 3.07 -1.36 -0.33 115.11 115.84 2kw5 h GLN 72 Ca -0.08 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.65 2kw5 h GLN 72 Cb 0.60 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.16 2kw5 h GLN 72 CO 0.13 0.16 -0.13 1.49 0.09 0.00 0.00 178.83 180.57 2kw5 h GLU 73 N 0.00 -0.35 -0.00 0.06 4.81 -1.38 -3.32 114.58 114.40 2kw5 h GLU 73 Ca -0.00 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.25 2kw5 h GLU 73 Cb 0.40 0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.86 2kw5 h GLU 73 CO 0.02 -0.00 -0.06 1.17 -0.73 0.00 0.00 179.01 179.41 2kw5 n LYS 74 N -5.07 0.54 -2.29 1.92 4.81 -0.53 -4.90 118.16 112.63 2kw5 n LYS 74 Ca -0.09 -0.10 -0.03 0.00 -0.87 0.00 0.00 58.31 57.22 2kw5 n LYS 74 Cb 0.26 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 33.82 2kw5 n LYS 74 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2kw5 n GLY 75 N 1.28 0.48 3.52 3.14 0.00 -0.28 -5.07 105.19 108.26 2kw5 n GLY 75 Ca 0.14 -0.69 -0.24 0.00 0.00 0.00 0.00 46.02 45.23 2kw5 n GLY 75 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2kw5 s VAL 76 N -2.51 1.44 -0.03 1.61 -7.23 -0.36 -5.03 120.40 108.30 2kw5 s VAL 76 Ca 0.03 -2.00 0.07 0.00 -1.81 0.00 0.00 61.98 58.27 2kw5 s VAL 76 Cb -0.01 -2.84 -0.01 0.00 0.56 0.00 0.00 36.38 34.08 2kw5 s VAL 76 CO 0.04 0.00 -0.24 -0.75 -0.31 0.00 0.00 175.10 173.84 2kw5 s LYS 77 N -3.82 2.11 0.37 4.82 2.20 -1.26 -3.81 119.74 120.34 2kw5 s LYS 77 Ca 0.35 -0.85 0.08 0.00 -0.36 0.00 0.00 55.97 55.19 2kw5 s LYS 77 Cb 0.09 -1.94 -0.06 0.00 -1.51 0.00 0.00 37.83 34.41 2kw5 s LYS 77 CO 0.16 0.46 0.05 0.42 -0.36 0.00 0.00 175.35 176.07 2kw5 s ILE 78 N -0.40 2.39 -0.25 5.43 -1.09 -1.26 -3.91 121.20 122.11 2kw5 s ILE 78 Ca 0.05 -1.93 -0.02 0.00 -2.23 0.00 0.00 60.65 56.52 2kw5 s ILE 78 Cb -0.11 -2.88 0.08 0.00 -1.58 0.00 0.00 42.46 37.97 2kw5 s ILE 78 CO 0.01 -0.11 0.06 -0.89 -1.23 0.00 0.00 174.94 172.78 2kw5 s THR 79 N -2.58 0.61 0.02 2.92 2.01 -0.55 -4.96 115.64 113.11 2kw5 s THR 79 Ca 0.36 -0.89 -0.19 0.00 0.31 0.00 0.00 61.69 61.28 2kw5 s THR 79 Cb 0.03 -1.27 -0.06 0.00 0.01 0.00 0.00 72.50 71.21 2kw5 s THR 79 CO 0.20 -0.42 0.56 0.42 -0.69 0.00 0.00 174.62 174.68 2kw5 s THR 80 N 1.79 4.87 -0.05 -0.82 -4.23 -1.26 -0.95 115.64 114.99 2kw5 s THR 80 Ca 0.04 1.17 0.04 0.00 -1.18 0.00 0.00 61.69 61.76 2kw5 s THR 80 Cb -0.17 -3.89 -0.00 0.00 1.34 0.00 0.00 72.50 69.78 2kw5 s THR 80 CO -0.17 0.49 -0.18 -0.69 -0.54 0.00 0.00 174.62 173.52 2kw5 s VAL 81 N -0.61 1.53 0.18 2.29 1.01 0.10 -4.93 120.40 119.97 2kw5 s VAL 81 Ca 0.29 -0.77 -0.26 0.00 0.00 0.00 0.00 61.98 61.24 2kw5 s VAL 81 Cb -0.18 -1.31 -0.08 0.00 0.00 0.00 0.00 36.38 34.80 2kw5 s VAL 81 CO 0.17 0.44 0.81 -1.10 0.00 0.00 0.00 175.10 175.42 2kw5 s GLN 82 N 0.04 4.63 -0.40 2.72 -0.21 -1.26 -3.22 119.66 121.95 2kw5 s GLN 82 Ca -0.05 1.23 -0.36 0.00 0.02 0.00 0.00 55.36 56.20 2kw5 s GLN 82 Cb -0.12 -3.27 -0.13 0.00 1.00 0.00 0.00 33.01 30.49 2kw5 s GLN 82 CO 0.03 0.55 2.21 -1.13 -2.12 0.00 0.00 175.29 174.83 2kw5 n SER 83 N 1.60 1.83 -3.57 5.90 3.41 -1.12 -4.88 113.62 116.79 2kw5 n SER 83 Ca -0.05 0.42 -0.29 0.00 -0.26 0.00 0.00 58.87 58.69 2kw5 n SER 83 Cb 0.48 -1.20 -0.13 0.00 -0.26 0.00 0.00 64.21 63.10 2kw5 n SER 83 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2kw5 s ASN 84 N 7.33 3.40 -0.19 4.04 0.01 -1.26 -5.01 114.94 123.25 2kw5 s ASN 84 Ca 1.12 -2.00 0.08 0.00 -0.71 0.00 0.00 52.86 51.36 2kw5 s ASN 84 Cb -0.96 -0.59 -0.18 0.00 0.41 0.00 0.00 41.25 39.93 2kw5 s ASN 84 CO 0.51 -0.35 -0.07 0.18 -1.51 0.00 0.00 177.10 175.86 2kw5 n LEU 85 N 4.33 1.57 0.00 0.60 4.77 -1.21 -3.10 117.00 123.95 2kw5 n LEU 85 Ca 0.05 -0.06 0.13 0.00 -0.03 0.00 0.00 56.01 56.10 2kw5 n LEU 85 Cb 0.38 -0.20 0.65 0.00 -2.33 0.00 0.00 43.42 41.92 2kw5 n LEU 85 CO 0.14 0.66 0.93 0.00 -1.33 0.00 0.00 177.39 177.78 2kw5 n ALA 86 N -2.90 2.30 -0.02 -1.18 0.00 -1.26 -3.54 120.51 113.91 2kw5 n ALA 86 Ca -0.34 -0.12 -0.01 0.00 0.00 0.00 0.00 53.44 52.97 2kw5 n ALA 86 Cb 0.98 -1.42 -0.03 0.00 0.00 0.00 0.00 19.45 18.98 2kw5 n ALA 86 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2kw5 n ASP 87 N -1.29 4.06 -3.52 0.00 2.03 -1.26 -5.09 116.55 111.47 2kw5 n ASP 87 Ca 0.12 0.00 -0.14 0.00 0.52 0.00 0.00 54.79 55.29 2kw5 n ASP 87 Cb 0.21 0.68 -0.04 0.00 -0.72 0.00 0.00 41.12 41.24 2kw5 n ASP 87 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 2kw5 s PHE 88 N -2.12 -0.48 0.00 -0.67 5.36 -1.18 -5.12 117.98 113.78 2kw5 s PHE 88 Ca -0.02 0.48 0.00 0.00 -0.96 0.00 0.00 56.93 56.43 2kw5 s PHE 88 Cb 0.01 0.41 0.00 0.00 -0.34 0.00 0.00 43.02 43.10 2kw5 s PHE 88 CO 0.16 -0.71 0.00 -0.40 -1.46 0.00 0.00 175.22 172.81 2kw5 n ASP 89 N 0.19 0.00 -3.67 6.13 5.68 -1.26 -3.35 116.55 120.26 2kw5 n ASP 89 Ca -0.18 0.00 -0.21 0.00 -0.50 0.00 0.00 54.79 53.90 2kw5 n ASP 89 Cb 0.62 0.27 -0.18 0.00 -1.14 0.00 0.00 41.12 40.69 2kw5 n ASP 89 CO 0.00 0.00 0.00 0.27 -1.33 0.00 0.00 177.20 176.14 2kw5 s ILE 90 N -0.94 -0.05 -0.49 2.12 -4.36 -1.26 -4.95 121.20 111.26 2kw5 s ILE 90 Ca 0.00 0.32 0.03 0.00 -0.26 0.00 0.00 60.65 60.74 2kw5 s ILE 90 Cb 0.00 -0.24 0.15 0.00 1.25 0.00 0.00 42.46 43.61 2kw5 s ILE 90 CO 0.00 0.13 0.31 -0.69 0.24 0.00 0.00 174.94 174.93 2kw5 s VAL 91 N 2.14 1.65 -2.00 8.37 1.01 -1.26 -4.02 120.40 126.29 2kw5 s VAL 91 Ca 0.05 -2.98 0.16 0.00 0.00 0.00 0.00 61.98 59.21 2kw5 s VAL 91 Cb -0.13 -2.13 0.45 0.00 0.00 0.00 0.00 36.38 34.57 2kw5 s VAL 91 CO -0.04 -0.96 1.37 0.00 0.00 0.00 0.00 175.10 175.47 2kw5 n ALA 92 N 3.09 2.20 -0.04 5.51 0.00 -1.05 -1.34 120.51 128.89 2kw5 n ALA 92 Ca 0.14 -0.10 -0.12 0.00 0.00 0.00 0.00 53.44 53.35 2kw5 n ALA 92 Cb 0.36 -1.26 -0.07 0.00 0.00 0.00 0.00 19.45 18.49 2kw5 n ALA 92 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 2kw5 h ASP 93 N 0.00 0.22 0.57 0.00 3.58 -1.91 -3.32 116.42 115.57 2kw5 h ASP 93 Ca 0.00 -0.36 0.00 0.00 0.42 0.00 0.00 57.03 57.09 2kw5 h ASP 93 Cb 0.00 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 40.99 2kw5 h ASP 93 CO 0.00 0.53 -0.61 0.00 -2.88 0.00 0.00 179.24 176.28 2kw5 n ALA 94 N -2.33 3.40 -4.10 -0.78 0.00 -0.45 -4.81 120.51 111.45 2kw5 n ALA 94 Ca -0.06 -0.34 -0.33 0.00 0.00 0.00 0.00 53.44 52.72 2kw5 n ALA 94 Cb 0.24 -1.11 -0.16 0.00 0.00 0.00 0.00 19.45 18.43 2kw5 n ALA 94 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2kw5 s TRP 95 N -3.07 2.85 0.14 0.00 0.52 -0.75 -5.04 118.94 113.59 2kw5 s TRP 95 Ca 0.09 -1.77 -0.18 0.00 0.02 0.00 0.00 56.10 54.26 2kw5 s TRP 95 Cb 0.16 -1.90 0.00 0.00 -1.15 0.00 0.00 33.47 30.58 2kw5 s TRP 95 CO 0.72 -0.82 1.77 0.93 0.02 0.00 0.00 176.95 179.57 2kw5 h GLU 96 N 7.91 0.29 -6.01 4.98 5.08 -1.48 -3.39 114.58 121.96 2kw5 h GLU 96 Ca -0.40 -0.02 -0.54 0.00 -1.00 0.00 0.00 59.36 57.41 2kw5 h GLU 96 Cb 1.12 -0.07 -0.17 0.00 0.50 0.00 0.00 28.75 30.13 2kw5 h GLU 96 CO 0.59 0.19 -0.78 0.20 -1.00 0.00 0.00 179.01 178.22 2kw5 s GLY 97 N -2.56 1.50 0.06 -3.84 0.00 -0.71 -4.72 107.32 97.06 2kw5 s GLY 97 Ca -0.13 -1.58 0.06 0.00 0.00 0.00 0.00 44.72 43.07 2kw5 s GLY 97 CO 0.70 -1.64 -0.15 -0.42 0.00 0.00 0.00 173.10 171.59 2kw5 s ILE 98 N -2.18 1.22 0.01 0.90 1.01 -1.22 -1.72 121.20 119.23 2kw5 s ILE 98 Ca 0.19 -1.24 0.02 0.00 0.00 0.00 0.00 60.65 59.62 2kw5 s ILE 98 Cb -0.05 -1.14 -0.01 0.00 0.01 0.00 0.00 42.46 41.27 2kw5 s ILE 98 CO 0.08 -0.12 -0.07 0.54 0.00 0.00 0.00 174.94 175.37 2kw5 s VAL 99 N -1.11 0.53 -0.27 2.92 0.11 -0.24 -0.82 120.40 121.51 2kw5 s VAL 99 Ca 0.01 -0.53 -0.03 0.00 -2.93 0.00 0.00 61.98 58.50 2kw5 s VAL 99 Cb -0.09 -0.49 0.11 0.00 -1.53 0.00 0.00 36.38 34.38 2kw5 s VAL 99 CO 0.02 -0.02 0.21 -0.44 -3.33 0.00 0.00 175.10 171.54 2kw5 s SER 100 N -0.60 2.40 -1.14 3.54 0.01 -1.01 -2.96 113.70 113.94 2kw5 s SER 100 Ca -0.01 -0.87 -0.21 0.00 1.31 0.00 0.00 55.95 56.16 2kw5 s SER 100 Cb -0.05 0.11 0.01 0.00 0.21 0.00 0.00 66.02 66.30 2kw5 s SER 100 CO 0.00 -0.40 1.76 -0.63 0.41 0.00 0.00 173.24 174.38 2kw5 s ILE 101 N 2.24 3.82 -0.21 1.44 -1.09 -1.26 -1.47 121.20 124.67 2kw5 s ILE 101 Ca 0.08 -1.14 -0.29 0.00 -2.23 0.00 0.00 60.65 57.07 2kw5 s ILE 101 Cb -0.15 -4.81 -0.01 0.00 -1.58 0.00 0.00 42.46 35.91 2kw5 s ILE 101 CO -0.30 -1.56 1.33 0.12 -1.23 0.00 0.00 174.94 173.30 2kw5 s PHE 102 N 7.13 2.68 0.46 3.97 2.19 -0.21 -3.10 117.98 131.10 2kw5 s PHE 102 Ca 0.59 0.88 0.06 0.00 0.33 0.00 0.00 56.93 58.78 2kw5 s PHE 102 Cb 0.00 -3.71 -0.02 0.00 -1.31 0.00 0.00 43.02 37.99 2kw5 s PHE 102 CO 0.04 -1.93 0.22 0.00 1.83 0.00 0.00 175.22 175.38 2kw5 n HIS 104 N -1.40 1.30 -2.93 0.00 -0.00 -1.26 -4.94 115.22 106.00 2kw5 n HIS 104 Ca -0.04 0.16 -0.40 0.00 -0.00 0.00 0.00 57.72 57.45 2kw5 n HIS 104 Cb 0.65 -2.59 -0.06 0.00 -0.00 0.00 0.00 29.99 27.99 2kw5 n HIS 104 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 2kw5 s LEU 105 N 11.11 4.60 0.43 2.41 1.43 -1.26 -5.06 118.68 132.35 2kw5 s LEU 105 Ca 1.06 1.71 -0.23 0.00 -1.03 0.00 0.00 54.13 55.64 2kw5 s LEU 105 Cb -0.43 -3.37 -0.11 0.00 0.03 0.00 0.00 46.19 42.31 2kw5 s LEU 105 CO 0.32 0.19 0.84 -2.65 0.23 0.00 0.00 176.35 175.29 2kw5 n PRO 106 N 1.61 1.02 -0.45 1.29 -0.02 -1.26 -4.58 135.00 132.61 2kw5 n PRO 106 Ca -0.05 0.37 0.37 0.00 -2.02 0.00 0.00 63.50 62.18 2kw5 n PRO 106 Cb 0.48 -1.86 0.67 0.00 -0.02 0.00 0.00 33.50 32.77 2kw5 n PRO 106 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 2kw5 h SER 107 N 1.18 0.21 0.39 2.55 0.02 -1.98 -0.29 113.55 115.63 2kw5 h SER 107 Ca -0.43 0.10 -0.01 0.00 -0.84 0.00 0.00 61.79 60.60 2kw5 h SER 107 Cb 1.36 0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.98 2kw5 h SER 107 CO 0.54 -0.10 -0.29 -1.28 -1.14 0.00 0.00 176.83 174.56 2kw5 h SER 108 N 0.11 -0.77 0.53 3.07 0.87 -2.01 -2.81 113.55 112.54 2kw5 h SER 108 Ca 0.78 0.05 -0.13 0.00 -1.23 0.00 0.00 61.79 61.26 2kw5 h SER 108 Cb 2.57 0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 64.75 2kw5 h SER 108 CO -0.31 -0.42 -0.59 -0.07 -0.53 0.00 0.00 176.83 174.92 2kw5 h LEU 109 N -0.65 0.07 0.63 2.23 3.38 -1.44 -2.96 115.31 116.58 2kw5 h LEU 109 Ca -0.05 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 2kw5 h LEU 109 Cb 0.54 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 41.28 2kw5 h LEU 109 CO 0.02 0.65 -0.30 -0.09 0.09 0.00 0.00 178.44 178.80 2kw5 h ARG 110 N 0.05 -0.82 -0.22 1.13 2.43 -1.35 -1.51 114.38 114.10 2kw5 h ARG 110 Ca -0.01 0.06 0.04 0.00 -0.81 0.00 0.00 59.98 59.26 2kw5 h ARG 110 Cb 1.06 0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 30.78 2kw5 h ARG 110 CO 0.08 -0.55 0.15 -0.56 -1.51 0.00 0.00 179.97 177.58 2kw5 h GLN 111 N -0.99 0.09 -0.05 0.20 3.07 -1.56 -2.40 115.11 113.47 2kw5 h GLN 111 Ca -0.09 -0.01 -0.18 0.00 0.09 0.00 0.00 58.65 58.47 2kw5 h GLN 111 Cb 0.65 -0.02 -0.01 0.00 0.08 0.00 0.00 27.48 28.18 2kw5 h GLN 111 CO 0.14 0.06 -0.74 1.96 0.09 0.00 0.00 178.83 180.35 2kw5 h GLN 112 N 0.10 0.31 -0.06 0.06 1.08 -1.45 -3.33 115.11 111.82 2kw5 h GLN 112 Ca 0.10 -0.27 -0.02 0.00 -1.45 0.00 0.00 58.65 57.01 2kw5 h GLN 112 Cb 0.27 0.06 -0.00 0.00 -0.05 0.00 0.00 27.48 27.75 2kw5 h GLN 112 CO -0.01 0.92 -0.05 1.25 -0.95 0.00 0.00 178.83 179.99 2kw5 h LEU 113 N 0.21 0.16 -0.63 1.46 5.85 -0.74 -3.38 115.31 118.24 2kw5 h LEU 113 Ca -0.03 -0.46 0.04 0.00 0.84 0.00 0.00 57.88 58.28 2kw5 h LEU 113 Cb 1.31 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 42.25 2kw5 h LEU 113 CO 0.12 0.58 0.36 1.88 -0.34 0.00 0.00 178.44 181.04 2kw5 h TYR 114 N -0.27 0.67 0.00 1.25 0.05 -1.65 -0.86 116.97 116.16 2kw5 h TYR 114 Ca 0.01 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.80 2kw5 h TYR 114 Cb 0.53 -0.21 -0.00 0.00 1.01 0.00 0.00 36.73 38.06 2kw5 h TYR 114 CO 0.08 0.35 -0.06 -1.00 -1.05 0.00 0.00 178.16 176.48 2kw5 h PRO 115 N 0.69 0.00 0.00 4.88 0.13 -1.77 -0.05 132.00 135.88 2kw5 h PRO 115 Ca 0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.40 2kw5 h PRO 115 Cb 0.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.24 2kw5 h PRO 115 CO -0.14 0.06 -0.51 1.63 -0.23 0.00 0.00 178.00 178.81 2kw5 n LYS 116 N -4.19 0.14 0.04 0.86 5.02 -0.42 -1.47 118.16 118.13 2kw5 n LYS 116 Ca -0.03 0.04 -0.13 0.00 -2.02 0.00 0.00 58.31 56.18 2kw5 n LYS 116 Cb 0.14 -1.59 -0.14 0.00 -0.02 0.00 0.00 35.03 33.42 2kw5 n LYS 116 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2kw5 h VAL 117 N 0.00 1.15 0.60 -0.18 2.07 -0.60 -1.82 116.25 117.48 2kw5 h VAL 117 Ca 0.00 -2.87 -0.03 0.00 0.82 0.00 0.00 66.70 64.62 2kw5 h VAL 117 Cb 0.62 2.67 0.01 0.00 -1.52 0.00 0.00 31.29 33.07 2kw5 h VAL 117 CO 0.00 0.77 -0.29 0.22 0.02 0.00 0.00 177.57 178.29 2kw5 h TYR 118 N 0.04 -0.75 0.04 1.57 3.20 -0.94 -3.08 116.97 117.05 2kw5 h TYR 118 Ca -0.22 -0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.56 2kw5 h TYR 118 Cb 1.97 0.25 0.01 0.00 1.54 0.00 0.00 36.73 40.50 2kw5 h TYR 118 CO 0.04 -0.47 -0.30 1.96 -1.64 0.00 0.00 178.16 177.75 2kw5 h GLN 119 N -1.07 0.13 -0.06 1.82 4.20 -1.48 -3.42 115.11 115.23 2kw5 h GLN 119 Ca -0.08 -0.20 -0.24 0.00 0.06 0.00 0.00 58.65 58.19 2kw5 h GLN 119 Cb 0.62 0.07 0.01 0.00 0.30 0.00 0.00 27.48 28.48 2kw5 h GLN 119 CO 0.14 1.05 -0.92 0.78 -0.67 0.00 0.00 178.83 179.20 2kw5 h GLY 120 N -0.68 0.78 -7.38 3.46 0.00 -1.50 -3.38 103.07 94.37 2kw5 h GLY 120 Ca -0.05 -1.24 -0.44 0.00 0.00 0.00 0.00 47.33 45.60 2kw5 h GLY 120 CO 0.06 1.10 1.13 -2.27 0.00 0.00 0.00 176.54 176.56 2kw5 s LEU 121 N -8.19 3.25 0.14 3.11 2.96 -1.06 -2.52 118.68 116.36 2kw5 s LEU 121 Ca -0.09 -0.13 -0.31 0.00 -0.22 0.00 0.00 54.13 53.37 2kw5 s LEU 121 Cb 0.08 -2.54 -0.09 0.00 0.50 0.00 0.00 46.19 44.14 2kw5 s LEU 121 CO 0.91 -2.43 1.47 -0.54 -1.32 0.00 0.00 176.35 174.43 2kw5 s LYS 122 N 6.86 4.28 -0.33 1.98 -0.14 -1.26 -4.83 119.74 126.30 2kw5 s LYS 122 Ca 0.65 2.20 -0.44 0.00 -1.36 0.00 0.00 55.97 57.02 2kw5 s LYS 122 Cb -0.10 -3.20 -0.20 0.00 -1.68 0.00 0.00 37.83 32.65 2kw5 s LYS 122 CO 0.12 -0.51 1.41 -2.30 -0.76 0.00 0.00 175.35 173.31 2kw5 n PRO 123 N 3.92 0.00 0.00 -1.68 -0.02 -1.26 -3.86 135.00 132.10 2kw5 n PRO 123 Ca 0.12 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.60 2kw5 n PRO 123 Cb 0.41 -1.49 0.00 0.00 -0.02 0.00 0.00 33.50 32.40 2kw5 n PRO 123 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2kw5 n GLY 124 N 3.12 1.06 3.36 -1.23 0.00 -1.26 -4.89 105.19 105.34 2kw5 n GLY 124 Ca 0.27 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.02 2kw5 n GLY 124 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2kw5 s GLY 125 N -1.40 1.47 -0.14 -0.02 0.00 -1.25 -3.37 107.32 102.61 2kw5 s GLY 125 Ca 0.00 -1.41 -0.03 0.00 0.00 0.00 0.00 44.72 43.29 2kw5 s GLY 125 CO 0.00 -1.40 -0.05 -1.34 0.00 0.00 0.00 173.10 170.31 2kw5 s VAL 126 N -1.17 3.77 -0.30 1.40 -7.23 -0.00 -4.42 120.40 112.45 2kw5 s VAL 126 Ca 0.12 -0.41 -0.05 0.00 -1.81 0.00 0.00 61.98 59.82 2kw5 s VAL 126 Cb -0.10 -2.63 0.02 0.00 0.56 0.00 0.00 36.38 34.24 2kw5 s VAL 126 CO 0.06 0.52 0.06 0.12 -0.31 0.00 0.00 175.10 175.54 2kw5 s PHE 127 N 0.16 3.17 -0.29 2.82 5.36 -1.20 -2.41 117.98 125.60 2kw5 s PHE 127 Ca -0.02 -1.28 -0.02 0.00 -0.96 0.00 0.00 56.93 54.65 2kw5 s PHE 127 Cb -0.14 -2.22 0.04 0.00 -0.34 0.00 0.00 43.02 40.37 2kw5 s PHE 127 CO 0.03 -0.67 -0.01 0.42 -1.46 0.00 0.00 175.22 173.53 2kw5 s ILE 128 N 1.42 3.01 0.08 3.12 1.01 -0.54 -2.17 121.20 127.12 2kw5 s ILE 128 Ca 0.00 -1.25 0.06 0.00 0.00 0.00 0.00 60.65 59.47 2kw5 s ILE 128 Cb -0.18 -2.66 -0.03 0.00 0.01 0.00 0.00 42.46 39.60 2kw5 s ILE 128 CO 0.01 -0.01 -0.16 -0.76 0.00 0.00 0.00 174.94 174.02 2kw5 s LEU 129 N 1.29 2.27 -0.26 2.97 1.02 -1.15 -1.04 118.68 123.77 2kw5 s LEU 129 Ca -0.03 -0.62 -0.03 0.00 0.02 0.00 0.00 54.13 53.47 2kw5 s LEU 129 Cb -0.19 -0.62 0.09 0.00 0.02 0.00 0.00 46.19 45.49 2kw5 s LEU 129 CO -0.02 -0.03 0.09 -0.70 0.02 0.00 0.00 176.35 175.71 2kw5 s GLU 130 N -1.71 0.49 0.37 1.70 2.12 -1.25 -1.49 118.70 118.92 2kw5 s GLU 130 Ca 0.00 -0.65 -0.21 0.00 0.36 0.00 0.00 54.97 54.47 2kw5 s GLU 130 Cb -0.10 -1.77 -0.10 0.00 0.26 0.00 0.00 34.13 32.42 2kw5 s GLU 130 CO 0.03 -0.87 0.89 0.20 -0.54 0.00 0.00 175.26 174.96 2kw5 s GLY 131 N 1.87 2.49 0.39 -1.50 0.00 -0.93 -4.86 107.32 104.77 2kw5 s GLY 131 Ca 0.06 0.34 0.08 0.00 0.00 0.00 0.00 44.72 45.19 2kw5 s GLY 131 CO -0.23 0.64 0.22 -1.36 0.00 0.00 0.00 173.10 172.38 2kw5 s PHE 132 N -1.97 2.68 0.76 1.90 0.40 -1.26 -1.67 117.98 118.81 2kw5 s PHE 132 Ca 0.56 -0.49 -0.11 0.00 -0.60 0.00 0.00 56.93 56.29 2kw5 s PHE 132 Cb -0.12 -1.91 0.05 0.00 0.51 0.00 0.00 43.02 41.55 2kw5 s PHE 132 CO 0.17 0.15 1.09 0.00 0.70 0.00 0.00 175.22 177.33 2kw5 s ALA 133 N -2.50 2.48 0.64 5.36 0.00 -0.29 -4.92 121.76 122.52 2kw5 s ALA 133 Ca 0.42 -0.21 0.25 0.00 0.00 0.00 0.00 51.96 52.42 2kw5 s ALA 133 Cb -0.00 -3.09 1.31 0.00 0.00 0.00 0.00 23.12 21.33 2kw5 s ALA 133 CO 0.24 -1.50 1.74 -1.35 0.00 0.00 0.00 175.76 174.89 2kw5 h PRO 134 N -0.92 0.00 0.00 0.00 0.11 -1.98 -1.93 132.00 127.28 2kw5 h PRO 134 Ca -0.46 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.59 2kw5 h PRO 134 Cb 1.26 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 2kw5 h PRO 134 CO 0.60 0.00 -0.26 0.93 -0.21 0.00 0.00 178.00 179.06 2kw5 h GLU 135 N 0.00 0.00 0.34 1.05 5.08 -1.97 -3.35 114.58 115.73 2kw5 h GLU 135 Ca 0.08 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.43 2kw5 h GLU 135 Cb 1.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.39 2kw5 h GLU 135 CO -0.00 0.26 -0.17 0.37 -1.00 0.00 0.00 179.01 178.48 2kw5 h GLN 136 N 0.00 -0.44 -0.65 2.33 5.75 -1.71 -0.42 115.11 119.96 2kw5 h GLN 136 Ca -0.00 0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 58.51 2kw5 h GLN 136 Cb 0.75 0.10 -0.03 0.00 1.07 0.00 0.00 27.48 29.37 2kw5 h GLN 136 CO 0.03 -0.17 0.35 -0.07 -2.65 0.00 0.00 178.83 176.33 2kw5 h LEU 137 N -1.02 0.81 -0.67 -2.39 -0.00 -1.78 0.11 115.31 110.36 2kw5 h LEU 137 Ca -0.05 -0.06 0.01 0.00 -0.00 0.00 0.00 57.88 57.78 2kw5 h LEU 137 Cb 0.48 -0.20 -0.03 0.00 -0.00 0.00 0.00 40.66 40.90 2kw5 h LEU 137 CO 0.08 0.66 0.45 -0.61 -0.00 0.00 0.00 178.44 179.01 2kw5 h GLN 138 N 0.91 0.89 0.00 1.13 4.15 -1.68 -1.56 115.11 118.95 2kw5 h GLN 138 Ca 0.23 -0.05 -0.03 0.00 0.77 0.00 0.00 58.65 59.57 2kw5 h GLN 138 Cb 0.03 -0.20 -0.00 0.00 0.21 0.00 0.00 27.48 27.52 2kw5 h GLN 138 CO -0.04 0.59 -0.12 1.88 -1.93 0.00 0.00 178.83 179.21 2kw5 h TYR 139 N 0.91 0.00 -0.94 3.99 -1.99 -0.76 -3.47 116.97 114.71 2kw5 h TYR 139 Ca 0.25 0.00 -0.35 0.00 2.00 0.00 0.00 58.73 60.63 2kw5 h TYR 139 Cb -0.11 0.00 -0.13 0.00 2.00 0.00 0.00 36.73 38.49 2kw5 h TYR 139 CO -0.03 0.12 -0.33 -1.71 -0.00 0.00 0.00 178.16 176.22 2kw5 n ASN 140 N -3.15 -5.06 -0.53 3.88 2.85 0.37 -4.86 115.26 108.76 2kw5 n ASN 140 Ca 0.03 0.39 0.06 0.00 -0.11 0.00 0.00 54.58 54.95 2kw5 n ASN 140 Cb 0.54 -4.07 0.21 0.00 1.24 0.00 0.00 39.78 37.70 2kw5 n ASN 140 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 2kw5 n THR 141 N -2.62 0.34 0.00 -0.44 -2.24 -1.19 -4.37 114.28 103.77 2kw5 n THR 141 Ca -0.17 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.23 2kw5 n THR 141 Cb 0.57 0.22 0.00 0.00 -2.10 0.00 0.00 70.33 69.02 2kw5 n THR 141 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2kw5 n GLY 142 N 1.01 -0.48 2.90 3.38 0.00 -1.26 -5.11 105.19 105.63 2kw5 n GLY 142 Ca 0.12 0.18 -0.24 0.00 0.00 0.00 0.00 46.02 46.07 2kw5 n GLY 142 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2kw5 s GLY 143 N 0.00 0.69 0.00 -0.02 0.00 -1.26 -4.72 107.32 102.00 2kw5 s GLY 143 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 44.72 44.36 2kw5 s GLY 143 CO 0.00 0.70 0.39 -1.05 0.00 0.00 0.00 173.10 173.14 2kw5 n PRO 144 N 4.64 0.00 0.02 2.90 -0.02 -1.26 -4.91 135.00 136.37 2kw5 n PRO 144 Ca -0.15 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.78 2kw5 n PRO 144 Cb 0.50 -1.15 0.00 0.00 -0.02 0.00 0.00 33.50 32.83 2kw5 n PRO 144 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2kw5 n LYS 145 N -1.84 0.00 -3.59 -0.52 4.01 -1.26 -5.13 118.16 109.84 2kw5 n LYS 145 Ca 0.00 0.00 -0.16 0.00 -0.51 0.00 0.00 58.31 57.64 2kw5 n LYS 145 Cb 0.00 -0.30 -0.06 0.00 -0.51 0.00 0.00 35.03 34.16 2kw5 n LYS 145 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 2kw5 s ASP 146 N -5.13 -0.51 0.00 4.39 2.15 -1.26 -5.03 116.67 111.28 2kw5 s ASP 146 Ca 0.00 0.46 0.00 0.00 0.43 0.00 0.00 52.55 53.44 2kw5 s ASP 146 Cb 0.00 0.48 0.00 0.00 -0.30 0.00 0.00 42.92 43.10 2kw5 s ASP 146 CO 0.00 -0.59 0.77 0.18 -0.17 0.00 0.00 175.17 175.36 2kw5 n LEU 147 N 0.90 0.00 -0.33 -1.34 4.77 -1.26 -1.46 117.00 118.27 2kw5 n LEU 147 Ca -0.19 0.29 0.01 0.00 -0.03 0.00 0.00 56.01 56.09 2kw5 n LEU 147 Cb 0.57 -0.29 0.19 0.00 -2.33 0.00 0.00 43.42 41.56 2kw5 n LEU 147 CO 0.23 -0.29 1.27 -0.78 -1.33 0.00 0.00 177.39 176.49 2kw5 h ASP 148 N 0.00 1.01 0.00 -1.43 3.58 -2.02 -2.32 116.42 115.24 2kw5 h ASP 148 Ca 0.00 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.44 2kw5 h ASP 148 Cb 0.35 -0.23 0.00 0.00 1.72 0.00 0.00 39.33 41.17 2kw5 h ASP 148 CO 0.00 0.69 0.00 0.18 -2.88 0.00 0.00 179.24 177.23 2kw5 n LEU 149 N -4.45 0.00 -4.58 2.28 4.77 -0.54 -4.61 117.00 109.88 2kw5 n LEU 149 Ca 0.13 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.68 2kw5 n LEU 149 Cb 0.12 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.18 2kw5 n LEU 149 CO 0.34 0.00 0.96 -0.76 -1.33 0.00 0.00 177.39 176.60 2kw5 s LEU 150 N -1.83 3.70 -0.16 2.23 1.43 -0.87 -4.66 118.68 118.50 2kw5 s LEU 150 Ca 0.37 0.18 -0.26 0.00 -1.03 0.00 0.00 54.13 53.39 2kw5 s LEU 150 Cb 0.17 -3.27 -0.01 0.00 0.03 0.00 0.00 46.19 43.11 2kw5 s LEU 150 CO 0.29 -1.29 0.87 -2.16 0.23 0.00 0.00 176.35 174.29 2kw5 s PRO 151 N 4.44 4.32 0.48 1.29 0.04 -1.26 -4.92 135.00 139.39 2kw5 s PRO 151 Ca 0.42 1.11 -0.06 0.00 0.04 0.00 0.00 61.00 62.50 2kw5 s PRO 151 Cb -0.08 -3.57 -0.04 0.00 0.04 0.00 0.00 34.50 30.85 2kw5 s PRO 151 CO 0.27 -0.34 0.80 0.15 0.04 0.00 0.00 177.00 177.92 2kw5 s LYS 152 N 2.16 3.59 0.32 4.56 1.02 -1.26 -3.94 119.74 126.18 2kw5 s LYS 152 Ca 0.40 0.28 0.01 0.00 0.02 0.00 0.00 55.97 56.68 2kw5 s LYS 152 Cb -0.17 -2.36 0.53 0.00 -0.52 0.00 0.00 37.83 35.31 2kw5 s LYS 152 CO 0.13 -0.20 1.93 -0.07 -0.92 0.00 0.00 175.35 176.22 2kw5 h LEU 153 N 0.37 0.75 -0.10 3.17 3.38 -1.96 -1.10 115.31 119.82 2kw5 h LEU 153 Ca -0.47 -0.07 0.03 0.00 0.09 0.00 0.00 57.88 57.46 2kw5 h LEU 153 Cb 1.20 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.73 2kw5 h LEU 153 CO 0.62 0.63 -0.06 -0.33 0.09 0.00 0.00 178.44 179.40 2kw5 h GLU 154 N 0.84 -0.05 0.44 1.13 4.39 -1.99 -2.43 114.58 116.91 2kw5 h GLU 154 Ca 0.21 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.89 2kw5 h GLU 154 Cb 0.07 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.73 2kw5 h GLU 154 CO -0.03 -0.03 -0.21 1.79 -1.16 0.00 0.00 179.01 179.36 2kw5 h THR 155 N -0.05 0.00 -0.01 1.13 1.35 -1.91 -3.19 112.91 110.23 2kw5 h THR 155 Ca 0.06 -0.34 -0.00 0.00 -0.55 0.00 0.00 66.41 65.58 2kw5 h THR 155 Cb 0.14 0.00 -0.00 0.00 -1.73 0.00 0.00 68.15 66.56 2kw5 h THR 155 CO -0.13 0.00 0.00 -0.07 -0.25 0.00 0.00 175.52 175.07 2kw5 h LEU 156 N -0.93 0.01 -0.71 3.87 3.38 -1.27 0.50 115.31 120.16 2kw5 h LEU 156 Ca -0.06 -0.09 0.03 0.00 0.09 0.00 0.00 57.88 57.85 2kw5 h LEU 156 Cb 0.45 -0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.16 2kw5 h LEU 156 CO 0.10 0.10 0.44 -0.61 0.09 0.00 0.00 178.44 178.56 2kw5 h GLN 157 N -0.08 0.84 0.00 1.13 4.15 -1.63 -2.28 115.11 117.24 2kw5 h GLN 157 Ca 0.00 -0.05 -0.04 0.00 0.77 0.00 0.00 58.65 59.33 2kw5 h GLN 157 Cb 0.09 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 27.59 2kw5 h GLN 157 CO -0.00 0.55 -0.21 1.03 -1.93 0.00 0.00 178.83 178.27 2kw5 h SER 158 N 0.86 0.00 1.73 -0.69 0.87 -1.35 -2.88 113.55 112.08 2kw5 h SER 158 Ca 0.29 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.85 2kw5 h SER 158 Cb 0.03 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.99 2kw5 h SER 158 CO -0.12 0.21 -0.08 -0.33 -0.53 0.00 0.00 176.83 175.99 2kw5 h GLU 159 N 0.00 0.00 -2.07 2.24 5.08 -0.45 -3.38 114.58 116.00 2kw5 h GLU 159 Ca -0.00 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 57.80 2kw5 h GLU 159 Cb 0.82 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 29.67 2kw5 h GLU 159 CO 0.03 0.00 -0.97 1.28 -1.00 0.00 0.00 179.01 178.35 2kw5 n LEU 160 N -2.76 1.54 0.00 1.33 4.77 -0.90 -4.88 117.00 116.10 2kw5 n LEU 160 Ca 0.04 -5.03 0.11 0.00 -0.03 0.00 0.00 56.01 51.10 2kw5 n LEU 160 Cb 0.49 0.25 0.65 0.00 -2.33 0.00 0.00 43.42 42.48 2kw5 n LEU 160 CO 0.33 2.15 0.90 -0.81 -1.33 0.00 0.00 177.39 178.63 2kw5 n PRO 161 N 0.86 0.97 0.04 3.23 -0.04 -1.21 -2.05 135.00 136.80 2kw5 n PRO 161 Ca 0.25 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.55 2kw5 n PRO 161 Cb 0.52 -1.35 -0.14 0.00 -0.04 0.00 0.00 33.50 32.49 2kw5 n PRO 161 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2kw5 h SER 162 N 0.00 0.31 -2.85 3.54 0.02 -1.91 -3.41 113.55 109.26 2kw5 h SER 162 Ca 0.00 -0.49 -0.79 0.00 -0.84 0.00 0.00 61.79 59.67 2kw5 h SER 162 Cb 0.00 -0.10 -0.29 0.00 0.14 0.00 0.00 62.40 62.14 2kw5 h SER 162 CO 0.00 1.42 0.64 -0.11 -1.14 0.00 0.00 176.83 177.64 2kw5 n LEU 163 N -3.38 6.15 -4.76 5.07 7.94 -0.87 -4.84 117.00 122.31 2kw5 n LEU 163 Ca -0.18 -5.24 -0.41 0.00 -1.11 0.00 0.00 56.01 49.07 2kw5 n LEU 163 Cb 1.04 -1.21 -0.02 0.00 0.53 0.00 0.00 43.42 43.76 2kw5 n LEU 163 CO 0.48 1.73 1.08 0.21 -1.11 0.00 0.00 177.39 179.79 2kw5 s ASN 164 N -1.84 6.64 -0.10 1.96 3.04 -1.26 -4.85 114.94 118.54 2kw5 s ASN 164 Ca 0.32 2.73 -0.11 0.00 0.04 0.00 0.00 52.86 55.84 2kw5 s ASN 164 Cb 0.06 -2.64 -0.05 0.00 -1.54 0.00 0.00 41.25 37.08 2kw5 s ASN 164 CO 0.09 -0.69 0.26 0.26 -3.04 0.00 0.00 177.10 173.99 2kw5 s TRP 165 N -0.43 3.59 0.35 0.43 0.52 -1.26 -3.97 118.94 118.18 2kw5 s TRP 165 Ca 0.56 0.68 0.12 0.00 0.02 0.00 0.00 56.10 57.48 2kw5 s TRP 165 Cb -0.42 -2.16 0.65 0.00 -1.15 0.00 0.00 33.47 30.39 2kw5 s TRP 165 CO 0.48 0.56 1.79 -0.07 0.02 0.00 0.00 176.95 179.73 2kw5 h LEU 166 N 5.42 0.00 -7.73 2.99 3.38 -0.85 -3.43 115.31 115.10 2kw5 h LEU 166 Ca -0.50 -0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.00 2kw5 h LEU 166 Cb 1.21 -0.00 -0.35 0.00 0.09 0.00 0.00 40.66 41.60 2kw5 h LEU 166 CO 0.65 0.42 -0.79 -0.63 0.09 0.00 0.00 178.44 178.17 2kw5 s ILE 167 N -4.09 0.77 -0.45 1.22 1.01 -1.12 -4.95 121.20 113.58 2kw5 s ILE 167 Ca -0.03 -0.20 0.07 0.00 0.00 0.00 0.00 60.65 60.50 2kw5 s ILE 167 Cb 0.14 -0.80 0.27 0.00 0.01 0.00 0.00 42.46 42.09 2kw5 s ILE 167 CO 0.73 0.30 0.87 0.00 0.00 0.00 0.00 174.94 176.84 2kw5 n ALA 168 N 4.46 -0.22 -2.60 9.38 0.00 -1.22 -1.98 120.51 128.34 2kw5 n ALA 168 Ca -0.17 -1.98 -0.22 0.00 0.00 0.00 0.00 53.44 51.07 2kw5 n ALA 168 Cb 0.51 -1.16 -0.14 0.00 0.00 0.00 0.00 19.45 18.66 2kw5 n ALA 168 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2kw5 s ASN 169 N -1.57 1.78 -0.66 0.00 2.47 -1.10 -4.99 114.94 110.86 2kw5 s ASN 169 Ca 0.31 -0.40 -0.21 0.00 0.42 0.00 0.00 52.86 52.97 2kw5 s ASN 169 Cb 0.25 -0.15 0.08 0.00 -1.45 0.00 0.00 41.25 39.98 2kw5 s ASN 169 CO -0.16 0.10 0.91 0.20 -3.72 0.00 0.00 177.10 174.43 2kw5 s ASN 170 N -0.88 6.21 -0.16 -4.21 0.01 -1.26 -2.58 114.94 112.07 2kw5 s ASN 170 Ca 0.04 -1.18 -0.04 0.00 -0.71 0.00 0.00 52.86 50.96 2kw5 s ASN 170 Cb -0.07 -2.39 -0.03 0.00 0.41 0.00 0.00 41.25 39.17 2kw5 s ASN 170 CO 0.01 -1.33 -0.02 -0.76 -1.51 0.00 0.00 177.10 173.49 2kw5 s LEU 171 N 3.60 3.34 -0.13 0.60 1.43 0.49 -4.96 118.68 123.05 2kw5 s LEU 171 Ca 0.20 -0.09 -0.15 0.00 -1.03 0.00 0.00 54.13 53.06 2kw5 s LEU 171 Cb -0.18 -1.81 -0.05 0.00 0.03 0.00 0.00 46.19 44.18 2kw5 s LEU 171 CO 0.08 0.17 0.35 -1.83 0.23 0.00 0.00 176.35 175.35 2kw5 s GLU 172 N 0.36 4.23 -0.15 1.70 1.03 -1.26 -1.08 118.70 123.54 2kw5 s GLU 172 Ca -0.03 0.22 -0.04 0.00 0.03 0.00 0.00 54.97 55.15 2kw5 s GLU 172 Cb -0.14 -3.41 -0.03 0.00 -0.80 0.00 0.00 34.13 29.75 2kw5 s GLU 172 CO 0.02 0.27 -0.01 0.50 -1.33 0.00 0.00 175.26 174.71 2kw5 s ARG 173 N 0.35 3.60 -0.52 -4.83 3.52 -0.74 -4.88 118.95 115.44 2kw5 s ARG 173 Ca 0.20 -0.46 -0.28 0.00 -0.13 0.00 0.00 55.73 55.06 2kw5 s ARG 173 Cb -0.14 -2.95 -0.01 0.00 -1.56 0.00 0.00 34.95 30.30 2kw5 s ARG 173 CO 0.06 0.34 1.67 -0.80 -0.81 0.00 0.00 175.30 175.76 2kw5 s ASN 174 N 0.12 5.77 0.72 -2.12 0.01 -1.26 -1.49 114.94 116.69 2kw5 s ASN 174 Ca 0.01 0.56 -0.08 0.00 -0.71 0.00 0.00 52.86 52.64 2kw5 s ASN 174 Cb -0.13 -2.53 0.06 0.00 0.41 0.00 0.00 41.25 39.05 2kw5 s ASN 174 CO 0.02 -1.94 1.06 -0.76 -1.51 0.00 0.00 177.10 173.96 2kw5 s LEU 175 N 7.33 2.77 0.39 0.60 1.43 0.63 -4.94 118.68 126.89 2kw5 s LEU 175 Ca 0.64 0.61 -0.27 0.00 -1.03 0.00 0.00 54.13 54.09 2kw5 s LEU 175 Cb -0.14 -3.24 -0.09 0.00 0.03 0.00 0.00 46.19 42.75 2kw5 s LEU 175 CO 0.26 -1.62 1.32 -1.81 0.23 0.00 0.00 176.35 174.73 2kw5 s ASP 176 N -4.51 6.40 0.05 2.29 1.11 -1.26 -4.45 116.67 116.30 2kw5 s ASP 176 Ca 0.60 2.71 -0.10 0.00 0.18 0.00 0.00 52.55 55.93 2kw5 s ASP 176 Cb -0.11 -2.64 -0.06 0.00 1.07 0.00 0.00 42.92 41.18 2kw5 s ASP 176 CO 0.46 -0.79 0.38 -0.70 1.18 0.00 0.00 175.17 175.70 2kw5 s GLU 177 N -2.13 3.76 0.28 8.23 2.12 -1.26 -4.32 118.70 125.37 2kw5 s GLU 177 Ca 0.55 0.19 0.00 0.00 0.36 0.00 0.00 54.97 56.07 2kw5 s GLU 177 Cb -0.39 -3.06 0.00 0.00 0.26 0.00 0.00 34.13 30.93 2kw5 s GLU 177 CO 0.51 0.61 0.00 0.41 -0.54 0.00 0.00 175.26 176.25 2kw5 n GLY 178 N 1.17 -1.78 0.93 -1.50 0.00 -1.25 -5.02 105.19 97.74 2kw5 n GLY 178 Ca -0.10 0.39 -0.07 0.00 0.00 0.00 0.00 46.02 46.24 2kw5 n GLY 178 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kw5 n ALA 179 N -3.06 -0.35 -0.16 4.61 0.00 -1.26 -4.94 120.51 115.35 2kw5 n ALA 179 Ca 0.00 -0.42 0.19 0.00 0.00 0.00 0.00 53.44 53.21 2kw5 n ALA 179 Cb 0.00 -0.02 0.56 0.00 0.00 0.00 0.00 19.45 20.00 2kw5 n ALA 179 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 2kw5 h TYR 180 N -1.15 0.36 -0.80 0.00 3.20 -2.03 -3.34 116.97 113.22 2kw5 h TYR 180 Ca -0.10 0.01 -0.17 0.00 3.14 0.00 0.00 58.73 61.60 2kw5 h TYR 180 Cb 0.29 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.45 2kw5 h TYR 180 CO 0.00 0.12 0.63 1.58 -1.64 0.00 0.00 178.16 178.85 2kw5 n HIS 181 N -4.45 1.25 1.07 -3.82 -0.00 -1.26 -4.80 115.22 103.21 2kw5 n HIS 181 Ca 0.15 0.03 0.06 0.00 0.46 0.00 0.00 57.72 58.43 2kw5 n HIS 181 Cb 0.64 -2.61 0.35 0.00 -0.12 0.00 0.00 29.99 28.25 2kw5 n HIS 181 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2kw5 n GLN 182 N 8.85 0.53 -0.58 1.57 10.64 -1.25 -3.96 117.38 133.18 2kw5 n GLN 182 Ca 0.44 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.61 2kw5 n GLN 182 Cb 0.47 -1.34 0.00 0.00 -0.86 0.00 0.00 30.24 28.51 2kw5 n GLN 182 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2kw5 n GLY 183 N 0.06 0.85 3.50 2.61 0.00 -1.26 -4.31 105.19 106.64 2kw5 n GLY 183 Ca 0.09 -0.61 -0.24 0.00 0.00 0.00 0.00 46.02 45.26 2kw5 n GLY 183 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kw5 s LYS 184 N -2.39 1.77 -0.08 1.61 0.00 -1.26 -0.27 119.74 119.13 2kw5 s LYS 184 Ca 0.00 -2.02 -0.05 0.00 0.00 0.00 0.00 55.97 53.90 2kw5 s LYS 184 Cb 0.00 -0.95 0.04 0.00 0.00 0.00 0.00 37.83 36.92 2kw5 s LYS 184 CO 0.00 -0.24 0.20 0.00 0.00 0.00 0.00 175.35 175.31 2kw5 s ALA 185 N -3.19 -0.45 -0.49 0.59 0.00 -0.56 -4.74 121.76 112.93 2kw5 s ALA 185 Ca 0.32 0.79 -0.28 0.00 0.00 0.00 0.00 51.96 52.79 2kw5 s ALA 185 Cb 0.07 -0.50 0.01 0.00 0.00 0.00 0.00 23.12 22.70 2kw5 s ALA 185 CO 0.15 -0.16 1.45 0.00 0.00 0.00 0.00 175.76 177.20 2kw5 s ALA 186 N 0.96 2.88 0.11 0.00 0.00 -1.26 -1.79 121.76 122.67 2kw5 s ALA 186 Ca -0.07 -0.39 0.09 0.00 0.00 0.00 0.00 51.96 51.59 2kw5 s ALA 186 Cb -0.09 -4.04 -0.04 0.00 0.00 0.00 0.00 23.12 18.96 2kw5 s ALA 186 CO -0.06 -2.73 -0.20 -0.51 0.00 0.00 0.00 175.76 172.27 2kw5 s LEU 187 N 5.97 2.62 -0.12 0.00 1.43 -0.24 -1.14 118.68 127.19 2kw5 s LEU 187 Ca 0.58 -0.58 -0.01 0.00 -1.03 0.00 0.00 54.13 53.09 2kw5 s LEU 187 Cb -0.13 -1.48 0.04 0.00 0.03 0.00 0.00 46.19 44.65 2kw5 s LEU 187 CO 0.29 0.19 -0.02 0.27 0.23 0.00 0.00 176.35 177.30 2kw5 s ILE 188 N -1.10 0.71 -0.01 -0.59 -4.36 -0.67 -0.38 121.20 114.80 2kw5 s ILE 188 Ca 0.17 -0.26 -0.05 0.00 -0.26 0.00 0.00 60.65 60.25 2kw5 s ILE 188 Cb -0.10 -0.90 -0.04 0.00 1.25 0.00 0.00 42.46 42.66 2kw5 s ILE 188 CO 0.09 0.18 0.23 -1.10 0.24 0.00 0.00 174.94 174.57 2kw5 s GLN 189 N 1.82 3.52 -0.03 0.37 -0.21 -1.06 -2.20 119.66 121.87 2kw5 s GLN 189 Ca 0.03 -0.16 0.04 0.00 0.02 0.00 0.00 55.36 55.29 2kw5 s GLN 189 Cb -0.14 -3.10 -0.00 0.00 1.00 0.00 0.00 33.01 30.77 2kw5 s GLN 189 CO -0.07 0.67 -0.14 -0.51 -2.12 0.00 0.00 175.29 173.12 2kw5 s LEU 190 N -1.74 1.92 -0.25 2.90 1.43 -0.56 -2.72 118.68 119.67 2kw5 s LEU 190 Ca 0.26 -0.28 -0.03 0.00 -1.03 0.00 0.00 54.13 53.06 2kw5 s LEU 190 Cb -0.13 -0.78 0.08 0.00 0.03 0.00 0.00 46.19 45.39 2kw5 s LEU 190 CO 0.16 0.14 0.08 -0.22 0.23 0.00 0.00 176.35 176.73 2kw5 s LEU 191 N -0.07 1.33 0.02 1.79 2.96 -0.84 -2.94 118.68 120.94 2kw5 s LEU 191 Ca -0.00 -1.15 -0.18 0.00 -0.22 0.00 0.00 54.13 52.59 2kw5 s LEU 191 Cb -0.09 -0.61 -0.06 0.00 0.50 0.00 0.00 46.19 45.94 2kw5 s LEU 191 CO 0.01 -0.37 0.51 -0.83 -1.32 0.00 0.00 176.35 174.34 2kw5 s GLY 192 N 1.85 2.57 0.05 7.98 0.00 -0.92 -0.09 107.32 118.75 2kw5 s GLY 192 Ca 0.04 -0.08 -0.05 0.00 0.00 0.00 0.00 44.72 44.63 2kw5 s GLY 192 CO -0.19 0.43 0.08 1.62 0.00 0.00 0.00 173.10 175.04 2kw5 s GLN 193 N -0.77 0.65 -0.04 2.90 2.00 -1.25 -3.23 119.66 119.91 2kw5 s GLN 193 Ca 0.27 -0.93 -0.33 0.00 -2.00 0.00 0.00 55.36 52.37 2kw5 s GLN 193 Cb -0.18 0.25 -0.11 0.00 0.80 0.00 0.00 33.01 33.77 2kw5 s GLN 193 CO 0.16 -0.17 1.89 1.17 -0.50 0.00 0.00 175.29 177.84 2kw5 n LYS 194 N 0.40 2.35 -2.19 1.67 4.81 -1.26 -4.58 118.16 119.36 2kw5 n LYS 194 Ca -0.17 0.86 -0.43 0.00 -0.87 0.00 0.00 58.31 57.71 2kw5 n LYS 194 Cb 0.60 -2.73 -0.02 0.00 0.02 0.00 0.00 35.03 32.90 2kw5 n LYS 194 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2kw5 s LEU 195 N 3.97 3.98 -0.19 3.14 1.43 -1.26 -4.93 118.68 124.81 2kw5 s LEU 195 Ca 0.91 1.64 -0.13 0.00 -1.03 0.00 0.00 54.13 55.52 2kw5 s LEU 195 Cb -0.63 -3.53 0.06 0.00 0.03 0.00 0.00 46.19 42.12 2kw5 s LEU 195 CO 0.48 -1.13 0.48 -0.70 0.23 0.00 0.00 176.35 175.71 2kw5 s GLU 196 N 4.38 0.50 -0.06 1.70 -6.30 -1.26 -5.01 118.70 112.64 2kw5 s GLU 196 Ca 0.67 0.83 0.02 0.00 -2.50 0.00 0.00 54.97 53.99 2kw5 s GLU 196 Cb -0.24 0.09 0.07 0.00 0.00 0.00 0.00 34.13 34.05 2kw5 s GLU 196 CO 0.27 -0.13 0.93 -2.39 0.02 0.00 0.00 175.26 173.95 2kw5 n HIS 197 N 3.86 -0.34 -1.64 5.30 1.44 -1.26 -5.07 115.22 117.51 2kw5 n HIS 197 Ca -0.20 -0.61 0.00 0.00 -2.01 0.00 0.00 57.72 54.90 2kw5 n HIS 197 Cb 0.56 0.64 0.00 0.00 0.12 0.00 0.00 29.99 31.31 2kw5 n HIS 197 CO 0.00 0.00 0.00 1.58 -2.81 0.00 0.00 176.34 175.11 2kw5 n HIS 198 N -0.26 -2.95 -2.41 -1.40 -0.00 -1.26 -4.83 115.22 102.11 2kw5 n HIS 198 Ca -0.21 1.77 -0.34 0.00 0.46 0.00 0.00 57.72 59.39 2kw5 n HIS 198 Cb 0.66 -3.07 -0.02 0.00 -0.12 0.00 0.00 29.99 27.44 2kw5 n HIS 198 CO 0.00 0.00 0.00 -1.01 0.46 0.00 0.00 176.34 175.79 2kw5 s HIS 199 N -0.34 2.94 -0.14 1.57 3.76 -1.26 -3.08 115.29 118.75 2kw5 s HIS 199 Ca 0.00 1.56 0.00 0.00 -0.15 0.00 0.00 55.06 56.47 2kw5 s HIS 199 Cb 0.00 -3.09 0.00 0.00 1.11 0.00 0.00 32.58 30.60 2kw5 s HIS 199 CO 0.00 -1.00 0.00 0.72 -0.85 0.00 0.00 174.74 173.61 2kw5 n HIS 200 N -1.21 0.00 -3.76 1.40 8.25 -1.26 -5.01 115.22 113.63 2kw5 n HIS 200 Ca 0.10 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.18 2kw5 n HIS 200 Cb 0.52 -1.05 -0.12 0.00 1.12 0.00 0.00 29.99 30.46 2kw5 n HIS 200 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2kw5 s HIS 201 N -1.65 3.24 0.00 4.41 5.04 -1.18 -5.27 115.29 119.88 2kw5 s HIS 201 Ca 0.00 -1.40 0.00 0.00 -1.54 0.00 0.00 55.06 52.12 2kw5 s HIS 201 Cb 0.00 -2.27 0.00 0.00 0.04 0.00 0.00 32.58 30.35 2kw5 s HIS 201 CO 0.00 -0.72 0.31 1.58 -2.34 0.00 0.00 174.74 173.58