#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 2.85 -1.00 2.03 0.52 -1.26 -4.91 118.94 117.18 2kw5 s TRP 2 Ca 0.00 -1.57 -0.19 0.00 0.02 0.00 0.00 56.10 54.36 2kw5 s TRP 2 Cb 0.00 -4.67 0.11 0.00 -1.15 0.00 0.00 33.47 27.76 2kw5 s TRP 2 CO 0.00 -1.76 1.26 0.16 0.02 0.00 0.00 176.95 176.63 2kw5 s ASP 3 N 4.13 6.66 0.01 2.95 -4.77 -1.26 -4.99 116.67 119.39 2kw5 s ASP 3 Ca 0.50 -2.03 0.03 0.00 -3.30 0.00 0.00 52.55 47.76 2kw5 s ASP 3 Cb 0.02 -2.45 -0.01 0.00 -1.09 0.00 0.00 42.92 39.39 2kw5 s ASP 3 CO 0.03 -1.14 -0.10 -1.83 0.70 0.00 0.00 175.17 172.83 2kw5 s GLU 4 N 3.17 0.78 -0.30 2.11 -1.05 -1.26 -5.12 118.70 117.04 2kw5 s GLU 4 Ca 0.38 -0.45 -0.03 0.00 -0.15 0.00 0.00 54.97 54.71 2kw5 s GLU 4 Cb -0.03 -0.74 0.19 0.00 -0.44 0.00 0.00 34.13 33.11 2kw5 s GLU 4 CO -0.08 0.20 0.81 0.50 0.95 0.00 0.00 175.26 177.64 2kw5 s ARG 5 N -0.52 0.37 -0.12 -4.83 3.52 -1.26 -5.16 118.95 110.95 2kw5 s ARG 5 Ca 0.02 0.44 0.00 0.00 -0.13 0.00 0.00 55.73 56.06 2kw5 s ARG 5 Cb -0.05 0.22 0.02 0.00 -1.56 0.00 0.00 34.95 33.58 2kw5 s ARG 5 CO 0.00 -0.61 -0.10 -0.06 -0.81 0.00 0.00 175.30 173.72 2kw5 s PHE 6 N 2.89 1.74 -0.31 5.12 0.08 -1.26 -5.10 117.98 121.15 2kw5 s PHE 6 Ca 0.16 -0.90 0.03 0.00 0.12 0.00 0.00 56.93 56.34 2kw5 s PHE 6 Cb -0.08 -1.36 0.16 0.00 -0.57 0.00 0.00 43.02 41.18 2kw5 s PHE 6 CO -0.22 -0.55 0.43 0.45 -0.10 0.00 0.00 175.22 175.23 2kw5 s SER 7 N 1.54 0.24 -0.82 1.36 0.15 -1.26 -5.10 113.70 109.81 2kw5 s SER 7 Ca 0.03 -0.54 -0.13 0.00 0.70 0.00 0.00 55.95 56.01 2kw5 s SER 7 Cb -0.13 1.15 0.22 0.00 -1.71 0.00 0.00 66.02 65.55 2kw5 s SER 7 CO -0.08 -0.33 0.75 -1.10 1.20 0.00 0.00 173.24 173.68 2kw5 s GLN 8 N 2.36 3.54 -0.88 5.44 -1.52 -1.26 -5.02 119.66 122.32 2kw5 s GLN 8 Ca 0.11 -2.49 -0.22 0.00 -1.95 0.00 0.00 55.36 50.81 2kw5 s GLN 8 Cb -0.12 -4.38 0.07 0.00 -0.22 0.00 0.00 33.01 28.37 2kw5 s GLN 8 CO -0.25 -1.28 1.23 -1.54 -0.25 0.00 0.00 175.29 173.20 2kw5 s SER 9 N 2.02 6.42 -0.07 5.90 1.04 -1.26 -4.97 113.70 122.78 2kw5 s SER 9 Ca 0.18 -1.38 -0.11 0.00 0.48 0.00 0.00 55.95 55.12 2kw5 s SER 9 Cb -0.11 -2.49 0.02 0.00 0.10 0.00 0.00 66.02 63.55 2kw5 s SER 9 CO -0.09 -1.42 0.28 -1.83 0.98 0.00 0.00 173.24 171.17 2kw5 s GLU 10 N 4.24 0.46 -0.28 4.02 -1.05 -1.26 -5.16 118.70 119.66 2kw5 s GLU 10 Ca 0.36 0.12 -0.18 0.00 -0.15 0.00 0.00 54.97 55.12 2kw5 s GLU 10 Cb -0.06 0.21 0.12 0.00 -0.44 0.00 0.00 34.13 33.96 2kw5 s GLU 10 CO -0.02 -0.09 0.87 1.52 0.95 0.00 0.00 175.26 178.48 2kw5 s TYR 11 N -0.49 -0.75 -1.05 4.83 1.13 -1.26 -5.11 117.35 114.65 2kw5 s TYR 11 Ca -0.06 1.54 -0.18 0.00 -1.41 0.00 0.00 57.07 56.96 2kw5 s TYR 11 Cb -0.04 0.45 0.12 0.00 -1.10 0.00 0.00 41.96 41.38 2kw5 s TYR 11 CO 0.02 -0.37 1.33 0.14 -2.51 0.00 0.00 175.55 174.16 2kw5 s VAL 12 N 1.27 4.55 -0.13 -3.49 -7.23 -1.26 -4.92 120.40 109.19 2kw5 s VAL 12 Ca -0.08 -1.67 -0.04 0.00 -1.81 0.00 0.00 61.98 58.38 2kw5 s VAL 12 Cb -0.04 -4.92 0.06 0.00 0.56 0.00 0.00 36.38 32.05 2kw5 s VAL 12 CO -0.15 -1.68 0.21 -0.47 -0.31 0.00 0.00 175.10 172.70 2kw5 s TYR 13 N 3.11 -0.28 -0.35 2.82 5.04 -1.26 -5.02 117.35 121.41 2kw5 s TYR 13 Ca 0.40 0.63 0.07 0.00 -2.44 0.00 0.00 57.07 55.73 2kw5 s TYR 13 Cb -0.02 -0.21 0.29 0.00 0.35 0.00 0.00 41.96 42.36 2kw5 s TYR 13 CO -0.06 -0.38 1.26 0.41 -1.34 0.00 0.00 175.55 175.44 2kw5 n GLY 14 N 5.33 0.77 3.82 8.97 0.00 -1.26 -5.15 105.19 117.67 2kw5 n GLY 14 Ca -0.05 -0.09 -0.34 0.00 0.00 0.00 0.00 46.02 45.53 2kw5 n GLY 14 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2kw5 s THR 15 N 0.13 4.41 -0.44 2.61 -4.23 -1.26 -5.05 115.64 111.81 2kw5 s THR 15 Ca 0.14 1.46 0.07 0.00 -1.18 0.00 0.00 61.69 62.18 2kw5 s THR 15 Cb 0.30 -3.69 0.27 0.00 1.34 0.00 0.00 72.50 70.71 2kw5 s THR 15 CO -0.07 -0.19 0.80 1.21 -0.54 0.00 0.00 174.62 175.83 2kw5 n GLU 16 N -0.31 0.82 -3.61 3.99 4.07 -1.26 -5.13 120.64 119.21 2kw5 n GLU 16 Ca 0.05 -2.38 -0.37 0.00 -0.06 0.00 0.00 57.16 54.40 2kw5 n GLU 16 Cb 0.53 -1.35 -0.09 0.00 -0.06 0.00 0.00 31.44 30.47 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 -0.26 4.07 -0.87 5.31 0.04 -1.26 -5.06 135.00 136.96 2kw5 s PRO 17 Ca 0.32 -0.21 -0.09 0.00 0.04 0.00 0.00 61.00 61.06 2kw5 s PRO 17 Cb 0.23 -3.56 0.22 0.00 0.04 0.00 0.00 34.50 31.44 2kw5 s PRO 17 CO -0.16 0.01 0.79 1.21 0.04 0.00 0.00 177.00 178.90 2kw5 s ASN 18 N 1.16 6.52 0.14 6.66 2.47 -1.26 -4.77 114.94 125.86 2kw5 s ASN 18 Ca 0.09 -3.08 -0.16 0.00 0.42 0.00 0.00 52.86 50.13 2kw5 s ASN 18 Cb -0.14 -2.11 0.03 0.00 -1.45 0.00 0.00 41.25 37.59 2kw5 s ASN 18 CO 0.06 -0.41 0.42 -0.62 -3.72 0.00 0.00 177.10 172.82 2kw5 s ASP 19 N 1.38 -0.23 0.03 -4.21 2.15 -1.26 -5.10 116.67 109.44 2kw5 s ASP 19 Ca 0.22 -0.37 -0.27 0.00 0.43 0.00 0.00 52.55 52.56 2kw5 s ASP 19 Cb -0.11 0.49 -0.17 0.00 -0.30 0.00 0.00 42.92 42.83 2kw5 s ASP 19 CO -0.08 -0.90 1.41 0.15 -0.17 0.00 0.00 175.17 175.58 2kw5 h PHE 20 N 2.34 -0.43 0.09 -5.34 3.57 -2.01 -3.20 116.94 111.95 2kw5 h PHE 20 Ca -0.33 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.16 2kw5 h PHE 20 Cb 1.26 0.14 0.00 0.00 2.79 0.00 0.00 35.95 40.14 2kw5 h PHE 20 CO 0.33 -0.15 -0.04 1.25 -2.23 0.00 0.00 178.31 177.47 2kw5 h LEU 21 N -0.68 -0.10 -1.94 0.59 5.85 -1.99 -2.94 115.31 114.10 2kw5 h LEU 21 Ca -0.05 -0.41 0.40 0.00 0.84 0.00 0.00 57.88 58.67 2kw5 h LEU 21 Cb 0.48 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.48 2kw5 h LEU 21 CO 0.08 0.38 1.02 -0.37 -0.34 0.00 0.00 178.44 179.21 2kw5 h VAL 22 N -0.61 0.26 -0.13 1.05 -1.51 -1.94 -0.25 116.25 113.13 2kw5 h VAL 22 Ca -0.01 0.00 -0.12 0.00 -1.23 0.00 0.00 66.70 65.34 2kw5 h VAL 22 Cb 0.50 0.28 0.00 0.00 -2.13 0.00 0.00 31.29 29.94 2kw5 h VAL 22 CO 0.02 0.00 -0.39 0.28 -1.23 0.00 0.00 177.57 176.25 2kw5 h SER 23 N 0.00 0.57 0.06 4.19 0.02 -1.51 -2.71 113.55 114.17 2kw5 h SER 23 Ca 0.65 -0.60 -0.10 0.00 -0.84 0.00 0.00 61.79 60.90 2kw5 h SER 23 Cb 2.69 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 65.06 2kw5 h SER 23 CO -0.01 1.07 -0.32 -0.37 -1.14 0.00 0.00 176.83 176.06 2kw5 h VAL 24 N 0.10 1.28 -0.16 2.27 -1.51 -1.07 -2.45 116.25 114.70 2kw5 h VAL 24 Ca -0.01 -1.37 -0.05 0.00 -1.23 0.00 0.00 66.70 64.05 2kw5 h VAL 24 Cb 1.01 1.49 -0.01 0.00 -2.13 0.00 0.00 31.29 31.65 2kw5 h VAL 24 CO 0.08 0.42 -0.11 0.00 -1.23 0.00 0.00 177.57 176.74 2kw5 h ALA 25 N 1.33 1.52 0.00 5.19 0.00 -1.20 0.13 119.26 126.23 2kw5 h ALA 25 Ca 0.04 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 2kw5 h ALA 25 Cb 0.73 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 2kw5 h ALA 25 CO 0.06 0.34 -0.18 -0.97 0.00 0.00 0.00 179.25 178.50 2kw5 h ASN 26 N 0.24 0.00 0.39 0.00 -1.24 -1.10 -2.80 115.58 111.08 2kw5 h ASN 26 Ca 0.05 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.06 2kw5 h ASN 26 Cb 0.35 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.40 2kw5 h ASN 26 CO 0.02 0.18 -1.04 0.00 -1.29 0.00 0.00 177.43 175.30 2kw5 n GLN 27 N -3.45 0.27 -2.88 6.67 1.13 -0.43 -4.72 117.38 113.96 2kw5 n GLN 27 Ca -0.01 -0.01 -0.41 0.00 -1.94 0.00 0.00 57.00 54.63 2kw5 n GLN 27 Cb 0.36 -1.58 -0.04 0.00 0.11 0.00 0.00 30.24 29.09 2kw5 n GLN 27 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2kw5 s ILE 28 N -3.19 4.90 0.76 5.09 1.01 0.32 -4.88 121.20 125.23 2kw5 s ILE 28 Ca 0.04 1.68 -0.12 0.00 0.00 0.00 0.00 60.65 62.25 2kw5 s ILE 28 Cb 0.15 -4.15 0.06 0.00 0.01 0.00 0.00 42.46 38.52 2kw5 s ILE 28 CO 0.81 0.08 1.12 -2.84 0.00 0.00 0.00 174.94 174.11 2kw5 s PRO 29 N 1.74 2.16 0.00 2.79 0.02 -1.26 -4.91 135.00 135.54 2kw5 s PRO 29 Ca 0.41 1.38 0.00 0.00 0.02 0.00 0.00 61.00 62.81 2kw5 s PRO 29 Cb -0.17 -1.87 0.00 0.00 0.02 0.00 0.00 34.50 32.47 2kw5 s PRO 29 CO 0.16 -1.75 0.57 1.04 -0.33 0.00 0.00 177.00 176.69 2kw5 n GLN 30 N -3.25 0.63 0.00 5.54 6.02 -1.26 -4.60 117.38 120.46 2kw5 n GLN 30 Ca 0.11 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.10 2kw5 n GLN 30 Cb 0.52 -1.21 0.00 0.00 1.02 0.00 0.00 30.24 30.57 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 0.60 4.71 3.63 1.08 0.00 -1.26 -4.92 105.19 109.04 2kw5 n GLY 31 Ca 0.00 -1.71 -0.43 0.00 0.00 0.00 0.00 46.02 43.88 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 3.75 3.85 -0.23 1.61 -0.14 -1.26 -4.00 119.74 123.32 2kw5 s LYS 32 Ca 0.00 1.63 -0.06 0.00 -1.36 0.00 0.00 55.97 56.17 2kw5 s LYS 32 Cb 0.00 -4.00 -0.03 0.00 -1.68 0.00 0.00 37.83 32.13 2kw5 s LYS 32 CO 0.00 -1.22 0.04 0.42 -0.76 0.00 0.00 175.35 173.83 2kw5 s ILE 33 N 4.93 4.15 -0.38 2.17 1.01 -0.39 -0.93 121.20 131.76 2kw5 s ILE 33 Ca 0.68 -0.23 -0.13 0.00 0.00 0.00 0.00 60.65 60.97 2kw5 s ILE 33 Cb -0.24 -2.92 0.02 0.00 0.01 0.00 0.00 42.46 39.33 2kw5 s ILE 33 CO 0.28 0.38 0.26 -0.22 0.00 0.00 0.00 174.94 175.63 2kw5 s LEU 34 N 1.36 4.85 -0.39 2.97 2.96 -0.84 -0.58 118.68 129.02 2kw5 s LEU 34 Ca 0.05 -0.83 -0.13 0.00 -0.22 0.00 0.00 54.13 53.00 2kw5 s LEU 34 Cb -0.15 -2.11 0.02 0.00 0.50 0.00 0.00 46.19 44.46 2kw5 s LEU 34 CO 0.02 -0.38 0.25 0.00 -1.32 0.00 0.00 176.35 174.91 2kw5 s LEU 36 N 1.61 2.78 -0.44 0.00 1.43 -0.57 -0.96 118.68 122.52 2kw5 s LEU 36 Ca 0.03 1.27 -0.41 0.00 -1.03 0.00 0.00 54.13 54.00 2kw5 s LEU 36 Cb -0.19 -3.99 -0.17 0.00 0.03 0.00 0.00 46.19 41.86 2kw5 s LEU 36 CO 0.08 -1.65 1.48 0.00 0.23 0.00 0.00 176.35 176.49 2kw5 n ALA 37 N -3.23 -0.96 0.00 4.21 0.00 0.15 -4.16 120.51 116.53 2kw5 n ALA 37 Ca 0.07 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.90 2kw5 n ALA 37 Cb 0.56 -1.70 0.00 0.00 0.00 0.00 0.00 19.45 18.31 2kw5 n ALA 37 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2kw5 n GLU 38 N 4.02 1.96 0.00 0.00 -0.00 -1.26 -4.58 120.64 120.78 2kw5 n GLU 38 Ca 0.31 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.47 2kw5 n GLU 38 Cb -0.05 -0.81 0.00 0.00 -0.00 0.00 0.00 31.44 30.58 2kw5 n GLU 38 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2kw5 n GLY 39 N 1.77 2.89 0.12 -1.84 0.00 -1.26 -4.83 105.19 102.04 2kw5 n GLY 39 Ca 0.00 -0.57 -0.19 0.00 0.00 0.00 0.00 46.02 45.26 2kw5 n GLY 39 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2kw5 h GLU 40 N 0.00 0.30 0.00 1.61 4.39 -1.97 -3.41 114.58 115.49 2kw5 h GLU 40 Ca 0.00 -0.48 0.00 0.00 0.34 0.00 0.00 59.36 59.22 2kw5 h GLU 40 Cb 0.00 0.17 0.00 0.00 -0.10 0.00 0.00 28.75 28.82 2kw5 h GLU 40 CO 0.00 1.21 0.00 0.41 -1.16 0.00 0.00 179.01 179.47 2kw5 n GLY 41 N 1.58 0.79 0.07 -3.84 0.00 -1.26 -4.78 105.19 97.76 2kw5 n GLY 41 Ca -0.13 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.77 2kw5 n GLY 41 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2kw5 h ARG 42 N 3.09 0.00 -0.89 1.61 2.43 -1.89 -3.32 114.38 115.42 2kw5 h ARG 42 Ca 0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 2kw5 h ARG 42 Cb 0.00 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.51 2kw5 h ARG 42 CO 0.00 0.70 0.50 -0.91 -1.51 0.00 0.00 179.97 178.76 2kw5 h ASN 43 N -1.00 1.09 0.34 -3.80 4.21 -1.97 -1.80 115.58 112.65 2kw5 h ASN 43 Ca -0.08 -0.09 -0.00 0.00 1.21 0.00 0.00 56.30 57.34 2kw5 h ASN 43 Cb 0.82 -0.28 -0.03 0.00 -1.12 0.00 0.00 38.32 37.72 2kw5 h ASN 43 CO -0.05 0.86 -0.40 0.00 -1.29 0.00 0.00 177.43 176.56 2kw5 h ALA 44 N 1.27 -0.84 -0.31 -0.83 0.00 -1.97 -2.18 119.26 114.40 2kw5 h ALA 44 Ca 0.31 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.06 2kw5 h ALA 44 Cb -0.00 0.59 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 2kw5 h ALA 44 CO -0.05 -1.01 0.03 0.00 0.00 0.00 0.00 179.25 178.22 2kw5 h PHE 46 N 0.45 -0.01 0.00 0.00 3.57 -1.12 -1.15 116.94 118.68 2kw5 h PHE 46 Ca 0.10 -0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.52 2kw5 h PHE 46 Cb 0.24 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.97 2kw5 h PHE 46 CO 0.01 0.16 -0.40 -0.07 -2.23 0.00 0.00 178.31 175.77 2kw5 h LEU 47 N -0.18 0.00 -0.20 0.59 3.38 -1.27 -2.60 115.31 115.03 2kw5 h LEU 47 Ca -0.00 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.78 2kw5 h LEU 47 Cb 0.18 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.93 2kw5 h LEU 47 CO 0.00 0.40 -0.62 0.00 0.09 0.00 0.00 178.44 178.31 2kw5 h ALA 48 N 1.60 0.35 0.00 1.53 0.00 -1.31 -3.11 119.26 118.32 2kw5 h ALA 48 Ca -0.00 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.36 2kw5 h ALA 48 Cb 0.73 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2kw5 h ALA 48 CO 0.05 0.61 0.00 -1.13 0.00 0.00 0.00 179.25 178.79 2kw5 n SER 49 N -4.03 0.00 -0.04 0.00 3.41 -0.44 -1.06 113.62 111.46 2kw5 n SER 49 Ca -0.06 -0.18 0.05 0.00 -0.26 0.00 0.00 58.87 58.41 2kw5 n SER 49 Cb 0.66 -0.19 0.26 0.00 -0.26 0.00 0.00 64.21 64.68 2kw5 n SER 49 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2kw5 n LEU 50 N -1.19 0.11 0.00 1.04 4.77 -1.01 -4.91 117.00 115.82 2kw5 n LEU 50 Ca 0.11 -0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 2kw5 n LEU 50 Cb 0.12 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 2kw5 n LEU 50 CO 0.13 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 176.83 2kw5 n GLY 51 N 0.66 0.73 3.39 -0.72 0.00 -0.22 -5.09 105.19 103.95 2kw5 n GLY 51 Ca 0.07 -0.67 -0.20 0.00 0.00 0.00 0.00 46.02 45.22 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 1.84 -0.89 1.61 2.02 -0.98 -5.06 117.35 113.90 2kw5 s TYR 52 Ca 0.00 -0.63 -0.19 0.00 -0.37 0.00 0.00 57.07 55.87 2kw5 s TYR 52 Cb 0.00 -0.95 0.12 0.00 -0.40 0.00 0.00 41.96 40.73 2kw5 s TYR 52 CO 0.00 0.32 1.11 -1.21 -1.57 0.00 0.00 175.55 174.21 2kw5 s GLU 53 N -3.68 3.53 -0.46 -0.62 2.02 -1.26 -4.37 118.70 113.85 2kw5 s GLU 53 Ca 0.26 -1.60 -0.17 0.00 0.02 0.00 0.00 54.97 53.48 2kw5 s GLU 53 Cb 0.01 -4.84 0.05 0.00 0.10 0.00 0.00 34.13 29.45 2kw5 s GLU 53 CO 0.10 -1.80 0.47 0.08 0.02 0.00 0.00 175.26 174.13 2kw5 s VAL 54 N 2.97 5.08 -0.48 2.63 1.01 -1.26 -1.26 120.40 129.10 2kw5 s VAL 54 Ca 0.32 -0.65 -0.24 0.00 0.00 0.00 0.00 61.98 61.41 2kw5 s VAL 54 Cb -0.06 -4.14 0.03 0.00 0.00 0.00 0.00 36.38 32.21 2kw5 s VAL 54 CO -0.07 -0.58 0.85 -0.89 0.00 0.00 0.00 175.10 174.41 2kw5 s THR 55 N 2.09 4.55 -0.19 3.92 2.01 0.26 -1.58 115.64 126.69 2kw5 s THR 55 Ca 0.10 0.44 -0.09 0.00 0.31 0.00 0.00 61.69 62.46 2kw5 s THR 55 Cb -0.20 -4.40 -0.04 0.00 0.01 0.00 0.00 72.50 67.86 2kw5 s THR 55 CO 0.11 -0.84 0.09 0.00 -0.69 0.00 0.00 174.62 173.28 2kw5 s ALA 56 N 3.54 3.52 -0.24 7.40 0.00 -0.03 -0.76 121.76 135.20 2kw5 s ALA 56 Ca 0.31 -0.74 -0.04 0.00 0.00 0.00 0.00 51.96 51.50 2kw5 s ALA 56 Cb -0.12 -2.04 -0.00 0.00 0.00 0.00 0.00 23.12 20.97 2kw5 s ALA 56 CO 0.23 0.14 -0.03 0.08 0.00 0.00 0.00 175.76 176.18 2kw5 s VAL 57 N 0.42 3.38 0.04 0.00 1.01 -0.14 -0.86 120.40 124.25 2kw5 s VAL 57 Ca 0.05 -0.60 0.06 0.00 0.00 0.00 0.00 61.98 61.48 2kw5 s VAL 57 Cb -0.12 -2.59 -0.02 0.00 0.00 0.00 0.00 36.38 33.64 2kw5 s VAL 57 CO -0.00 0.34 -0.16 -0.62 0.00 0.00 0.00 175.10 174.66 2kw5 s ASP 58 N 1.46 1.90 0.50 3.32 2.15 -1.21 0.35 116.67 125.13 2kw5 s ASP 58 Ca 0.04 -0.48 0.20 0.00 0.43 0.00 0.00 52.55 52.74 2kw5 s ASP 58 Cb -0.15 -0.13 1.27 0.00 -0.30 0.00 0.00 42.92 43.61 2kw5 s ASP 58 CO -0.03 0.06 2.02 0.06 -0.17 0.00 0.00 175.17 177.11 2kw5 h GLN 59 N 4.87 0.11 -6.54 4.34 3.07 -1.93 -3.18 115.11 115.86 2kw5 h GLN 59 Ca -0.39 -0.01 -0.69 0.00 0.09 0.00 0.00 58.65 57.65 2kw5 h GLN 59 Cb 1.17 -0.03 -0.23 0.00 0.08 0.00 0.00 27.48 28.48 2kw5 h GLN 59 CO 0.44 0.08 -0.81 -1.12 0.09 0.00 0.00 178.83 177.51 2kw5 s SER 60 N -6.36 3.78 0.47 0.06 0.01 -1.26 -4.84 113.70 105.56 2kw5 s SER 60 Ca -0.06 -0.40 0.25 0.00 1.31 0.00 0.00 55.95 57.05 2kw5 s SER 60 Cb 0.19 -0.63 1.12 0.00 0.21 0.00 0.00 66.02 66.91 2kw5 s SER 60 CO 0.73 0.27 1.92 0.77 0.41 0.00 0.00 173.24 177.34 2kw5 h SER 61 N 4.71 0.00 -0.07 2.44 4.64 -1.99 -2.72 113.55 120.56 2kw5 h SER 61 Ca -0.47 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.77 2kw5 h SER 61 Cb 1.15 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.23 2kw5 h SER 61 CO 0.48 0.20 -0.17 -0.37 -0.87 0.00 0.00 176.83 176.09 2kw5 h VAL 62 N 0.00 1.24 -0.03 0.95 -1.51 -1.96 -0.42 116.25 114.52 2kw5 h VAL 62 Ca -0.00 -1.07 -0.12 0.00 -1.23 0.00 0.00 66.70 64.27 2kw5 h VAL 62 Cb 0.59 1.24 -0.02 0.00 -2.13 0.00 0.00 31.29 30.97 2kw5 h VAL 62 CO 0.03 0.34 -0.54 1.23 -1.23 0.00 0.00 177.57 177.40 2kw5 h GLY 63 N 0.94 0.08 0.98 5.19 0.00 -1.73 -0.70 103.07 107.83 2kw5 h GLY 63 Ca 0.07 -0.09 -0.21 0.00 0.00 0.00 0.00 47.33 47.10 2kw5 h GLY 63 CO 0.03 0.08 -0.83 1.41 0.00 0.00 0.00 176.54 177.24 2kw5 h LEU 64 N 0.06 0.71 -0.81 3.11 3.38 -1.47 -1.63 115.31 118.65 2kw5 h LEU 64 Ca -0.00 -0.76 -0.06 0.00 0.09 0.00 0.00 57.88 57.14 2kw5 h LEU 64 Cb 0.98 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.48 2kw5 h LEU 64 CO 0.07 1.38 0.16 0.00 0.09 0.00 0.00 178.44 180.15 2kw5 h ALA 65 N 0.34 1.03 -0.56 1.53 0.00 -1.06 -0.84 119.26 119.70 2kw5 h ALA 65 Ca -0.11 -0.24 -0.11 0.00 0.00 0.00 0.00 54.91 54.45 2kw5 h ALA 65 Cb 1.52 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 2kw5 h ALA 65 CO 0.16 0.64 -0.09 0.87 0.00 0.00 0.00 179.25 180.83 2kw5 h LYS 66 N 1.01 1.04 0.09 0.00 1.79 -1.18 -0.98 116.57 118.33 2kw5 h LYS 66 Ca 0.21 -0.38 0.01 0.00 -2.18 0.00 0.00 60.65 58.32 2kw5 h LYS 66 Cb 0.35 -0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 30.90 2kw5 h LYS 66 CO 0.00 1.07 -0.17 0.00 -1.08 0.00 0.00 179.45 179.27 2kw5 h ALA 67 N 0.94 -0.27 0.09 3.86 0.00 -1.16 -2.36 119.26 120.36 2kw5 h ALA 67 Ca 0.15 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 2kw5 h ALA 67 Cb 0.66 0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2kw5 h ALA 67 CO 0.05 -0.69 -0.04 -0.22 0.00 0.00 0.00 179.25 178.35 2kw5 h LYS 68 N -0.32 -0.11 -0.20 0.00 3.64 -1.04 -2.24 116.57 116.29 2kw5 h LYS 68 Ca 0.03 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.40 2kw5 h LYS 68 Cb 0.34 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.18 2kw5 h LYS 68 CO -0.10 0.15 0.08 0.37 -2.27 0.00 0.00 179.45 177.67 2kw5 h GLN 69 N -0.37 0.30 -0.24 1.90 4.15 -1.27 -1.24 115.11 118.35 2kw5 h GLN 69 Ca -0.01 -0.06 -0.05 0.00 0.77 0.00 0.00 58.65 59.29 2kw5 h GLN 69 Cb 0.31 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 27.94 2kw5 h GLN 69 CO 0.02 0.38 -0.09 1.25 -1.93 0.00 0.00 178.83 178.46 2kw5 h LEU 70 N 0.17 0.37 0.06 -2.39 5.85 -1.47 -0.89 115.31 117.00 2kw5 h LEU 70 Ca 0.07 -0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 2kw5 h LEU 70 Cb 0.19 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.13 2kw5 h LEU 70 CO -0.00 0.50 -0.03 0.00 -0.34 0.00 0.00 178.44 178.57 2kw5 h ALA 71 N 1.54 -0.08 0.00 1.25 0.00 -1.21 -2.64 119.26 118.12 2kw5 h ALA 71 Ca 0.08 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.72 2kw5 h ALA 71 Cb 0.39 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2kw5 h ALA 71 CO 0.02 -0.34 -0.30 0.37 0.00 0.00 0.00 179.25 179.00 2kw5 h GLN 72 N -0.50 0.00 -0.41 0.00 4.15 -1.02 -0.02 115.11 117.32 2kw5 h GLN 72 Ca -0.01 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.39 2kw5 h GLN 72 Cb 0.44 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.11 2kw5 h GLN 72 CO 0.01 0.30 0.16 1.49 -1.93 0.00 0.00 178.83 178.87 2kw5 h GLU 73 N 0.00 0.61 -0.00 1.69 4.81 -1.17 -3.09 114.58 117.43 2kw5 h GLU 73 Ca -0.00 -0.11 0.00 0.00 -0.13 0.00 0.00 59.36 59.12 2kw5 h GLU 73 Cb 0.56 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.84 2kw5 h GLU 73 CO 0.04 0.57 -0.16 1.17 -0.73 0.00 0.00 179.01 179.90 2kw5 n LYS 74 N -4.64 0.51 -2.38 1.92 4.81 -0.57 -4.93 118.16 112.88 2kw5 n LYS 74 Ca 0.00 -0.19 0.00 0.00 -0.87 0.00 0.00 58.31 57.25 2kw5 n LYS 74 Cb 0.14 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 33.70 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 1.34 0.96 3.25 3.14 0.00 -0.38 -5.09 105.19 108.41 2kw5 n GLY 75 Ca 0.12 -0.65 -0.16 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.95 0.03 0.04 1.61 -7.23 -0.16 -5.01 120.40 106.72 2kw5 s VAL 76 Ca 0.00 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.25 2kw5 s VAL 76 Cb 0.00 -2.50 -0.02 0.00 0.56 0.00 0.00 36.38 34.41 2kw5 s VAL 76 CO 0.00 0.00 -0.22 -0.75 -0.31 0.00 0.00 175.10 173.82 2kw5 s LYS 77 N -3.83 1.51 0.29 4.82 2.20 -1.26 -3.14 119.74 120.31 2kw5 s LYS 77 Ca 0.39 -0.95 0.10 0.00 -0.36 0.00 0.00 55.97 55.16 2kw5 s LYS 77 Cb 0.05 -1.61 -0.05 0.00 -1.51 0.00 0.00 37.83 34.71 2kw5 s LYS 77 CO 0.19 0.42 -0.03 0.42 -0.36 0.00 0.00 175.35 175.98 2kw5 s ILE 78 N -0.76 3.09 -0.30 5.43 -1.09 -1.26 -4.23 121.20 122.08 2kw5 s ILE 78 Ca 0.08 -2.01 0.03 0.00 -2.23 0.00 0.00 60.65 56.52 2kw5 s ILE 78 Cb -0.09 -2.73 0.08 0.00 -1.58 0.00 0.00 42.46 38.14 2kw5 s ILE 78 CO 0.01 -0.34 -0.01 -0.89 -1.23 0.00 0.00 174.94 172.48 2kw5 s THR 79 N -2.40 2.02 -0.22 2.92 2.01 -0.61 -4.96 115.64 114.40 2kw5 s THR 79 Ca 0.32 -1.88 -0.18 0.00 0.31 0.00 0.00 61.69 60.26 2kw5 s THR 79 Cb -0.05 -2.35 -0.03 0.00 0.01 0.00 0.00 72.50 70.08 2kw5 s THR 79 CO 0.19 -0.35 0.49 0.42 -0.69 0.00 0.00 174.62 174.67 2kw5 s THR 80 N 1.09 5.12 -0.03 -0.82 -4.23 -1.26 -0.85 115.64 114.67 2kw5 s THR 80 Ca 0.02 0.87 0.05 0.00 -1.18 0.00 0.00 61.69 61.45 2kw5 s THR 80 Cb -0.19 -3.81 -0.03 0.00 1.34 0.00 0.00 72.50 69.81 2kw5 s THR 80 CO -0.08 0.17 -0.17 -0.69 -0.54 0.00 0.00 174.62 173.31 2kw5 s VAL 81 N 1.76 2.82 0.10 2.29 1.01 -0.04 -4.97 120.40 123.37 2kw5 s VAL 81 Ca 0.22 -0.89 -0.30 0.00 0.00 0.00 0.00 61.98 61.01 2kw5 s VAL 81 Cb -0.15 -2.10 -0.06 0.00 0.00 0.00 0.00 36.38 34.07 2kw5 s VAL 81 CO 0.09 0.54 0.96 -1.58 0.00 0.00 0.00 175.10 175.11 2kw5 s GLN 82 N -0.86 4.69 -0.45 2.72 0.74 -1.26 -3.32 119.66 121.92 2kw5 s GLN 82 Ca 0.12 1.45 -0.30 0.00 0.05 0.00 0.00 55.36 56.68 2kw5 s GLN 82 Cb -0.10 -3.38 -0.09 0.00 1.10 0.00 0.00 33.01 30.53 2kw5 s GLN 82 CO 0.01 0.20 2.34 -1.13 -0.55 0.00 0.00 175.29 176.16 2kw5 n SER 83 N 2.86 2.26 -3.41 6.67 3.41 -1.20 -4.88 113.62 119.33 2kw5 n SER 83 Ca 0.02 -0.02 -0.26 0.00 -0.26 0.00 0.00 58.87 58.36 2kw5 n SER 83 Cb 0.49 -1.42 -0.10 0.00 -0.26 0.00 0.00 64.21 62.92 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 9.63 2.15 0.00 4.04 0.01 -1.26 -5.00 114.94 124.51 2kw5 s ASN 84 Ca 1.06 -2.33 0.23 0.00 -0.71 0.00 0.00 52.86 51.12 2kw5 s ASN 84 Cb -0.52 -0.20 0.20 0.00 0.41 0.00 0.00 41.25 41.14 2kw5 s ASN 84 CO 0.37 -0.26 1.20 0.18 -1.51 0.00 0.00 177.10 177.09 2kw5 n LEU 85 N 3.72 0.74 -0.42 0.60 4.77 -1.25 -0.91 117.00 124.24 2kw5 n LEU 85 Ca 0.17 -0.22 0.10 0.00 -0.03 0.00 0.00 56.01 56.03 2kw5 n LEU 85 Cb 0.42 -0.14 0.41 0.00 -2.33 0.00 0.00 43.42 41.78 2kw5 n LEU 85 CO 0.11 0.18 0.79 0.00 -1.33 0.00 0.00 177.39 177.14 2kw5 n ALA 86 N -1.46 2.54 0.00 -1.18 0.00 -1.26 -4.29 120.51 114.86 2kw5 n ALA 86 Ca 0.05 -0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.07 2kw5 n ALA 86 Cb 0.34 -1.14 0.00 0.00 0.00 0.00 0.00 19.45 18.65 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 0.06 1.54 -3.65 0.00 2.03 -1.16 -5.10 116.55 110.26 2kw5 n ASP 87 Ca 0.15 0.00 -0.05 0.00 0.52 0.00 0.00 54.79 55.42 2kw5 n ASP 87 Cb 0.26 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 40.60 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 -1.53 -1.08 0.01 -0.67 5.36 -0.09 -5.09 117.98 114.88 2kw5 s PHE 88 Ca 0.00 1.97 0.00 0.00 -0.96 0.00 0.00 56.93 57.94 2kw5 s PHE 88 Cb 0.00 0.58 0.00 0.00 -0.34 0.00 0.00 43.02 43.26 2kw5 s PHE 88 CO 0.00 -0.57 0.00 -0.40 -1.46 0.00 0.00 175.22 172.79 2kw5 n ASP 89 N 5.23 0.02 -3.71 6.13 5.68 -1.26 -3.87 116.55 124.77 2kw5 n ASP 89 Ca -0.12 0.01 -0.11 0.00 -0.50 0.00 0.00 54.79 54.06 2kw5 n ASP 89 Cb 0.51 -0.00 -0.11 0.00 -1.14 0.00 0.00 41.12 40.37 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 -1.04 -0.03 0.05 2.12 -4.36 -1.26 -5.00 121.20 111.69 2kw5 s ILE 90 Ca 0.00 0.10 0.08 0.00 -0.26 0.00 0.00 60.65 60.56 2kw5 s ILE 90 Cb 0.00 -0.53 -0.03 0.00 1.25 0.00 0.00 42.46 43.15 2kw5 s ILE 90 CO 0.00 0.04 -0.19 -0.69 0.24 0.00 0.00 174.94 174.34 2kw5 s VAL 91 N 1.21 2.69 -0.02 8.37 1.01 -1.26 -4.53 120.40 127.88 2kw5 s VAL 91 Ca -0.08 -1.26 0.10 0.00 0.00 0.00 0.00 61.98 60.74 2kw5 s VAL 91 Cb -0.08 -2.14 -0.23 0.00 0.00 0.00 0.00 36.38 33.93 2kw5 s VAL 91 CO -0.10 0.31 0.75 0.00 0.00 0.00 0.00 175.10 176.06 2kw5 h ALA 92 N 4.48 0.68 0.05 5.51 0.00 -1.76 -3.35 119.26 124.85 2kw5 h ALA 92 Ca -0.48 -1.37 -0.00 0.00 0.00 0.00 0.00 54.91 53.06 2kw5 h ALA 92 Cb 1.15 0.39 0.00 0.00 0.00 0.00 0.00 17.79 19.34 2kw5 h ALA 92 CO 0.47 1.51 -0.02 0.22 0.00 0.00 0.00 179.25 181.42 2kw5 h ASP 93 N 0.01 -0.05 -0.03 0.00 1.82 -1.97 -3.37 116.42 112.83 2kw5 h ASP 93 Ca -0.25 0.00 0.01 0.00 -0.39 0.00 0.00 57.03 56.40 2kw5 h ASP 93 Cb 1.98 0.01 -0.00 0.00 0.68 0.00 0.00 39.33 42.00 2kw5 h ASP 93 CO 0.09 0.38 0.02 0.00 -1.61 0.00 0.00 179.24 178.12 2kw5 h ALA 94 N -1.14 1.96 -3.80 -0.78 0.00 -2.01 -3.43 119.26 110.05 2kw5 h ALA 94 Ca -0.01 -0.00 -0.68 0.00 0.00 0.00 0.00 54.91 54.22 2kw5 h ALA 94 Cb 0.05 0.00 -0.20 0.00 0.00 0.00 0.00 17.79 17.64 2kw5 h ALA 94 CO 0.01 -0.04 -0.76 -1.58 0.00 0.00 0.00 179.25 176.89 2kw5 s TRP 95 N -5.00 2.72 -0.25 0.00 0.52 -1.26 -4.83 118.94 110.83 2kw5 s TRP 95 Ca -0.05 -0.15 -0.10 0.00 0.02 0.00 0.00 56.10 55.82 2kw5 s TRP 95 Cb 0.17 -1.53 -0.15 0.00 -1.15 0.00 0.00 33.47 30.80 2kw5 s TRP 95 CO 0.65 0.31 -0.21 -1.91 0.02 0.00 0.00 176.95 175.82 2kw5 n GLU 96 N 1.55 0.62 -4.82 4.98 4.07 -0.17 -4.76 120.64 122.10 2kw5 n GLU 96 Ca -0.16 0.26 -0.32 0.00 -0.06 0.00 0.00 57.16 56.88 2kw5 n GLU 96 Cb 0.52 -1.54 -0.13 0.00 -0.06 0.00 0.00 31.44 30.23 2kw5 n GLU 96 CO 0.00 0.00 0.00 0.20 -0.06 0.00 0.00 177.13 177.27 2kw5 s GLY 97 N -5.75 1.55 0.13 8.31 0.00 -0.10 -4.61 107.32 106.85 2kw5 s GLY 97 Ca -0.36 -1.04 0.10 0.00 0.00 0.00 0.00 44.72 43.43 2kw5 s GLY 97 CO 0.55 -0.86 -0.22 -0.42 0.00 0.00 0.00 173.10 172.16 2kw5 s ILE 98 N -0.79 2.59 -0.10 0.90 1.01 -1.21 -1.99 121.20 121.61 2kw5 s ILE 98 Ca 0.13 -1.66 -0.05 0.00 0.00 0.00 0.00 60.65 59.07 2kw5 s ILE 98 Cb -0.11 -2.18 0.05 0.00 0.01 0.00 0.00 42.46 40.23 2kw5 s ILE 98 CO 0.02 0.06 0.23 0.54 0.00 0.00 0.00 174.94 175.79 2kw5 s VAL 99 N -1.19 -0.07 -0.39 2.92 0.11 -0.15 -0.71 120.40 120.92 2kw5 s VAL 99 Ca 0.17 0.17 0.01 0.00 -2.93 0.00 0.00 61.98 59.40 2kw5 s VAL 99 Cb -0.10 -0.36 0.12 0.00 -1.53 0.00 0.00 36.38 34.51 2kw5 s VAL 99 CO 0.09 0.07 0.17 -0.44 -3.33 0.00 0.00 175.10 171.66 2kw5 s SER 100 N 1.34 3.88 0.39 3.54 0.01 -0.89 -1.51 113.70 120.46 2kw5 s SER 100 Ca -0.08 -2.25 -0.25 0.00 1.31 0.00 0.00 55.95 54.67 2kw5 s SER 100 Cb -0.11 -1.03 -0.09 0.00 0.21 0.00 0.00 66.02 65.01 2kw5 s SER 100 CO -0.08 -0.33 1.17 -0.63 0.41 0.00 0.00 173.24 173.78 2kw5 s ILE 101 N 0.83 3.18 0.00 1.44 -1.09 -1.26 -0.97 121.20 123.32 2kw5 s ILE 101 Ca 0.14 1.00 0.00 0.00 -2.23 0.00 0.00 60.65 59.56 2kw5 s ILE 101 Cb -0.22 -3.56 0.00 0.00 -1.58 0.00 0.00 42.46 37.10 2kw5 s ILE 101 CO -0.09 0.10 0.00 2.22 -1.23 0.00 0.00 174.94 175.94 2kw5 n PHE 102 N 0.14 0.00 -3.55 3.97 1.16 0.01 -4.60 117.46 114.58 2kw5 n PHE 102 Ca 0.04 0.00 -0.40 0.00 -1.87 0.00 0.00 57.45 55.22 2kw5 n PHE 102 Cb 0.46 0.00 -0.11 0.00 -1.61 0.00 0.00 39.48 38.23 2kw5 n PHE 102 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2kw5 s HIS 104 N 1.71 3.39 0.19 0.00 3.76 -1.26 -4.94 115.29 118.14 2kw5 s HIS 104 Ca 0.06 -2.86 0.07 0.00 -0.15 0.00 0.00 55.06 52.17 2kw5 s HIS 104 Cb -0.17 -2.74 -0.04 0.00 1.11 0.00 0.00 32.58 30.74 2kw5 s HIS 104 CO 0.10 -0.91 0.07 -0.51 -0.85 0.00 0.00 174.74 172.64 2kw5 s LEU 105 N 0.81 3.52 0.44 0.89 1.43 -1.26 -4.79 118.68 119.71 2kw5 s LEU 105 Ca 0.12 -0.31 -0.25 0.00 -1.03 0.00 0.00 54.13 52.66 2kw5 s LEU 105 Cb -0.20 -2.13 -0.09 0.00 0.03 0.00 0.00 46.19 43.79 2kw5 s LEU 105 CO -0.09 0.06 1.21 -2.65 0.23 0.00 0.00 176.35 175.11 2kw5 n PRO 106 N -0.37 1.75 0.07 1.29 -0.02 -1.26 -4.60 135.00 131.86 2kw5 n PRO 106 Ca -0.09 0.63 0.21 0.00 -2.02 0.00 0.00 63.50 62.22 2kw5 n PRO 106 Cb 0.56 -2.31 0.68 0.00 -0.02 0.00 0.00 33.50 32.40 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 1.86 0.00 0.46 2.55 0.02 -1.92 0.20 113.55 116.72 2kw5 h SER 107 Ca -0.47 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.47 2kw5 h SER 107 Cb 1.31 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.83 2kw5 h SER 107 CO 0.59 0.00 -0.40 0.28 -1.14 0.00 0.00 176.83 176.16 2kw5 h SER 108 N 0.00 -1.06 0.78 3.07 0.02 -1.98 -1.73 113.55 112.65 2kw5 h SER 108 Ca 0.22 0.08 -0.24 0.00 -0.84 0.00 0.00 61.79 61.01 2kw5 h SER 108 Cb 1.41 0.35 -0.01 0.00 0.14 0.00 0.00 62.40 64.29 2kw5 h SER 108 CO -0.00 -0.56 -1.12 -0.07 -1.14 0.00 0.00 176.83 173.94 2kw5 h LEU 109 N -0.85 0.24 0.27 5.07 3.38 -1.08 -3.05 115.31 119.29 2kw5 h LEU 109 Ca -0.04 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.66 2kw5 h LEU 109 Cb 0.74 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.42 2kw5 h LEU 109 CO -0.03 1.19 -0.13 -0.09 0.09 0.00 0.00 178.44 179.47 2kw5 h ARG 110 N 0.05 -0.35 0.00 1.13 1.12 -0.94 0.13 114.38 115.52 2kw5 h ARG 110 Ca -0.08 0.02 0.00 0.00 -1.11 0.00 0.00 59.98 58.82 2kw5 h ARG 110 Cb 1.86 0.08 0.00 0.00 -0.01 0.00 0.00 29.97 31.90 2kw5 h ARG 110 CO 0.17 -0.15 0.00 0.94 -3.11 0.00 0.00 179.97 177.82 2kw5 n GLN 111 N -5.01 0.01 0.01 0.20 -0.06 -0.65 -1.85 117.38 110.03 2kw5 n GLN 111 Ca -0.06 0.30 -0.13 0.00 -2.00 0.00 0.00 57.00 55.11 2kw5 n GLN 111 Cb 0.18 -1.52 -0.14 0.00 -4.06 0.00 0.00 30.24 24.70 2kw5 n GLN 111 CO 0.00 0.00 0.00 0.37 -0.20 0.00 0.00 177.06 177.23 2kw5 h GLN 112 N 0.00 0.12 -0.12 3.69 4.15 -1.45 -3.41 115.11 118.09 2kw5 h GLN 112 Ca 0.00 -0.20 -0.03 0.00 0.77 0.00 0.00 58.65 59.19 2kw5 h GLN 112 Cb 0.22 0.07 -0.00 0.00 0.21 0.00 0.00 27.48 27.98 2kw5 h GLN 112 CO 0.00 0.83 -0.04 1.25 -1.93 0.00 0.00 178.83 178.94 2kw5 h LEU 113 N 0.03 0.24 -0.86 -2.39 5.85 0.03 -3.24 115.31 114.96 2kw5 h LEU 113 Ca -0.30 -0.39 -0.05 0.00 0.84 0.00 0.00 57.88 57.98 2kw5 h LEU 113 Cb 2.01 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 42.94 2kw5 h LEU 113 CO 0.10 0.57 0.25 1.88 -0.34 0.00 0.00 178.44 180.91 2kw5 h TYR 114 N -0.10 1.12 -0.43 1.25 0.05 -1.75 0.13 116.97 117.24 2kw5 h TYR 114 Ca 0.03 -0.09 0.08 0.00 0.05 0.00 0.00 58.73 58.79 2kw5 h TYR 114 Cb 0.48 -0.33 -0.02 0.00 1.01 0.00 0.00 36.73 37.86 2kw5 h TYR 114 CO 0.06 0.87 0.30 -1.35 -1.05 0.00 0.00 178.16 176.98 2kw5 h PRO 115 N 1.06 0.24 0.00 4.88 0.11 -1.80 -0.72 132.00 135.76 2kw5 h PRO 115 Ca 0.24 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.33 2kw5 h PRO 115 Cb 0.25 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.31 2kw5 h PRO 115 CO -0.01 0.16 -0.11 0.87 -0.21 0.00 0.00 178.00 178.69 2kw5 h LYS 116 N 0.24 0.00 0.14 1.05 1.79 -0.86 -1.53 116.57 117.41 2kw5 h LYS 116 Ca 0.20 0.00 -0.27 0.00 -2.18 0.00 0.00 60.65 58.40 2kw5 h LYS 116 Cb 0.46 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.12 2kw5 h LYS 116 CO -0.04 0.00 -1.32 0.28 -1.08 0.00 0.00 179.45 177.29 2kw5 h VAL 117 N 0.00 1.15 -0.10 0.50 2.07 -0.57 0.38 116.25 119.68 2kw5 h VAL 117 Ca 0.00 -2.48 -0.00 0.00 0.82 0.00 0.00 66.70 65.04 2kw5 h VAL 117 Cb 0.89 2.87 -0.00 0.00 -1.52 0.00 0.00 31.29 33.53 2kw5 h VAL 117 CO 0.00 0.74 0.05 0.22 0.02 0.00 0.00 177.57 178.60 2kw5 h TYR 118 N -0.22 0.14 0.13 1.57 3.20 -1.15 -2.00 116.97 118.64 2kw5 h TYR 118 Ca -0.27 -0.01 -0.20 0.00 3.14 0.00 0.00 58.73 61.39 2kw5 h TYR 118 Cb 1.82 -0.04 0.02 0.00 1.54 0.00 0.00 36.73 40.07 2kw5 h TYR 118 CO 0.14 0.19 -0.88 1.96 -1.64 0.00 0.00 178.16 177.93 2kw5 h GLN 119 N 0.05 0.37 0.00 1.82 4.20 -1.45 -3.43 115.11 116.67 2kw5 h GLN 119 Ca 0.03 -0.57 -0.01 0.00 0.06 0.00 0.00 58.65 58.16 2kw5 h GLN 119 Cb 0.10 0.20 -0.00 0.00 0.30 0.00 0.00 27.48 28.08 2kw5 h GLN 119 CO -0.00 1.25 -2.01 0.41 -0.67 0.00 0.00 178.83 177.80 2kw5 n GLY 120 N 1.54 -1.00 3.71 3.46 0.00 0.11 -4.93 105.19 108.10 2kw5 n GLY 120 Ca -0.14 -0.51 -0.42 0.00 0.00 0.00 0.00 46.02 44.95 2kw5 n GLY 120 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2kw5 s LEU 121 N -4.55 4.37 0.36 0.99 2.96 -0.75 -2.31 118.68 119.74 2kw5 s LEU 121 Ca -0.08 2.72 -0.27 0.00 -0.22 0.00 0.00 54.13 56.28 2kw5 s LEU 121 Cb 0.14 -3.59 -0.09 0.00 0.50 0.00 0.00 46.19 43.15 2kw5 s LEU 121 CO 0.90 -0.91 1.18 -0.75 -1.32 0.00 0.00 176.35 175.45 2kw5 s LYS 122 N 1.50 4.25 -0.35 1.98 2.20 -1.26 -4.84 119.74 123.21 2kw5 s LYS 122 Ca 0.74 1.90 -0.33 0.00 -0.36 0.00 0.00 55.97 57.92 2kw5 s LYS 122 Cb -0.46 -2.87 -0.10 0.00 -1.51 0.00 0.00 37.83 32.89 2kw5 s LYS 122 CO 0.32 -0.17 2.23 -2.30 -0.36 0.00 0.00 175.35 175.07 2kw5 n PRO 123 N 0.46 1.21 0.00 4.03 -0.02 -1.26 -1.70 135.00 137.72 2kw5 n PRO 123 Ca 0.02 0.31 0.00 0.00 -2.02 0.00 0.00 63.50 61.81 2kw5 n PRO 123 Cb 0.45 -2.65 0.00 0.00 -0.02 0.00 0.00 33.50 31.29 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 6.37 1.25 3.88 -1.23 0.00 -1.26 -4.96 105.19 109.23 2kw5 n GLY 124 Ca 0.40 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.06 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 -1.79 2.25 -0.16 -0.02 0.00 -0.69 -3.31 107.32 103.60 2kw5 s GLY 125 Ca 0.00 -0.56 -0.04 0.00 0.00 0.00 0.00 44.72 44.12 2kw5 s GLY 125 CO 0.00 -0.34 -0.03 -1.34 0.00 0.00 0.00 173.10 171.39 2kw5 s VAL 126 N -1.21 3.98 -0.29 1.40 -7.23 0.11 -4.18 120.40 112.98 2kw5 s VAL 126 Ca 0.24 -0.33 -0.04 0.00 -1.81 0.00 0.00 61.98 60.05 2kw5 s VAL 126 Cb -0.13 -2.75 0.03 0.00 0.56 0.00 0.00 36.38 34.09 2kw5 s VAL 126 CO 0.13 0.49 0.02 0.12 -0.31 0.00 0.00 175.10 175.55 2kw5 s PHE 127 N 0.40 3.19 -0.29 2.82 5.36 -1.18 -2.09 117.98 126.19 2kw5 s PHE 127 Ca -0.03 -1.53 -0.05 0.00 -0.96 0.00 0.00 56.93 54.36 2kw5 s PHE 127 Cb -0.14 -2.16 0.02 0.00 -0.34 0.00 0.00 43.02 40.40 2kw5 s PHE 127 CO 0.03 -0.73 0.05 0.42 -1.46 0.00 0.00 175.22 173.53 2kw5 s ILE 128 N 1.35 3.66 -0.20 3.12 1.01 -0.15 -1.54 121.20 128.46 2kw5 s ILE 128 Ca -0.02 -0.86 0.01 0.00 0.00 0.00 0.00 60.65 59.78 2kw5 s ILE 128 Cb -0.18 -2.92 0.04 0.00 0.01 0.00 0.00 42.46 39.41 2kw5 s ILE 128 CO -0.00 0.06 -0.10 -0.76 0.00 0.00 0.00 174.94 174.13 2kw5 s LEU 129 N 1.44 2.25 -0.22 2.97 1.43 -1.17 -0.81 118.68 124.56 2kw5 s LEU 129 Ca 0.01 -0.87 -0.04 0.00 -1.03 0.00 0.00 54.13 52.21 2kw5 s LEU 129 Cb -0.18 -1.23 0.10 0.00 0.03 0.00 0.00 46.19 44.91 2kw5 s LEU 129 CO 0.01 -0.14 0.21 -0.70 0.23 0.00 0.00 176.35 175.95 2kw5 s GLU 130 N 1.40 0.19 0.00 1.70 2.12 -1.26 -0.96 118.70 121.89 2kw5 s GLU 130 Ca -0.01 0.06 0.00 0.00 0.36 0.00 0.00 54.97 55.39 2kw5 s GLU 130 Cb -0.16 -1.22 0.00 0.00 0.26 0.00 0.00 34.13 33.01 2kw5 s GLU 130 CO -0.08 -0.73 0.00 0.41 -0.54 0.00 0.00 175.26 174.31 2kw5 n GLY 131 N 5.31 0.57 3.07 -1.50 0.00 -1.24 -4.81 105.19 106.59 2kw5 n GLY 131 Ca -0.05 0.06 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 2kw5 n GLY 131 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2kw5 s PHE 132 N 0.00 0.12 -0.06 1.61 0.40 -1.26 -4.98 117.98 113.81 2kw5 s PHE 132 Ca 0.00 -0.28 -0.32 0.00 -0.60 0.00 0.00 56.93 55.74 2kw5 s PHE 132 Cb 0.00 -0.10 0.13 0.00 0.51 0.00 0.00 43.02 43.56 2kw5 s PHE 132 CO 0.00 -0.27 1.27 0.00 0.70 0.00 0.00 175.22 176.92 2kw5 s ALA 133 N -1.51 -2.20 0.11 5.36 0.00 -1.21 -3.35 121.76 118.96 2kw5 s ALA 133 Ca -0.14 0.91 -0.18 0.00 0.00 0.00 0.00 51.96 52.55 2kw5 s ALA 133 Cb -0.08 0.25 -0.05 0.00 0.00 0.00 0.00 23.12 23.23 2kw5 s ALA 133 CO 0.00 -0.95 1.63 -1.35 0.00 0.00 0.00 175.76 175.10 2kw5 h PRO 134 N 2.00 0.45 -0.01 0.00 0.11 -1.92 -3.31 132.00 129.31 2kw5 h PRO 134 Ca -0.25 -0.09 0.00 0.00 0.11 0.00 0.00 66.00 65.77 2kw5 h PRO 134 Cb 1.19 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2kw5 h PRO 134 CO 0.27 0.49 -0.20 -0.85 -0.21 0.00 0.00 178.00 177.50 2kw5 n GLU 135 N -4.72 1.03 -0.09 1.05 -0.00 -1.26 -4.71 120.64 111.94 2kw5 n GLU 135 Ca -0.02 -0.60 -0.09 0.00 -0.00 0.00 0.00 57.16 56.45 2kw5 n GLU 135 Cb 0.15 -1.49 -0.06 0.00 -0.00 0.00 0.00 31.44 30.04 2kw5 n GLU 135 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.13 177.50 2kw5 h GLN 136 N 1.47 -0.25 0.00 3.44 5.75 -1.91 -1.87 115.11 121.74 2kw5 h GLN 136 Ca 0.00 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.52 2kw5 h GLN 136 Cb 0.51 0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.11 2kw5 h GLN 136 CO 0.00 -0.17 -0.19 -0.07 -2.65 0.00 0.00 178.83 175.75 2kw5 h LEU 137 N -0.26 0.00 -2.75 -2.39 3.38 -1.86 -3.29 115.31 108.13 2kw5 h LEU 137 Ca 0.05 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2kw5 h LEU 137 Cb 0.39 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 2kw5 h LEU 137 CO -0.38 0.03 -0.00 -0.61 0.09 0.00 0.00 178.44 177.57 2kw5 h GLN 138 N 0.00 0.00 -0.82 1.13 4.15 -1.62 -1.43 115.11 116.52 2kw5 h GLN 138 Ca 0.00 0.00 0.16 0.00 0.77 0.00 0.00 58.65 59.58 2kw5 h GLN 138 Cb 0.76 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 28.39 2kw5 h GLN 138 CO 0.00 0.00 0.54 1.88 -1.93 0.00 0.00 178.83 179.32 2kw5 h TYR 139 N 0.00 0.56 0.00 3.99 -1.99 -1.61 -3.46 116.97 114.46 2kw5 h TYR 139 Ca -0.00 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.75 2kw5 h TYR 139 Cb 0.08 -0.18 0.00 0.00 2.00 0.00 0.00 36.73 38.63 2kw5 h TYR 139 CO 0.00 0.20 0.00 -1.71 -0.00 0.00 0.00 178.16 176.65 2kw5 n ASN 140 N -4.50 0.00 -0.04 3.88 5.15 -0.54 -4.69 115.26 114.52 2kw5 n ASN 140 Ca 0.16 0.00 0.04 0.00 -0.60 0.00 0.00 54.58 54.18 2kw5 n ASN 140 Cb 0.56 -1.03 -0.04 0.00 -0.53 0.00 0.00 39.78 38.74 2kw5 n ASN 140 CO 0.00 0.00 0.00 1.07 1.40 0.00 0.00 177.26 179.73 2kw5 n THR 141 N -2.00 0.00 -3.18 -0.44 5.66 -1.26 -4.76 114.28 108.30 2kw5 n THR 141 Ca 0.00 -0.33 -0.22 0.00 -3.05 0.00 0.00 64.05 60.45 2kw5 n THR 141 Cb 0.00 1.02 -0.06 0.00 -1.55 0.00 0.00 70.33 69.74 2kw5 n THR 141 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2kw5 n GLY 142 N 1.11 1.98 0.00 1.09 0.00 -1.26 -5.08 105.19 103.03 2kw5 n GLY 142 Ca 0.02 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 44.93 2kw5 n GLY 142 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kw5 n GLY 143 N 2.09 0.51 0.31 -0.02 0.00 -1.26 -3.81 105.19 103.01 2kw5 n GLY 143 Ca 0.23 0.65 0.20 0.00 0.00 0.00 0.00 46.02 47.10 2kw5 n GLY 143 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2kw5 h PRO 144 N 0.00 0.00 0.00 1.61 0.11 -1.92 -3.43 132.00 128.37 2kw5 h PRO 144 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2kw5 h PRO 144 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 2kw5 h PRO 144 CO 0.00 0.01 0.00 0.36 -0.21 0.00 0.00 178.00 178.16 2kw5 n LYS 145 N -3.12 0.00 0.00 1.05 2.85 -1.26 -4.97 118.16 112.71 2kw5 n LYS 145 Ca -0.01 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.25 2kw5 n LYS 145 Cb 0.18 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.56 2kw5 n LYS 145 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 2kw5 n ASP 146 N -0.99 0.00 0.00 -5.58 2.03 -1.26 -5.03 116.55 105.72 2kw5 n ASP 146 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2kw5 n ASP 146 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 2kw5 n ASP 146 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2kw5 n LEU 147 N 0.00 0.00 -0.00 -2.67 4.77 -1.26 -1.64 117.00 116.19 2kw5 n LEU 147 Ca 0.00 0.22 0.19 0.00 -0.03 0.00 0.00 56.01 56.39 2kw5 n LEU 147 Cb 0.00 -0.22 0.67 0.00 -2.33 0.00 0.00 43.42 41.54 2kw5 n LEU 147 CO 0.00 -0.22 1.18 -0.78 -1.33 0.00 0.00 177.39 176.24 2kw5 h ASP 148 N 0.00 0.04 0.00 -1.43 3.58 -2.00 -1.65 116.42 114.96 2kw5 h ASP 148 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2kw5 h ASP 148 Cb 0.26 -0.01 0.00 0.00 1.72 0.00 0.00 39.33 41.30 2kw5 h ASP 148 CO 0.00 0.02 0.00 0.18 -2.88 0.00 0.00 179.24 176.56 2kw5 n LEU 149 N -4.39 0.00 -4.24 2.28 4.77 -0.65 -4.67 117.00 110.09 2kw5 n LEU 149 Ca 0.10 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.65 2kw5 n LEU 149 Cb 0.57 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.59 2kw5 n LEU 149 CO 0.36 0.00 0.07 -0.76 -1.33 0.00 0.00 177.39 175.74 2kw5 s LEU 150 N -1.15 5.90 -0.11 2.23 1.43 -0.62 -4.71 118.68 121.65 2kw5 s LEU 150 Ca 0.07 -2.05 -0.26 0.00 -1.03 0.00 0.00 54.13 50.86 2kw5 s LEU 150 Cb 0.03 -2.07 -0.02 0.00 0.03 0.00 0.00 46.19 44.16 2kw5 s LEU 150 CO 0.05 -0.69 0.83 -2.16 0.23 0.00 0.00 176.35 174.61 2kw5 s PRO 151 N 1.16 4.39 1.02 1.29 0.04 -1.26 -5.09 135.00 136.55 2kw5 s PRO 151 Ca 0.07 1.07 -0.15 0.00 0.04 0.00 0.00 61.00 62.04 2kw5 s PRO 151 Cb -0.25 -3.52 0.20 0.00 0.04 0.00 0.00 34.50 30.98 2kw5 s PRO 151 CO -0.01 -0.17 1.14 -1.59 0.04 0.00 0.00 177.00 176.41 2kw5 s LYS 152 N 1.58 0.21 0.31 4.56 -2.85 -1.26 -4.74 119.74 117.55 2kw5 s LYS 152 Ca 0.41 0.15 0.03 0.00 -1.00 0.00 0.00 55.97 55.56 2kw5 s LYS 152 Cb -0.18 -1.74 0.61 0.00 -2.06 0.00 0.00 37.83 34.46 2kw5 s LYS 152 CO 0.17 -2.80 1.88 -0.07 0.10 0.00 0.00 175.35 174.63 2kw5 h LEU 153 N -1.93 0.84 -1.28 2.77 3.38 -1.98 -0.93 115.31 116.19 2kw5 h LEU 153 Ca -0.49 0.02 0.05 0.00 0.09 0.00 0.00 57.88 57.55 2kw5 h LEU 153 Cb 1.31 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 41.86 2kw5 h LEU 153 CO 0.50 0.50 0.52 -0.33 0.09 0.00 0.00 178.44 179.72 2kw5 h GLU 154 N 0.93 0.88 0.07 1.13 4.39 -1.99 -0.30 114.58 119.69 2kw5 h GLU 154 Ca 0.43 -0.05 -0.00 0.00 0.34 0.00 0.00 59.36 60.07 2kw5 h GLU 154 Cb 0.39 -0.20 0.00 0.00 -0.10 0.00 0.00 28.75 28.85 2kw5 h GLU 154 CO -0.19 0.58 -0.03 1.15 -1.16 0.00 0.00 179.01 179.36 2kw5 h THR 155 N 0.90 1.24 0.41 1.13 2.02 -1.58 -3.09 112.91 113.94 2kw5 h THR 155 Ca 0.33 -1.40 -0.02 0.00 0.77 0.00 0.00 66.41 66.09 2kw5 h THR 155 Cb 0.16 2.10 0.00 0.00 -1.74 0.00 0.00 68.15 68.67 2kw5 h THR 155 CO -0.11 0.33 -0.20 -0.07 0.37 0.00 0.00 175.52 175.84 2kw5 h LEU 156 N -0.76 -0.47 -1.52 2.58 3.38 -0.99 -0.02 115.31 117.51 2kw5 h LEU 156 Ca -0.01 -0.11 0.03 0.00 0.09 0.00 0.00 57.88 57.88 2kw5 h LEU 156 Cb 0.61 0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.45 2kw5 h LEU 156 CO 0.01 -0.13 0.36 -0.61 0.09 0.00 0.00 178.44 178.16 2kw5 h GLN 157 N -0.84 0.61 0.00 1.13 4.15 -1.26 -1.36 115.11 117.54 2kw5 h GLN 157 Ca -0.06 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.33 2kw5 h GLN 157 Cb 0.55 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 28.10 2kw5 h GLN 157 CO 0.09 0.40 -0.07 0.45 -1.93 0.00 0.00 178.83 177.78 2kw5 n SER 158 N -4.47 0.56 -0.20 -0.69 2.88 -1.08 -2.40 113.62 108.22 2kw5 n SER 158 Ca 0.06 0.49 0.11 0.00 -1.33 0.00 0.00 58.87 58.20 2kw5 n SER 158 Cb 0.13 -0.59 0.01 0.00 -0.75 0.00 0.00 64.21 63.01 2kw5 n SER 158 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2kw5 n GLU 159 N -2.01 0.51 -3.18 -1.46 4.71 -0.04 -4.40 120.64 114.77 2kw5 n GLU 159 Ca 0.06 -0.40 -0.18 0.00 -0.01 0.00 0.00 57.16 56.62 2kw5 n GLU 159 Cb 0.40 -1.49 -0.03 0.00 -1.01 0.00 0.00 31.44 29.31 2kw5 n GLU 159 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 2kw5 n LEU 160 N -0.89 0.93 0.25 -4.62 4.77 -0.58 -4.82 117.00 112.05 2kw5 n LEU 160 Ca 0.07 -5.02 0.13 0.00 -0.03 0.00 0.00 56.01 51.16 2kw5 n LEU 160 Cb 0.38 0.68 0.61 0.00 -2.33 0.00 0.00 43.42 42.76 2kw5 n LEU 160 CO 0.35 2.29 0.91 1.55 -1.33 0.00 0.00 177.39 181.16 2kw5 h PRO 161 N 3.00 0.00 0.23 3.23 0.13 -1.68 -2.83 132.00 134.08 2kw5 h PRO 161 Ca 0.10 0.00 -0.34 0.00 -0.87 0.00 0.00 66.00 64.89 2kw5 h PRO 161 Cb 0.96 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.12 2kw5 h PRO 161 CO 0.51 0.12 -1.57 0.66 -0.23 0.00 0.00 178.00 177.49 2kw5 h SER 162 N 0.00 0.77 0.00 1.44 4.64 -1.94 -3.37 113.55 115.09 2kw5 h SER 162 Ca -0.00 -0.93 -0.61 0.00 -0.47 0.00 0.00 61.79 59.78 2kw5 h SER 162 Cb 0.57 -0.25 0.04 0.00 -0.31 0.00 0.00 62.40 62.45 2kw5 h SER 162 CO 0.02 1.74 2.36 -0.11 -0.87 0.00 0.00 176.83 179.97 2kw5 n LEU 163 N -3.69 4.26 -4.77 5.97 7.94 -1.07 -4.81 117.00 120.83 2kw5 n LEU 163 Ca -0.20 -2.91 -0.41 0.00 -1.11 0.00 0.00 56.01 51.39 2kw5 n LEU 163 Cb 1.09 -1.12 -0.01 0.00 0.53 0.00 0.00 43.42 43.91 2kw5 n LEU 163 CO 0.58 -0.19 1.02 0.21 -1.11 0.00 0.00 177.39 177.89 2kw5 s ASN 164 N 4.73 6.60 -0.15 1.96 2.47 -1.26 -4.88 114.94 124.40 2kw5 s ASN 164 Ca 0.54 2.78 -0.08 0.00 0.42 0.00 0.00 52.86 56.52 2kw5 s ASN 164 Cb 0.14 -2.65 -0.04 0.00 -1.45 0.00 0.00 41.25 37.24 2kw5 s ASN 164 CO 0.09 -0.66 0.12 0.26 -3.72 0.00 0.00 177.10 173.19 2kw5 s TRP 165 N -1.15 3.46 0.27 0.43 0.52 -1.26 -3.84 118.94 117.36 2kw5 s TRP 165 Ca 0.51 0.38 0.09 0.00 0.02 0.00 0.00 56.10 57.10 2kw5 s TRP 165 Cb -0.41 -2.02 0.34 0.00 -1.15 0.00 0.00 33.47 30.22 2kw5 s TRP 165 CO 0.55 0.50 1.61 -0.07 0.02 0.00 0.00 176.95 179.55 2kw5 h LEU 166 N 5.79 0.08 -7.80 2.99 3.38 -0.75 -3.43 115.31 115.57 2kw5 h LEU 166 Ca -0.48 -0.05 -0.50 0.00 0.09 0.00 0.00 57.88 56.95 2kw5 h LEU 166 Cb 1.19 -0.02 -0.35 0.00 0.09 0.00 0.00 40.66 41.57 2kw5 h LEU 166 CO 0.66 0.66 -0.80 -0.63 0.09 0.00 0.00 178.44 178.42 2kw5 s ILE 167 N -3.68 0.94 -0.47 1.22 1.01 -1.18 -4.98 121.20 114.06 2kw5 s ILE 167 Ca -0.02 -0.30 0.06 0.00 0.00 0.00 0.00 60.65 60.38 2kw5 s ILE 167 Cb 0.13 -0.92 0.18 0.00 0.01 0.00 0.00 42.46 41.85 2kw5 s ILE 167 CO 0.77 0.33 0.56 0.00 0.00 0.00 0.00 174.94 176.61 2kw5 n ALA 168 N 4.37 0.15 -2.65 9.38 0.00 -1.25 -1.94 120.51 128.58 2kw5 n ALA 168 Ca -0.18 -1.92 -0.20 0.00 0.00 0.00 0.00 53.44 51.14 2kw5 n ALA 168 Cb 0.51 -1.18 -0.14 0.00 0.00 0.00 0.00 19.45 18.64 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 0.52 1.41 -0.04 0.00 2.47 -1.16 -5.00 114.94 113.13 2kw5 s ASN 169 Ca 0.31 -0.31 -0.21 0.00 0.42 0.00 0.00 52.86 53.08 2kw5 s ASN 169 Cb 0.02 -0.12 -0.05 0.00 -1.45 0.00 0.00 41.25 39.65 2kw5 s ASN 169 CO -0.11 0.09 0.61 0.54 -3.72 0.00 0.00 177.10 174.50 2kw5 s ASN 170 N -0.63 6.93 -0.29 -4.21 4.22 -1.26 -1.59 114.94 118.11 2kw5 s ASN 170 Ca 0.03 1.11 -0.06 0.00 -2.14 0.00 0.00 52.86 51.80 2kw5 s ASN 170 Cb -0.06 -2.37 0.02 0.00 1.28 0.00 0.00 41.25 40.12 2kw5 s ASN 170 CO 0.00 0.01 0.05 -0.76 -2.04 0.00 0.00 177.10 174.36 2kw5 s LEU 171 N 0.28 3.76 -0.05 3.54 1.43 0.17 -4.95 118.68 122.86 2kw5 s LEU 171 Ca 0.32 -0.80 -0.30 0.00 -1.03 0.00 0.00 54.13 52.32 2kw5 s LEU 171 Cb -0.18 -1.83 -0.05 0.00 0.03 0.00 0.00 46.19 44.16 2kw5 s LEU 171 CO 0.16 -0.19 1.58 -1.61 0.23 0.00 0.00 176.35 176.52 2kw5 s GLU 172 N 1.45 4.20 -0.23 1.70 2.02 -1.26 -0.74 118.70 125.84 2kw5 s GLU 172 Ca 0.01 2.12 -0.20 0.00 0.02 0.00 0.00 54.97 56.92 2kw5 s GLU 172 Cb -0.17 -3.88 -0.02 0.00 0.10 0.00 0.00 34.13 30.15 2kw5 s GLU 172 CO 0.01 -0.79 0.60 0.50 0.02 0.00 0.00 175.26 175.60 2kw5 s ARG 173 N 3.66 4.14 -0.64 1.61 3.52 -0.45 -4.95 118.95 125.84 2kw5 s ARG 173 Ca 0.70 0.52 -0.21 0.00 -0.13 0.00 0.00 55.73 56.60 2kw5 s ARG 173 Cb -0.32 -3.62 0.08 0.00 -1.56 0.00 0.00 34.95 29.53 2kw5 s ARG 173 CO 0.28 -0.32 0.88 -0.80 -0.81 0.00 0.00 175.30 174.53 2kw5 s ASN 174 N 1.36 6.18 0.11 -2.12 0.01 -1.26 -1.19 114.94 118.03 2kw5 s ASN 174 Ca 0.26 -1.15 -0.20 0.00 -0.71 0.00 0.00 52.86 51.06 2kw5 s ASN 174 Cb -0.16 -2.38 -0.07 0.00 0.41 0.00 0.00 41.25 39.05 2kw5 s ASN 174 CO 0.09 -1.33 0.61 -0.76 -1.51 0.00 0.00 177.10 174.21 2kw5 s LEU 175 N 3.59 4.49 -0.08 0.60 1.43 -1.20 -5.00 118.68 122.51 2kw5 s LEU 175 Ca 0.19 1.31 -0.30 0.00 -1.03 0.00 0.00 54.13 54.30 2kw5 s LEU 175 Cb -0.19 -3.08 -0.03 0.00 0.03 0.00 0.00 46.19 42.91 2kw5 s LEU 175 CO 0.09 0.22 1.32 -1.81 0.23 0.00 0.00 176.35 176.39 2kw5 s ASP 176 N -1.26 6.92 0.36 2.29 1.11 -1.26 -4.53 116.67 120.30 2kw5 s ASP 176 Ca 0.33 1.88 -0.28 0.00 0.18 0.00 0.00 52.55 54.66 2kw5 s ASP 176 Cb -0.19 -2.55 -0.11 0.00 1.07 0.00 0.00 42.92 41.14 2kw5 s ASP 176 CO 0.20 -0.72 1.46 -1.83 1.18 0.00 0.00 175.17 175.47 2kw5 s GLU 177 N 2.94 4.15 0.00 8.23 1.03 -1.26 -4.69 118.70 129.10 2kw5 s GLU 177 Ca 0.59 2.51 0.00 0.00 0.03 0.00 0.00 54.97 58.10 2kw5 s GLU 177 Cb -0.26 -2.99 0.00 0.00 -0.80 0.00 0.00 34.13 30.08 2kw5 s GLU 177 CO 0.21 -0.48 0.00 0.41 -1.33 0.00 0.00 175.26 174.07 2kw5 n GLY 178 N 0.65 -0.38 0.21 -3.83 0.00 -1.26 -4.94 105.19 95.64 2kw5 n GLY 178 Ca 0.01 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.85 2kw5 n GLY 178 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kw5 h ALA 179 N 0.00 0.23 -1.92 4.61 0.00 -1.88 -3.47 119.26 116.83 2kw5 h ALA 179 Ca 0.00 -0.66 -0.50 0.00 0.00 0.00 0.00 54.91 53.75 2kw5 h ALA 179 Cb 0.00 0.02 -0.14 0.00 0.00 0.00 0.00 17.79 17.68 2kw5 h ALA 179 CO 0.00 0.69 -0.60 0.71 0.00 0.00 0.00 179.25 180.06 2kw5 s TYR 180 N -3.51 2.02 0.42 0.00 2.02 -1.26 -5.03 117.35 112.02 2kw5 s TYR 180 Ca -0.10 -0.95 0.14 0.00 -0.37 0.00 0.00 57.07 55.79 2kw5 s TYR 180 Cb 0.08 -1.34 0.92 0.00 -0.40 0.00 0.00 41.96 41.21 2kw5 s TYR 180 CO 0.91 0.04 1.94 1.12 -1.57 0.00 0.00 175.55 178.00 2kw5 h HIS 181 N 2.03 0.01 -0.78 2.71 2.07 -1.96 -3.44 115.15 115.80 2kw5 h HIS 181 Ca -0.41 -0.00 -0.53 0.00 -2.85 0.00 0.00 60.37 56.58 2kw5 h HIS 181 Cb 1.25 -0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.22 2kw5 h HIS 181 CO 0.68 0.24 -0.21 1.14 -3.07 0.00 0.00 177.93 176.72 2kw5 s GLN 182 N -4.53 2.32 0.00 5.12 -2.07 -1.26 -4.85 119.66 114.39 2kw5 s GLN 182 Ca -0.04 -1.77 0.00 0.00 -1.82 0.00 0.00 55.36 51.73 2kw5 s GLN 182 Cb 0.15 -2.41 0.00 0.00 -1.09 0.00 0.00 33.01 29.67 2kw5 s GLN 182 CO 0.71 -0.69 0.00 0.41 -1.32 0.00 0.00 175.29 174.40 2kw5 n GLY 183 N -1.98 1.49 3.80 2.60 0.00 -1.26 -4.57 105.19 105.27 2kw5 n GLY 183 Ca 0.07 0.45 -0.09 0.00 0.00 0.00 0.00 46.02 46.46 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 0.00 2.22 0.31 1.61 -2.85 -1.26 -3.23 119.74 116.54 2kw5 s LYS 184 Ca 0.00 -1.43 -0.14 0.00 -1.00 0.00 0.00 55.97 53.39 2kw5 s LYS 184 Cb 0.00 0.62 0.02 0.00 -2.06 0.00 0.00 37.83 36.41 2kw5 s LYS 184 CO 0.00 -1.03 0.63 0.00 0.10 0.00 0.00 175.35 175.05 2kw5 s ALA 185 N -2.38 -0.48 -0.16 0.59 0.00 -0.33 -4.83 121.76 114.16 2kw5 s ALA 185 Ca 0.16 -0.80 -0.01 0.00 0.00 0.00 0.00 51.96 51.31 2kw5 s ALA 185 Cb -0.05 0.91 0.04 0.00 0.00 0.00 0.00 23.12 24.03 2kw5 s ALA 185 CO 0.12 -0.93 -0.04 0.00 0.00 0.00 0.00 175.76 174.91 2kw5 s ALA 186 N -3.35 1.37 0.21 0.00 0.00 -1.26 -1.34 121.76 117.39 2kw5 s ALA 186 Ca 0.19 -0.77 0.06 0.00 0.00 0.00 0.00 51.96 51.43 2kw5 s ALA 186 Cb -0.03 -1.11 -0.04 0.00 0.00 0.00 0.00 23.12 21.94 2kw5 s ALA 186 CO 0.11 -0.82 0.21 -0.51 0.00 0.00 0.00 175.76 174.75 2kw5 s LEU 187 N 1.68 3.95 -0.11 0.00 1.43 0.08 -3.31 118.68 122.40 2kw5 s LEU 187 Ca 0.01 -0.12 -0.05 0.00 -1.03 0.00 0.00 54.13 52.94 2kw5 s LEU 187 Cb -0.15 -2.50 0.05 0.00 0.03 0.00 0.00 46.19 43.62 2kw5 s LEU 187 CO -0.07 -0.00 0.24 0.27 0.23 0.00 0.00 176.35 177.02 2kw5 s ILE 188 N -1.96 -0.23 0.10 -0.59 -4.36 -1.26 -0.66 121.20 112.24 2kw5 s ILE 188 Ca 0.33 0.23 -0.10 0.00 -0.26 0.00 0.00 60.65 60.84 2kw5 s ILE 188 Cb -0.09 -0.40 -0.06 0.00 1.25 0.00 0.00 42.46 43.16 2kw5 s ILE 188 CO 0.25 0.09 0.44 -1.10 0.24 0.00 0.00 174.94 174.87 2kw5 s GLN 189 N 1.87 3.80 0.02 0.37 -0.21 -0.62 -3.59 119.66 121.29 2kw5 s GLN 189 Ca -0.04 0.23 0.03 0.00 0.02 0.00 0.00 55.36 55.60 2kw5 s GLN 189 Cb -0.11 -2.96 -0.01 0.00 1.00 0.00 0.00 33.01 30.92 2kw5 s GLN 189 CO -0.08 0.53 -0.09 -0.51 -2.12 0.00 0.00 175.29 173.02 2kw5 s LEU 190 N -2.00 2.11 -0.21 2.90 1.43 -0.14 -3.01 118.68 119.77 2kw5 s LEU 190 Ca 0.35 -0.31 -0.04 0.00 -1.03 0.00 0.00 54.13 53.10 2kw5 s LEU 190 Cb -0.14 -0.36 0.09 0.00 0.03 0.00 0.00 46.19 45.81 2kw5 s LEU 190 CO 0.19 -0.00 0.17 -0.22 0.23 0.00 0.00 176.35 176.72 2kw5 s LEU 191 N -0.75 0.11 0.12 1.79 2.96 -0.82 -3.04 118.68 119.05 2kw5 s LEU 191 Ca -0.01 -0.51 -0.10 0.00 -0.22 0.00 0.00 54.13 53.29 2kw5 s LEU 191 Cb -0.06 0.10 -0.06 0.00 0.50 0.00 0.00 46.19 46.67 2kw5 s LEU 191 CO 0.00 -0.35 0.45 -0.83 -1.32 0.00 0.00 176.35 174.30 2kw5 s GLY 192 N 2.24 2.34 0.05 7.98 0.00 -0.59 0.02 107.32 119.36 2kw5 s GLY 192 Ca 0.06 -0.33 -0.10 0.00 0.00 0.00 0.00 44.72 44.35 2kw5 s GLY 192 CO -0.15 -0.13 0.21 1.62 0.00 0.00 0.00 173.10 174.65 2kw5 s GLN 193 N -2.15 0.74 0.04 2.90 2.00 -1.25 -3.08 119.66 118.86 2kw5 s GLN 193 Ca 0.37 -0.68 -0.30 0.00 -2.00 0.00 0.00 55.36 52.75 2kw5 s GLN 193 Cb -0.13 0.31 -0.09 0.00 0.80 0.00 0.00 33.01 33.90 2kw5 s GLN 193 CO 0.20 -0.22 1.87 -1.59 -0.50 0.00 0.00 175.29 175.04 2kw5 s LYS 194 N -2.82 4.15 -0.61 1.67 -2.85 -1.26 -4.61 119.74 113.41 2kw5 s LYS 194 Ca -0.03 2.53 -0.26 0.00 -1.00 0.00 0.00 55.97 57.20 2kw5 s LYS 194 Cb 0.00 -3.98 -0.06 0.00 -2.06 0.00 0.00 37.83 31.73 2kw5 s LYS 194 CO -0.05 -0.90 2.19 -0.51 0.10 0.00 0.00 175.35 176.17 2kw5 s LEU 195 N 3.91 3.27 -0.68 2.77 1.43 -1.26 -3.91 118.68 124.21 2kw5 s LEU 195 Ca 0.84 0.53 -0.09 0.00 -1.03 0.00 0.00 54.13 54.38 2kw5 s LEU 195 Cb -0.42 -2.52 0.09 0.00 0.03 0.00 0.00 46.19 43.37 2kw5 s LEU 195 CO 0.38 -2.84 0.21 -0.62 0.23 0.00 0.00 176.35 173.71 2kw5 n GLU 196 N 9.03 -1.12 -1.82 1.70 -0.58 -1.26 -4.83 120.64 121.77 2kw5 n GLU 196 Ca 0.33 0.05 -0.42 0.00 -0.42 0.00 0.00 57.16 56.70 2kw5 n GLU 196 Cb 0.52 -2.18 -0.03 0.00 -0.57 0.00 0.00 31.44 29.18 2kw5 n GLU 196 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 2kw5 s HIS 197 N -1.79 1.48 -1.00 -0.32 5.65 -1.25 -4.63 115.29 113.43 2kw5 s HIS 197 Ca 0.30 0.74 -0.31 0.00 0.25 0.00 0.00 55.06 56.04 2kw5 s HIS 197 Cb -0.18 -3.99 -0.22 0.00 -1.18 0.00 0.00 32.58 27.02 2kw5 s HIS 197 CO 0.37 -3.20 2.70 0.72 -0.65 0.00 0.00 174.74 174.68 2kw5 n HIS 198 N 11.76 0.56 -4.31 3.88 -0.00 -1.26 -4.90 115.22 120.94 2kw5 n HIS 198 Ca 0.27 0.38 -0.22 0.00 -0.00 0.00 0.00 57.72 58.15 2kw5 n HIS 198 Cb 0.48 -2.38 -0.11 0.00 -0.00 0.00 0.00 29.99 27.97 2kw5 n HIS 198 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.34 172.96 2kw5 s HIS 199 N 9.01 1.76 -0.02 4.41 -3.43 -1.26 -5.11 115.29 120.64 2kw5 s HIS 199 Ca 1.36 -0.47 -0.38 0.00 -0.80 0.00 0.00 55.06 54.77 2kw5 s HIS 199 Cb -1.26 -0.89 -0.16 0.00 -1.43 0.00 0.00 32.58 28.84 2kw5 s HIS 199 CO 0.49 0.29 1.49 -2.39 -2.00 0.00 0.00 174.74 172.62 2kw5 n HIS 200 N 0.43 1.73 -0.22 0.38 -0.00 -1.26 -4.86 115.22 111.42 2kw5 n HIS 200 Ca -0.14 0.57 0.27 0.00 -0.00 0.00 0.00 57.72 58.42 2kw5 n HIS 200 Cb 0.57 -2.39 0.67 0.00 -0.00 0.00 0.00 29.99 28.84 2kw5 n HIS 200 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.34 177.59 2kw5 h HIS 201 N 5.55 0.14 0.00 -1.40 2.76 -1.99 -3.51 115.15 116.70 2kw5 h HIS 201 Ca -0.47 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.70 2kw5 h HIS 201 Cb 1.32 -0.04 0.00 0.00 1.55 0.00 0.00 27.41 30.24 2kw5 h HIS 201 CO 0.66 0.03 0.00 -2.39 -1.30 0.00 0.00 177.93 174.93