#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mw9 n ASP 2 N 0.00 0.00 0.00 0.00 4.64 -1.26 -5.12 116.55 114.81 3mw9 n ASP 2 Ca 0.00 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.41 3mw9 n ASP 2 Cb 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.08 3mw9 n ASP 2 CO 0.00 0.00 0.00 -2.11 -0.82 0.00 0.00 177.20 174.27 3mw9 n ARG 3 N 0.00 0.00 0.10 -0.67 1.85 -1.26 -4.91 116.66 111.77 3mw9 n ARG 3 Ca 0.00 0.00 0.08 0.00 -1.00 0.00 0.00 57.85 56.93 3mw9 n ARG 3 Cb 0.00 0.00 0.39 0.00 -1.05 0.00 0.00 32.46 31.80 3mw9 n ARG 3 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 3mw9 n GLU 4 N 0.00 0.10 -2.80 2.89 -0.58 -1.26 -4.10 120.64 114.88 3mw9 n GLU 4 Ca 0.00 0.55 -0.03 0.00 -0.42 0.00 0.00 57.16 57.26 3mw9 n GLU 4 Cb 0.00 -1.79 0.01 0.00 -0.57 0.00 0.00 31.44 29.09 3mw9 n GLU 4 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 3mw9 s ASP 5 N -3.69 -1.37 -0.40 1.62 2.15 -1.26 -4.94 116.67 108.78 3mw9 s ASP 5 Ca -0.00 -1.52 0.10 0.00 0.43 0.00 0.00 52.55 51.56 3mw9 s ASP 5 Cb 0.05 1.79 0.32 0.00 -0.30 0.00 0.00 42.92 44.78 3mw9 s ASP 5 CO 0.17 -0.06 0.70 -0.67 -0.17 0.00 0.00 175.17 175.13 3mw9 n ASP 6 N 3.08 1.02 -4.73 -0.34 2.03 -1.26 -4.58 116.55 111.77 3mw9 n ASP 6 Ca 0.17 -3.00 -0.31 0.00 0.52 0.00 0.00 54.79 52.17 3mw9 n ASP 6 Cb 0.57 -0.62 0.12 0.00 -0.72 0.00 0.00 41.12 40.47 3mw9 n ASP 6 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 3mw9 s PRO 7 N -2.21 1.77 -0.14 -0.67 0.04 -1.26 -4.91 135.00 127.63 3mw9 s PRO 7 Ca 0.39 1.23 -0.29 0.00 0.04 0.00 0.00 61.00 62.38 3mw9 s PRO 7 Cb 0.30 -1.84 -0.05 0.00 0.04 0.00 0.00 34.50 32.95 3mw9 s PRO 7 CO -0.09 -2.01 1.83 1.21 0.04 0.00 0.00 177.00 177.98 3mw9 s ASN 8 N -3.19 6.24 0.16 6.66 3.84 -1.26 -4.89 114.94 122.51 3mw9 s ASN 8 Ca 0.63 2.01 -0.19 0.00 0.21 0.00 0.00 52.86 55.52 3mw9 s ASN 8 Cb -0.19 -2.53 0.08 0.00 -0.55 0.00 0.00 41.25 38.06 3mw9 s ASN 8 CO 0.57 -1.31 1.65 0.15 -2.79 0.00 0.00 177.10 175.37 3mw9 h PHE 9 N 11.42 -0.40 -0.78 0.43 -0.00 -1.90 0.14 116.94 125.85 3mw9 h PHE 9 Ca -0.40 0.04 0.09 0.00 -0.00 0.00 0.00 57.97 57.71 3mw9 h PHE 9 Cb 1.19 0.23 -0.07 0.00 -0.00 0.00 0.00 35.95 37.30 3mw9 h PHE 9 CO 0.92 -0.24 0.43 0.35 -0.00 0.00 0.00 178.31 179.77 3mw9 h PHE 10 N -0.11 0.77 0.00 0.41 3.04 -1.91 -2.14 116.94 117.00 3mw9 h PHE 10 Ca 0.18 0.03 -0.06 0.00 3.98 0.00 0.00 57.97 62.10 3mw9 h PHE 10 Cb 0.37 -0.23 -0.01 0.00 2.56 0.00 0.00 35.95 38.65 3mw9 h PHE 10 CO -0.38 0.30 -0.27 0.87 -2.02 0.00 0.00 178.31 176.81 3mw9 h LYS 11 N 0.72 0.00 -0.24 1.11 1.57 -1.22 -2.56 116.57 115.95 3mw9 h LYS 11 Ca 0.38 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.14 3mw9 h LYS 11 Cb 0.37 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 3mw9 h LYS 11 CO -0.26 0.27 0.05 1.98 -0.57 0.00 0.00 179.45 180.93 3mw9 h MET 12 N 0.00 0.38 -0.68 3.15 1.85 -0.27 -2.31 114.93 117.05 3mw9 h MET 12 Ca -0.00 -0.09 -0.04 0.00 -0.61 0.00 0.00 59.70 58.96 3mw9 h MET 12 Cb 0.98 -0.05 -0.03 0.00 0.43 0.00 0.00 31.60 32.93 3mw9 h MET 12 CO 0.03 0.50 0.27 0.28 -0.40 0.00 0.00 176.91 177.60 3mw9 h VAL 13 N 0.21 1.23 0.00 -5.77 2.07 -1.29 -1.10 116.25 111.60 3mw9 h VAL 13 Ca 0.07 -0.72 -0.03 0.00 0.82 0.00 0.00 66.70 66.84 3mw9 h VAL 13 Cb 0.29 0.42 -0.00 0.00 -1.52 0.00 0.00 31.29 30.47 3mw9 h VAL 13 CO 0.00 0.29 -0.15 -0.33 0.02 0.00 0.00 177.57 177.40 3mw9 h GLU 14 N 0.97 0.00 0.09 1.57 5.08 -1.32 -2.45 114.58 118.53 3mw9 h GLU 14 Ca 0.23 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.58 3mw9 h GLU 14 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 3mw9 h GLU 14 CO -0.02 0.15 -0.05 0.78 -1.00 0.00 0.00 179.01 178.87 3mw9 h GLY 15 N 1.00 -0.13 -0.41 -3.84 0.00 -0.64 -0.29 103.07 98.76 3mw9 h GLY 15 Ca -0.00 0.05 0.22 0.00 0.00 0.00 0.00 47.33 47.60 3mw9 h GLY 15 CO 0.02 -0.05 0.20 0.74 0.00 0.00 0.00 176.54 177.45 3mw9 h PHE 16 N -0.63 0.29 -0.29 5.60 0.05 -1.30 0.81 116.94 121.48 3mw9 h PHE 16 Ca -0.01 0.05 -0.15 0.00 3.82 0.00 0.00 57.97 61.68 3mw9 h PHE 16 Cb 0.51 0.01 -0.01 0.00 2.00 0.00 0.00 35.95 38.46 3mw9 h PHE 16 CO 0.08 -0.20 -0.43 0.35 -0.18 0.00 0.00 178.31 177.93 3mw9 h PHE 17 N 0.20 0.87 -0.45 -0.55 3.57 -1.32 -1.70 116.94 117.55 3mw9 h PHE 17 Ca 0.52 -0.27 -0.09 0.00 3.53 0.00 0.00 57.97 61.66 3mw9 h PHE 17 Cb 1.03 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.57 3mw9 h PHE 17 CO -0.29 1.02 -0.10 -0.44 -2.23 0.00 0.00 178.31 176.27 3mw9 h ASP 18 N 0.58 0.80 0.72 0.41 3.32 0.25 0.51 116.42 123.00 3mw9 h ASP 18 Ca 0.04 -0.24 -0.03 0.00 0.02 0.00 0.00 57.03 56.82 3mw9 h ASP 18 Cb 0.98 -0.21 0.01 0.00 0.22 0.00 0.00 39.33 40.32 3mw9 h ASP 18 CO 0.09 0.92 -0.35 -0.09 -1.72 0.00 0.00 179.24 178.09 3mw9 h ARG 19 N 0.73 -0.94 -0.66 3.56 9.65 -0.55 -1.50 114.38 124.68 3mw9 h ARG 19 Ca 0.12 0.06 0.10 0.00 -1.10 0.00 0.00 59.98 59.17 3mw9 h ARG 19 Cb 0.59 0.21 -0.08 0.00 -1.39 0.00 0.00 29.97 29.31 3mw9 h ARG 19 CO 0.04 -0.63 0.27 0.78 2.80 0.00 0.00 179.97 183.23 3mw9 h GLY 20 N -0.97 0.95 0.67 2.80 0.00 -1.17 -2.71 103.07 102.64 3mw9 h GLY 20 Ca -0.10 -0.14 0.07 0.00 0.00 0.00 0.00 47.33 47.15 3mw9 h GLY 20 CO 0.16 -0.02 0.46 0.00 0.00 0.00 0.00 176.54 177.13 3mw9 h ALA 21 N 1.45 1.06 -0.48 3.60 0.00 0.46 -2.54 119.26 122.81 3mw9 h ALA 21 Ca 0.34 0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.12 3mw9 h ALA 21 Cb 0.43 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3mw9 h ALA 21 CO -0.32 0.16 -0.22 0.66 0.00 0.00 0.00 179.25 179.53 3mw9 h SER 22 N 0.83 1.01 -0.29 0.00 4.64 -0.97 -1.22 113.55 117.54 3mw9 h SER 22 Ca 0.35 -0.38 0.07 0.00 -0.47 0.00 0.00 61.79 61.35 3mw9 h SER 22 Cb 0.21 -0.28 -0.08 0.00 -0.31 0.00 0.00 62.40 61.94 3mw9 h SER 22 CO -0.19 1.18 -0.28 0.40 -0.87 0.00 0.00 176.83 177.07 3mw9 h ILE 23 N 0.84 0.32 0.00 0.95 1.08 -1.30 -3.20 117.51 116.19 3mw9 h ILE 23 Ca 0.11 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.58 3mw9 h ILE 23 Cb 0.79 0.32 0.00 0.00 -3.07 0.00 0.00 36.82 34.86 3mw9 h ILE 23 CO 0.07 0.00 -0.57 -0.37 -0.69 0.00 0.00 178.15 176.59 3mw9 h VAL 24 N -0.26 0.00 -1.03 1.67 -1.51 -1.38 -3.39 116.25 110.35 3mw9 h VAL 24 Ca 0.15 -0.54 0.36 0.00 -1.23 0.00 0.00 66.70 65.44 3mw9 h VAL 24 Cb 0.50 1.17 -0.16 0.00 -2.13 0.00 0.00 31.29 30.67 3mw9 h VAL 24 CO -0.44 0.00 0.59 -0.08 -1.23 0.00 0.00 177.57 176.40 3mw9 h GLU 25 N 0.00 0.21 -0.44 5.19 4.81 -1.22 0.37 114.58 123.49 3mw9 h GLU 25 Ca 0.00 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.16 3mw9 h GLU 25 Cb 0.77 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.08 3mw9 h GLU 25 CO 0.00 0.14 0.05 -0.44 -0.73 0.00 0.00 179.01 178.03 3mw9 h ASP 26 N 0.21 0.72 -0.47 1.04 3.45 -1.81 -2.65 116.42 116.92 3mw9 h ASP 26 Ca 0.77 -0.27 -0.06 0.00 0.43 0.00 0.00 57.03 57.89 3mw9 h ASP 26 Cb 1.91 -0.19 -0.02 0.00 -0.56 0.00 0.00 39.33 40.46 3mw9 h ASP 26 CO -0.63 0.81 0.07 0.50 -1.57 0.00 0.00 179.24 178.42 3mw9 h LYS 27 N 0.60 0.85 0.16 3.56 3.64 -0.57 0.33 116.57 125.13 3mw9 h LYS 27 Ca 0.13 -0.20 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 3mw9 h LYS 27 Cb 0.41 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 3mw9 h LYS 27 CO 0.01 0.80 -0.08 -0.07 -2.27 0.00 0.00 179.45 177.85 3mw9 h LEU 28 N 0.80 -0.18 -1.09 5.20 3.38 -1.38 -1.21 115.31 120.83 3mw9 h LEU 28 Ca 0.17 -0.22 0.10 0.00 0.09 0.00 0.00 57.88 58.02 3mw9 h LEU 28 Cb 0.38 0.05 -0.07 0.00 0.09 0.00 0.00 40.66 41.11 3mw9 h LEU 28 CO 0.01 0.12 0.61 0.58 0.09 0.00 0.00 178.44 179.86 3mw9 h VAL 29 N -0.49 0.98 0.00 1.22 2.07 -1.32 -2.39 116.25 116.32 3mw9 h VAL 29 Ca -0.02 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.16 3mw9 h VAL 29 Cb 0.38 -0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.05 3mw9 h VAL 29 CO 0.04 0.18 0.00 1.21 0.02 0.00 0.00 177.57 179.02 3mw9 n GLU 30 N -4.55 0.00 0.00 1.57 4.07 0.11 -3.20 120.64 118.64 3mw9 n GLU 30 Ca 0.17 0.23 0.05 0.00 -0.06 0.00 0.00 57.16 57.55 3mw9 n GLU 30 Cb 0.29 -1.02 0.31 0.00 -0.06 0.00 0.00 31.44 30.96 3mw9 n GLU 30 CO 0.00 0.00 0.00 -0.40 -0.06 0.00 0.00 177.13 176.67 3mw9 n ASP 31 N -0.78 0.00 -4.51 4.31 3.85 -0.49 -4.51 116.55 114.42 3mw9 n ASP 31 Ca 0.00 -0.19 -0.42 0.00 -0.71 0.00 0.00 54.79 53.47 3mw9 n ASP 31 Cb 0.00 -0.09 -0.03 0.00 -1.35 0.00 0.00 41.12 39.64 3mw9 n ASP 31 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.20 175.97 3mw9 s LEU 32 N -2.19 3.71 -0.33 -2.12 2.96 -0.90 -5.00 118.68 114.81 3mw9 s LEU 32 Ca 0.14 -0.62 -0.22 0.00 -0.22 0.00 0.00 54.13 53.22 3mw9 s LEU 32 Cb 0.07 -2.55 -0.00 0.00 0.50 0.00 0.00 46.19 44.21 3mw9 s LEU 32 CO 0.14 -1.63 0.69 -0.54 -1.32 0.00 0.00 176.35 173.69 3mw9 s LYS 33 N 4.94 3.83 -0.04 1.98 -0.14 -1.26 -4.96 119.74 124.10 3mw9 s LYS 33 Ca 0.30 0.30 -0.03 0.00 -1.36 0.00 0.00 55.97 55.18 3mw9 s LYS 33 Cb -0.12 -3.76 0.01 0.00 -1.68 0.00 0.00 37.83 32.28 3mw9 s LYS 33 CO 0.14 -0.69 0.09 0.99 -0.76 0.00 0.00 175.35 175.13 3mw9 s THR 34 N 2.80 -0.00 0.03 2.17 2.01 -1.26 -5.07 115.64 116.32 3mw9 s THR 34 Ca 0.28 0.02 -0.14 0.00 0.31 0.00 0.00 61.69 62.16 3mw9 s THR 34 Cb -0.14 -0.14 -0.07 0.00 0.01 0.00 0.00 72.50 72.16 3mw9 s THR 34 CO 0.14 0.01 1.21 -0.09 -0.69 0.00 0.00 174.62 175.19 3mw9 h ARG 35 N 6.10 -0.39 -1.44 4.92 9.65 -2.06 -2.45 114.38 128.71 3mw9 h ARG 35 Ca -0.26 0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.65 3mw9 h ARG 35 Cb 1.20 0.09 0.00 0.00 -1.39 0.00 0.00 29.97 29.87 3mw9 h ARG 35 CO 0.45 -0.26 0.00 0.39 2.80 0.00 0.00 179.97 183.35 3mw9 n GLU 36 N -3.47 0.46 -0.90 0.20 -0.58 -1.26 -4.86 120.64 110.24 3mw9 n GLU 36 Ca -0.05 0.00 -0.36 0.00 -0.42 0.00 0.00 57.16 56.33 3mw9 n GLU 36 Cb 0.18 -1.26 0.08 0.00 -0.57 0.00 0.00 31.44 29.86 3mw9 n GLU 36 CO 0.00 0.00 0.00 -2.37 -0.48 0.00 0.00 177.13 174.28 3mw9 n THR 37 N 0.72 0.00 0.00 2.62 5.66 -0.92 -4.65 114.28 117.71 3mw9 n THR 37 Ca 0.00 -0.23 0.00 0.00 -3.05 0.00 0.00 64.05 60.77 3mw9 n THR 37 Cb 0.22 -0.22 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 3mw9 n THR 37 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 175.07 173.23 3mw9 n GLU 38 N 0.88 0.00 -0.17 1.09 2.13 -1.26 -4.81 120.64 118.49 3mw9 n GLU 38 Ca -0.00 0.00 0.06 0.00 0.66 0.00 0.00 57.16 57.87 3mw9 n GLU 38 Cb 0.64 0.00 0.13 0.00 0.27 0.00 0.00 31.44 32.48 3mw9 n GLU 38 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 3mw9 n GLU 39 N 0.00 2.63 0.22 5.31 -0.58 -1.26 -3.97 120.64 122.99 3mw9 n GLU 39 Ca 0.00 -2.18 0.11 0.00 -0.42 0.00 0.00 57.16 54.67 3mw9 n GLU 39 Cb 0.00 -1.37 0.40 0.00 -0.57 0.00 0.00 31.44 29.90 3mw9 n GLU 39 CO 0.00 0.00 0.00 0.37 -0.48 0.00 0.00 177.13 177.02 3mw9 h GLN 40 N 1.05 0.00 -0.10 3.49 5.75 -1.87 -2.99 115.11 120.45 3mw9 h GLN 40 Ca 0.00 0.00 0.04 0.00 -0.15 0.00 0.00 58.65 58.54 3mw9 h GLN 40 Cb 0.88 0.00 -0.05 0.00 1.07 0.00 0.00 27.48 29.38 3mw9 h GLN 40 CO 0.05 0.18 -0.23 0.87 -2.65 0.00 0.00 178.83 177.05 3mw9 h LYS 41 N 0.00 -0.29 -0.90 1.69 1.57 -1.83 0.15 116.57 116.95 3mw9 h LYS 41 Ca -0.00 0.02 0.17 0.00 -1.87 0.00 0.00 60.65 58.96 3mw9 h LYS 41 Cb 0.83 0.07 -0.10 0.00 0.08 0.00 0.00 32.23 33.11 3mw9 h LYS 41 CO 0.02 -0.20 0.49 0.00 -0.57 0.00 0.00 179.45 179.19 3mw9 h ARG 42 N -0.31 0.63 -0.00 3.15 2.47 -1.76 -0.66 114.38 117.90 3mw9 h ARG 42 Ca 0.09 -0.04 -0.16 0.00 -1.26 0.00 0.00 59.98 58.61 3mw9 h ARG 42 Cb 0.44 -0.14 -0.02 0.00 -1.65 0.00 0.00 29.97 28.59 3mw9 h ARG 42 CO -0.27 0.42 -0.78 -0.91 0.56 0.00 0.00 179.97 178.99 3mw9 h ASN 43 N 0.65 0.02 -0.22 7.04 2.35 -1.33 -2.13 115.58 121.96 3mw9 h ASN 43 Ca 0.51 -0.01 -0.16 0.00 -0.55 0.00 0.00 56.30 56.08 3mw9 h ASN 43 Cb 0.76 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 39.12 3mw9 h ASN 43 CO -0.38 0.79 -0.49 -0.09 -1.65 0.00 0.00 177.43 175.60 3mw9 h ARG 44 N 0.01 0.72 -0.53 0.81 2.43 0.01 -2.06 114.38 115.78 3mw9 h ARG 44 Ca -0.01 -0.48 -0.03 0.00 -0.81 0.00 0.00 59.98 58.64 3mw9 h ARG 44 Cb 1.37 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.96 3mw9 h ARG 44 CO 0.10 1.11 0.20 0.28 -1.51 0.00 0.00 179.97 180.15 3mw9 h VAL 45 N 0.44 1.22 -0.24 0.20 2.07 -1.11 -1.83 116.25 117.01 3mw9 h VAL 45 Ca 0.00 -0.70 -0.11 0.00 0.82 0.00 0.00 66.70 66.71 3mw9 h VAL 45 Cb 1.11 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 31.56 3mw9 h VAL 45 CO 0.11 0.26 -0.30 0.03 0.02 0.00 0.00 177.57 177.69 3mw9 h ARG 46 N 0.71 0.48 0.34 1.57 3.08 -1.42 -1.95 114.38 117.19 3mw9 h ARG 46 Ca 0.17 -0.20 -0.02 0.00 0.07 0.00 0.00 59.98 60.01 3mw9 h ARG 46 Cb 0.22 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.25 3mw9 h ARG 46 CO -0.01 0.73 -0.16 0.77 -1.07 0.00 0.00 179.97 180.23 3mw9 h SER 47 N 0.42 -0.38 -0.32 7.04 0.02 -1.12 -0.60 113.55 118.60 3mw9 h SER 47 Ca 0.05 -0.05 0.05 0.00 -0.84 0.00 0.00 61.79 61.00 3mw9 h SER 47 Cb 0.74 0.10 -0.04 0.00 0.14 0.00 0.00 62.40 63.33 3mw9 h SER 47 CO 0.06 -0.19 0.05 0.40 -1.14 0.00 0.00 176.83 176.00 3mw9 h ILE 48 N -0.55 0.83 -0.70 3.27 2.04 -1.27 0.67 117.51 121.79 3mw9 h ILE 48 Ca -0.05 -0.05 0.05 0.00 1.00 0.00 0.00 64.86 65.81 3mw9 h ILE 48 Cb 0.41 0.66 -0.04 0.00 -0.74 0.00 0.00 36.82 37.10 3mw9 h ILE 48 CO 0.08 0.03 0.46 -0.07 0.00 0.00 0.00 178.15 178.65 3mw9 h LEU 49 N 0.16 0.67 -1.19 1.44 3.38 -1.28 0.17 115.31 118.66 3mw9 h LEU 49 Ca 0.15 -0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.04 3mw9 h LEU 49 Cb 0.17 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 3mw9 h LEU 49 CO -0.21 0.45 -0.38 -0.09 0.09 0.00 0.00 178.44 178.30 3mw9 h ARG 50 N 0.77 0.00 -0.00 1.13 2.43 0.27 -2.71 114.38 116.27 3mw9 h ARG 50 Ca 0.30 0.00 -0.18 0.00 -0.81 0.00 0.00 59.98 59.29 3mw9 h ARG 50 Cb 0.19 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.72 3mw9 h ARG 50 CO -0.09 0.38 -0.83 0.82 -1.51 0.00 0.00 179.97 178.74 3mw9 h ILE 51 N 0.00 1.53 -0.27 1.20 2.04 0.15 -3.31 117.51 118.85 3mw9 h ILE 51 Ca -0.00 -2.66 -0.12 0.00 1.00 0.00 0.00 64.86 63.08 3mw9 h ILE 51 Cb 0.74 2.46 -0.01 0.00 -0.74 0.00 0.00 36.82 39.26 3mw9 h ILE 51 CO 0.05 0.77 -0.32 0.40 0.00 0.00 0.00 178.15 179.04 3mw9 h ILE 52 N 0.05 1.28 -0.04 -0.67 2.04 -0.76 -3.36 117.51 116.07 3mw9 h ILE 52 Ca -0.02 -1.43 -0.00 0.00 1.00 0.00 0.00 64.86 64.40 3mw9 h ILE 52 Cb 1.44 1.43 -0.00 0.00 -0.74 0.00 0.00 36.82 38.95 3mw9 h ILE 52 CO 0.12 0.46 0.02 0.11 0.00 0.00 0.00 178.15 178.85 3mw9 h LYS 53 N 0.48 0.05 -7.13 2.37 1.57 -1.62 -3.45 116.57 108.84 3mw9 h LYS 53 Ca 0.06 -0.01 -0.47 0.00 -1.87 0.00 0.00 60.65 58.36 3mw9 h LYS 53 Cb 0.80 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 33.10 3mw9 h LYS 53 CO 0.07 0.09 0.34 -1.25 -0.57 0.00 0.00 179.45 178.13 3mw9 s PRO 54 N -5.95 3.99 -0.05 3.15 0.04 -1.26 -5.01 135.00 129.92 3mw9 s PRO 54 Ca -0.13 0.94 -0.30 0.00 0.04 0.00 0.00 61.00 61.55 3mw9 s PRO 54 Cb 0.06 -2.17 -0.05 0.00 0.04 0.00 0.00 34.50 32.38 3mw9 s PRO 54 CO 0.67 -0.20 1.42 0.00 0.04 0.00 0.00 177.00 178.93 3mw9 h ASN 56 N 8.26 0.01 -3.61 0.00 -0.26 -1.26 -3.44 115.58 115.28 3mw9 h ASN 56 Ca -0.36 -0.03 -0.44 0.00 -0.56 0.00 0.00 56.30 54.91 3mw9 h ASN 56 Cb 1.16 -0.00 -0.32 0.00 -1.06 0.00 0.00 38.32 38.10 3mw9 h ASN 56 CO 0.93 0.04 -0.79 -1.00 -1.06 0.00 0.00 177.43 175.54 3mw9 s HIS 57 N -6.08 1.01 -0.06 1.19 3.76 -1.03 -5.04 115.29 109.04 3mw9 s HIS 57 Ca -0.13 -0.30 0.01 0.00 -0.15 0.00 0.00 55.06 54.49 3mw9 s HIS 57 Cb 0.06 -0.77 0.02 0.00 1.11 0.00 0.00 32.58 33.00 3mw9 s HIS 57 CO 0.66 -0.17 -0.07 0.08 -0.85 0.00 0.00 174.74 174.39 3mw9 s VAL 58 N 0.52 0.78 -0.21 -0.90 1.01 -1.26 -0.42 120.40 119.92 3mw9 s VAL 58 Ca -0.09 -0.24 -0.03 0.00 0.00 0.00 0.00 61.98 61.62 3mw9 s VAL 58 Cb -0.12 -0.78 -0.01 0.00 0.00 0.00 0.00 36.38 35.48 3mw9 s VAL 58 CO 0.01 0.29 -0.06 -0.22 0.00 0.00 0.00 175.10 175.12 3mw9 s LEU 59 N 1.00 2.84 -0.13 3.92 2.96 0.20 -4.98 118.68 124.48 3mw9 s LEU 59 Ca -0.09 -0.39 -0.02 0.00 -0.22 0.00 0.00 54.13 53.40 3mw9 s LEU 59 Cb -0.14 -1.71 -0.03 0.00 0.50 0.00 0.00 46.19 44.81 3mw9 s LEU 59 CO -0.00 0.01 -0.06 -0.44 -1.32 0.00 0.00 176.35 174.53 3mw9 s SER 60 N 1.31 4.60 0.05 3.68 0.01 -1.26 -0.89 113.70 121.20 3mw9 s SER 60 Ca 0.04 -0.15 0.02 0.00 1.31 0.00 0.00 55.95 57.16 3mw9 s SER 60 Cb -0.14 -1.63 -0.03 0.00 0.21 0.00 0.00 66.02 64.43 3mw9 s SER 60 CO -0.03 0.20 -0.07 -1.48 0.41 0.00 0.00 173.24 172.28 3mw9 s LEU 61 N 0.14 2.31 0.06 2.44 0.05 -0.80 -5.01 118.68 117.88 3mw9 s LEU 61 Ca -0.03 -0.65 0.10 0.00 0.05 0.00 0.00 54.13 53.60 3mw9 s LEU 61 Cb -0.14 -0.10 -0.03 0.00 -2.05 0.00 0.00 46.19 43.87 3mw9 s LEU 61 CO 0.03 -0.28 -0.26 -0.44 -0.55 0.00 0.00 176.35 174.84 3mw9 s SER 62 N -1.91 3.19 -0.12 1.48 0.01 -1.26 -1.31 113.70 113.78 3mw9 s SER 62 Ca -0.06 -0.63 -0.22 0.00 1.31 0.00 0.00 55.95 56.36 3mw9 s SER 62 Cb -0.06 -0.27 0.05 0.00 0.21 0.00 0.00 66.02 65.95 3mw9 s SER 62 CO -0.01 0.24 0.54 0.72 0.41 0.00 0.00 173.24 175.13 3mw9 s PHE 63 N -0.86 -0.53 0.19 2.43 -0.12 -0.90 -5.02 117.98 113.18 3mw9 s PHE 63 Ca 0.12 1.10 -0.27 0.00 -0.05 0.00 0.00 56.93 57.83 3mw9 s PHE 63 Cb -0.10 0.24 -0.08 0.00 -0.63 0.00 0.00 43.02 42.45 3mw9 s PHE 63 CO 0.03 -0.41 0.84 -1.25 -0.05 0.00 0.00 175.22 174.38 3mw9 s PRO 64 N -0.53 4.68 -0.04 1.99 0.04 -1.26 -2.14 135.00 137.75 3mw9 s PRO 64 Ca -0.06 1.29 0.04 0.00 0.04 0.00 0.00 61.00 62.30 3mw9 s PRO 64 Cb -0.03 -3.27 -0.00 0.00 0.04 0.00 0.00 34.50 31.24 3mw9 s PRO 64 CO 0.04 0.55 -0.15 0.42 0.04 0.00 0.00 177.00 177.90 3mw9 s ILE 65 N -1.15 1.27 -0.38 0.56 -1.09 0.53 -4.96 121.20 115.97 3mw9 s ILE 65 Ca 0.38 -0.63 -0.18 0.00 -2.23 0.00 0.00 60.65 57.99 3mw9 s ILE 65 Cb -0.24 -1.09 0.01 0.00 -1.58 0.00 0.00 42.46 39.55 3mw9 s ILE 65 CO 0.28 0.37 0.50 -0.60 -1.23 0.00 0.00 174.94 174.26 3mw9 s ARG 66 N 0.03 3.42 1.06 2.79 3.52 -1.26 0.20 118.95 128.71 3mw9 s ARG 66 Ca -0.03 -0.39 -0.12 0.00 -0.13 0.00 0.00 55.73 55.07 3mw9 s ARG 66 Cb -0.10 -3.87 0.23 0.00 -1.56 0.00 0.00 34.95 29.64 3mw9 s ARG 66 CO 0.01 -0.75 1.07 1.03 -0.81 0.00 0.00 175.30 175.86 3mw9 s ARG 67 N 2.35 -0.11 0.47 5.12 1.81 0.10 -4.90 118.95 123.78 3mw9 s ARG 67 Ca 0.17 1.01 0.21 0.00 -1.72 0.00 0.00 55.73 55.40 3mw9 s ARG 67 Cb -0.16 -1.64 1.16 0.00 -0.45 0.00 0.00 34.95 33.87 3mw9 s ARG 67 CO 0.14 -3.23 1.98 -0.44 -0.68 0.00 0.00 175.30 173.07 3mw9 h ASP 68 N -2.28 0.00 -0.08 0.23 3.45 -1.97 -2.50 116.42 113.28 3mw9 h ASP 68 Ca -0.55 0.00 0.00 0.00 0.43 0.00 0.00 57.03 56.91 3mw9 h ASP 68 Cb 1.31 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.08 3mw9 h ASP 68 CO 0.49 0.20 0.00 -0.90 -1.57 0.00 0.00 179.24 177.45 3mw9 n ASP 69 N -3.84 0.64 0.00 6.45 3.85 -1.26 -4.91 116.55 117.49 3mw9 n ASP 69 Ca -0.02 -1.62 0.00 0.00 -0.71 0.00 0.00 54.79 52.44 3mw9 n ASP 69 Cb 0.29 -0.05 0.00 0.00 -1.35 0.00 0.00 41.12 40.01 3mw9 n ASP 69 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3mw9 n GLY 70 N 0.88 3.35 3.79 6.12 0.00 -0.94 -5.06 105.19 113.32 3mw9 n GLY 70 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 3mw9 n GLY 70 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3mw9 s SER 71 N -0.78 6.68 0.03 1.61 1.04 -1.26 -4.65 113.70 116.37 3mw9 s SER 71 Ca 0.00 1.95 -0.25 0.00 0.48 0.00 0.00 55.95 58.14 3mw9 s SER 71 Cb 0.00 -2.57 -0.05 0.00 0.10 0.00 0.00 66.02 63.50 3mw9 s SER 71 CO 0.00 -0.55 0.75 0.26 0.98 0.00 0.00 173.24 174.69 3mw9 s TRP 72 N -1.82 3.72 -0.04 5.02 0.52 -1.26 0.01 118.94 125.09 3mw9 s TRP 72 Ca 0.61 1.45 0.03 0.00 0.02 0.00 0.00 56.10 58.21 3mw9 s TRP 72 Cb -0.19 -2.81 0.00 0.00 -1.15 0.00 0.00 33.47 29.33 3mw9 s TRP 72 CO 0.23 0.26 -0.14 -2.00 0.02 0.00 0.00 176.95 175.33 3mw9 s GLU 73 N 0.01 1.54 -0.43 4.98 2.12 0.13 -4.95 118.70 122.10 3mw9 s GLU 73 Ca 0.38 -0.48 -0.22 0.00 0.36 0.00 0.00 54.97 55.01 3mw9 s GLU 73 Cb -0.20 -1.34 0.02 0.00 0.26 0.00 0.00 34.13 32.87 3mw9 s GLU 73 CO 0.22 0.16 0.72 0.08 -0.54 0.00 0.00 175.26 175.90 3mw9 s VAL 74 N 0.21 4.74 -0.08 3.70 1.01 -1.26 -0.35 120.40 128.38 3mw9 s VAL 74 Ca -0.06 0.38 -0.05 0.00 0.00 0.00 0.00 61.98 62.25 3mw9 s VAL 74 Cb -0.12 -4.25 -0.04 0.00 0.00 0.00 0.00 36.38 31.98 3mw9 s VAL 74 CO 0.02 -0.61 0.13 0.27 0.00 0.00 0.00 175.10 174.91 3mw9 s ILE 75 N 3.05 5.30 0.05 2.22 -0.00 -0.91 -4.93 121.20 125.98 3mw9 s ILE 75 Ca 0.27 0.02 0.04 0.00 -0.00 0.00 0.00 60.65 60.99 3mw9 s ILE 75 Cb -0.13 -3.35 -0.04 0.00 -0.00 0.00 0.00 42.46 38.94 3mw9 s ILE 75 CO 0.20 0.53 -0.06 -1.83 -0.00 0.00 0.00 174.94 173.78 3mw9 s GLU 76 N -1.28 2.47 0.20 0.37 -1.05 -1.26 -2.12 118.70 116.01 3mw9 s GLU 76 Ca 0.18 -0.81 -0.03 0.00 -0.15 0.00 0.00 54.97 54.16 3mw9 s GLU 76 Cb -0.12 -2.48 -0.03 0.00 -0.44 0.00 0.00 34.13 31.06 3mw9 s GLU 76 CO 0.08 0.57 0.17 0.20 0.95 0.00 0.00 175.26 177.23 3mw9 s GLY 77 N -1.81 1.22 -0.02 -3.83 0.00 -0.43 -1.20 107.32 101.25 3mw9 s GLY 77 Ca 0.20 -1.52 -0.17 0.00 0.00 0.00 0.00 44.72 43.23 3mw9 s GLY 77 CO 0.12 -1.26 0.36 -0.19 0.00 0.00 0.00 173.10 172.12 3mw9 s TYR 78 N -4.12 -0.25 -0.04 1.90 1.51 0.78 -1.90 117.35 115.25 3mw9 s TYR 78 Ca 0.34 0.38 -0.01 0.00 -1.01 0.00 0.00 57.07 56.77 3mw9 s TYR 78 Cb 0.06 0.14 0.03 0.00 -0.11 0.00 0.00 41.96 42.08 3mw9 s TYR 78 CO 0.10 -0.42 0.07 0.50 -1.11 0.00 0.00 175.55 174.68 3mw9 s ARG 79 N -1.32 -0.01 -0.07 -0.62 3.52 -0.07 -1.09 118.95 119.30 3mw9 s ARG 79 Ca -0.13 0.27 -0.01 0.00 -0.13 0.00 0.00 55.73 55.73 3mw9 s ARG 79 Cb -0.04 -0.26 -0.03 0.00 -1.56 0.00 0.00 34.95 33.05 3mw9 s ARG 79 CO 0.05 -0.19 -0.00 0.00 -0.81 0.00 0.00 175.30 174.35 3mw9 s ALA 80 N 1.27 3.27 -0.27 6.12 0.00 0.17 -0.63 121.76 131.69 3mw9 s ALA 80 Ca -0.07 -0.84 -0.01 0.00 0.00 0.00 0.00 51.96 51.03 3mw9 s ALA 80 Cb -0.12 -1.43 0.04 0.00 0.00 0.00 0.00 23.12 21.60 3mw9 s ALA 80 CO -0.04 0.60 -0.04 -0.65 0.00 0.00 0.00 175.76 175.63 3mw9 s GLN 81 N -1.02 2.60 -0.09 0.00 -0.21 0.44 -1.29 119.66 120.09 3mw9 s GLN 81 Ca 0.15 -1.14 -0.19 0.00 0.02 0.00 0.00 55.36 54.20 3mw9 s GLN 81 Cb -0.11 -3.07 -0.16 0.00 1.00 0.00 0.00 33.01 30.67 3mw9 s GLN 81 CO 0.04 -0.51 0.64 1.25 -2.12 0.00 0.00 175.29 174.58 3mw9 h HIS 82 N 7.99 -0.08 -3.86 0.91 -0.00 -0.64 -2.67 115.15 116.79 3mw9 h HIS 82 Ca -0.26 -0.00 -0.18 0.00 -0.00 0.00 0.00 60.37 59.92 3mw9 h HIS 82 Cb 1.08 0.02 -0.23 0.00 -0.00 0.00 0.00 27.41 28.29 3mw9 h HIS 82 CO 0.60 0.46 -0.68 0.45 -0.00 0.00 0.00 177.93 178.76 3mw9 s SER 83 N -5.77 0.15 -0.15 3.26 0.15 -1.24 -2.64 113.70 107.46 3mw9 s SER 83 Ca -0.12 -0.33 0.17 0.00 0.70 0.00 0.00 55.95 56.36 3mw9 s SER 83 Cb -0.01 0.09 0.45 0.00 -1.71 0.00 0.00 66.02 64.84 3mw9 s SER 83 CO 0.44 -0.23 1.33 0.00 1.20 0.00 0.00 173.24 175.99 3mw9 n GLN 84 N 1.98 2.50 0.25 5.44 3.00 -1.26 -3.93 117.38 125.36 3mw9 n GLN 84 Ca -0.21 -2.71 0.10 0.00 -0.01 0.00 0.00 57.00 54.18 3mw9 n GLN 84 Cb 0.56 -1.71 0.64 0.00 0.00 0.00 0.00 30.24 29.73 3mw9 n GLN 84 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.06 178.18 3mw9 h HIS 85 N 1.31 0.00 -3.91 1.08 2.07 -1.96 -3.39 115.15 110.36 3mw9 h HIS 85 Ca 0.00 0.00 -0.58 0.00 -2.85 0.00 0.00 60.37 56.94 3mw9 h HIS 85 Cb 1.27 0.00 -0.22 0.00 2.57 0.00 0.00 27.41 31.04 3mw9 h HIS 85 CO 0.34 0.16 -0.83 1.03 -3.07 0.00 0.00 177.93 175.56 3mw9 s ARG 86 N -4.30 1.18 0.05 5.12 1.81 -1.26 -5.03 118.95 116.52 3mw9 s ARG 86 Ca -0.03 -1.20 0.04 0.00 -1.72 0.00 0.00 55.73 52.81 3mw9 s ARG 86 Cb 0.14 -1.48 -0.03 0.00 -0.45 0.00 0.00 34.95 33.13 3mw9 s ARG 86 CO 0.62 0.35 -0.11 0.95 -0.68 0.00 0.00 175.30 176.43 3mw9 s THR 87 N -1.17 0.85 0.96 0.02 -4.23 -1.26 -3.12 115.64 107.69 3mw9 s THR 87 Ca 0.08 -1.13 -0.15 0.00 -1.18 0.00 0.00 61.69 59.31 3mw9 s THR 87 Cb -0.10 -0.84 0.18 0.00 1.34 0.00 0.00 72.50 73.08 3mw9 s THR 87 CO 0.05 -0.24 1.25 -2.16 -0.54 0.00 0.00 174.62 172.97 3mw9 s PRO 88 N -1.53 0.71 0.46 3.99 0.04 -1.25 -4.85 135.00 132.56 3mw9 s PRO 88 Ca -0.05 -0.19 -0.21 0.00 0.04 0.00 0.00 61.00 60.60 3mw9 s PRO 88 Cb -0.09 -1.83 -0.09 0.00 0.04 0.00 0.00 34.50 32.53 3mw9 s PRO 88 CO 0.01 -2.40 1.04 0.00 0.04 0.00 0.00 177.00 175.69 3mw9 s LYS 90 N -3.01 0.71 0.00 0.00 2.47 0.13 -0.13 119.74 119.91 3mw9 s LYS 90 Ca 0.64 -0.25 0.00 0.00 -1.56 0.00 0.00 55.97 54.80 3mw9 s LYS 90 Cb -0.18 -0.68 0.00 0.00 -1.46 0.00 0.00 37.83 35.51 3mw9 s LYS 90 CO 0.22 0.12 0.00 0.41 0.16 0.00 0.00 175.35 176.26 3mw9 n GLY 91 N 3.14 2.56 3.21 5.54 0.00 -1.15 -0.64 105.19 117.84 3mw9 n GLY 91 Ca -0.16 -0.52 -0.24 0.00 0.00 0.00 0.00 46.02 45.10 3mw9 n GLY 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mw9 n GLY 92 N -0.64 -1.31 3.00 -0.02 0.00 -1.26 -3.19 105.19 101.77 3mw9 n GLY 92 Ca 0.00 -1.72 -0.31 0.00 0.00 0.00 0.00 46.02 43.99 3mw9 n GLY 92 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3mw9 s ILE 93 N -3.36 1.74 -0.21 -0.61 1.01 0.17 -0.87 121.20 119.07 3mw9 s ILE 93 Ca 0.62 -1.20 -0.18 0.00 0.00 0.00 0.00 60.65 59.89 3mw9 s ILE 93 Cb -0.02 -1.87 -0.03 0.00 0.01 0.00 0.00 42.46 40.56 3mw9 s ILE 93 CO 0.43 0.07 0.53 -0.60 0.00 0.00 0.00 174.94 175.37 3mw9 s ARG 94 N 1.33 4.16 -0.47 2.79 3.52 -0.14 -3.29 118.95 126.84 3mw9 s ARG 94 Ca -0.04 0.41 -0.16 0.00 -0.13 0.00 0.00 55.73 55.81 3mw9 s ARG 94 Cb -0.18 -3.58 0.06 0.00 -1.56 0.00 0.00 34.95 29.70 3mw9 s ARG 94 CO -0.07 -0.20 0.44 0.71 -0.81 0.00 0.00 175.30 175.37 3mw9 s TYR 95 N 1.81 3.20 -0.16 5.12 2.02 -0.79 -0.28 117.35 128.27 3mw9 s TYR 95 Ca 0.24 -0.81 -0.29 0.00 -0.37 0.00 0.00 57.07 55.84 3mw9 s TYR 95 Cb -0.15 -3.21 0.09 0.00 -0.40 0.00 0.00 41.96 38.29 3mw9 s TYR 95 CO 0.09 -0.83 0.83 0.45 -1.57 0.00 0.00 175.55 174.52 3mw9 s SER 96 N 2.54 -0.56 0.00 2.29 0.15 -0.62 -4.60 113.70 112.89 3mw9 s SER 96 Ca 0.07 0.79 0.18 0.00 0.70 0.00 0.00 55.95 57.69 3mw9 s SER 96 Cb -0.23 0.70 0.82 0.00 -1.71 0.00 0.00 66.02 65.60 3mw9 s SER 96 CO 0.08 -0.40 1.58 0.35 1.20 0.00 0.00 173.24 176.05 3mw9 n THR 97 N 1.38 0.67 1.62 6.45 -2.24 -0.91 -2.29 114.28 118.96 3mw9 n THR 97 Ca -0.15 0.17 0.15 0.00 -2.27 0.00 0.00 64.05 61.95 3mw9 n THR 97 Cb 0.57 -0.85 0.65 0.00 -2.10 0.00 0.00 70.33 68.59 3mw9 n THR 97 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3mw9 n ASP 98 N -1.45 0.92 -4.75 3.42 10.43 -1.26 -4.91 116.55 118.95 3mw9 n ASP 98 Ca 0.06 -1.21 -0.41 0.00 2.57 0.00 0.00 54.79 55.80 3mw9 n ASP 98 Cb 0.20 -0.00 -0.04 0.00 1.84 0.00 0.00 41.12 43.12 3mw9 n ASP 98 CO 0.00 0.00 0.00 0.68 -1.07 0.00 0.00 177.20 176.81 3mw9 s VAL 99 N -2.09 3.59 0.30 2.53 -7.23 -0.97 -4.92 120.40 111.61 3mw9 s VAL 99 Ca 0.39 1.45 0.05 0.00 -1.81 0.00 0.00 61.98 62.06 3mw9 s VAL 99 Cb 0.21 -3.93 -0.03 0.00 0.56 0.00 0.00 36.38 33.19 3mw9 s VAL 99 CO 0.37 0.29 0.23 -0.94 -0.31 0.00 0.00 175.10 174.74 3mw9 s SER 100 N -0.38 1.37 0.53 4.85 1.04 -1.26 -4.85 113.70 115.00 3mw9 s SER 100 Ca 0.48 -1.66 0.31 0.00 0.48 0.00 0.00 55.95 55.56 3mw9 s SER 100 Cb -0.32 0.50 1.42 0.00 0.10 0.00 0.00 66.02 67.73 3mw9 s SER 100 CO 0.39 -0.99 2.02 1.62 0.98 0.00 0.00 173.24 177.26 3mw9 h VAL 101 N 2.24 0.32 0.12 5.02 3.04 -1.98 -2.57 116.25 122.43 3mw9 h VAL 101 Ca -0.29 -0.60 -0.22 0.00 -1.01 0.00 0.00 66.70 64.58 3mw9 h VAL 101 Cb 1.24 1.46 0.01 0.00 -2.01 0.00 0.00 31.29 31.98 3mw9 h VAL 101 CO 0.42 0.09 -1.08 0.44 -1.01 0.00 0.00 177.57 176.44 3mw9 h ASP 102 N 0.00 0.40 -0.57 3.17 3.32 -1.98 -1.79 116.42 118.96 3mw9 h ASP 102 Ca -0.00 -0.89 0.11 0.00 0.02 0.00 0.00 57.03 56.27 3mw9 h ASP 102 Cb 0.45 -0.13 -0.09 0.00 0.22 0.00 0.00 39.33 39.78 3mw9 h ASP 102 CO 0.01 1.49 0.06 -0.08 -1.72 0.00 0.00 179.24 179.00 3mw9 h GLU 103 N -0.38 0.17 -0.19 3.56 4.81 -1.91 -0.49 114.58 120.14 3mw9 h GLU 103 Ca -0.22 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 58.95 3mw9 h GLU 103 Cb 1.67 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 31.00 3mw9 h GLU 103 CO 0.09 0.11 -0.07 0.28 -0.73 0.00 0.00 179.01 178.69 3mw9 h VAL 104 N 0.18 1.30 -0.60 0.32 2.07 -1.50 -0.34 116.25 117.68 3mw9 h VAL 104 Ca 0.30 -1.09 0.09 0.00 0.82 0.00 0.00 66.70 66.82 3mw9 h VAL 104 Cb 0.46 1.63 -0.07 0.00 -1.52 0.00 0.00 31.29 31.78 3mw9 h VAL 104 CO -0.44 0.33 0.22 0.11 0.02 0.00 0.00 177.57 177.80 3mw9 h LYS 105 N 0.08 0.38 -0.07 1.57 1.57 -1.16 -0.91 116.57 118.03 3mw9 h LYS 105 Ca 0.04 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.80 3mw9 h LYS 105 Cb 0.54 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.76 3mw9 h LYS 105 CO 0.02 0.25 0.03 0.00 -0.57 0.00 0.00 179.45 179.19 3mw9 h ALA 106 N 1.42 0.09 -0.94 3.86 0.00 -0.75 -2.19 119.26 120.74 3mw9 h ALA 106 Ca 0.31 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.18 3mw9 h ALA 106 Cb 0.38 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.09 3mw9 h ALA 106 CO -0.31 -0.35 0.62 -0.07 0.00 0.00 0.00 179.25 179.14 3mw9 h LEU 107 N -0.01 1.04 -0.80 0.00 -0.00 -0.92 -2.26 115.31 112.36 3mw9 h LEU 107 Ca 0.02 -0.01 -0.09 0.00 -0.00 0.00 0.00 57.88 57.80 3mw9 h LEU 107 Cb 0.12 -0.24 -0.02 0.00 -0.00 0.00 0.00 40.66 40.52 3mw9 h LEU 107 CO -0.00 0.72 -0.10 0.00 -0.00 0.00 0.00 178.44 179.05 3mw9 h ALA 108 N 1.44 0.98 -0.15 1.53 0.00 -0.90 -1.17 119.26 120.99 3mw9 h ALA 108 Ca 0.37 -0.32 -0.13 0.00 0.00 0.00 0.00 54.91 54.83 3mw9 h ALA 108 Cb -0.02 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3mw9 h ALA 108 CO -0.11 0.61 -0.47 0.66 0.00 0.00 0.00 179.25 179.93 3mw9 h SER 109 N 0.73 0.42 -0.56 0.00 4.64 -1.12 -2.15 113.55 115.51 3mw9 h SER 109 Ca 0.12 -0.20 0.02 0.00 -0.47 0.00 0.00 61.79 61.26 3mw9 h SER 109 Cb 0.59 -0.12 -0.03 0.00 -0.31 0.00 0.00 62.40 62.52 3mw9 h SER 109 CO 0.04 0.84 0.34 -0.07 -0.87 0.00 0.00 176.83 177.11 3mw9 h LEU 110 N 0.32 0.57 -0.55 5.97 3.38 -0.78 -2.57 115.31 121.64 3mw9 h LEU 110 Ca 0.02 -0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.08 3mw9 h LEU 110 Cb 0.95 -0.12 -0.07 0.00 0.09 0.00 0.00 40.66 41.51 3mw9 h LEU 110 CO 0.08 0.40 0.15 0.24 0.09 0.00 0.00 178.44 179.41 3mw9 h MET 111 N 0.69 0.30 -0.49 1.13 2.86 -0.59 0.20 114.93 119.02 3mw9 h MET 111 Ca 0.22 -0.02 -0.09 0.00 -2.06 0.00 0.00 59.70 57.76 3mw9 h MET 111 Cb 0.00 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.58 3mw9 h MET 111 CO -0.09 0.20 -0.03 0.00 1.06 0.00 0.00 176.91 178.05 3mw9 h THR 112 N 0.31 1.27 -0.34 2.22 1.03 -1.14 -1.02 112.91 115.23 3mw9 h THR 112 Ca 0.28 -1.13 -0.15 0.00 -0.01 0.00 0.00 66.41 65.40 3mw9 h THR 112 Cb 0.37 1.01 -0.01 0.00 -1.07 0.00 0.00 68.15 68.45 3mw9 h THR 112 CO -0.33 0.40 -0.38 1.88 -0.01 0.00 0.00 175.52 177.08 3mw9 h TYR 113 N 0.75 0.95 0.12 0.00 0.99 -1.09 -2.56 116.97 116.13 3mw9 h TYR 113 Ca 0.14 -0.28 0.01 0.00 2.00 0.00 0.00 58.73 60.59 3mw9 h TYR 113 Cb 0.56 -0.20 -0.03 0.00 1.00 0.00 0.00 36.73 38.05 3mw9 h TYR 113 CO 0.04 1.05 -0.40 -0.22 -0.00 0.00 0.00 178.16 178.64 3mw9 h LYS 114 N 0.66 -0.57 -1.01 4.88 3.64 -0.56 -1.12 116.57 122.48 3mw9 h LYS 114 Ca 0.06 0.04 0.25 0.00 -1.27 0.00 0.00 60.65 59.73 3mw9 h LYS 114 Cb 0.94 0.13 -0.12 0.00 -0.41 0.00 0.00 32.23 32.77 3mw9 h LYS 114 CO 0.09 -0.38 0.61 0.00 -2.27 0.00 0.00 179.45 177.50 3mw9 h ALA 116 N 1.71 0.74 -0.80 0.00 0.00 -1.09 -0.72 119.26 119.10 3mw9 h ALA 116 Ca 0.64 -0.39 0.12 0.00 0.00 0.00 0.00 54.91 55.28 3mw9 h ALA 116 Cb 1.29 -0.16 -0.08 0.00 0.00 0.00 0.00 17.79 18.83 3mw9 h ALA 116 CO -0.45 0.66 0.42 0.28 0.00 0.00 0.00 179.25 180.17 3mw9 h VAL 117 N 0.80 0.80 -0.50 0.00 2.07 0.27 -2.64 116.25 117.04 3mw9 h VAL 117 Ca 0.10 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.40 3mw9 h VAL 117 Cb 0.80 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.66 3mw9 h VAL 117 CO 0.07 0.12 0.00 1.33 0.02 0.00 0.00 177.57 179.11 3mw9 n VAL 118 N -4.84 2.28 -2.80 2.57 0.24 -1.02 -4.84 118.33 109.92 3mw9 n VAL 118 Ca 0.14 -1.45 -0.21 0.00 -2.04 0.00 0.00 64.34 60.79 3mw9 n VAL 118 Cb 0.35 -0.11 0.01 0.00 -1.47 0.00 0.00 33.84 32.62 3mw9 n VAL 118 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 3mw9 n ASP 119 N 0.47 -5.40 -4.67 -1.34 8.00 -0.54 -4.96 116.55 108.11 3mw9 n ASP 119 Ca 0.25 -0.15 -0.38 0.00 0.71 0.00 0.00 54.79 55.21 3mw9 n ASP 119 Cb 0.99 -4.44 -0.07 0.00 -0.02 0.00 0.00 41.12 37.57 3mw9 n ASP 119 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3mw9 s VAL 120 N -3.02 5.17 -1.12 2.53 1.01 -0.39 -4.98 120.40 119.60 3mw9 s VAL 120 Ca 0.18 0.79 -0.08 0.00 0.00 0.00 0.00 61.98 62.87 3mw9 s VAL 120 Cb -0.08 -3.77 -0.10 0.00 0.00 0.00 0.00 36.38 32.43 3mw9 s VAL 120 CO 0.22 0.23 3.04 -0.81 0.00 0.00 0.00 175.10 177.78 3mw9 n PRO 121 N 4.56 3.34 -4.72 2.72 -0.04 -1.26 -4.52 135.00 135.08 3mw9 n PRO 121 Ca -0.07 -2.09 -0.28 0.00 -0.04 0.00 0.00 63.50 61.02 3mw9 n PRO 121 Cb 0.51 -2.54 -0.14 0.00 -0.04 0.00 0.00 33.50 31.28 3mw9 n PRO 121 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3mw9 s PHE 122 N 1.20 2.12 0.63 0.54 2.99 -1.26 -4.31 117.98 119.89 3mw9 s PHE 122 Ca 0.66 -0.40 -0.09 0.00 0.00 0.00 0.00 56.93 57.11 3mw9 s PHE 122 Cb 0.23 -1.25 0.00 0.00 0.00 0.00 0.00 43.02 42.00 3mw9 s PHE 122 CO -0.06 0.14 0.98 0.20 -0.00 0.00 0.00 175.22 176.49 3mw9 s GLY 123 N -1.35 1.61 0.14 4.36 0.00 -1.04 -4.77 107.32 106.27 3mw9 s GLY 123 Ca 0.10 -0.48 -0.07 0.00 0.00 0.00 0.00 44.72 44.28 3mw9 s GLY 123 CO 0.03 -0.17 0.41 -0.32 0.00 0.00 0.00 173.10 173.05 3mw9 s GLY 124 N -4.30 2.27 0.16 0.20 0.00 -1.25 0.22 107.32 104.62 3mw9 s GLY 124 Ca 0.55 -0.46 -0.18 0.00 0.00 0.00 0.00 44.72 44.64 3mw9 s GLY 124 CO 0.49 -0.33 0.48 0.00 0.00 0.00 0.00 173.10 173.73 3mw9 s ALA 125 N -1.62 -1.02 -0.07 3.20 0.00 0.18 0.06 121.76 122.50 3mw9 s ALA 125 Ca 0.40 -0.05 -0.14 0.00 0.00 0.00 0.00 51.96 52.16 3mw9 s ALA 125 Cb -0.12 0.79 0.03 0.00 0.00 0.00 0.00 23.12 23.82 3mw9 s ALA 125 CO 0.22 -0.73 0.34 0.21 0.00 0.00 0.00 175.76 175.81 3mw9 s LYS 126 N -3.83 0.58 0.07 0.00 2.47 -0.41 -3.49 119.74 115.13 3mw9 s LYS 126 Ca 0.05 0.12 0.09 0.00 -1.56 0.00 0.00 55.97 54.68 3mw9 s LYS 126 Cb 0.00 0.26 -0.03 0.00 -1.46 0.00 0.00 37.83 36.61 3mw9 s LYS 126 CO -0.08 -0.13 -0.25 0.00 0.16 0.00 0.00 175.35 175.05 3mw9 s ALA 127 N -0.67 2.17 -0.02 3.13 0.00 -0.05 -0.65 121.76 125.66 3mw9 s ALA 127 Ca -0.08 -1.28 0.01 0.00 0.00 0.00 0.00 51.96 50.61 3mw9 s ALA 127 Cb -0.04 -0.41 0.01 0.00 0.00 0.00 0.00 23.12 22.68 3mw9 s ALA 127 CO 0.03 0.50 -0.04 0.20 0.00 0.00 0.00 175.76 176.45 3mw9 s GLY 128 N -1.48 0.30 -0.14 0.00 0.00 -0.25 -0.97 107.32 104.78 3mw9 s GLY 128 Ca 0.11 -0.07 -0.03 0.00 0.00 0.00 0.00 44.72 44.74 3mw9 s GLY 128 CO 0.03 0.19 -0.06 0.14 0.00 0.00 0.00 173.10 173.41 3mw9 s VAL 129 N 0.46 3.73 -1.26 1.40 1.01 0.61 -0.15 120.40 126.21 3mw9 s VAL 129 Ca -0.05 -0.42 -0.07 0.00 0.00 0.00 0.00 61.98 61.44 3mw9 s VAL 129 Cb -0.09 -2.62 0.18 0.00 0.00 0.00 0.00 36.38 33.85 3mw9 s VAL 129 CO -0.00 0.51 1.97 1.17 0.00 0.00 0.00 175.10 178.74 3mw9 n LYS 130 N 3.41 4.06 -4.24 2.72 4.81 -0.34 -1.94 118.16 126.63 3mw9 n LYS 130 Ca -0.18 -3.67 -0.14 0.00 -0.87 0.00 0.00 58.31 53.45 3mw9 n LYS 130 Cb 0.53 -2.78 -0.10 0.00 0.02 0.00 0.00 35.03 32.70 3mw9 n LYS 130 CO 0.00 0.00 0.00 0.96 1.17 0.00 0.00 177.40 179.53 3mw9 s ILE 131 N -0.59 0.30 -0.36 3.15 -4.36 -1.21 -4.70 121.20 113.43 3mw9 s ILE 131 Ca 0.42 -1.99 -0.04 0.00 -0.26 0.00 0.00 60.65 58.79 3mw9 s ILE 131 Cb 0.12 -2.47 0.07 0.00 1.25 0.00 0.00 42.46 41.43 3mw9 s ILE 131 CO -0.01 -0.10 0.12 0.21 0.24 0.00 0.00 174.94 175.39 3mw9 s ASN 132 N -3.21 5.18 0.63 4.36 3.04 -1.26 -1.59 114.94 122.09 3mw9 s ASN 132 Ca 0.35 -1.52 0.26 0.00 0.04 0.00 0.00 52.86 51.99 3mw9 s ASN 132 Cb 0.07 -1.81 1.32 0.00 -1.54 0.00 0.00 41.25 39.29 3mw9 s ASN 132 CO 0.11 -0.40 1.75 -0.65 -3.04 0.00 0.00 177.10 174.87 3mw9 h PRO 133 N 8.10 0.00 0.00 0.43 0.11 -1.95 0.23 132.00 138.92 3mw9 h PRO 133 Ca -0.19 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.87 3mw9 h PRO 133 Cb 1.06 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 3mw9 h PRO 133 CO 0.62 0.00 -0.22 0.87 -0.21 0.00 0.00 178.00 179.07 3mw9 h LYS 134 N 0.00 0.00 -0.82 1.05 1.57 -1.98 -2.91 116.57 113.48 3mw9 h LYS 134 Ca 0.13 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 3mw9 h LYS 134 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.55 3mw9 h LYS 134 CO -0.00 0.22 0.00 0.09 -0.57 0.00 0.00 179.45 179.19 3mw9 n ASN 135 N -3.48 2.94 -4.04 0.86 3.02 0.07 -4.91 115.26 109.72 3mw9 n ASN 135 Ca -0.00 -2.38 -0.13 0.00 -0.03 0.00 0.00 54.58 52.03 3mw9 n ASN 135 Cb 0.39 -0.57 -0.12 0.00 -0.61 0.00 0.00 39.78 38.87 3mw9 n ASN 135 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3mw9 s TYR 136 N -1.73 0.62 0.76 3.10 1.51 -1.10 -5.07 117.35 115.44 3mw9 s TYR 136 Ca 0.22 -0.42 -0.11 0.00 -1.01 0.00 0.00 57.07 55.75 3mw9 s TYR 136 Cb 0.17 -0.37 0.05 0.00 -0.11 0.00 0.00 41.96 41.69 3mw9 s TYR 136 CO 0.07 -0.07 1.09 0.95 -1.11 0.00 0.00 175.55 176.47 3mw9 s THR 137 N -1.13 3.34 0.22 -0.71 -4.23 -1.26 -4.87 115.64 107.01 3mw9 s THR 137 Ca -0.08 0.44 -0.09 0.00 -1.18 0.00 0.00 61.69 60.78 3mw9 s THR 137 Cb -0.08 -3.23 0.18 0.00 1.34 0.00 0.00 72.50 70.71 3mw9 s THR 137 CO 0.00 -0.57 1.88 0.44 -0.54 0.00 0.00 174.62 175.83 3mw9 h ASP 138 N -0.93 0.89 -0.83 3.99 3.32 -1.99 -0.98 116.42 119.89 3mw9 h ASP 138 Ca -0.46 -0.01 0.09 0.00 0.02 0.00 0.00 57.03 56.67 3mw9 h ASP 138 Cb 1.25 -0.21 -0.07 0.00 0.22 0.00 0.00 39.33 40.52 3mw9 h ASP 138 CO 0.60 0.62 0.48 -1.13 -1.72 0.00 0.00 179.24 178.09 3mw9 h ASN 139 N 1.04 0.69 0.54 6.45 -1.24 -2.00 0.05 115.58 121.12 3mw9 h ASN 139 Ca 0.31 0.05 -0.13 0.00 0.71 0.00 0.00 56.30 57.24 3mw9 h ASN 139 Cb -0.05 -0.09 -0.02 0.00 0.73 0.00 0.00 38.32 38.89 3mw9 h ASN 139 CO -0.09 0.40 -0.59 -0.33 -1.29 0.00 0.00 177.43 175.53 3mw9 h GLU 140 N 0.81 0.05 -0.18 6.67 5.08 -1.71 -2.66 114.58 122.64 3mw9 h GLU 140 Ca 0.40 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.68 3mw9 h GLU 140 Cb 0.35 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 3mw9 h GLU 140 CO -0.24 0.62 -0.07 -0.07 -1.00 0.00 0.00 179.01 178.26 3mw9 h LEU 141 N 0.03 0.37 -0.46 1.33 3.38 0.15 -1.47 115.31 118.64 3mw9 h LEU 141 Ca -0.01 -0.39 0.08 0.00 0.09 0.00 0.00 57.88 57.65 3mw9 h LEU 141 Cb 1.05 -0.10 -0.10 0.00 0.09 0.00 0.00 40.66 41.60 3mw9 h LEU 141 CO 0.08 0.68 -0.40 -0.08 0.09 0.00 0.00 178.44 178.81 3mw9 h GLU 142 N 0.07 -0.26 -0.80 1.13 4.81 -1.00 -0.06 114.58 118.46 3mw9 h GLU 142 Ca 0.04 0.02 0.06 0.00 -0.13 0.00 0.00 59.36 59.35 3mw9 h GLU 142 Cb 0.53 0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.91 3mw9 h GLU 142 CO 0.02 -0.18 0.48 0.87 -0.73 0.00 0.00 179.01 179.48 3mw9 h LYS 143 N -0.27 0.85 -0.10 1.92 1.57 -1.37 0.13 116.57 119.30 3mw9 h LYS 143 Ca 0.16 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.87 3mw9 h LYS 143 Cb 0.57 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.68 3mw9 h LYS 143 CO -0.61 0.57 -0.01 0.82 -0.57 0.00 0.00 179.45 179.65 3mw9 h ILE 144 N 0.88 1.27 -0.28 1.86 2.04 -0.24 -1.40 117.51 121.64 3mw9 h ILE 144 Ca 0.35 -0.88 -0.13 0.00 1.00 0.00 0.00 64.86 65.21 3mw9 h ILE 144 Cb 0.19 1.66 -0.00 0.00 -0.74 0.00 0.00 36.82 37.92 3mw9 h ILE 144 CO -0.18 0.25 -0.32 0.00 0.00 0.00 0.00 178.15 177.90 3mw9 h THR 145 N -0.12 1.30 -0.72 -0.27 1.03 -0.70 -1.15 112.91 112.29 3mw9 h THR 145 Ca 0.03 -1.49 0.09 0.00 -0.01 0.00 0.00 66.41 65.03 3mw9 h THR 145 Cb 0.39 1.60 -0.05 0.00 -1.07 0.00 0.00 68.15 69.03 3mw9 h THR 145 CO 0.01 0.48 0.47 0.03 -0.01 0.00 0.00 175.52 176.50 3mw9 h ARG 146 N 0.46 0.60 0.16 0.00 3.08 -0.74 -0.62 114.38 117.32 3mw9 h ARG 146 Ca 0.04 -0.04 -0.29 0.00 0.07 0.00 0.00 59.98 59.76 3mw9 h ARG 146 Cb 0.89 -0.14 0.01 0.00 0.08 0.00 0.00 29.97 30.82 3mw9 h ARG 146 CO 0.08 0.40 -1.32 -0.09 -1.07 0.00 0.00 179.97 177.96 3mw9 h ARG 147 N 0.62 0.33 -0.82 0.04 9.65 -1.09 -2.90 114.38 120.22 3mw9 h ARG 147 Ca 0.33 -0.57 -0.04 0.00 -1.10 0.00 0.00 59.98 58.60 3mw9 h ARG 147 Cb 0.47 0.21 -0.04 0.00 -1.39 0.00 0.00 29.97 29.22 3mw9 h ARG 147 CO -0.11 1.27 0.35 0.35 2.80 0.00 0.00 179.97 184.62 3mw9 h PHE 148 N 0.09 1.22 -0.37 2.20 3.57 -0.75 -1.44 116.94 121.46 3mw9 h PHE 148 Ca -0.17 -0.08 0.01 0.00 3.53 0.00 0.00 57.97 61.25 3mw9 h PHE 148 Cb 2.02 -0.37 -0.02 0.00 2.79 0.00 0.00 35.95 40.37 3mw9 h PHE 148 CO 0.08 0.91 0.24 1.15 -2.23 0.00 0.00 178.31 178.45 3mw9 h THR 149 N 1.18 1.08 -0.72 4.41 2.02 -1.17 -0.74 112.91 118.97 3mw9 h THR 149 Ca 0.28 -0.17 0.02 0.00 0.77 0.00 0.00 66.41 67.31 3mw9 h THR 149 Cb 0.18 0.56 -0.04 0.00 -1.74 0.00 0.00 68.15 67.11 3mw9 h THR 149 CO -0.03 0.09 0.46 0.24 0.37 0.00 0.00 175.52 176.65 3mw9 h MET 150 N 0.48 0.88 -0.25 6.66 2.86 -1.23 -0.99 114.93 123.33 3mw9 h MET 150 Ca 0.14 -0.05 -0.15 0.00 -2.06 0.00 0.00 59.70 57.57 3mw9 h MET 150 Cb -0.04 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.41 3mw9 h MET 150 CO -0.04 0.58 -0.46 0.93 1.06 0.00 0.00 176.91 178.99 3mw9 h GLU 151 N 0.91 0.66 -0.37 1.72 4.39 -0.90 -1.15 114.58 119.83 3mw9 h GLU 151 Ca 0.28 -0.37 -0.14 0.00 0.34 0.00 0.00 59.36 59.47 3mw9 h GLU 151 Cb -0.02 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.65 3mw9 h GLU 151 CO -0.09 0.98 -0.34 -0.07 -1.16 0.00 0.00 179.01 178.33 3mw9 h LEU 152 N 0.53 0.88 -0.36 1.33 3.38 -0.97 -3.27 115.31 116.83 3mw9 h LEU 152 Ca 0.03 -0.37 -0.05 0.00 0.09 0.00 0.00 57.88 57.58 3mw9 h LEU 152 Cb 1.00 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 3mw9 h LEU 152 CO 0.09 1.13 0.04 0.00 0.09 0.00 0.00 178.44 179.79 3mw9 h ALA 153 N 0.92 0.48 -0.65 1.53 0.00 -0.73 -1.02 119.26 119.79 3mw9 h ALA 153 Ca 0.07 -0.22 0.18 0.00 0.00 0.00 0.00 54.91 54.93 3mw9 h ALA 153 Cb 0.89 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 3mw9 h ALA 153 CO 0.08 0.20 0.46 0.87 0.00 0.00 0.00 179.25 180.87 3mw9 h LYS 154 N 0.43 0.08 -0.37 0.00 1.57 -1.27 -2.78 116.57 114.22 3mw9 h LYS 154 Ca 0.11 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 3mw9 h LYS 154 Cb 0.40 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.69 3mw9 h LYS 154 CO 0.01 0.05 0.00 1.63 -0.57 0.00 0.00 179.45 180.58 3mw9 n LYS 155 N -4.38 2.83 -1.85 3.15 4.76 -0.93 -4.99 118.16 116.76 3mw9 n LYS 155 Ca 0.13 -2.09 0.00 0.00 -2.87 0.00 0.00 58.31 53.48 3mw9 n LYS 155 Cb 0.67 -1.29 0.00 0.00 -1.84 0.00 0.00 35.03 32.57 3mw9 n LYS 155 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3mw9 n GLY 156 N 0.61 0.82 0.00 0.72 0.00 -1.02 -4.97 105.19 101.35 3mw9 n GLY 156 Ca 0.13 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.51 3mw9 n GLY 156 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3mw9 n PHE 157 N -2.73 0.00 -3.81 1.61 3.01 -0.43 -4.90 117.46 110.22 3mw9 n PHE 157 Ca 0.00 -0.23 -0.12 0.00 1.01 0.00 0.00 57.45 58.10 3mw9 n PHE 157 Cb 0.41 -0.02 -0.11 0.00 -0.01 0.00 0.00 39.48 39.74 3mw9 n PHE 157 CO 0.00 0.00 0.00 -1.50 1.01 0.00 0.00 176.76 176.27 3mw9 s ILE 158 N -0.47 0.02 0.00 4.37 2.07 -1.24 -4.82 121.20 121.13 3mw9 s ILE 158 Ca 0.00 -0.17 0.00 0.00 -1.41 0.00 0.00 60.65 59.07 3mw9 s ILE 158 Cb 0.00 -0.35 0.00 0.00 0.13 0.00 0.00 42.46 42.24 3mw9 s ILE 158 CO 0.00 -0.09 0.00 0.61 -1.91 0.00 0.00 174.94 173.55 3mw9 n GLY 159 N 2.56 3.92 0.38 1.50 0.00 0.26 -4.72 105.19 109.09 3mw9 n GLY 159 Ca -0.15 -0.42 0.20 0.00 0.00 0.00 0.00 46.02 45.65 3mw9 n GLY 159 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3mw9 h PRO 160 N 0.00 0.00 0.00 1.61 0.11 -1.79 0.16 132.00 132.10 3mw9 h PRO 160 Ca 0.00 0.00 -0.33 0.00 0.11 0.00 0.00 66.00 65.78 3mw9 h PRO 160 Cb 0.00 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.05 3mw9 h PRO 160 CO 0.00 0.00 -2.18 0.41 -0.21 0.00 0.00 178.00 176.02 3mw9 n GLY 161 N -1.54 -1.01 0.11 -0.55 0.00 -1.26 -4.67 105.19 96.28 3mw9 n GLY 161 Ca 0.07 -0.27 -0.23 0.00 0.00 0.00 0.00 46.02 45.60 3mw9 n GLY 161 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3mw9 n VAL 162 N -2.81 1.58 -3.55 1.61 0.31 -0.52 -3.89 118.33 111.06 3mw9 n VAL 162 Ca -0.27 -0.17 -0.01 0.00 -0.01 0.00 0.00 64.34 63.87 3mw9 n VAL 162 Cb 1.10 -1.97 -0.05 0.00 -0.91 0.00 0.00 33.84 32.02 3mw9 n VAL 162 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3mw9 s ASP 163 N -6.95 -0.77 -0.29 4.52 3.68 0.46 -0.28 116.67 117.05 3mw9 s ASP 163 Ca -0.29 1.11 0.02 0.00 2.13 0.00 0.00 52.55 55.52 3mw9 s ASP 163 Cb 0.07 1.71 0.08 0.00 -1.45 0.00 0.00 42.92 43.33 3mw9 s ASP 163 CO 0.61 -0.16 0.00 -0.69 0.13 0.00 0.00 175.17 175.06 3mw9 s VAL 164 N 2.23 1.76 0.00 1.11 1.01 0.82 -0.57 120.40 126.76 3mw9 s VAL 164 Ca -0.06 -1.70 0.00 0.00 0.00 0.00 0.00 61.98 60.22 3mw9 s VAL 164 Cb -0.07 -2.15 0.00 0.00 0.00 0.00 0.00 36.38 34.16 3mw9 s VAL 164 CO -0.18 -0.37 0.00 -2.65 0.00 0.00 0.00 175.10 171.91 3mw9 n PRO 165 N 4.52 0.12 0.00 2.72 -0.02 -1.23 -2.94 135.00 138.18 3mw9 n PRO 165 Ca -0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.43 3mw9 n PRO 165 Cb 0.43 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.91 3mw9 n PRO 165 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3mw9 n ALA 166 N -3.00 0.00 -1.65 3.55 0.00 -1.19 -1.54 120.51 116.68 3mw9 n ALA 166 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.14 3mw9 n ALA 166 Cb 0.00 0.00 0.07 0.00 0.00 0.00 0.00 19.45 19.52 3mw9 n ALA 166 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3mw9 s PRO 167 N -2.00 2.51 0.00 0.00 0.04 -1.26 0.46 135.00 134.75 3mw9 s PRO 167 Ca 0.00 0.67 0.00 0.00 0.04 0.00 0.00 61.00 61.71 3mw9 s PRO 167 Cb 0.00 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.58 3mw9 s PRO 167 CO 0.00 -1.33 0.00 -3.47 0.04 0.00 0.00 177.00 172.24 3mw9 n ASP 168 N -3.24 3.77 -4.67 6.66 -0.08 -1.21 -4.28 116.55 113.50 3mw9 n ASP 168 Ca 0.07 0.00 -0.42 0.00 -1.51 0.00 0.00 54.79 52.93 3mw9 n ASP 168 Cb 0.56 0.00 -0.03 0.00 2.34 0.00 0.00 41.12 43.99 3mw9 n ASP 168 CO 0.00 0.00 0.00 -0.04 0.12 0.00 0.00 177.20 177.28 3mw9 s MET 169 N 4.96 4.21 0.00 -0.67 -1.94 -1.26 -2.80 119.30 121.80 3mw9 s MET 169 Ca 0.00 2.02 0.00 0.00 -1.71 0.00 0.00 55.69 56.00 3mw9 s MET 169 Cb 0.00 -3.84 0.00 0.00 2.01 0.00 0.00 34.83 33.00 3mw9 s MET 169 CO 0.00 -0.76 0.00 0.43 -0.01 0.00 0.00 175.02 174.68 3mw9 n SER 170 N 6.63 -0.49 -4.42 3.03 7.64 -1.26 -1.88 113.62 122.87 3mw9 n SER 170 Ca 0.16 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.74 3mw9 n SER 170 Cb 0.43 -0.72 -0.13 0.00 -1.01 0.00 0.00 64.21 62.78 3mw9 n SER 170 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3mw9 s THR 171 N -3.04 2.50 0.00 0.44 -4.23 -1.12 -4.82 115.64 105.37 3mw9 s THR 171 Ca 0.00 -1.46 0.00 0.00 -1.18 0.00 0.00 61.69 59.05 3mw9 s THR 171 Cb 0.00 -2.07 0.00 0.00 1.34 0.00 0.00 72.50 71.77 3mw9 s THR 171 CO 0.00 0.23 0.00 0.61 -0.54 0.00 0.00 174.62 174.92 3mw9 n GLY 172 N 1.27 4.37 0.32 3.99 0.00 -1.26 -3.47 105.19 110.42 3mw9 n GLY 172 Ca -0.17 -0.80 0.12 0.00 0.00 0.00 0.00 46.02 45.17 3mw9 n GLY 172 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3mw9 h GLU 173 N 0.00 0.06 -0.28 1.61 5.08 -1.94 -2.08 114.58 117.02 3mw9 h GLU 173 Ca 0.00 -0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 3mw9 h GLU 173 Cb 0.00 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 3mw9 h GLU 173 CO 0.00 0.04 0.03 -0.09 -1.00 0.00 0.00 179.01 177.99 3mw9 h ARG 174 N 0.06 0.48 -0.07 2.33 2.43 -1.95 0.16 114.38 117.82 3mw9 h ARG 174 Ca 0.55 -0.13 -0.19 0.00 -0.81 0.00 0.00 59.98 59.39 3mw9 h ARG 174 Cb 1.08 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 30.58 3mw9 h ARG 174 CO -0.83 0.60 -0.77 1.05 -1.51 0.00 0.00 179.97 178.51 3mw9 h GLU 175 N 0.28 0.42 -0.91 0.20 9.09 -1.87 -2.65 114.58 119.14 3mw9 h GLU 175 Ca 0.08 -0.36 0.07 0.00 0.05 0.00 0.00 59.36 59.20 3mw9 h GLU 175 Cb 0.36 0.08 -0.06 0.00 -1.65 0.00 0.00 28.75 27.48 3mw9 h GLU 175 CO 0.01 1.01 0.59 0.52 0.05 0.00 0.00 179.01 181.19 3mw9 h MET 176 N 0.28 0.99 -0.45 1.06 2.86 -1.08 0.26 114.93 118.85 3mw9 h MET 176 Ca -0.04 -0.06 -0.02 0.00 -2.06 0.00 0.00 59.70 57.52 3mw9 h MET 176 Cb 1.36 -0.22 -0.02 0.00 0.06 0.00 0.00 31.60 32.78 3mw9 h MET 176 CO 0.13 0.65 0.19 1.03 1.06 0.00 0.00 176.91 179.98 3mw9 h SER 177 N 1.02 0.61 0.32 1.22 0.87 -0.68 -2.14 113.55 114.78 3mw9 h SER 177 Ca 0.40 -0.16 -0.02 0.00 -1.23 0.00 0.00 61.79 60.79 3mw9 h SER 177 Cb 0.24 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.04 3mw9 h SER 177 CO -0.16 0.60 -0.16 -0.50 -0.53 0.00 0.00 176.83 176.09 3mw9 h TRP 178 N 0.59 -0.40 -0.59 2.24 6.55 -0.89 -2.16 115.95 121.29 3mw9 h TRP 178 Ca 0.15 -0.01 0.11 0.00 0.95 0.00 0.00 58.89 60.10 3mw9 h TRP 178 Cb 0.17 0.13 -0.11 0.00 -0.86 0.00 0.00 29.16 28.49 3mw9 h TRP 178 CO -0.00 -0.18 -0.23 0.82 -1.05 0.00 0.00 178.44 177.81 3mw9 h ILE 179 N -0.55 0.30 -0.68 1.49 2.04 -0.93 -1.30 117.51 117.87 3mw9 h ILE 179 Ca -0.04 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.77 3mw9 h ILE 179 Cb 0.41 0.30 -0.03 0.00 -0.74 0.00 0.00 36.82 36.75 3mw9 h ILE 179 CO 0.07 0.00 0.25 0.00 0.00 0.00 0.00 178.15 178.47 3mw9 h ALA 180 N 1.35 1.16 -0.16 1.87 0.00 -1.27 -1.52 119.26 120.68 3mw9 h ALA 180 Ca 0.27 -0.19 -0.16 0.00 0.00 0.00 0.00 54.91 54.83 3mw9 h ALA 180 Cb 0.50 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3mw9 h ALA 180 CO -0.64 0.60 -0.56 0.22 0.00 0.00 0.00 179.25 178.87 3mw9 h ASP 181 N 0.99 0.55 0.63 0.00 3.58 -0.71 0.24 116.42 121.70 3mw9 h ASP 181 Ca 0.23 -0.30 -0.26 0.00 0.42 0.00 0.00 57.03 57.12 3mw9 h ASP 181 Cb 0.23 -0.16 0.00 0.00 1.72 0.00 0.00 39.33 41.12 3mw9 h ASP 181 CO -0.02 1.00 -1.19 0.71 -2.88 0.00 0.00 179.24 176.86 3mw9 h THR 182 N 0.38 1.51 -0.19 2.25 1.35 -1.03 -2.45 112.91 114.72 3mw9 h THR 182 Ca 0.00 -3.02 -0.02 0.00 -0.55 0.00 0.00 66.41 62.83 3mw9 h THR 182 Cb 1.09 2.88 -0.01 0.00 -1.73 0.00 0.00 68.15 70.38 3mw9 h THR 182 CO 0.10 0.88 0.06 0.22 -0.25 0.00 0.00 175.52 176.53 3mw9 h TYR 183 N 0.08 0.31 0.00 4.73 3.20 -1.17 -2.61 116.97 121.53 3mw9 h TYR 183 Ca -0.12 -0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.66 3mw9 h TYR 183 Cb 1.91 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 40.08 3mw9 h TYR 183 CO 0.06 0.41 -0.30 0.00 -1.64 0.00 0.00 178.16 176.68 3mw9 h ALA 184 N 0.87 1.44 0.00 1.82 0.00 -1.01 0.01 119.26 122.40 3mw9 h ALA 184 Ca 0.06 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3mw9 h ALA 184 Cb 0.24 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.98 3mw9 h ALA 184 CO -0.00 0.37 -0.34 0.77 0.00 0.00 0.00 179.25 180.05 3mw9 h SER 185 N 0.00 0.00 0.00 0.00 0.02 -1.36 -3.04 113.55 109.17 3mw9 h SER 185 Ca -0.00 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 3mw9 h SER 185 Cb 0.55 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.09 3mw9 h SER 185 CO 0.04 0.03 0.00 0.41 -1.14 0.00 0.00 176.83 176.17 3mw9 n THR 186 N -2.46 0.00 -0.31 -2.27 -1.04 -0.99 -4.69 114.28 102.52 3mw9 n THR 186 Ca 0.04 0.00 0.27 0.00 -2.04 0.00 0.00 64.05 62.32 3mw9 n THR 186 Cb 0.47 0.00 0.59 0.00 -1.82 0.00 0.00 70.33 69.58 3mw9 n THR 186 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 3mw9 h ILE 187 N 0.00 0.49 -0.59 12.58 1.08 -1.75 -2.21 117.51 127.10 3mw9 h ILE 187 Ca 0.00 -0.09 0.00 0.00 -0.39 0.00 0.00 64.86 64.38 3mw9 h ILE 187 Cb 0.00 0.21 0.00 0.00 -3.07 0.00 0.00 36.82 33.96 3mw9 h ILE 187 CO 0.00 0.05 0.00 0.61 -0.69 0.00 0.00 178.15 178.12 3mw9 n GLY 188 N -1.57 2.86 0.33 5.37 0.00 -0.03 -4.60 105.19 107.54 3mw9 n GLY 188 Ca 0.25 -0.82 0.22 0.00 0.00 0.00 0.00 46.02 45.67 3mw9 n GLY 188 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3mw9 h HIS 189 N 3.72 0.00 -0.01 1.61 6.17 -1.27 -0.75 115.15 124.62 3mw9 h HIS 189 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.08 3mw9 h HIS 189 Cb 1.36 0.00 0.00 0.00 2.52 0.00 0.00 27.41 31.29 3mw9 h HIS 189 CO 0.68 0.00 -0.35 0.66 0.71 0.00 0.00 177.93 179.63 3mw9 n TYR 190 N -3.15 0.00 -2.77 5.26 4.02 -1.26 -4.97 117.16 114.29 3mw9 n TYR 190 Ca -0.03 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.44 3mw9 n TYR 190 Cb 0.09 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.38 3mw9 n TYR 190 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 3mw9 s ASP 191 N -1.86 6.90 0.64 7.72 -1.08 -0.29 -4.90 116.67 123.80 3mw9 s ASP 191 Ca 0.12 1.07 0.30 0.00 -0.52 0.00 0.00 52.55 53.51 3mw9 s ASP 191 Cb 0.12 -2.49 1.62 0.00 -1.46 0.00 0.00 42.92 40.71 3mw9 s ASP 191 CO 0.40 -0.67 1.94 -0.29 0.52 0.00 0.00 175.17 177.07 3mw9 h ILE 192 N 5.54 0.14 -0.27 4.11 2.10 -1.93 -2.20 117.51 125.00 3mw9 h ILE 192 Ca -0.21 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.73 3mw9 h ILE 192 Cb 1.08 0.68 0.00 0.00 -1.09 0.00 0.00 36.82 37.49 3mw9 h ILE 192 CO 0.95 0.00 0.00 0.59 -1.08 0.00 0.00 178.15 178.61 3mw9 n ASN 193 N -3.19 3.64 -0.45 2.19 3.02 -1.26 -4.78 115.26 114.43 3mw9 n ASN 193 Ca 0.01 -2.81 0.41 0.00 -0.03 0.00 0.00 54.58 52.17 3mw9 n ASN 193 Cb 0.44 -0.47 0.75 0.00 -0.61 0.00 0.00 39.78 39.89 3mw9 n ASN 193 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3mw9 h ALA 194 N 1.78 3.37 -0.02 5.41 0.00 -1.64 0.58 119.26 128.73 3mw9 h ALA 194 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3mw9 h ALA 194 Cb 1.28 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.18 3mw9 h ALA 194 CO 0.17 -1.85 0.00 0.72 0.00 0.00 0.00 179.25 178.29 3mw9 n HIS 195 N -3.96 0.01 -0.44 0.00 8.25 -1.26 -2.87 115.22 114.95 3mw9 n HIS 195 Ca 0.32 -0.01 0.08 0.00 -0.26 0.00 0.00 57.72 57.85 3mw9 n HIS 195 Cb 1.56 0.00 0.33 0.00 1.12 0.00 0.00 29.99 33.00 3mw9 n HIS 195 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3mw9 n ALA 196 N 0.26 3.24 0.31 -1.41 0.00 0.20 -4.41 120.51 118.70 3mw9 n ALA 196 Ca 0.19 -1.48 0.16 0.00 0.00 0.00 0.00 53.44 52.30 3mw9 n ALA 196 Cb 0.37 -1.05 0.60 0.00 0.00 0.00 0.00 19.45 19.37 3mw9 n ALA 196 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3mw9 s VAL 198 N -3.54 0.02 0.54 0.00 0.11 -1.26 -3.50 120.40 112.78 3mw9 s VAL 198 Ca 0.03 -0.19 0.03 0.00 -2.93 0.00 0.00 61.98 58.91 3mw9 s VAL 198 Cb 0.09 -0.82 0.02 0.00 -1.53 0.00 0.00 36.38 34.14 3mw9 s VAL 198 CO 0.52 -0.11 0.23 0.42 -3.33 0.00 0.00 175.10 172.83 3mw9 s THR 199 N -1.09 1.35 -0.13 5.04 -4.23 -0.59 -4.71 115.64 111.28 3mw9 s THR 199 Ca -0.11 -1.72 0.00 0.00 -1.18 0.00 0.00 61.69 58.68 3mw9 s THR 199 Cb -0.03 -2.07 0.00 0.00 1.34 0.00 0.00 72.50 71.74 3mw9 s THR 199 CO 0.07 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.76 3mw9 n GLY 200 N -1.57 0.44 3.85 3.99 0.00 -1.26 -4.35 105.19 106.28 3mw9 n GLY 200 Ca -0.10 -0.98 -0.31 0.00 0.00 0.00 0.00 46.02 44.63 3mw9 n GLY 200 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mw9 s LYS 201 N -2.65 3.29 0.63 1.61 1.02 -1.26 -4.05 119.74 118.33 3mw9 s LYS 201 Ca 0.00 0.85 -0.19 0.00 0.02 0.00 0.00 55.97 56.65 3mw9 s LYS 201 Cb 0.00 -2.04 -0.02 0.00 -0.52 0.00 0.00 37.83 35.25 3mw9 s LYS 201 CO 0.00 -0.82 1.32 -2.14 -0.92 0.00 0.00 175.35 172.79 3mw9 s PRO 202 N -5.09 2.67 0.39 -1.68 0.02 -1.26 -3.97 135.00 126.08 3mw9 s PRO 202 Ca 0.57 2.13 0.12 0.00 0.02 0.00 0.00 61.00 63.83 3mw9 s PRO 202 Cb -0.12 -1.94 0.92 0.00 0.02 0.00 0.00 34.50 33.37 3mw9 s PRO 202 CO 0.54 -1.53 1.90 0.82 -0.33 0.00 0.00 177.00 178.40 3mw9 h ILE 203 N 0.75 0.83 0.00 2.83 1.08 -1.91 -0.62 117.51 120.47 3mw9 h ILE 203 Ca -0.51 -0.20 0.00 0.00 -0.39 0.00 0.00 64.86 63.76 3mw9 h ILE 203 Cb 1.33 0.21 0.00 0.00 -3.07 0.00 0.00 36.82 35.29 3mw9 h ILE 203 CO 0.54 0.10 0.00 -1.54 -0.69 0.00 0.00 178.15 176.56 3mw9 n SER 204 N -4.52 0.00 -0.04 1.72 3.41 -1.26 -2.31 113.62 110.62 3mw9 n SER 204 Ca 0.15 -0.03 0.00 0.00 -0.26 0.00 0.00 58.87 58.74 3mw9 n SER 204 Cb 0.47 -0.26 0.01 0.00 -0.26 0.00 0.00 64.21 64.17 3mw9 n SER 204 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3mw9 n GLN 205 N -1.26 2.60 0.00 4.33 1.13 -0.37 -4.94 117.38 118.86 3mw9 n GLN 205 Ca 0.09 -1.44 0.00 0.00 -1.94 0.00 0.00 57.00 53.71 3mw9 n GLN 205 Cb 0.14 -1.02 0.00 0.00 0.11 0.00 0.00 30.24 29.47 3mw9 n GLN 205 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3mw9 n GLY 206 N -0.38 1.09 3.69 1.08 0.00 -0.98 -4.90 105.19 104.80 3mw9 n GLY 206 Ca 0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 3mw9 n GLY 206 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3mw9 s GLY 207 N -1.09 1.58 0.16 -0.02 0.00 -0.44 -4.76 107.32 102.75 3mw9 s GLY 207 Ca 0.00 -0.31 0.10 0.00 0.00 0.00 0.00 44.72 44.51 3mw9 s GLY 207 CO 0.00 0.28 -0.21 -1.50 0.00 0.00 0.00 173.10 171.66 3mw9 s ILE 208 N -2.97 2.55 0.04 0.90 2.07 -1.26 -4.50 121.20 118.02 3mw9 s ILE 208 Ca 0.65 -1.81 -0.35 0.00 -1.41 0.00 0.00 60.65 57.73 3mw9 s ILE 208 Cb -0.18 -2.20 -0.14 0.00 0.13 0.00 0.00 42.46 40.07 3mw9 s ILE 208 CO 0.57 -0.02 1.62 1.57 -1.91 0.00 0.00 174.94 176.77 3mw9 n HIS 209 N 0.50 2.12 -0.84 3.50 -0.00 -1.26 -2.60 115.22 116.63 3mw9 n HIS 209 Ca -0.14 0.30 0.00 0.00 -0.00 0.00 0.00 57.72 57.87 3mw9 n HIS 209 Cb 0.54 -2.52 0.00 0.00 -0.00 0.00 0.00 29.99 28.01 3mw9 n HIS 209 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3mw9 n GLY 210 N 3.56 0.78 0.34 1.57 0.00 -1.26 -4.91 105.19 105.27 3mw9 n GLY 210 Ca 0.20 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.26 3mw9 n GLY 210 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3mw9 h ARG 211 N 2.56 0.72 -0.25 1.61 9.65 -1.87 0.04 114.38 126.83 3mw9 h ARG 211 Ca 0.00 -0.04 -0.12 0.00 -1.10 0.00 0.00 59.98 58.71 3mw9 h ARG 211 Cb 0.00 -0.16 -0.00 0.00 -1.39 0.00 0.00 29.97 28.42 3mw9 h ARG 211 CO 0.00 0.47 -0.32 0.97 2.80 0.00 0.00 179.97 183.89 3mw9 h ILE 212 N 0.74 1.31 -0.03 1.20 2.10 -1.91 -2.43 117.51 118.49 3mw9 h ILE 212 Ca 0.26 -1.51 0.00 0.00 1.08 0.00 0.00 64.86 64.68 3mw9 h ILE 212 Cb 0.10 1.69 0.00 0.00 -1.09 0.00 0.00 36.82 37.51 3mw9 h ILE 212 CO -0.07 0.48 0.00 -1.54 -1.08 0.00 0.00 178.15 175.94 3mw9 n SER 213 N -4.26 1.16 -0.30 2.19 3.41 -1.03 -4.48 113.62 110.30 3mw9 n SER 213 Ca -0.05 -1.42 -0.03 0.00 -0.26 0.00 0.00 58.87 57.12 3mw9 n SER 213 Cb 0.49 -0.01 0.09 0.00 -0.26 0.00 0.00 64.21 64.52 3mw9 n SER 213 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3mw9 h ALA 214 N 4.23 1.05 0.00 7.33 0.00 -0.47 -0.34 119.26 131.05 3mw9 h ALA 214 Ca 0.00 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 3mw9 h ALA 214 Cb 0.38 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3mw9 h ALA 214 CO 0.00 0.38 -0.25 0.00 0.00 0.00 0.00 179.25 179.37 3mw9 h THR 215 N 1.04 0.45 -0.10 0.00 1.03 -1.77 -1.57 112.91 112.00 3mw9 h THR 215 Ca 0.31 -1.54 -0.03 0.00 -0.01 0.00 0.00 66.41 65.14 3mw9 h THR 215 Cb -0.04 2.14 -0.00 0.00 -1.07 0.00 0.00 68.15 69.18 3mw9 h THR 215 CO -0.10 0.25 -0.05 1.23 -0.01 0.00 0.00 175.52 176.84 3mw9 h GLY 216 N 3.46 0.22 1.46 2.99 0.00 -1.54 -1.42 103.07 108.24 3mw9 h GLY 216 Ca -0.00 -0.20 0.07 0.00 0.00 0.00 0.00 47.33 47.19 3mw9 h GLY 216 CO 0.03 0.18 0.20 -0.09 0.00 0.00 0.00 176.54 176.87 3mw9 h ARG 217 N -0.16 0.00 0.13 4.80 2.43 -0.79 -1.64 114.38 119.15 3mw9 h ARG 217 Ca 0.02 0.00 -0.28 0.00 -0.81 0.00 0.00 59.98 58.91 3mw9 h ARG 217 Cb 0.51 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.06 3mw9 h ARG 217 CO 0.01 0.00 -1.27 0.78 -1.51 0.00 0.00 179.97 177.99 3mw9 h GLY 218 N 0.00 0.31 1.03 2.80 0.00 -0.97 -2.39 103.07 103.85 3mw9 h GLY 218 Ca 0.11 -0.79 -0.06 0.00 0.00 0.00 0.00 47.33 46.59 3mw9 h GLY 218 CO -0.00 0.69 0.14 -2.08 0.00 0.00 0.00 176.54 175.29 3mw9 h VAL 219 N 0.07 1.26 0.42 4.60 2.07 -0.51 -0.41 116.25 123.75 3mw9 h VAL 219 Ca -0.14 -0.94 -0.01 0.00 0.82 0.00 0.00 66.70 66.43 3mw9 h VAL 219 Cb 1.98 0.68 -0.03 0.00 -1.52 0.00 0.00 31.29 32.39 3mw9 h VAL 219 CO 0.20 0.35 -0.52 0.15 0.02 0.00 0.00 177.57 177.77 3mw9 h PHE 220 N 0.91 -1.45 -0.94 1.57 3.57 -1.28 -1.76 116.94 117.56 3mw9 h PHE 220 Ca 0.19 0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.78 3mw9 h PHE 220 Cb 0.37 0.58 -0.06 0.00 2.79 0.00 0.00 35.95 39.63 3mw9 h PHE 220 CO 0.03 -0.67 0.61 0.45 -2.23 0.00 0.00 178.31 176.50 3mw9 h HIS 221 N -0.96 1.09 -0.56 0.41 3.86 -1.32 0.15 115.15 117.81 3mw9 h HIS 221 Ca -0.05 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.17 3mw9 h HIS 221 Cb 0.86 -0.36 -0.03 0.00 1.06 0.00 0.00 27.41 28.95 3mw9 h HIS 221 CO -0.30 0.55 0.30 0.78 0.86 0.00 0.00 177.93 180.11 3mw9 h GLY 222 N 1.05 0.85 0.73 2.45 0.00 -0.97 -1.91 103.07 105.27 3mw9 h GLY 222 Ca 0.41 -0.40 -0.04 0.00 0.00 0.00 0.00 47.33 47.31 3mw9 h GLY 222 CO -0.17 0.38 -0.34 -2.22 0.00 0.00 0.00 176.54 174.19 3mw9 h ILE 223 N 0.76 0.02 -0.27 2.60 2.04 -0.48 -3.22 117.51 118.95 3mw9 h ILE 223 Ca 0.20 -0.29 0.02 0.00 1.00 0.00 0.00 64.86 65.79 3mw9 h ILE 223 Cb 0.07 0.02 -0.03 0.00 -0.74 0.00 0.00 36.82 36.14 3mw9 h ILE 223 CO -0.03 0.00 -0.16 1.21 0.00 0.00 0.00 178.15 179.17 3mw9 n GLU 224 N -5.41 -0.12 -0.49 2.37 2.13 0.44 0.08 120.64 119.64 3mw9 n GLU 224 Ca -0.12 0.86 0.41 0.00 0.66 0.00 0.00 57.16 58.97 3mw9 n GLU 224 Cb 0.38 -1.28 0.69 0.00 0.27 0.00 0.00 31.44 31.50 3mw9 n GLU 224 CO 0.00 0.00 0.00 -0.91 -0.41 0.00 0.00 177.13 175.81 3mw9 h ASN 225 N 0.00 0.19 0.16 4.31 2.35 -1.41 -0.77 115.58 120.41 3mw9 h ASN 225 Ca 0.04 0.14 -0.35 0.00 -0.55 0.00 0.00 56.30 55.58 3mw9 h ASN 225 Cb 0.11 0.14 -0.05 0.00 0.05 0.00 0.00 38.32 38.57 3mw9 h ASN 225 CO -0.26 -0.22 -2.14 0.49 -1.65 0.00 0.00 177.43 173.65 3mw9 n PHE 226 N -4.65 0.53 0.25 1.19 3.01 0.11 -4.22 117.46 113.67 3mw9 n PHE 226 Ca 0.40 0.15 0.12 0.00 1.01 0.00 0.00 57.45 59.13 3mw9 n PHE 226 Cb 1.59 -1.08 0.63 0.00 -0.01 0.00 0.00 39.48 40.60 3mw9 n PHE 226 CO 0.00 0.00 0.00 0.97 1.01 0.00 0.00 176.76 178.74 3mw9 h ILE 227 N 0.01 0.54 -0.78 4.37 6.09 0.83 -2.56 117.51 126.01 3mw9 h ILE 227 Ca -0.46 -0.77 -0.33 0.00 -1.37 0.00 0.00 64.86 61.94 3mw9 h ILE 227 Cb 2.07 1.51 -0.19 0.00 0.47 0.00 0.00 36.82 40.68 3mw9 h ILE 227 CO 0.03 0.16 0.41 0.59 -3.07 0.00 0.00 178.15 176.27 3mw9 n ASN 228 N -3.51 4.16 -4.06 2.19 5.03 -0.47 -2.76 115.26 115.84 3mw9 n ASN 228 Ca -0.01 -3.26 -0.32 0.00 0.87 0.00 0.00 54.58 51.85 3mw9 n ASN 228 Cb 0.31 -0.76 -0.14 0.00 -1.02 0.00 0.00 39.78 38.17 3mw9 n ASN 228 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 3mw9 s GLU 229 N -2.85 1.80 0.16 3.52 2.56 -0.96 -4.96 118.70 117.97 3mw9 s GLU 229 Ca 0.51 -1.72 -0.20 0.00 0.00 0.00 0.00 54.97 53.56 3mw9 s GLU 229 Cb 0.41 -3.22 0.07 0.00 2.00 0.00 0.00 34.13 33.40 3mw9 s GLU 229 CO 0.11 -0.87 1.63 0.00 -0.56 0.00 0.00 175.26 175.58 3mw9 h ALA 230 N 7.75 0.03 -0.86 6.30 0.00 -1.88 -0.80 119.26 129.80 3mw9 h ALA 230 Ca -0.10 0.12 0.18 0.00 0.00 0.00 0.00 54.91 55.11 3mw9 h ALA 230 Cb 1.03 0.48 -0.06 0.00 0.00 0.00 0.00 17.79 19.23 3mw9 h ALA 230 CO 0.54 -0.59 0.57 0.66 0.00 0.00 0.00 179.25 180.43 3mw9 h SER 231 N -0.16 0.47 0.30 0.00 4.64 -1.96 0.12 113.55 116.95 3mw9 h SER 231 Ca 0.18 0.04 -0.33 0.00 -0.47 0.00 0.00 61.79 61.20 3mw9 h SER 231 Cb 0.43 -0.05 0.03 0.00 -0.31 0.00 0.00 62.40 62.49 3mw9 h SER 231 CO -0.44 0.21 -1.53 1.88 -0.87 0.00 0.00 176.83 176.08 3mw9 h TYR 232 N 0.48 0.84 0.00 4.77 0.05 -1.73 -3.20 116.97 118.17 3mw9 h TYR 232 Ca 0.44 -0.61 0.00 0.00 0.05 0.00 0.00 58.73 58.61 3mw9 h TYR 232 Cb 0.98 -0.03 0.00 0.00 1.01 0.00 0.00 36.73 38.69 3mw9 h TYR 232 CO -0.00 1.55 0.00 -1.33 -1.05 0.00 0.00 178.16 177.33 3mw9 n MET 233 N -3.65 0.12 0.13 4.88 2.81 -0.37 -2.78 117.12 118.27 3mw9 n MET 233 Ca -0.18 0.16 -0.06 0.00 -1.81 0.00 0.00 57.70 55.81 3mw9 n MET 233 Cb 1.09 -1.50 -0.03 0.00 -0.71 0.00 0.00 33.22 32.07 3mw9 n MET 233 CO 0.00 0.00 0.00 0.77 1.51 0.00 0.00 175.97 178.25 3mw9 h SER 234 N 0.00 -0.34 0.00 7.83 0.02 -0.80 -0.51 113.55 119.75 3mw9 h SER 234 Ca 0.00 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 3mw9 h SER 234 Cb 0.23 0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.86 3mw9 h SER 234 CO 0.00 0.08 0.30 0.40 -1.14 0.00 0.00 176.83 176.47 3mw9 h ILE 235 N -1.06 0.00 0.00 3.27 1.08 -1.55 0.72 117.51 119.97 3mw9 h ILE 235 Ca -0.04 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.43 3mw9 h ILE 235 Cb 0.31 0.49 0.00 0.00 -3.07 0.00 0.00 36.82 34.55 3mw9 h ILE 235 CO 0.07 0.00 -0.80 0.18 -0.69 0.00 0.00 178.15 176.91 3mw9 n LEU 236 N -2.47 0.51 -2.77 1.44 4.77 -1.16 -4.98 117.00 112.34 3mw9 n LEU 236 Ca -0.01 -0.41 -0.12 0.00 -0.03 0.00 0.00 56.01 55.43 3mw9 n LEU 236 Cb 0.33 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.49 3mw9 n LEU 236 CO 0.10 0.13 0.08 0.61 -1.33 0.00 0.00 177.39 176.97 3mw9 n GLY 237 N 1.38 -0.16 3.23 -0.72 0.00 0.24 -5.04 105.19 104.13 3mw9 n GLY 237 Ca 0.02 -0.04 -0.13 0.00 0.00 0.00 0.00 46.02 45.87 3mw9 n GLY 237 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3mw9 s MET 238 N -4.95 1.05 -0.15 1.61 -1.94 -0.25 -5.05 119.30 109.62 3mw9 s MET 238 Ca 0.01 -1.48 -0.19 0.00 -1.71 0.00 0.00 55.69 52.32 3mw9 s MET 238 Cb -0.00 -0.33 -0.04 0.00 2.01 0.00 0.00 34.83 36.47 3mw9 s MET 238 CO 0.53 -0.07 0.53 -0.08 -0.01 0.00 0.00 175.02 175.92 3mw9 s THR 239 N -3.58 5.13 0.53 2.05 -1.32 -1.26 -4.58 115.64 112.61 3mw9 s THR 239 Ca 0.20 1.03 -0.19 0.00 -1.21 0.00 0.00 61.69 61.52 3mw9 s THR 239 Cb 0.05 -3.86 -0.09 0.00 -1.51 0.00 0.00 72.50 67.09 3mw9 s THR 239 CO 0.02 0.25 0.60 -2.65 -2.21 0.00 0.00 174.62 170.62 3mw9 n PRO 240 N 4.17 0.62 0.00 7.08 -0.02 -1.26 -4.86 135.00 140.73 3mw9 n PRO 240 Ca -0.05 0.24 0.00 0.00 -2.02 0.00 0.00 63.50 61.67 3mw9 n PRO 240 Cb 0.51 -1.72 0.00 0.00 -0.02 0.00 0.00 33.50 32.27 3mw9 n PRO 240 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3mw9 n GLY 241 N 1.70 2.14 0.00 -1.23 0.00 -1.11 -4.79 105.19 101.91 3mw9 n GLY 241 Ca 0.11 -1.96 0.11 0.00 0.00 0.00 0.00 46.02 44.29 3mw9 n GLY 241 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3mw9 n PHE 242 N 1.36 0.03 -0.33 1.61 3.72 -1.26 -4.60 117.46 117.99 3mw9 n PHE 242 Ca 0.00 0.01 0.17 0.00 -0.05 0.00 0.00 57.45 57.58 3mw9 n PHE 242 Cb 0.00 -0.21 0.37 0.00 -0.94 0.00 0.00 39.48 38.70 3mw9 n PHE 242 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 3mw9 h GLY 243 N 4.95 1.78 -0.90 1.37 0.00 -1.81 -2.30 103.07 106.16 3mw9 h GLY 243 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.10 3mw9 h GLY 243 CO 0.00 -0.32 0.00 2.09 0.00 0.00 0.00 176.54 178.31 3mw9 n ASP 244 N -5.00 2.17 -4.91 0.19 3.85 -1.26 -4.81 116.55 106.78 3mw9 n ASP 244 Ca 0.26 -1.62 -0.28 0.00 -0.71 0.00 0.00 54.79 52.44 3mw9 n ASP 244 Cb 0.76 -0.07 0.02 0.00 -1.35 0.00 0.00 41.12 40.48 3mw9 n ASP 244 CO 0.00 0.00 0.00 -0.54 -1.01 0.00 0.00 177.20 175.65 3mw9 s LYS 245 N -0.88 3.12 -0.00 0.11 3.01 -0.86 -4.97 119.74 119.27 3mw9 s LYS 245 Ca 0.15 0.18 0.00 0.00 -1.01 0.00 0.00 55.97 55.29 3mw9 s LYS 245 Cb 0.09 -2.24 0.00 0.00 -1.01 0.00 0.00 37.83 34.67 3mw9 s LYS 245 CO 0.13 -0.62 -0.01 -0.08 0.51 0.00 0.00 175.35 175.27 3mw9 s THR 246 N -3.01 0.11 0.23 2.17 -1.32 -1.26 -1.56 115.64 111.00 3mw9 s THR 246 Ca 0.53 -0.05 -0.06 0.00 -1.21 0.00 0.00 61.69 60.91 3mw9 s THR 246 Cb -0.11 -0.11 -0.02 0.00 -1.51 0.00 0.00 72.50 70.75 3mw9 s THR 246 CO 0.47 0.04 0.29 0.72 -2.21 0.00 0.00 174.62 173.93 3mw9 s PHE 247 N 0.04 0.83 -0.07 9.09 -0.12 0.85 -1.33 117.98 127.28 3mw9 s PHE 247 Ca -0.00 -1.11 -0.08 0.00 -0.05 0.00 0.00 56.93 55.69 3mw9 s PHE 247 Cb -0.01 -0.23 0.02 0.00 -0.63 0.00 0.00 43.02 42.16 3mw9 s PHE 247 CO -0.00 -0.81 0.21 0.54 -0.05 0.00 0.00 175.22 175.11 3mw9 s VAL 248 N -4.05 0.01 -0.17 -2.49 0.11 -0.23 -1.98 120.40 111.60 3mw9 s VAL 248 Ca 0.32 -0.09 -0.01 0.00 -2.93 0.00 0.00 61.98 59.27 3mw9 s VAL 248 Cb 0.03 -0.34 -0.00 0.00 -1.53 0.00 0.00 36.38 34.55 3mw9 s VAL 248 CO 0.11 -0.05 -0.13 0.54 -3.33 0.00 0.00 175.10 172.24 3mw9 s VAL 249 N -0.10 2.79 -0.52 2.04 0.11 -1.19 0.26 120.40 123.79 3mw9 s VAL 249 Ca -0.02 -0.71 -0.24 0.00 -2.93 0.00 0.00 61.98 58.08 3mw9 s VAL 249 Cb -0.02 -2.21 0.04 0.00 -1.53 0.00 0.00 36.38 32.66 3mw9 s VAL 249 CO 0.01 0.50 0.89 -1.58 -3.33 0.00 0.00 175.10 171.58 3mw9 s GLN 250 N 1.01 3.35 0.00 1.54 0.74 -0.29 -1.27 119.66 124.74 3mw9 s GLN 250 Ca -0.01 -0.23 0.00 0.00 0.05 0.00 0.00 55.36 55.17 3mw9 s GLN 250 Cb -0.15 -4.02 0.00 0.00 1.10 0.00 0.00 33.01 29.94 3mw9 s GLN 250 CO -0.02 -1.37 0.00 0.41 -0.55 0.00 0.00 175.29 173.75 3mw9 n GLY 251 N 5.08 2.74 2.18 2.59 0.00 -0.31 0.11 105.19 117.58 3mw9 n GLY 251 Ca 0.02 -1.11 -0.28 0.00 0.00 0.00 0.00 46.02 44.65 3mw9 n GLY 251 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3mw9 n PHE 252 N 0.94 2.95 -0.42 1.61 7.35 -1.25 -4.10 117.46 124.55 3mw9 n PHE 252 Ca 0.00 -2.53 0.00 0.00 -0.76 0.00 0.00 57.45 54.16 3mw9 n PHE 252 Cb 0.00 -0.68 0.00 0.00 0.35 0.00 0.00 39.48 39.15 3mw9 n PHE 252 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3mw9 n GLY 253 N -0.75 1.36 0.24 7.13 0.00 -1.26 -4.42 105.19 107.50 3mw9 n GLY 253 Ca 0.50 -1.66 -0.10 0.00 0.00 0.00 0.00 46.02 44.75 3mw9 n GLY 253 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3mw9 h ASN 254 N 0.00 0.75 -0.14 1.61 -0.26 -1.94 -1.16 115.58 114.45 3mw9 h ASN 254 Ca 0.00 -0.28 -0.23 0.00 -0.56 0.00 0.00 56.30 55.22 3mw9 h ASN 254 Cb 0.00 -0.20 0.01 0.00 -1.06 0.00 0.00 38.32 37.07 3mw9 h ASN 254 CO 0.00 0.85 -0.81 1.62 -1.06 0.00 0.00 177.43 178.03 3mw9 h VAL 255 N 0.63 1.27 0.32 2.81 3.04 -1.90 -3.18 116.25 119.25 3mw9 h VAL 255 Ca 0.13 -2.00 -0.02 0.00 -1.01 0.00 0.00 66.70 63.81 3mw9 h VAL 255 Cb 0.44 2.02 0.00 0.00 -2.01 0.00 0.00 31.29 31.75 3mw9 h VAL 255 CO 0.02 0.63 -0.15 1.23 -1.01 0.00 0.00 177.57 178.29 3mw9 h GLY 256 N 0.53 -0.44 0.90 3.17 0.00 -1.68 -0.77 103.07 104.78 3mw9 h GLY 256 Ca -0.06 0.16 0.01 0.00 0.00 0.00 0.00 47.33 47.44 3mw9 h GLY 256 CO 0.17 -0.16 0.04 -2.00 0.00 0.00 0.00 176.54 174.59 3mw9 h LEU 257 N -0.46 0.05 -0.23 3.11 5.85 -1.32 -1.93 115.31 120.37 3mw9 h LEU 257 Ca -0.04 0.01 -0.22 0.00 0.84 0.00 0.00 57.88 58.47 3mw9 h LEU 257 Cb 0.35 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.39 3mw9 h LEU 257 CO 0.07 0.05 -0.89 0.45 -0.34 0.00 0.00 178.44 177.79 3mw9 h HIS 258 N 0.11 0.61 -0.72 1.25 3.86 -1.53 -0.08 115.15 118.64 3mw9 h HIS 258 Ca 0.06 -0.31 0.16 0.00 -1.16 0.00 0.00 60.37 59.11 3mw9 h HIS 258 Cb 0.03 -0.08 -0.11 0.00 1.06 0.00 0.00 27.41 28.31 3mw9 h HIS 258 CO -0.11 1.12 0.13 0.77 0.86 0.00 0.00 177.93 180.71 3mw9 h SER 259 N 0.25 -0.07 -0.29 2.45 0.02 -1.04 -1.54 113.55 113.33 3mw9 h SER 259 Ca -0.07 0.15 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 3mw9 h SER 259 Cb 1.51 0.23 -0.01 0.00 0.14 0.00 0.00 62.40 64.26 3mw9 h SER 259 CO 0.15 -0.07 0.18 -0.03 -1.14 0.00 0.00 176.83 175.93 3mw9 h MET 260 N 0.22 0.38 -0.92 3.45 -1.53 -0.59 -2.67 114.93 113.27 3mw9 h MET 260 Ca 0.40 -0.03 0.04 0.00 -3.44 0.00 0.00 59.70 56.67 3mw9 h MET 260 Cb 0.69 -0.08 -0.05 0.00 -0.55 0.00 0.00 31.60 31.61 3mw9 h MET 260 CO -0.53 0.27 0.60 0.00 0.14 0.00 0.00 176.91 177.39 3mw9 h ARG 261 N 0.38 1.11 0.14 0.39 3.08 -0.05 -1.34 114.38 118.09 3mw9 h ARG 261 Ca 0.10 -0.07 -0.18 0.00 0.07 0.00 0.00 59.98 59.91 3mw9 h ARG 261 Cb -0.02 -0.25 0.02 0.00 0.08 0.00 0.00 29.97 29.80 3mw9 h ARG 261 CO -0.02 0.74 -0.80 1.88 -1.07 0.00 0.00 179.97 180.69 3mw9 h TYR 262 N 1.15 0.52 -0.91 3.04 0.99 -1.36 -1.93 116.97 118.47 3mw9 h TYR 262 Ca 0.36 -0.38 0.06 0.00 2.00 0.00 0.00 58.73 60.77 3mw9 h TYR 262 Cb 0.02 -0.02 -0.06 0.00 1.00 0.00 0.00 36.73 37.67 3mw9 h TYR 262 CO -0.00 1.31 0.59 -0.07 -0.00 0.00 0.00 178.16 179.99 3mw9 h LEU 263 N -0.39 0.93 -0.95 3.88 3.38 -1.47 -1.54 115.31 119.13 3mw9 h LEU 263 Ca -0.14 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.73 3mw9 h LEU 263 Cb 1.62 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 42.16 3mw9 h LEU 263 CO 0.14 0.60 -0.33 -0.74 0.09 0.00 0.00 178.44 178.21 3mw9 h HIS 264 N 1.06 0.41 -0.02 1.13 2.76 -1.24 -0.56 115.15 118.69 3mw9 h HIS 264 Ca 0.39 -0.10 -0.09 0.00 -2.20 0.00 0.00 60.37 58.37 3mw9 h HIS 264 Cb 0.16 -0.10 -0.01 0.00 1.55 0.00 0.00 27.41 29.02 3mw9 h HIS 264 CO -0.00 0.65 -0.40 -0.09 -1.30 0.00 0.00 177.93 176.79 3mw9 h ARG 265 N 0.31 0.03 -0.77 5.26 2.43 -0.47 -2.59 114.38 118.58 3mw9 h ARG 265 Ca 0.04 -0.01 -0.40 0.00 -0.81 0.00 0.00 59.98 58.79 3mw9 h ARG 265 Cb 0.73 -0.00 -0.24 0.00 -0.42 0.00 0.00 29.97 30.04 3mw9 h ARG 265 CO 0.06 0.42 0.39 1.19 -1.51 0.00 0.00 179.97 180.52 3mw9 n PHE 266 N -4.06 2.37 -0.89 2.20 3.01 -0.93 -4.95 117.46 114.21 3mw9 n PHE 266 Ca -0.02 -1.77 0.00 0.00 1.01 0.00 0.00 57.45 56.67 3mw9 n PHE 266 Cb 0.43 -0.79 0.00 0.00 -0.01 0.00 0.00 39.48 39.11 3mw9 n PHE 266 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3mw9 n GLY 267 N -1.14 0.55 3.86 1.37 0.00 -0.98 -4.47 105.19 104.37 3mw9 n GLY 267 Ca 0.51 -0.07 -0.31 0.00 0.00 0.00 0.00 46.02 46.15 3mw9 n GLY 267 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mw9 s ALA 268 N -2.00 3.21 -0.15 4.61 0.00 -0.23 -4.59 121.76 122.62 3mw9 s ALA 268 Ca 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 51.96 51.92 3mw9 s ALA 268 Cb 0.00 -2.90 -0.02 0.00 0.00 0.00 0.00 23.12 20.20 3mw9 s ALA 268 CO 0.00 -0.14 -0.10 0.21 0.00 0.00 0.00 175.76 175.73 3mw9 s LYS 269 N -4.02 3.45 -0.29 0.00 2.20 -0.60 -4.18 119.74 116.30 3mw9 s LYS 269 Ca 0.55 -0.64 -0.12 0.00 -0.36 0.00 0.00 55.97 55.39 3mw9 s LYS 269 Cb -0.10 -2.74 -0.04 0.00 -1.51 0.00 0.00 37.83 33.43 3mw9 s LYS 269 CO 0.32 0.16 0.25 0.00 -0.36 0.00 0.00 175.35 175.73 3mw9 n ILE 271 N 5.09 0.29 -4.12 0.00 -5.35 -0.84 0.11 119.36 114.55 3mw9 n ILE 271 Ca -0.12 -0.35 -0.08 0.00 -0.27 0.00 0.00 62.75 61.93 3mw9 n ILE 271 Cb 0.51 -0.13 -0.10 0.00 -1.74 0.00 0.00 39.64 38.18 3mw9 n ILE 271 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 3mw9 s THR 272 N -2.61 0.24 -0.25 7.28 -4.23 -1.26 0.18 115.64 114.98 3mw9 s THR 272 Ca -0.05 -1.85 -0.02 0.00 -1.18 0.00 0.00 61.69 58.60 3mw9 s THR 272 Cb 0.06 -1.69 0.14 0.00 1.34 0.00 0.00 72.50 72.35 3mw9 s THR 272 CO 0.48 -0.83 0.37 -0.69 -0.54 0.00 0.00 174.62 173.40 3mw9 s VAL 273 N -3.93 -0.58 0.24 2.29 1.01 -0.95 -3.19 120.40 115.30 3mw9 s VAL 273 Ca 0.12 -0.16 -0.13 0.00 0.00 0.00 0.00 61.98 61.82 3mw9 s VAL 273 Cb 0.08 -0.86 -0.08 0.00 0.00 0.00 0.00 36.38 35.52 3mw9 s VAL 273 CO -0.06 -0.19 0.62 -0.83 0.00 0.00 0.00 175.10 174.64 3mw9 s GLY 274 N 2.52 2.35 0.28 4.51 0.00 -0.40 -2.54 107.32 114.04 3mw9 s GLY 274 Ca 0.11 -0.12 0.06 0.00 0.00 0.00 0.00 44.72 44.77 3mw9 s GLY 274 CO -0.20 0.08 0.21 1.18 0.00 0.00 0.00 173.10 174.36 3mw9 n GLU 275 N 0.02 0.39 -0.21 2.90 -0.58 -0.49 -1.16 120.64 121.50 3mw9 n GLU 275 Ca 0.00 -2.74 -0.07 0.00 -0.42 0.00 0.00 57.16 53.93 3mw9 n GLU 275 Cb 0.52 2.10 0.07 0.00 -0.57 0.00 0.00 31.44 33.57 3mw9 n GLU 275 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 3mw9 h SER 276 N 1.61 0.99 0.56 1.62 4.64 -2.01 -3.14 113.55 117.81 3mw9 h SER 276 Ca -0.20 -0.24 -0.29 0.00 -0.47 0.00 0.00 61.79 60.59 3mw9 h SER 276 Cb 0.98 -0.26 -0.00 0.00 -0.31 0.00 0.00 62.40 62.80 3mw9 h SER 276 CO 0.30 1.00 -1.39 -2.24 -0.87 0.00 0.00 176.83 173.63 3mw9 h ASP 277 N 0.97 0.37 0.00 4.97 3.04 -2.02 -3.50 116.42 120.25 3mw9 h ASP 277 Ca 0.19 -0.46 0.00 0.00 -3.24 0.00 0.00 57.03 53.52 3mw9 h ASP 277 Cb 0.44 -0.12 0.00 0.00 -1.04 0.00 0.00 39.33 38.61 3mw9 h ASP 277 CO 0.01 1.37 0.00 0.61 -2.04 0.00 0.00 179.24 179.20 3mw9 n GLY 278 N 1.59 -1.72 3.74 7.15 0.00 -1.19 -5.15 105.19 109.61 3mw9 n GLY 278 Ca -0.12 -1.10 -0.23 0.00 0.00 0.00 0.00 46.02 44.57 3mw9 n GLY 278 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3mw9 s SER 279 N -1.29 4.72 0.12 1.61 0.01 -1.26 -1.40 113.70 116.21 3mw9 s SER 279 Ca 0.00 -0.75 0.01 0.00 1.31 0.00 0.00 55.95 56.52 3mw9 s SER 279 Cb 0.00 -0.75 -0.04 0.00 0.21 0.00 0.00 66.02 65.44 3mw9 s SER 279 CO 0.00 -0.29 -0.03 0.27 0.41 0.00 0.00 173.24 173.60 3mw9 s ILE 280 N -2.41 0.55 -0.14 1.44 -4.36 -1.05 -2.36 121.20 112.86 3mw9 s ILE 280 Ca 0.38 -1.93 -0.19 0.00 -0.26 0.00 0.00 60.65 58.65 3mw9 s ILE 280 Cb -0.03 -1.84 0.05 0.00 1.25 0.00 0.00 42.46 41.89 3mw9 s ILE 280 CO 0.23 -0.72 0.50 0.86 0.24 0.00 0.00 174.94 176.04 3mw9 s TRP 281 N -3.73 -0.51 -0.30 1.37 -0.00 -0.88 -2.24 118.94 112.65 3mw9 s TRP 281 Ca 0.16 1.14 -0.12 0.00 -0.00 0.00 0.00 56.10 57.29 3mw9 s TRP 281 Cb 0.06 0.20 0.18 0.00 -0.00 0.00 0.00 33.47 33.91 3mw9 s TRP 281 CO -0.02 -0.33 1.00 1.21 -0.00 0.00 0.00 176.95 178.81 3mw9 s ASN 282 N -0.19 -0.56 0.02 5.86 3.04 0.13 -1.54 114.94 121.70 3mw9 s ASN 282 Ca -0.04 0.37 0.20 0.00 0.04 0.00 0.00 52.86 53.43 3mw9 s ASN 282 Cb -0.03 1.48 0.85 0.00 -1.54 0.00 0.00 41.25 42.01 3mw9 s ASN 282 CO 0.02 -0.11 1.65 -2.65 -3.04 0.00 0.00 177.10 172.97 3mw9 n PRO 283 N 5.45 0.02 0.00 0.43 -0.02 -1.26 -1.28 135.00 138.35 3mw9 n PRO 283 Ca -0.06 0.18 0.14 0.00 -2.02 0.00 0.00 63.50 61.73 3mw9 n PRO 283 Cb 0.53 -1.53 0.65 0.00 -0.02 0.00 0.00 33.50 33.13 3mw9 n PRO 283 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3mw9 n ASP 284 N -1.57 0.09 0.00 2.55 8.00 -1.26 -4.97 116.55 119.39 3mw9 n ASP 284 Ca 0.05 0.07 0.00 0.00 0.71 0.00 0.00 54.79 55.62 3mw9 n ASP 284 Cb 0.24 -0.31 0.00 0.00 -0.02 0.00 0.00 41.12 41.02 3mw9 n ASP 284 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3mw9 n GLY 285 N 1.39 2.27 3.16 0.44 0.00 -0.40 -4.99 105.19 107.07 3mw9 n GLY 285 Ca 0.11 -1.81 -0.32 0.00 0.00 0.00 0.00 46.02 44.00 3mw9 n GLY 285 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3mw9 s ILE 286 N -2.44 1.97 -0.23 -0.61 1.01 0.31 -4.91 121.20 116.29 3mw9 s ILE 286 Ca 0.00 -0.93 -0.29 0.00 0.00 0.00 0.00 60.65 59.43 3mw9 s ILE 286 Cb 0.00 -1.74 0.01 0.00 0.01 0.00 0.00 42.46 40.74 3mw9 s ILE 286 CO 0.00 0.53 1.04 -0.62 0.00 0.00 0.00 174.94 175.90 3mw9 s ASP 287 N 0.74 7.09 0.35 3.58 -1.08 -1.26 -4.59 116.67 121.50 3mw9 s ASP 287 Ca -0.09 1.36 0.02 0.00 -0.52 0.00 0.00 52.55 53.32 3mw9 s ASP 287 Cb -0.16 -2.54 0.63 0.00 -1.46 0.00 0.00 42.92 39.39 3mw9 s ASP 287 CO 0.00 -0.68 2.00 -0.65 0.52 0.00 0.00 175.17 176.37 3mw9 h PRO 288 N 7.48 0.85 -0.51 4.34 0.11 -1.98 -2.05 132.00 140.25 3mw9 h PRO 288 Ca -0.19 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 65.83 3mw9 h PRO 288 Cb 1.06 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 31.96 3mw9 h PRO 288 CO 0.98 0.56 0.17 -0.22 -0.21 0.00 0.00 178.00 179.29 3mw9 h LYS 289 N 0.88 0.78 -0.32 1.05 1.63 -1.99 -0.66 116.57 117.93 3mw9 h LYS 289 Ca 0.25 -0.16 -0.12 0.00 -0.85 0.00 0.00 60.65 59.77 3mw9 h LYS 289 Cb -0.07 -0.12 -0.01 0.00 -0.60 0.00 0.00 32.23 31.43 3mw9 h LYS 289 CO -0.06 0.71 -0.25 0.93 -3.45 0.00 0.00 179.45 177.34 3mw9 h GLU 290 N 0.68 0.74 -0.43 1.90 5.08 -1.90 -2.14 114.58 118.51 3mw9 h GLU 290 Ca 0.17 -0.36 -0.05 0.00 -1.00 0.00 0.00 59.36 58.11 3mw9 h GLU 290 Cb 0.25 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 3mw9 h GLU 290 CO -0.01 0.98 0.07 1.25 -1.00 0.00 0.00 179.01 180.30 3mw9 h LEU 291 N 0.50 0.61 -0.35 1.33 6.46 -1.32 -0.69 115.31 121.85 3mw9 h LEU 291 Ca 0.06 -0.11 -0.16 0.00 -0.12 0.00 0.00 57.88 57.55 3mw9 h LEU 291 Cb 0.81 -0.16 -0.00 0.00 -0.73 0.00 0.00 40.66 40.58 3mw9 h LEU 291 CO 0.07 0.64 -0.42 -0.08 -0.62 0.00 0.00 178.44 178.03 3mw9 h GLU 292 N 0.64 0.90 0.00 1.25 4.81 -0.91 -0.14 114.58 121.12 3mw9 h GLU 292 Ca 0.14 -0.50 -0.07 0.00 -0.13 0.00 0.00 59.36 58.80 3mw9 h GLU 292 Cb 0.30 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 3mw9 h GLU 292 CO 0.00 1.15 -0.34 -0.44 -0.73 0.00 0.00 179.01 178.65 3mw9 h ASP 293 N 0.70 0.00 0.24 1.04 3.45 -1.16 0.64 116.42 121.33 3mw9 h ASP 293 Ca 0.05 0.00 -0.22 0.00 0.43 0.00 0.00 57.03 57.29 3mw9 h ASP 293 Cb 1.02 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.79 3mw9 h ASP 293 CO 0.10 0.34 -0.87 0.15 -1.57 0.00 0.00 179.24 177.39 3mw9 h PHE 294 N 0.00 0.67 -0.10 4.55 3.04 -0.87 -2.12 116.94 122.11 3mw9 h PHE 294 Ca -0.00 -0.34 -0.17 0.00 3.98 0.00 0.00 57.97 61.44 3mw9 h PHE 294 Cb 0.61 -0.09 -0.01 0.00 2.56 0.00 0.00 35.95 39.02 3mw9 h PHE 294 CO 0.00 1.14 -0.65 -0.22 -2.02 0.00 0.00 178.31 176.57 3mw9 h LYS 295 N 0.29 0.38 0.00 1.11 1.63 -0.65 -1.88 116.57 117.45 3mw9 h LYS 295 Ca -0.07 -0.28 -0.10 0.00 -0.85 0.00 0.00 60.65 59.35 3mw9 h LYS 295 Cb 1.49 0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 33.16 3mw9 h LYS 295 CO 0.16 0.90 -0.50 -0.07 -3.45 0.00 0.00 179.45 176.49 3mw9 h LEU 296 N 0.28 0.00 0.12 5.20 3.38 -0.88 -1.10 115.31 122.31 3mw9 h LEU 296 Ca -0.01 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.79 3mw9 h LEU 296 Cb 1.19 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.96 3mw9 h LEU 296 CO 0.11 0.50 -0.72 -0.61 0.09 0.00 0.00 178.44 177.80 3mw9 h GLN 297 N 0.00 0.25 -0.01 1.13 5.75 -1.10 -3.39 115.11 117.74 3mw9 h GLN 297 Ca -0.00 -0.42 0.00 0.00 -0.15 0.00 0.00 58.65 58.07 3mw9 h GLN 297 Cb 0.96 0.16 0.00 0.00 1.07 0.00 0.00 27.48 29.67 3mw9 h GLN 297 CO 0.06 1.20 -0.06 0.72 -2.65 0.00 0.00 178.83 178.10 3mw9 n HIS 298 N -4.19 0.00 -1.32 3.99 8.25 -0.73 -4.99 115.22 116.23 3mw9 n HIS 298 Ca -0.14 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.21 3mw9 n HIS 298 Cb 0.77 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.84 3mw9 n HIS 298 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3mw9 n GLY 299 N 0.56 1.22 3.45 -1.41 0.00 -0.42 -4.96 105.19 103.63 3mw9 n GLY 299 Ca 0.03 -0.52 -0.12 0.00 0.00 0.00 0.00 46.02 45.42 3mw9 n GLY 299 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3mw9 s THR 300 N -2.40 0.00 -0.16 2.61 -1.32 -1.25 -5.04 115.64 108.08 3mw9 s THR 300 Ca 0.00 0.00 0.21 0.00 -1.21 0.00 0.00 61.69 60.69 3mw9 s THR 300 Cb 0.00 -1.00 -0.13 0.00 -1.51 0.00 0.00 72.50 69.86 3mw9 s THR 300 CO 0.00 0.00 0.81 2.30 -2.21 0.00 0.00 174.62 175.52 3mw9 n ILE 301 N -0.26 0.53 -1.70 5.08 -5.35 -1.26 -4.13 119.36 112.27 3mw9 n ILE 301 Ca -0.15 -0.56 -0.44 0.00 -0.27 0.00 0.00 62.75 61.33 3mw9 n ILE 301 Cb 0.64 -0.29 -0.03 0.00 -1.74 0.00 0.00 39.64 38.22 3mw9 n ILE 301 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 3mw9 n LEU 302 N -2.58 3.58 0.00 7.28 4.77 -1.26 -2.03 117.00 126.76 3mw9 n LEU 302 Ca -0.04 1.13 0.00 0.00 -0.03 0.00 0.00 56.01 57.07 3mw9 n LEU 302 Cb 0.61 -1.49 0.00 0.00 -2.33 0.00 0.00 43.42 40.21 3mw9 n LEU 302 CO 0.42 -0.20 0.00 0.61 -1.33 0.00 0.00 177.39 176.89 3mw9 n GLY 303 N 2.50 0.64 3.67 -0.72 0.00 -1.26 -5.01 105.19 105.01 3mw9 n GLY 303 Ca 0.12 -0.42 -0.42 0.00 0.00 0.00 0.00 46.02 45.30 3mw9 n GLY 303 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3mw9 s PHE 304 N -2.00 2.08 0.22 1.61 5.36 -0.86 -4.91 117.98 119.49 3mw9 s PHE 304 Ca 0.00 0.22 -0.19 0.00 -0.96 0.00 0.00 56.93 56.00 3mw9 s PHE 304 Cb 0.00 -3.93 0.20 0.00 -0.34 0.00 0.00 43.02 38.96 3mw9 s PHE 304 CO 0.00 -3.85 1.55 -2.30 -1.46 0.00 0.00 175.22 169.16 3mw9 n PRO 305 N 6.74 -0.26 -0.36 10.12 -0.02 -1.26 -2.36 135.00 147.60 3mw9 n PRO 305 Ca 0.17 1.53 -0.03 0.00 -2.02 0.00 0.00 63.50 63.15 3mw9 n PRO 305 Cb 0.42 -2.27 0.10 0.00 -0.02 0.00 0.00 33.50 31.73 3mw9 n PRO 305 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3mw9 n LYS 306 N -5.44 1.84 -3.89 -0.52 4.76 -1.26 -4.85 118.16 108.80 3mw9 n LYS 306 Ca 0.09 -1.03 -0.10 0.00 -2.87 0.00 0.00 58.31 54.40 3mw9 n LYS 306 Cb 0.38 -1.57 0.00 0.00 -1.84 0.00 0.00 35.03 32.01 3mw9 n LYS 306 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3mw9 s ALA 307 N -1.33 -0.41 -0.06 7.82 0.00 -0.99 -4.85 121.76 121.93 3mw9 s ALA 307 Ca 0.19 -0.90 0.06 0.00 0.00 0.00 0.00 51.96 51.31 3mw9 s ALA 307 Cb 0.15 0.82 -0.01 0.00 0.00 0.00 0.00 23.12 24.08 3mw9 s ALA 307 CO 0.04 -0.94 -0.25 0.15 0.00 0.00 0.00 175.76 174.77 3mw9 s LYS 308 N -2.70 2.58 -0.78 0.00 1.02 -0.59 -4.75 119.74 114.53 3mw9 s LYS 308 Ca 0.19 -0.90 -0.23 0.00 0.02 0.00 0.00 55.97 55.05 3mw9 s LYS 308 Cb -0.04 -2.18 -0.17 0.00 -0.52 0.00 0.00 37.83 34.93 3mw9 s LYS 308 CO 0.13 0.38 2.39 -0.89 -0.92 0.00 0.00 175.35 176.44 3mw9 n ILE 309 N 2.96 -0.02 -2.28 2.17 2.08 -1.26 -2.07 119.36 120.94 3mw9 n ILE 309 Ca -0.17 -0.53 -0.37 0.00 0.56 0.00 0.00 62.75 62.24 3mw9 n ILE 309 Cb 0.52 -1.71 -0.01 0.00 -0.75 0.00 0.00 39.64 37.69 3mw9 n ILE 309 CO 0.00 0.00 0.00 -0.47 0.56 0.00 0.00 176.55 176.64 3mw9 s TYR 310 N 11.14 2.88 -0.02 1.39 6.14 -0.99 -4.96 117.35 132.92 3mw9 s TYR 310 Ca 1.05 1.55 0.04 0.00 0.64 0.00 0.00 57.07 60.35 3mw9 s TYR 310 Cb -0.36 -3.34 -0.01 0.00 0.42 0.00 0.00 41.96 38.67 3mw9 s TYR 310 CO 0.24 -1.43 -0.15 -2.00 0.64 0.00 0.00 175.55 172.85 3mw9 s GLU 311 N -2.78 1.36 0.00 4.97 2.56 -1.26 -4.18 118.70 119.36 3mw9 s GLU 311 Ca 0.65 -0.54 0.00 0.00 0.00 0.00 0.00 54.97 55.08 3mw9 s GLU 311 Cb -0.27 -1.26 0.00 0.00 2.00 0.00 0.00 34.13 34.59 3mw9 s GLU 311 CO 0.33 0.28 0.00 0.41 -0.56 0.00 0.00 175.26 175.72 3mw9 n GLY 312 N 2.88 2.24 3.71 -1.50 0.00 -1.26 -5.00 105.19 106.26 3mw9 n GLY 312 Ca -0.16 -1.81 -0.56 0.00 0.00 0.00 0.00 46.02 43.49 3mw9 n GLY 312 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3mw9 n SER 313 N 0.00 2.53 -0.04 1.61 2.88 -1.26 -4.82 113.62 114.52 3mw9 n SER 313 Ca 0.00 1.06 0.23 0.00 -1.33 0.00 0.00 58.87 58.83 3mw9 n SER 313 Cb 0.00 -1.17 0.71 0.00 -0.75 0.00 0.00 64.21 63.00 3mw9 n SER 313 CO 0.00 0.00 0.00 -0.29 -1.23 0.00 0.00 175.04 173.52 3mw9 h ILE 314 N 5.27 0.65 0.00 2.46 6.09 -1.97 -0.52 117.51 129.49 3mw9 h ILE 314 Ca -0.47 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.02 3mw9 h ILE 314 Cb 1.31 0.67 0.00 0.00 0.47 0.00 0.00 36.82 39.28 3mw9 h ILE 314 CO 0.96 0.00 0.00 -0.07 -3.07 0.00 0.00 178.15 175.97 3mw9 h LEU 315 N 0.00 0.00 -1.87 2.19 3.38 -1.96 -3.06 115.31 113.99 3mw9 h LEU 315 Ca 0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.27 3mw9 h LEU 315 Cb 1.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 3mw9 h LEU 315 CO -0.00 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.91 3mw9 n GLU 316 N -2.92 1.65 -1.59 1.13 1.02 -0.21 -4.61 120.64 115.11 3mw9 n GLU 316 Ca 0.00 -1.68 -0.38 0.00 -0.02 0.00 0.00 57.16 55.09 3mw9 n GLU 316 Cb 0.26 -1.35 0.05 0.00 -0.02 0.00 0.00 31.44 30.38 3mw9 n GLU 316 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3mw9 n VAL 317 N 1.00 3.36 -2.71 2.62 0.31 -1.16 -4.76 118.33 116.99 3mw9 n VAL 317 Ca 0.12 -0.50 -0.42 0.00 -0.01 0.00 0.00 64.34 63.52 3mw9 n VAL 317 Cb 0.45 -1.08 -0.03 0.00 -0.91 0.00 0.00 33.84 32.27 3mw9 n VAL 317 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3mw9 s ASP 318 N -1.18 7.14 0.15 4.52 -1.08 -1.26 -4.56 116.67 120.39 3mw9 s ASP 318 Ca 0.73 1.41 -0.25 0.00 -0.52 0.00 0.00 52.55 53.92 3mw9 s ASP 318 Cb -0.43 -2.53 0.06 0.00 -1.46 0.00 0.00 42.92 38.56 3mw9 s ASP 318 CO 0.49 -0.53 0.89 0.00 0.52 0.00 0.00 175.17 176.55 3mw9 h ASP 320 N 2.00 0.07 -3.20 0.00 3.32 -1.52 -3.30 116.42 113.79 3mw9 h ASP 320 Ca -0.23 -0.87 -0.67 0.00 0.02 0.00 0.00 57.03 55.28 3mw9 h ASP 320 Cb 1.24 -0.02 -0.33 0.00 0.22 0.00 0.00 39.33 40.44 3mw9 h ASP 320 CO 0.26 1.19 -0.81 -0.63 -1.72 0.00 0.00 179.24 177.54 3mw9 s ILE 321 N -2.29 2.51 -0.29 0.35 1.01 -0.46 -0.54 121.20 121.50 3mw9 s ILE 321 Ca -0.21 -0.81 -0.12 0.00 0.00 0.00 0.00 60.65 59.52 3mw9 s ILE 321 Cb -0.00 -2.10 -0.04 0.00 0.01 0.00 0.00 42.46 40.32 3mw9 s ILE 321 CO 0.68 0.48 0.21 -0.22 0.00 0.00 0.00 174.94 176.10 3mw9 s LEU 322 N 1.35 4.14 -0.69 2.97 2.96 0.19 -1.07 118.68 128.53 3mw9 s LEU 322 Ca 0.05 -0.09 -0.08 0.00 -0.22 0.00 0.00 54.13 53.79 3mw9 s LEU 322 Cb -0.14 -2.14 0.18 0.00 0.50 0.00 0.00 46.19 44.59 3mw9 s LEU 322 CO -0.09 -0.10 0.56 -0.63 -1.32 0.00 0.00 176.35 174.76 3mw9 s ILE 323 N 1.77 4.52 -0.38 6.68 1.01 0.14 -0.59 121.20 134.35 3mw9 s ILE 323 Ca 0.07 -2.65 -0.28 0.00 0.00 0.00 0.00 60.65 57.79 3mw9 s ILE 323 Cb -0.16 -3.87 -0.02 0.00 0.01 0.00 0.00 42.46 38.42 3mw9 s ILE 323 CO 0.11 -0.93 1.76 -2.16 0.00 0.00 0.00 174.94 173.72 3mw9 s PRO 324 N 0.17 3.26 -0.36 2.79 0.04 -1.25 -1.14 135.00 138.50 3mw9 s PRO 324 Ca 0.16 1.25 0.08 0.00 0.04 0.00 0.00 61.00 62.53 3mw9 s PRO 324 Cb -0.17 -4.21 0.44 0.00 0.04 0.00 0.00 34.50 30.61 3mw9 s PRO 324 CO -0.05 -1.96 1.13 0.00 0.04 0.00 0.00 177.00 176.17 3mw9 n ALA 325 N 10.49 4.82 -2.20 8.56 0.00 0.31 -1.82 120.51 140.68 3mw9 n ALA 325 Ca 0.22 -3.96 0.00 0.00 0.00 0.00 0.00 53.44 49.70 3mw9 n ALA 325 Cb 0.48 -0.49 0.00 0.00 0.00 0.00 0.00 19.45 19.44 3mw9 n ALA 325 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3mw9 n ALA 326 N -0.55 0.00 -3.00 0.00 0.00 -1.04 -4.37 120.51 111.54 3mw9 n ALA 326 Ca 0.38 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.79 3mw9 n ALA 326 Cb 0.80 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.26 3mw9 n ALA 326 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3mw9 n SER 327 N 0.00 0.23 -4.89 0.00 7.64 -1.26 -4.74 113.62 110.59 3mw9 n SER 327 Ca 0.00 -1.17 -0.29 0.00 1.01 0.00 0.00 58.87 58.42 3mw9 n SER 327 Cb 0.00 -0.05 0.04 0.00 -1.01 0.00 0.00 64.21 63.20 3mw9 n SER 327 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 3mw9 s GLU 328 N -2.28 2.89 -1.35 1.43 8.01 -1.26 -4.44 118.70 121.69 3mw9 s GLU 328 Ca 0.07 0.37 -0.03 0.00 0.01 0.00 0.00 54.97 55.38 3mw9 s GLU 328 Cb -0.01 -2.08 0.02 0.00 -4.31 0.00 0.00 34.13 27.76 3mw9 s GLU 328 CO 0.04 -0.95 0.77 1.63 0.01 0.00 0.00 175.26 176.76 3mw9 n LYS 329 N -2.91 -5.14 0.05 1.61 5.02 0.08 -4.72 118.16 112.14 3mw9 n LYS 329 Ca 0.06 0.62 0.11 0.00 -2.02 0.00 0.00 58.31 57.09 3mw9 n LYS 329 Cb 0.57 -5.27 -0.02 0.00 -0.02 0.00 0.00 35.03 30.30 3mw9 n LYS 329 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 3mw9 n GLN 330 N -4.37 0.46 -4.04 1.97 1.13 0.76 -4.42 117.38 108.87 3mw9 n GLN 330 Ca -0.22 0.00 -0.34 0.00 -1.94 0.00 0.00 57.00 54.50 3mw9 n GLN 330 Cb 0.65 -1.66 -0.15 0.00 0.11 0.00 0.00 30.24 29.19 3mw9 n GLN 330 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3mw9 s LEU 331 N -4.50 2.51 0.00 1.08 1.02 0.13 -4.99 118.68 113.93 3mw9 s LEU 331 Ca 0.00 -0.63 0.03 0.00 0.02 0.00 0.00 54.13 53.55 3mw9 s LEU 331 Cb 0.13 -1.58 -0.01 0.00 0.02 0.00 0.00 46.19 44.75 3mw9 s LEU 331 CO 0.82 -0.03 0.10 0.35 0.02 0.00 0.00 176.35 177.61 3mw9 n THR 332 N 4.67 0.00 -0.26 5.49 -2.24 -1.26 -0.77 114.28 119.91 3mw9 n THR 332 Ca -0.19 -1.27 0.06 0.00 -2.27 0.00 0.00 64.05 60.38 3mw9 n THR 332 Cb 0.50 0.52 0.30 0.00 -2.10 0.00 0.00 70.33 69.54 3mw9 n THR 332 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 3mw9 h LYS 333 N 0.00 0.86 0.43 -0.78 3.64 -1.87 -2.31 116.57 116.54 3mw9 h LYS 333 Ca -0.15 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.16 3mw9 h LYS 333 Cb 0.64 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.25 3mw9 h LYS 333 CO 0.24 0.57 -0.39 0.77 -2.27 0.00 0.00 179.45 178.37 3mw9 h SER 334 N 0.89 -1.06 -0.00 4.20 0.02 -1.94 -3.34 113.55 112.31 3mw9 h SER 334 Ca 0.38 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.41 3mw9 h SER 334 Cb 0.31 0.34 0.00 0.00 0.14 0.00 0.00 62.40 63.20 3mw9 h SER 334 CO -0.15 -0.53 -0.18 -0.46 -1.14 0.00 0.00 176.83 174.37 3mw9 n ASN 335 N -4.78 2.37 -0.37 3.07 6.94 -1.20 -4.26 115.26 117.02 3mw9 n ASN 335 Ca -0.10 -1.70 -0.01 0.00 -0.02 0.00 0.00 54.58 52.75 3mw9 n ASN 335 Cb 0.36 0.17 0.12 0.00 -2.36 0.00 0.00 39.78 38.08 3mw9 n ASN 335 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3mw9 h ALA 336 N 4.32 1.28 0.00 -2.53 0.00 -1.53 -2.67 119.26 118.13 3mw9 h ALA 336 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3mw9 h ALA 336 Cb 0.83 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3mw9 h ALA 336 CO 0.00 0.58 0.00 -2.30 0.00 0.00 0.00 179.25 177.53 3mw9 n PRO 337 N -4.43 0.01 -1.59 0.00 -0.02 -1.26 -3.36 135.00 124.35 3mw9 n PRO 337 Ca 0.13 0.35 0.01 0.00 -2.02 0.00 0.00 63.50 61.97 3mw9 n PRO 337 Cb 0.06 -1.50 0.07 0.00 -0.02 0.00 0.00 33.50 32.11 3mw9 n PRO 337 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 3mw9 n ARG 338 N -1.47 0.98 0.01 -0.52 1.85 -1.01 -4.86 116.66 111.64 3mw9 n ARG 338 Ca 0.02 -2.75 -0.14 0.00 -1.00 0.00 0.00 57.85 53.98 3mw9 n ARG 338 Cb 0.09 -0.85 -0.02 0.00 -1.05 0.00 0.00 32.46 30.62 3mw9 n ARG 338 CO 0.00 0.00 0.00 -0.39 -0.01 0.00 0.00 177.63 177.23 3mw9 h VAL 339 N 4.99 1.33 0.00 8.89 -1.51 -1.58 -3.43 116.25 124.94 3mw9 h VAL 339 Ca -0.11 -2.05 0.00 0.00 -1.23 0.00 0.00 66.70 63.31 3mw9 h VAL 339 Cb 1.55 2.04 0.00 0.00 -2.13 0.00 0.00 31.29 32.75 3mw9 h VAL 339 CO 0.15 0.63 0.00 2.29 -1.23 0.00 0.00 177.57 179.41 3mw9 n LYS 340 N -3.89 0.00 -2.31 5.19 2.85 -1.26 -4.44 118.16 114.30 3mw9 n LYS 340 Ca -0.06 0.00 -0.32 0.00 -1.05 0.00 0.00 58.31 56.88 3mw9 n LYS 340 Cb 0.73 -2.88 -0.02 0.00 -0.65 0.00 0.00 35.03 32.20 3mw9 n LYS 340 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3mw9 s ALA 341 N -1.90 3.01 -0.10 0.58 0.00 -1.24 -4.51 121.76 117.59 3mw9 s ALA 341 Ca 0.00 0.21 0.02 0.00 0.00 0.00 0.00 51.96 52.19 3mw9 s ALA 341 Cb 0.00 -3.14 -0.25 0.00 0.00 0.00 0.00 23.12 19.74 3mw9 s ALA 341 CO 0.00 -0.36 0.43 1.63 0.00 0.00 0.00 175.76 177.46 3mw9 n LYS 342 N -1.71 0.70 -4.59 0.00 4.76 0.30 -4.86 118.16 112.76 3mw9 n LYS 342 Ca 0.07 0.26 -0.33 0.00 -2.87 0.00 0.00 58.31 55.44 3mw9 n LYS 342 Cb 0.54 -1.72 -0.16 0.00 -1.84 0.00 0.00 35.03 31.85 3mw9 n LYS 342 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3mw9 s ILE 343 N -2.57 2.47 -0.39 -0.18 1.01 -0.52 -1.36 121.20 119.67 3mw9 s ILE 343 Ca -0.16 -0.84 -0.14 0.00 0.00 0.00 0.00 60.65 59.52 3mw9 s ILE 343 Cb 0.07 -2.03 0.01 0.00 0.01 0.00 0.00 42.46 40.53 3mw9 s ILE 343 CO 0.78 0.53 0.26 -0.63 0.00 0.00 0.00 174.94 175.88 3mw9 s ILE 344 N 0.80 5.09 -0.66 2.92 1.01 0.41 -0.63 121.20 130.14 3mw9 s ILE 344 Ca -0.06 -0.62 -0.16 0.00 0.00 0.00 0.00 60.65 59.81 3mw9 s ILE 344 Cb -0.15 -3.79 0.16 0.00 0.01 0.00 0.00 42.46 38.68 3mw9 s ILE 344 CO -0.00 -0.23 0.64 0.00 0.00 0.00 0.00 174.94 175.35 3mw9 s ALA 345 N 1.66 3.74 -0.71 9.38 0.00 0.24 -0.50 121.76 135.57 3mw9 s ALA 345 Ca 0.05 -2.76 -0.26 0.00 0.00 0.00 0.00 51.96 48.99 3mw9 s ALA 345 Cb -0.19 -3.42 -0.02 0.00 0.00 0.00 0.00 23.12 19.49 3mw9 s ALA 345 CO 0.09 -2.20 1.82 -1.21 0.00 0.00 0.00 175.76 174.27 3mw9 s GLU 346 N 1.34 2.69 0.11 0.00 2.02 -0.72 -3.82 118.70 120.32 3mw9 s GLU 346 Ca 0.10 0.24 0.04 0.00 0.02 0.00 0.00 54.97 55.38 3mw9 s GLU 346 Cb -0.22 -4.58 -0.23 0.00 0.10 0.00 0.00 34.13 29.21 3mw9 s GLU 346 CO -0.01 -2.83 1.24 0.78 0.02 0.00 0.00 175.26 174.45 3mw9 h GLY 347 N 16.39 0.08 -2.11 -1.39 0.00 -1.84 -3.37 103.07 110.82 3mw9 h GLY 347 Ca -0.15 -0.20 -0.47 0.00 0.00 0.00 0.00 47.33 46.52 3mw9 h GLY 347 CO 1.23 0.17 -0.03 0.00 0.00 0.00 0.00 176.54 177.91 3mw9 s ALA 348 N -2.70 3.63 -0.22 3.60 0.00 -0.75 -4.64 121.76 120.68 3mw9 s ALA 348 Ca -0.00 -0.93 -0.28 0.00 0.00 0.00 0.00 51.96 50.74 3mw9 s ALA 348 Cb 0.09 -2.27 0.00 0.00 0.00 0.00 0.00 23.12 20.95 3mw9 s ALA 348 CO 0.84 -0.45 0.99 -0.80 0.00 0.00 0.00 175.76 176.34 3mw9 s ASN 349 N -4.22 7.06 -0.95 0.00 0.01 -1.26 -4.29 114.94 111.30 3mw9 s ASN 349 Ca 0.49 1.33 -0.06 0.00 -0.71 0.00 0.00 52.86 53.91 3mw9 s ASN 349 Cb -0.10 -2.52 0.01 0.00 0.41 0.00 0.00 41.25 39.05 3mw9 s ASN 349 CO 0.40 -0.61 0.82 0.61 -1.51 0.00 0.00 177.10 176.81 3mw9 n GLY 350 N 3.38 -0.11 0.03 0.66 0.00 -1.26 -4.06 105.19 103.83 3mw9 n GLY 350 Ca 0.10 -0.02 0.13 0.00 0.00 0.00 0.00 46.02 46.23 3mw9 n GLY 350 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3mw9 n PRO 351 N -3.64 0.06 -4.90 1.61 -0.04 -1.26 -0.74 135.00 126.09 3mw9 n PRO 351 Ca -0.02 0.09 -0.27 0.00 -0.04 0.00 0.00 63.50 63.27 3mw9 n PRO 351 Cb 0.55 -1.58 -0.16 0.00 -0.04 0.00 0.00 33.50 32.27 3mw9 n PRO 351 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3mw9 s THR 352 N -3.03 1.52 0.81 0.52 -4.23 -1.26 -0.17 115.64 109.79 3mw9 s THR 352 Ca 0.12 -0.78 -0.12 0.00 -1.18 0.00 0.00 61.69 59.74 3mw9 s THR 352 Cb 0.16 -1.29 0.07 0.00 1.34 0.00 0.00 72.50 72.78 3mw9 s THR 352 CO 0.51 0.43 1.11 0.42 -0.54 0.00 0.00 174.62 176.55 3mw9 s THR 353 N -0.08 2.83 0.41 3.99 -4.23 0.05 -4.87 115.64 113.75 3mw9 s THR 353 Ca -0.02 0.27 0.17 0.00 -1.18 0.00 0.00 61.69 60.93 3mw9 s THR 353 Cb -0.11 -3.08 0.18 0.00 1.34 0.00 0.00 72.50 70.83 3mw9 s THR 353 CO 0.02 -0.35 1.96 1.55 -0.54 0.00 0.00 174.62 177.25 3mw9 h PRO 354 N -1.09 0.00 0.02 3.99 0.13 -1.93 -1.50 132.00 131.62 3mw9 h PRO 354 Ca -0.47 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3mw9 h PRO 354 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 3mw9 h PRO 354 CO 0.61 0.23 -0.01 1.49 -0.23 0.00 0.00 178.00 180.09 3mw9 h GLU 355 N 0.00 -0.03 0.00 0.86 4.57 -1.93 -1.93 114.58 116.11 3mw9 h GLU 355 Ca -0.00 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.17 3mw9 h GLU 355 Cb 0.44 0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 29.03 3mw9 h GLU 355 CO 0.03 0.14 -0.03 0.00 -1.18 0.00 0.00 179.01 177.97 3mw9 h ALA 356 N 0.77 1.10 -0.16 2.92 0.00 -1.71 -1.87 119.26 120.31 3mw9 h ALA 356 Ca -0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 3mw9 h ALA 356 Cb 0.19 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3mw9 h ALA 356 CO 0.01 0.04 0.04 -0.44 0.00 0.00 0.00 179.25 178.90 3mw9 h ASP 357 N 0.00 0.23 0.28 0.00 3.32 -0.55 -2.10 116.42 117.61 3mw9 h ASP 357 Ca -0.00 -0.23 0.00 0.00 0.02 0.00 0.00 57.03 56.82 3mw9 h ASP 357 Cb 0.25 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.72 3mw9 h ASP 357 CO 0.00 0.40 -0.29 0.50 -1.72 0.00 0.00 179.24 178.14 3mw9 h LYS 358 N 0.06 -0.58 -0.54 3.56 3.64 -0.66 -1.20 116.57 120.84 3mw9 h LYS 358 Ca 0.05 0.04 0.09 0.00 -1.27 0.00 0.00 60.65 59.56 3mw9 h LYS 358 Cb 0.26 0.13 -0.11 0.00 -0.41 0.00 0.00 32.23 32.10 3mw9 h LYS 358 CO 0.00 -0.39 -0.37 0.82 -2.27 0.00 0.00 179.45 177.25 3mw9 h ILE 359 N -0.60 0.15 -0.41 2.00 1.08 -1.45 -2.00 117.51 116.28 3mw9 h ILE 359 Ca -0.01 0.00 0.02 0.00 -0.39 0.00 0.00 64.86 64.48 3mw9 h ILE 359 Cb 0.55 0.15 -0.03 0.00 -3.07 0.00 0.00 36.82 34.43 3mw9 h ILE 359 CO -0.06 0.00 0.23 -0.26 -0.69 0.00 0.00 178.15 177.37 3mw9 h PHE 360 N -0.21 0.44 -0.45 1.37 0.05 -1.16 -1.53 116.94 115.44 3mw9 h PHE 360 Ca 0.20 0.01 0.07 0.00 3.82 0.00 0.00 57.97 62.08 3mw9 h PHE 360 Cb 0.56 -0.14 -0.09 0.00 2.00 0.00 0.00 35.95 38.28 3mw9 h PHE 360 CO -0.64 0.25 -0.47 -0.07 -0.18 0.00 0.00 178.31 177.20 3mw9 h LEU 361 N 0.47 -1.57 -0.77 1.54 3.38 -0.54 -0.91 115.31 116.91 3mw9 h LEU 361 Ca 0.16 0.23 0.05 0.00 0.09 0.00 0.00 57.88 58.42 3mw9 h LEU 361 Cb 0.02 0.68 -0.06 0.00 0.09 0.00 0.00 40.66 41.39 3mw9 h LEU 361 CO -0.08 -0.37 0.46 -0.33 0.09 0.00 0.00 178.44 178.21 3mw9 h GLU 362 N -0.32 0.83 -0.66 1.13 5.08 -0.75 -2.09 114.58 117.81 3mw9 h GLU 362 Ca 0.13 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 3mw9 h GLU 362 Cb 0.58 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.64 3mw9 h GLU 362 CO -0.61 0.55 0.00 0.54 -1.00 0.00 0.00 179.01 178.49 3mw9 n ARG 363 N -4.68 0.97 -4.08 2.33 1.74 -0.64 -4.88 116.66 107.42 3mw9 n ARG 363 Ca 0.10 0.00 -0.28 0.00 -0.77 0.00 0.00 57.85 56.90 3mw9 n ARG 363 Cb 0.16 -1.33 -0.04 0.00 -1.02 0.00 0.00 32.46 30.22 3mw9 n ARG 363 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3mw9 n ASN 364 N -0.15 -0.26 -4.61 0.55 5.03 -0.78 -4.97 115.26 110.06 3mw9 n ASN 364 Ca 0.00 -1.08 -0.34 0.00 0.87 0.00 0.00 54.58 54.02 3mw9 n ASN 364 Cb 0.17 -2.62 -0.10 0.00 -1.02 0.00 0.00 39.78 36.20 3mw9 n ASN 364 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 3mw9 s ILE 365 N -4.00 4.54 -0.33 2.41 1.01 -0.38 -4.80 121.20 119.64 3mw9 s ILE 365 Ca 0.08 -0.13 -0.21 0.00 0.00 0.00 0.00 60.65 60.39 3mw9 s ILE 365 Cb -0.04 -3.02 -0.00 0.00 0.01 0.00 0.00 42.46 39.41 3mw9 s ILE 365 CO 0.92 0.49 0.68 -0.32 0.00 0.00 0.00 174.94 176.71 3mw9 s MET 366 N 0.22 3.80 -0.46 2.79 -2.45 -0.46 -4.36 119.30 118.37 3mw9 s MET 366 Ca 0.02 0.24 -0.19 0.00 -1.25 0.00 0.00 55.69 54.52 3mw9 s MET 366 Cb -0.13 -3.77 0.04 0.00 1.25 0.00 0.00 34.83 32.22 3mw9 s MET 366 CO 0.01 -0.70 0.55 0.08 1.05 0.00 0.00 175.02 176.01 3mw9 s VAL 367 N 2.78 4.96 -0.62 10.11 1.01 -1.26 -0.44 120.40 136.94 3mw9 s VAL 367 Ca 0.27 -0.33 -0.28 0.00 0.00 0.00 0.00 61.98 61.64 3mw9 s VAL 367 Cb -0.14 -4.17 0.03 0.00 0.00 0.00 0.00 36.38 32.09 3mw9 s VAL 367 CO 0.14 -0.60 1.22 -0.63 0.00 0.00 0.00 175.10 175.23 3mw9 s ILE 368 N 2.44 3.94 0.50 2.22 1.01 0.34 -4.49 121.20 127.16 3mw9 s ILE 368 Ca 0.15 0.78 -0.20 0.00 0.00 0.00 0.00 60.65 61.39 3mw9 s ILE 368 Cb -0.17 -4.76 -0.08 0.00 0.01 0.00 0.00 42.46 37.46 3mw9 s ILE 368 CO 0.14 -1.45 1.05 -2.16 0.00 0.00 0.00 174.94 172.51 3mw9 s PRO 369 N 5.17 3.70 0.16 2.79 0.04 -1.26 -1.75 135.00 143.84 3mw9 s PRO 369 Ca 0.42 1.36 -0.16 0.00 0.04 0.00 0.00 61.00 62.66 3mw9 s PRO 369 Cb -0.08 -2.08 0.07 0.00 0.04 0.00 0.00 34.50 32.45 3mw9 s PRO 369 CO 0.23 -0.52 1.74 0.38 0.04 0.00 0.00 177.00 178.87 3mw9 h ASP 370 N 1.38 0.07 -1.39 6.66 3.04 -1.85 -1.06 116.42 123.27 3mw9 h ASP 370 Ca -0.49 0.05 0.43 0.00 -3.24 0.00 0.00 57.03 53.78 3mw9 h ASP 370 Cb 1.22 0.05 -0.08 0.00 -1.04 0.00 0.00 39.33 39.48 3mw9 h ASP 370 CO 0.59 0.08 0.97 0.18 -2.04 0.00 0.00 179.24 179.01 3mw9 n LEU 371 N -5.06 0.07 -0.06 0.15 4.77 -1.26 -1.89 117.00 113.71 3mw9 n LEU 371 Ca 0.01 0.91 -0.14 0.00 -0.03 0.00 0.00 56.01 56.77 3mw9 n LEU 371 Cb 0.14 -0.45 -0.05 0.00 -2.33 0.00 0.00 43.42 40.73 3mw9 n LEU 371 CO 0.26 -0.95 -0.94 0.00 -1.33 0.00 0.00 177.39 174.43 3mw9 n TYR 372 N -3.83 0.00 -0.16 -1.77 9.36 -0.82 -4.49 117.16 115.45 3mw9 n TYR 372 Ca 0.34 0.00 -0.09 0.00 3.32 0.00 0.00 57.90 61.47 3mw9 n TYR 372 Cb 1.47 -0.46 0.04 0.00 -0.63 0.00 0.00 39.34 39.76 3mw9 n TYR 372 CO 0.00 0.00 0.00 1.25 0.22 0.00 0.00 176.86 178.33 3mw9 h LEU 373 N -0.44 0.98 -1.35 2.98 7.12 -0.74 -2.74 115.31 121.12 3mw9 h LEU 373 Ca -0.32 -0.32 0.00 0.00 0.13 0.00 0.00 57.88 57.37 3mw9 h LEU 373 Cb 1.29 -0.27 0.00 0.00 -0.53 0.00 0.00 40.66 41.15 3mw9 h LEU 373 CO -0.19 1.09 0.00 -0.46 -0.13 0.00 0.00 178.44 178.75 3mw9 n ASN 374 N -4.14 2.05 0.00 1.25 0.23 -0.79 -3.78 115.26 110.07 3mw9 n ASN 374 Ca 0.01 -1.74 0.00 0.00 -0.53 0.00 0.00 54.58 52.33 3mw9 n ASN 374 Cb 0.40 -0.09 0.01 0.00 -2.08 0.00 0.00 39.78 38.01 3mw9 n ASN 374 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3mw9 n ALA 375 N 0.58 1.27 0.46 -2.53 0.00 -1.03 -2.75 120.51 116.51 3mw9 n ALA 375 Ca 0.17 -0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.74 3mw9 n ALA 375 Cb 0.41 -1.01 0.43 0.00 0.00 0.00 0.00 19.45 19.28 3mw9 n ALA 375 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3mw9 h GLY 376 N 0.06 0.00 0.60 0.00 0.00 -1.82 -2.15 103.07 99.77 3mw9 h GLY 376 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 3mw9 h GLY 376 CO 0.00 0.00 -0.20 -1.33 0.00 0.00 0.00 176.54 175.01 3mw9 h GLY 377 N 3.48 -0.59 1.00 4.60 0.00 -1.74 -2.83 103.07 106.98 3mw9 h GLY 377 Ca 0.00 0.22 0.01 0.00 0.00 0.00 0.00 47.33 47.55 3mw9 h GLY 377 CO 0.00 -0.21 0.35 -0.39 0.00 0.00 0.00 176.54 176.28 3mw9 h VAL 378 N -0.97 1.13 -0.92 4.60 -1.51 -1.79 -0.42 116.25 116.37 3mw9 h VAL 378 Ca -0.06 -0.24 0.14 0.00 -1.23 0.00 0.00 66.70 65.31 3mw9 h VAL 378 Cb 0.56 0.36 -0.09 0.00 -2.13 0.00 0.00 31.29 29.98 3mw9 h VAL 378 CO 0.09 0.13 0.53 0.74 -1.23 0.00 0.00 177.57 177.83 3mw9 h THR 379 N 0.71 0.80 0.00 7.19 2.02 -1.46 0.53 112.91 122.70 3mw9 h THR 379 Ca 0.19 -0.27 -0.08 0.00 0.77 0.00 0.00 66.41 67.03 3mw9 h THR 379 Cb -0.08 -0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 66.28 3mw9 h THR 379 CO -0.05 0.14 -0.81 0.58 0.37 0.00 0.00 175.52 175.75 3mw9 h VAL 380 N 0.78 0.37 -0.65 3.16 2.07 -1.24 -2.35 116.25 118.38 3mw9 h VAL 380 Ca 0.49 -1.60 -0.03 0.00 0.82 0.00 0.00 66.70 66.38 3mw9 h VAL 380 Cb 0.62 1.98 -0.03 0.00 -1.52 0.00 0.00 31.29 32.34 3mw9 h VAL 380 CO -0.32 0.21 0.30 0.28 0.02 0.00 0.00 177.57 178.06 3mw9 h SER 381 N 0.00 0.86 -0.75 0.57 0.02 0.48 -2.51 113.55 112.21 3mw9 h SER 381 Ca -0.05 -0.14 0.04 0.00 -0.84 0.00 0.00 61.79 60.80 3mw9 h SER 381 Cb 1.27 -0.22 -0.05 0.00 0.14 0.00 0.00 62.40 63.54 3mw9 h SER 381 CO 0.03 0.76 0.47 0.22 -1.14 0.00 0.00 176.83 177.17 3mw9 h TYR 382 N 0.90 0.88 -0.29 3.45 3.20 0.24 -0.30 116.97 125.04 3mw9 h TYR 382 Ca 0.22 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.08 3mw9 h TYR 382 Cb 0.14 -0.29 -0.02 0.00 1.54 0.00 0.00 36.73 38.10 3mw9 h TYR 382 CO 0.00 0.49 0.03 0.74 -1.64 0.00 0.00 178.16 177.79 3mw9 h PHE 383 N 0.91 0.43 0.02 -3.82 0.04 -1.27 -1.22 116.94 112.02 3mw9 h PHE 383 Ca 0.31 -0.03 -0.00 0.00 2.80 0.00 0.00 57.97 61.05 3mw9 h PHE 383 Cb 0.04 -0.13 0.00 0.00 2.20 0.00 0.00 35.95 38.06 3mw9 h PHE 383 CO -0.04 0.41 -0.01 1.49 -0.60 0.00 0.00 178.31 179.56 3mw9 h GLU 384 N 0.42 -0.02 -0.41 1.51 4.81 -0.82 0.17 114.58 120.23 3mw9 h GLU 384 Ca 0.10 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.41 3mw9 h GLU 384 Cb 0.22 0.01 -0.09 0.00 0.63 0.00 0.00 28.75 29.52 3mw9 h GLU 384 CO 0.00 0.41 -0.27 2.35 -0.73 0.00 0.00 179.01 180.78 3mw9 h TRP 385 N -0.47 -0.72 -0.26 0.92 7.01 -0.98 0.14 115.95 121.59 3mw9 h TRP 385 Ca -0.00 0.05 0.03 0.00 2.11 0.00 0.00 58.89 61.08 3mw9 h TRP 385 Cb 0.45 0.38 -0.03 0.00 -2.10 0.00 0.00 29.16 27.86 3mw9 h TRP 385 CO 0.08 -0.34 0.05 -0.07 -2.79 0.00 0.00 178.44 175.37 3mw9 h LEU 386 N -0.20 0.02 -0.37 0.65 4.07 -1.12 -0.58 115.31 117.79 3mw9 h LEU 386 Ca 0.19 0.04 0.06 0.00 0.08 0.00 0.00 57.88 58.25 3mw9 h LEU 386 Cb 0.50 0.05 -0.09 0.00 1.08 0.00 0.00 40.66 42.20 3mw9 h LEU 386 CO -0.53 0.05 -0.44 -1.13 -1.08 0.00 0.00 178.44 175.31 3mw9 h ASN 387 N 0.15 -1.47 -0.31 -0.43 -0.00 0.03 -1.39 115.58 112.16 3mw9 h ASN 387 Ca 0.12 0.22 0.07 0.00 -0.00 0.00 0.00 56.30 56.70 3mw9 h ASN 387 Cb 0.12 0.63 -0.07 0.00 -0.00 0.00 0.00 38.32 38.99 3mw9 h ASN 387 CO -0.15 -0.38 -0.17 0.78 -0.00 0.00 0.00 177.43 177.51 3mw9 h ASN 388 N -0.36 -0.56 -0.46 1.15 2.35 -0.02 -2.20 115.58 115.47 3mw9 h ASN 388 Ca 0.12 0.13 0.03 0.00 -0.55 0.00 0.00 56.30 56.03 3mw9 h ASN 388 Cb 0.59 0.30 -0.03 0.00 0.05 0.00 0.00 38.32 39.24 3mw9 h ASN 388 CO -0.55 -0.20 0.31 -0.07 -1.65 0.00 0.00 177.43 175.26 3mw9 h LEU 389 N -0.13 0.44 -0.31 1.61 3.38 -0.89 -3.07 115.31 116.35 3mw9 h LEU 389 Ca 0.16 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 58.02 3mw9 h LEU 389 Cb 0.37 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 3mw9 h LEU 389 CO -0.39 0.31 -0.50 0.78 0.09 0.00 0.00 178.44 178.72 3mw9 h ASN 390 N 0.52 0.00 0.00 -0.43 2.35 -0.66 -3.48 115.58 113.88 3mw9 h ASN 390 Ca 0.19 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 3mw9 h ASN 390 Cb 0.10 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.47 3mw9 h ASN 390 CO -0.05 0.50 0.00 1.41 -1.65 0.00 0.00 177.43 177.65 3mw9 n HIS 391 N -3.33 0.00 -4.24 1.19 8.25 -0.97 -4.98 115.22 111.15 3mw9 n HIS 391 Ca 0.01 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.28 3mw9 n HIS 391 Cb 0.68 -1.26 -0.12 0.00 1.12 0.00 0.00 29.99 30.41 3mw9 n HIS 391 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 3mw9 s VAL 392 N -1.42 1.38 0.24 1.59 -7.23 -1.26 -5.13 120.40 108.57 3mw9 s VAL 392 Ca 0.00 -1.60 -0.30 0.00 -1.81 0.00 0.00 61.98 58.27 3mw9 s VAL 392 Cb 0.00 -1.44 -0.09 0.00 0.56 0.00 0.00 36.38 35.41 3mw9 s VAL 392 CO 0.00 -0.30 1.26 -0.94 -0.31 0.00 0.00 175.10 174.81 3mw9 s SER 393 N -2.20 6.95 -0.01 4.85 1.04 -1.26 -4.92 113.70 118.15 3mw9 s SER 393 Ca 0.06 2.42 -0.36 0.00 0.48 0.00 0.00 55.95 58.55 3mw9 s SER 393 Cb -0.07 -2.62 -0.15 0.00 0.10 0.00 0.00 66.02 63.28 3mw9 s SER 393 CO 0.03 -0.45 1.58 0.00 0.98 0.00 0.00 173.24 175.38 3mw9 n TYR 394 N 2.00 1.96 -0.49 5.02 9.36 -1.26 -2.31 117.16 131.44 3mw9 n TYR 394 Ca 0.03 0.42 0.00 0.00 3.32 0.00 0.00 57.90 61.67 3mw9 n TYR 394 Cb 0.43 -2.47 0.00 0.00 -0.63 0.00 0.00 39.34 36.67 3mw9 n TYR 394 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3mw9 n GLY 395 N 3.44 1.43 0.22 2.98 0.00 -1.26 -4.06 105.19 107.93 3mw9 n GLY 395 Ca 0.21 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.29 3mw9 n GLY 395 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3mw9 h ARG 396 N 3.07 0.00 0.00 1.61 2.43 -1.83 -1.32 114.38 118.34 3mw9 h ARG 396 Ca 0.00 0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 59.05 3mw9 h ARG 396 Cb 0.00 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 3mw9 h ARG 396 CO 0.00 0.27 -0.57 -0.07 -1.51 0.00 0.00 179.97 178.09 3mw9 h LEU 397 N 0.00 0.00 -1.25 3.80 3.38 -1.91 -3.37 115.31 115.96 3mw9 h LEU 397 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3mw9 h LEU 397 Cb 0.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 3mw9 h LEU 397 CO 0.03 0.57 0.00 0.35 0.09 0.00 0.00 178.44 179.49 3mw9 n THR 398 N -3.31 0.06 0.20 0.22 -2.24 -0.96 -4.78 114.28 103.48 3mw9 n THR 398 Ca 0.01 -0.53 -0.13 0.00 -2.27 0.00 0.00 64.05 61.13 3mw9 n THR 398 Cb 0.73 1.03 -0.07 0.00 -2.10 0.00 0.00 70.33 69.92 3mw9 n THR 398 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 3mw9 h PHE 399 N 0.66 -0.97 -0.89 4.78 0.05 -1.43 0.28 116.94 119.43 3mw9 h PHE 399 Ca 0.00 0.01 0.03 0.00 3.82 0.00 0.00 57.97 61.83 3mw9 h PHE 399 Cb 0.17 0.38 -0.05 0.00 2.00 0.00 0.00 35.95 38.45 3mw9 h PHE 399 CO 0.00 -0.46 0.58 -0.22 -0.18 0.00 0.00 178.31 178.03 3mw9 h LYS 400 N -0.69 1.08 0.14 1.51 3.64 -1.88 -1.51 116.57 118.86 3mw9 h LYS 400 Ca -0.04 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.26 3mw9 h LYS 400 Cb 0.60 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 3mw9 h LYS 400 CO -0.05 0.72 -0.07 -0.92 -2.27 0.00 0.00 179.45 176.86 3mw9 h TYR 401 N 1.12 -0.18 -0.93 1.91 3.20 -1.82 -1.20 116.97 119.06 3mw9 h TYR 401 Ca 0.35 -0.00 0.09 0.00 3.14 0.00 0.00 58.73 62.31 3mw9 h TYR 401 Cb 0.01 0.06 -0.07 0.00 1.54 0.00 0.00 36.73 38.27 3mw9 h TYR 401 CO -0.00 0.05 0.58 0.93 -1.64 0.00 0.00 178.16 178.08 3mw9 h GLU 402 N -0.40 0.95 0.80 1.82 4.39 -0.72 0.10 114.58 121.52 3mw9 h GLU 402 Ca -0.02 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.58 3mw9 h GLU 402 Cb 0.32 -0.21 0.01 0.00 -0.10 0.00 0.00 28.75 28.76 3mw9 h GLU 402 CO 0.03 0.63 -0.38 -0.09 -1.16 0.00 0.00 179.01 178.04 3mw9 h ARG 403 N 0.98 -1.03 -0.74 2.33 2.43 -1.11 0.59 114.38 117.82 3mw9 h ARG 403 Ca 0.44 0.07 0.14 0.00 -0.81 0.00 0.00 59.98 59.82 3mw9 h ARG 403 Cb 0.34 0.23 -0.10 0.00 -0.42 0.00 0.00 29.97 30.02 3mw9 h ARG 403 CO -0.23 -0.69 0.28 -0.44 -1.51 0.00 0.00 179.97 177.38 3mw9 h ASP 404 N -1.13 0.24 -0.47 -3.80 3.32 -1.11 -1.39 116.42 112.07 3mw9 h ASP 404 Ca -0.11 0.11 0.02 0.00 0.02 0.00 0.00 57.03 57.07 3mw9 h ASP 404 Cb 0.82 0.10 -0.03 0.00 0.22 0.00 0.00 39.33 40.44 3mw9 h ASP 404 CO 0.18 0.08 0.29 -1.28 -1.72 0.00 0.00 179.24 176.80 3mw9 h SER 405 N 0.41 0.49 -0.60 6.45 0.87 -0.68 -1.90 113.55 118.59 3mw9 h SER 405 Ca 0.41 -0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.97 3mw9 h SER 405 Cb 0.63 -0.11 -0.03 0.00 -0.44 0.00 0.00 62.40 62.45 3mw9 h SER 405 CO -0.41 0.35 0.38 0.78 -0.53 0.00 0.00 176.83 177.39 3mw9 h ASN 406 N 0.59 0.71 -0.67 6.23 -0.26 0.20 -1.08 115.58 121.31 3mw9 h ASN 406 Ca 0.18 -0.05 -0.07 0.00 -0.56 0.00 0.00 56.30 55.80 3mw9 h ASN 406 Cb -0.02 -0.18 -0.03 0.00 -1.06 0.00 0.00 38.32 37.04 3mw9 h ASN 406 CO -0.07 0.55 0.13 1.88 -1.06 0.00 0.00 177.43 178.86 3mw9 h TYR 407 N 0.82 1.17 -0.04 1.19 -1.99 -1.25 -2.30 116.97 114.57 3mw9 h TYR 407 Ca 0.22 -0.15 -0.07 0.00 2.00 0.00 0.00 58.73 60.73 3mw9 h TYR 407 Cb -0.05 -0.32 -0.01 0.00 2.00 0.00 0.00 36.73 38.35 3mw9 h TYR 407 CO -0.02 0.97 -0.29 0.45 -0.00 0.00 0.00 178.16 179.26 3mw9 h HIS 408 N 1.03 0.07 -0.42 4.88 3.86 -1.05 0.73 115.15 124.24 3mw9 h HIS 408 Ca 0.21 -0.01 -0.11 0.00 -1.16 0.00 0.00 60.37 59.30 3mw9 h HIS 408 Cb 0.42 -0.02 -0.01 0.00 1.06 0.00 0.00 27.41 28.86 3mw9 h HIS 408 CO 0.03 0.36 -0.16 1.25 0.86 0.00 0.00 177.93 180.27 3mw9 h LEU 409 N 0.06 0.86 -0.43 2.43 6.46 -0.95 -2.01 115.31 121.73 3mw9 h LEU 409 Ca 0.01 -0.39 -0.17 0.00 -0.12 0.00 0.00 57.88 57.21 3mw9 h LEU 409 Cb 0.55 -0.24 -0.01 0.00 -0.73 0.00 0.00 40.66 40.23 3mw9 h LEU 409 CO 0.04 1.05 -0.77 -0.07 -0.62 0.00 0.00 178.44 178.07 3mw9 h LEU 410 N 0.67 0.21 -1.34 2.25 4.07 -1.09 -2.34 115.31 117.74 3mw9 h LEU 410 Ca 0.10 -0.15 -0.07 0.00 0.08 0.00 0.00 57.88 57.84 3mw9 h LEU 410 Cb 0.71 -0.06 -0.01 0.00 1.08 0.00 0.00 40.66 42.37 3mw9 h LEU 410 CO 0.05 0.90 -0.33 -0.03 -1.08 0.00 0.00 178.44 177.96 3mw9 h MET 411 N 0.11 0.00 -0.40 1.13 4.05 -0.81 -2.39 114.93 116.62 3mw9 h MET 411 Ca -0.03 0.00 -0.06 0.00 -0.28 0.00 0.00 59.70 59.34 3mw9 h MET 411 Cb 1.35 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 32.14 3mw9 h MET 411 CO 0.12 0.33 0.03 0.77 0.23 0.00 0.00 176.91 178.38 3mw9 h SER 412 N 0.00 0.67 -0.10 1.39 0.02 -0.79 -0.09 113.55 114.65 3mw9 h SER 412 Ca -0.00 -0.29 -0.15 0.00 -0.84 0.00 0.00 61.79 60.51 3mw9 h SER 412 Cb 0.59 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.94 3mw9 h SER 412 CO 0.04 0.79 -0.46 1.62 -1.14 0.00 0.00 176.83 177.69 3mw9 h VAL 413 N 0.52 1.30 0.09 2.27 3.04 -1.46 -1.72 116.25 120.30 3mw9 h VAL 413 Ca 0.12 -1.66 -0.00 0.00 -1.01 0.00 0.00 66.70 64.15 3mw9 h VAL 413 Cb 0.44 1.60 -0.01 0.00 -2.01 0.00 0.00 31.29 31.31 3mw9 h VAL 413 CO 0.02 0.53 -0.10 -0.61 -1.01 0.00 0.00 177.57 176.39 3mw9 h GLN 414 N 0.52 -0.19 -0.93 4.17 4.15 -1.04 -1.97 115.11 119.83 3mw9 h GLN 414 Ca 0.03 0.01 0.18 0.00 0.77 0.00 0.00 58.65 59.64 3mw9 h GLN 414 Cb 1.00 0.04 -0.10 0.00 0.21 0.00 0.00 27.48 28.63 3mw9 h GLN 414 CO 0.09 -0.13 0.51 0.93 -1.93 0.00 0.00 178.83 178.31 3mw9 h GLU 415 N -0.20 0.63 -0.87 1.69 5.08 -1.08 0.27 114.58 120.11 3mw9 h GLU 415 Ca -0.01 -0.04 0.12 0.00 -1.00 0.00 0.00 59.36 58.43 3mw9 h GLU 415 Cb 0.17 -0.14 -0.07 0.00 0.50 0.00 0.00 28.75 29.21 3mw9 h GLU 415 CO -0.02 0.42 0.56 0.77 -1.00 0.00 0.00 179.01 179.74 3mw9 h SER 416 N 0.65 0.68 0.25 1.42 0.02 -1.14 -2.01 113.55 113.42 3mw9 h SER 416 Ca 0.53 0.03 -0.34 0.00 -0.84 0.00 0.00 61.79 61.17 3mw9 h SER 416 Cb 0.83 -0.11 0.02 0.00 0.14 0.00 0.00 62.40 63.29 3mw9 h SER 416 CO -0.40 0.37 -1.63 -0.07 -1.14 0.00 0.00 176.83 173.97 3mw9 h LEU 417 N 0.74 0.68 -1.99 5.07 3.38 0.25 -3.16 115.31 120.27 3mw9 h LEU 417 Ca 0.42 -0.88 -0.01 0.00 0.09 0.00 0.00 57.88 57.50 3mw9 h LEU 417 Cb 0.59 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 3mw9 h LEU 417 CO -0.18 1.72 -0.06 -0.33 0.09 0.00 0.00 178.44 179.68 3mw9 h GLU 418 N 0.12 0.00 0.03 1.13 5.08 -0.95 -1.43 114.58 118.56 3mw9 h GLU 418 Ca -0.30 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 57.97 3mw9 h GLU 418 Cb 2.12 0.00 0.01 0.00 0.50 0.00 0.00 28.75 31.38 3mw9 h GLU 418 CO 0.22 0.06 -0.36 -0.09 -1.00 0.00 0.00 179.01 177.83 3mw9 h ARG 419 N 0.00 0.18 0.50 2.33 2.43 -1.40 -3.26 114.38 115.16 3mw9 h ARG 419 Ca -0.00 -0.24 -0.02 0.00 -0.81 0.00 0.00 59.98 58.90 3mw9 h ARG 419 Cb 0.33 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 3mw9 h ARG 419 CO 0.01 1.03 -0.24 -0.22 -1.51 0.00 0.00 179.97 179.04 3mw9 h LYS 420 N -0.55 -0.64 -3.68 0.20 3.11 -1.50 -3.34 116.57 110.17 3mw9 h LYS 420 Ca -0.05 0.04 -0.74 0.00 -2.81 0.00 0.00 60.65 57.09 3mw9 h LYS 420 Cb 1.19 0.15 -0.12 0.00 -1.00 0.00 0.00 32.23 32.45 3mw9 h LYS 420 CO 0.07 -0.43 2.40 1.19 -2.81 0.00 0.00 179.45 179.87 3mw9 n PHE 421 N -4.60 3.15 0.00 1.91 0.99 -0.55 -4.94 117.46 113.42 3mw9 n PHE 421 Ca -0.08 -2.85 0.00 0.00 -0.00 0.00 0.00 57.45 54.51 3mw9 n PHE 421 Cb 0.26 -2.15 0.00 0.00 -1.00 0.00 0.00 39.48 36.59 3mw9 n PHE 421 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3mw9 n GLY 422 N 3.24 -3.30 0.23 1.37 0.00 -1.23 -4.05 105.19 101.46 3mw9 n GLY 422 Ca 0.44 -0.87 0.01 0.00 0.00 0.00 0.00 46.02 45.60 3mw9 n GLY 422 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3mw9 h LYS 423 N 0.00 0.23 0.00 1.61 1.79 -1.92 0.16 116.57 118.44 3mw9 h LYS 423 Ca 0.00 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 3mw9 h LYS 423 Cb 0.00 -0.05 0.00 0.00 -1.58 0.00 0.00 32.23 30.60 3mw9 h LYS 423 CO 0.00 0.15 0.74 1.25 -1.08 0.00 0.00 179.45 180.51 3mw9 h HIS 424 N 0.23 0.00 0.00 -1.35 2.76 -1.97 -2.96 115.15 111.86 3mw9 h HIS 424 Ca 0.32 0.00 -0.11 0.00 -2.20 0.00 0.00 60.37 58.38 3mw9 h HIS 424 Cb 0.49 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.44 3mw9 h HIS 424 CO -0.27 0.00 -1.39 0.41 -1.30 0.00 0.00 177.93 175.38 3mw9 n GLY 425 N -1.34 -0.10 0.00 5.26 0.00 0.54 -5.16 105.19 104.39 3mw9 n GLY 425 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.98 3mw9 n GLY 425 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mw9 n GLY 426 N 2.87 1.32 3.71 -0.02 0.00 -1.09 -5.03 105.19 106.95 3mw9 n GLY 426 Ca -0.13 -2.20 -0.42 0.00 0.00 0.00 0.00 46.02 43.27 3mw9 n GLY 426 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3mw9 s THR 427 N -1.41 3.30 -0.73 2.61 2.01 -1.26 -4.90 115.64 115.26 3mw9 s THR 427 Ca 0.00 0.93 0.04 0.00 0.31 0.00 0.00 61.69 62.97 3mw9 s THR 427 Cb 0.00 -3.59 0.24 0.00 0.01 0.00 0.00 72.50 69.16 3mw9 s THR 427 CO 0.00 0.07 0.80 -0.38 -0.69 0.00 0.00 174.62 174.42 3mw9 n ILE 428 N 3.96 2.68 -1.69 1.82 5.41 -1.26 -5.08 119.36 125.20 3mw9 n ILE 428 Ca 0.12 -5.25 -0.42 0.00 1.00 0.00 0.00 62.75 58.20 3mw9 n ILE 428 Cb 0.42 -2.14 -0.03 0.00 -0.71 0.00 0.00 39.64 37.19 3mw9 n ILE 428 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 3mw9 s PRO 429 N -2.27 4.13 -0.28 0.38 0.04 -1.26 -4.79 135.00 130.96 3mw9 s PRO 429 Ca 0.35 2.62 -0.09 0.00 0.04 0.00 0.00 61.00 63.93 3mw9 s PRO 429 Cb 0.09 -3.59 -0.02 0.00 0.04 0.00 0.00 34.50 31.01 3mw9 s PRO 429 CO -0.03 -0.85 0.13 0.42 0.04 0.00 0.00 177.00 176.70 3mw9 s ILE 430 N 2.74 4.65 0.07 0.56 -1.09 -1.26 -5.09 121.20 121.79 3mw9 s ILE 430 Ca 0.82 -0.19 0.04 0.00 -2.23 0.00 0.00 60.65 59.08 3mw9 s ILE 430 Cb -0.47 -3.26 -0.03 0.00 -1.58 0.00 0.00 42.46 37.12 3mw9 s ILE 430 CO 0.37 0.21 -0.11 -0.69 -1.23 0.00 0.00 174.94 173.49 3mw9 s VAL 431 N 1.65 0.87 0.35 2.92 1.01 -1.26 -4.80 120.40 121.13 3mw9 s VAL 431 Ca 0.06 -1.37 -0.27 0.00 0.00 0.00 0.00 61.98 60.40 3mw9 s VAL 431 Cb -0.16 -1.04 -0.09 0.00 0.00 0.00 0.00 36.38 35.08 3mw9 s VAL 431 CO 0.06 -0.40 1.19 -2.84 0.00 0.00 0.00 175.10 173.11 3mw9 s PRO 432 N -2.10 4.29 1.04 2.72 0.02 -1.26 -5.03 135.00 134.67 3mw9 s PRO 432 Ca -0.02 1.95 -0.11 0.00 0.02 0.00 0.00 61.00 62.84 3mw9 s PRO 432 Cb -0.07 -2.92 0.21 0.00 0.02 0.00 0.00 34.50 31.74 3mw9 s PRO 432 CO 0.01 -0.15 1.09 0.95 -0.33 0.00 0.00 177.00 178.57 3mw9 s THR 433 N -1.27 2.07 0.41 0.99 -4.23 -1.26 -4.72 115.64 107.62 3mw9 s THR 433 Ca 0.51 0.02 0.13 0.00 -1.18 0.00 0.00 61.69 61.17 3mw9 s THR 433 Cb -0.34 -2.07 0.15 0.00 1.34 0.00 0.00 72.50 71.59 3mw9 s THR 433 CO 0.44 -0.03 1.92 0.00 -0.54 0.00 0.00 174.62 176.41 3mw9 h ALA 434 N -2.24 1.56 0.39 3.99 0.00 -1.99 0.81 119.26 121.78 3mw9 h ALA 434 Ca -0.52 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.14 3mw9 h ALA 434 Cb 1.30 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3mw9 h ALA 434 CO 0.46 0.33 -0.19 0.93 0.00 0.00 0.00 179.25 180.78 3mw9 h GLU 435 N 0.06 -0.50 -0.59 0.00 3.07 -2.01 -3.03 114.58 111.58 3mw9 h GLU 435 Ca 0.01 0.03 -0.07 0.00 -0.50 0.00 0.00 59.36 58.84 3mw9 h GLU 435 Cb 0.43 0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.43 3mw9 h GLU 435 CO 0.03 -0.30 0.11 0.35 -1.40 0.00 0.00 179.01 177.81 3mw9 h PHE 436 N -0.59 1.02 -0.94 4.33 3.57 -1.84 -2.25 116.94 120.24 3mw9 h PHE 436 Ca -0.05 -0.14 0.26 0.00 3.53 0.00 0.00 57.97 61.57 3mw9 h PHE 436 Cb 0.44 -0.28 -0.18 0.00 2.79 0.00 0.00 35.95 38.72 3mw9 h PHE 436 CO -0.03 0.88 0.01 1.04 -2.23 0.00 0.00 178.31 177.98 3mw9 n GLN 437 N -4.33 -0.08 0.19 1.11 1.13 0.25 0.12 117.38 115.77 3mw9 n GLN 437 Ca 0.03 1.42 0.04 0.00 -1.94 0.00 0.00 57.00 56.54 3mw9 n GLN 437 Cb 0.26 -2.25 0.36 0.00 0.11 0.00 0.00 30.24 28.72 3mw9 n GLN 437 CO 0.00 0.00 0.00 -0.44 -1.44 0.00 0.00 177.06 175.18 3mw9 h ASP 438 N 0.00 0.00 -0.34 1.08 3.45 -1.28 -2.64 116.42 116.70 3mw9 h ASP 438 Ca 0.57 0.00 0.00 0.00 0.43 0.00 0.00 57.03 58.03 3mw9 h ASP 438 Cb 1.16 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.93 3mw9 h ASP 438 CO -0.89 0.39 0.00 0.54 -1.57 0.00 0.00 179.24 177.71 3mw9 n ARG 439 N -3.82 2.31 -0.14 3.56 1.74 0.12 -4.65 116.66 115.79 3mw9 n ARG 439 Ca -0.01 -1.98 0.19 0.00 -0.77 0.00 0.00 57.85 55.27 3mw9 n ARG 439 Cb 0.46 -1.48 0.58 0.00 -1.02 0.00 0.00 32.46 31.00 3mw9 n ARG 439 CO 0.00 0.00 0.00 0.97 -1.52 0.00 0.00 177.63 177.08 3mw9 h ILE 440 N 3.88 0.73 -0.65 0.55 6.09 -0.63 0.15 117.51 127.63 3mw9 h ILE 440 Ca 0.00 -0.09 0.00 0.00 -1.37 0.00 0.00 64.86 63.40 3mw9 h ILE 440 Cb 0.86 0.45 0.00 0.00 0.47 0.00 0.00 36.82 38.60 3mw9 h ILE 440 CO 0.00 0.05 0.00 -1.20 -3.07 0.00 0.00 178.15 173.93 3mw9 n SER 441 N -4.43 3.79 0.00 2.19 7.64 -1.26 -3.65 113.62 117.89 3mw9 n SER 441 Ca 0.14 -2.00 0.00 0.00 1.01 0.00 0.00 58.87 58.03 3mw9 n SER 441 Cb 0.63 -0.43 0.00 0.00 -1.01 0.00 0.00 64.21 63.40 3mw9 n SER 441 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3mw9 n GLY 442 N 1.62 -1.11 3.73 0.23 0.00 0.52 -4.46 105.19 105.72 3mw9 n GLY 442 Ca 0.23 -1.62 -0.42 0.00 0.00 0.00 0.00 46.02 44.22 3mw9 n GLY 442 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mw9 s ALA 443 N -2.32 3.70 0.83 4.61 0.00 -1.26 -4.96 121.76 122.36 3mw9 s ALA 443 Ca 0.00 1.36 -0.06 0.00 0.00 0.00 0.00 51.96 53.26 3mw9 s ALA 443 Cb 0.00 -3.59 0.17 0.00 0.00 0.00 0.00 23.12 19.70 3mw9 s ALA 443 CO 0.00 -0.78 1.13 -1.54 0.00 0.00 0.00 175.76 174.58 3mw9 s SER 444 N 0.70 3.76 0.13 0.00 1.04 -1.26 -4.40 113.70 113.67 3mw9 s SER 444 Ca 0.64 -0.24 -0.30 0.00 0.48 0.00 0.00 55.95 56.53 3mw9 s SER 444 Cb -0.43 0.06 -0.08 0.00 0.10 0.00 0.00 66.02 65.67 3mw9 s SER 444 CO 0.39 -2.28 1.58 -0.08 0.98 0.00 0.00 173.24 173.83 3mw9 h GLU 445 N -0.99 -0.52 -0.69 4.02 4.81 -1.96 -1.50 114.58 117.76 3mw9 h GLU 445 Ca -0.38 0.04 0.12 0.00 -0.13 0.00 0.00 59.36 59.00 3mw9 h GLU 445 Cb 1.25 0.12 -0.12 0.00 0.63 0.00 0.00 28.75 30.62 3mw9 h GLU 445 CO 0.36 -0.35 -0.35 -0.22 -0.73 0.00 0.00 179.01 177.73 3mw9 h LYS 446 N -0.54 -0.12 -0.21 1.92 3.64 -1.95 -1.14 116.57 118.16 3mw9 h LYS 446 Ca 0.06 0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.48 3mw9 h LYS 446 Cb 0.65 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.46 3mw9 h LYS 446 CO -0.37 -0.08 0.00 -0.44 -2.27 0.00 0.00 179.45 176.29 3mw9 h ASP 447 N -0.12 -0.08 -0.61 4.20 3.45 -1.82 -0.60 116.42 120.84 3mw9 h ASP 447 Ca 0.26 0.05 0.08 0.00 0.43 0.00 0.00 57.03 57.85 3mw9 h ASP 447 Cb 0.56 0.08 -0.07 0.00 -0.56 0.00 0.00 39.33 39.35 3mw9 h ASP 447 CO -0.75 -0.01 0.26 0.40 -1.57 0.00 0.00 179.24 177.56 3mw9 h ILE 448 N 0.07 0.82 -0.30 0.35 1.08 -0.74 -1.16 117.51 117.63 3mw9 h ILE 448 Ca 0.10 -0.16 -0.02 0.00 -0.39 0.00 0.00 64.86 64.39 3mw9 h ILE 448 Cb 0.12 0.32 -0.01 0.00 -3.07 0.00 0.00 36.82 34.18 3mw9 h ILE 448 CO -0.17 0.08 0.12 0.58 -0.69 0.00 0.00 178.15 178.07 3mw9 h VAL 449 N 0.46 1.18 0.59 1.67 2.07 -0.56 0.21 116.25 121.88 3mw9 h VAL 449 Ca 0.30 -0.56 -0.03 0.00 0.82 0.00 0.00 66.70 67.23 3mw9 h VAL 449 Cb 0.33 1.00 0.01 0.00 -1.52 0.00 0.00 31.29 31.10 3mw9 h VAL 449 CO -0.27 0.19 -0.28 0.45 0.02 0.00 0.00 177.57 177.68 3mw9 h HIS 450 N 0.33 -0.73 -0.01 1.57 3.86 -0.69 -1.40 115.15 118.09 3mw9 h HIS 450 Ca 0.10 -0.02 -0.17 0.00 -1.16 0.00 0.00 60.37 59.12 3mw9 h HIS 450 Cb 0.19 0.24 -0.02 0.00 1.06 0.00 0.00 27.41 28.89 3mw9 h HIS 450 CO -0.00 -0.41 -0.77 0.66 0.86 0.00 0.00 177.93 178.26 3mw9 h SER 451 N -0.92 0.13 -0.48 2.45 4.64 -1.29 -0.11 113.55 117.97 3mw9 h SER 451 Ca -0.08 -0.09 0.02 0.00 -0.47 0.00 0.00 61.79 61.17 3mw9 h SER 451 Cb 0.65 -0.04 -0.03 0.00 -0.31 0.00 0.00 62.40 62.67 3mw9 h SER 451 CO 0.13 0.85 0.28 1.23 -0.87 0.00 0.00 176.83 178.45 3mw9 h GLY 452 N 2.00 0.68 0.86 -0.77 0.00 -0.62 0.17 103.07 105.39 3mw9 h GLY 452 Ca -0.02 -0.21 -0.01 0.00 0.00 0.00 0.00 47.33 47.09 3mw9 h GLY 452 CO 0.11 0.17 0.05 -2.00 0.00 0.00 0.00 176.54 174.87 3mw9 h LEU 453 N 0.56 0.25 -1.26 3.11 5.85 -1.12 -2.45 115.31 120.24 3mw9 h LEU 453 Ca 0.20 -0.21 0.06 0.00 0.84 0.00 0.00 57.88 58.77 3mw9 h LEU 453 Cb 0.03 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 40.95 3mw9 h LEU 453 CO -0.10 0.39 0.53 0.00 -0.34 0.00 0.00 178.44 178.92 3mw9 h ALA 454 N 0.87 1.60 -0.10 1.25 0.00 -0.69 -1.48 119.26 120.72 3mw9 h ALA 454 Ca 0.05 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 3mw9 h ALA 454 Cb 0.23 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 3mw9 h ALA 454 CO -0.00 0.28 -0.02 -0.92 0.00 0.00 0.00 179.25 178.59 3mw9 h TYR 455 N 0.90 0.20 -0.05 0.00 3.20 -0.50 -1.62 116.97 119.09 3mw9 h TYR 455 Ca 0.35 -0.04 -0.20 0.00 3.14 0.00 0.00 58.73 61.98 3mw9 h TYR 455 Cb 0.21 -0.05 -0.00 0.00 1.54 0.00 0.00 36.73 38.43 3mw9 h TYR 455 CO -0.00 0.48 -0.79 1.79 -1.64 0.00 0.00 178.16 178.00 3mw9 h THR 456 N -0.13 1.39 -0.16 1.81 1.35 -1.02 0.11 112.91 116.26 3mw9 h THR 456 Ca 0.03 -2.25 0.03 0.00 -0.55 0.00 0.00 66.41 63.66 3mw9 h THR 456 Cb 0.41 2.21 -0.03 0.00 -1.73 0.00 0.00 68.15 69.02 3mw9 h THR 456 CO 0.01 0.67 -0.00 0.24 -0.25 0.00 0.00 175.52 176.19 3mw9 h MET 457 N 0.25 0.04 0.20 4.72 2.86 -1.29 0.24 114.93 121.96 3mw9 h MET 457 Ca -0.04 -0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.58 3mw9 h MET 457 Cb 1.39 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 33.04 3mw9 h MET 457 CO 0.14 0.03 -0.10 1.49 1.06 0.00 0.00 176.91 179.53 3mw9 h GLU 458 N 0.05 -0.26 -0.77 1.72 4.22 -1.14 -0.66 114.58 117.73 3mw9 h GLU 458 Ca 0.07 0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.53 3mw9 h GLU 458 Cb 0.09 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.36 3mw9 h GLU 458 CO -0.13 -0.17 0.50 -0.09 -2.18 0.00 0.00 179.01 176.94 3mw9 h ARG 459 N -0.28 1.03 -0.17 1.92 2.43 -0.59 -2.78 114.38 115.94 3mw9 h ARG 459 Ca -0.03 -0.07 -0.21 0.00 -0.81 0.00 0.00 59.98 58.86 3mw9 h ARG 459 Cb 0.21 -0.23 0.01 0.00 -0.42 0.00 0.00 29.97 29.54 3mw9 h ARG 459 CO 0.05 0.69 -0.72 0.77 -1.51 0.00 0.00 179.97 179.25 3mw9 h SER 460 N 1.05 0.87 -1.00 -3.80 0.02 -0.31 -3.00 113.55 107.38 3mw9 h SER 460 Ca 0.28 -0.54 0.03 0.00 -0.84 0.00 0.00 61.79 60.72 3mw9 h SER 460 Cb -0.10 -0.25 -0.06 0.00 0.14 0.00 0.00 62.40 62.13 3mw9 h SER 460 CO -0.06 1.33 0.66 0.00 -1.14 0.00 0.00 176.83 177.62 3mw9 h ALA 461 N 0.66 1.34 -0.10 3.77 0.00 -0.87 -2.44 119.26 121.61 3mw9 h ALA 461 Ca -0.03 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 3mw9 h ALA 461 Cb 1.33 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 3mw9 h ALA 461 CO 0.15 0.57 -0.37 0.00 0.00 0.00 0.00 179.25 179.60 3mw9 h ARG 462 N 1.28 0.21 -0.28 0.00 3.08 -1.48 -0.30 114.38 116.90 3mw9 h ARG 462 Ca 0.39 -0.09 -0.12 0.00 0.07 0.00 0.00 59.98 60.23 3mw9 h ARG 462 Cb -0.03 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.00 3mw9 h ARG 462 CO -0.12 0.56 -0.33 1.96 -1.07 0.00 0.00 179.97 180.98 3mw9 h GLN 463 N 0.18 0.59 0.26 0.04 4.20 -1.34 -1.03 115.11 118.02 3mw9 h GLN 463 Ca 0.02 -0.27 -0.01 0.00 0.06 0.00 0.00 58.65 58.45 3mw9 h GLN 463 Cb 0.74 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.52 3mw9 h GLN 463 CO 0.06 0.85 -0.13 0.82 -0.67 0.00 0.00 178.83 179.76 3mw9 h ILE 464 N 0.51 0.73 -0.59 2.54 2.04 -0.96 -2.16 117.51 119.62 3mw9 h ILE 464 Ca 0.06 -0.78 0.11 0.00 1.00 0.00 0.00 64.86 65.25 3mw9 h ILE 464 Cb 0.81 1.11 -0.09 0.00 -0.74 0.00 0.00 36.82 37.92 3mw9 h ILE 464 CO 0.07 0.15 0.11 0.24 0.00 0.00 0.00 178.15 178.71 3mw9 h MET 465 N -0.80 0.23 -0.47 2.37 2.86 -1.13 -0.88 114.93 117.10 3mw9 h MET 465 Ca -0.04 -0.01 0.09 0.00 -2.06 0.00 0.00 59.70 57.68 3mw9 h MET 465 Cb 0.51 -0.05 -0.08 0.00 0.06 0.00 0.00 31.60 32.04 3mw9 h MET 465 CO 0.06 0.15 -0.02 -0.09 1.06 0.00 0.00 176.91 178.07 3mw9 h ARG 466 N 0.24 0.09 0.00 1.72 2.43 -1.17 -1.90 114.38 115.79 3mw9 h ARG 466 Ca 0.31 -0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.37 3mw9 h ARG 466 Cb 0.46 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.97 3mw9 h ARG 466 CO -0.41 0.06 -0.48 1.15 -1.51 0.00 0.00 179.97 178.78 3mw9 h THR 467 N 0.09 1.19 -0.12 0.20 2.02 -0.65 -1.79 112.91 113.85 3mw9 h THR 467 Ca 0.24 -1.73 -0.05 0.00 0.77 0.00 0.00 66.41 65.63 3mw9 h THR 467 Cb 0.36 1.98 -0.00 0.00 -1.74 0.00 0.00 68.15 68.74 3mw9 h THR 467 CO -0.41 0.47 -0.13 0.00 0.37 0.00 0.00 175.52 175.82 3mw9 h ALA 468 N 1.52 0.17 -0.56 6.16 0.00 -0.61 -2.77 119.26 123.18 3mw9 h ALA 468 Ca -0.00 -0.32 0.03 0.00 0.00 0.00 0.00 54.91 54.62 3mw9 h ALA 468 Cb 0.94 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.65 3mw9 h ALA 468 CO 0.06 0.04 0.33 0.52 0.00 0.00 0.00 179.25 180.20 3mw9 h MET 469 N -0.10 0.62 -0.62 0.00 2.07 -1.30 0.19 114.93 115.78 3mw9 h MET 469 Ca 0.02 -0.04 0.01 0.00 -2.07 0.00 0.00 59.70 57.62 3mw9 h MET 469 Cb 0.66 -0.14 -0.03 0.00 -1.87 0.00 0.00 31.60 30.22 3mw9 h MET 469 CO 0.03 0.41 0.41 -0.22 1.07 0.00 0.00 176.91 178.61 3mw9 h LYS 470 N 0.64 0.79 -0.27 1.72 3.64 -1.27 -2.89 116.57 118.94 3mw9 h LYS 470 Ca 0.23 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 3mw9 h LYS 470 Cb 0.05 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.69 3mw9 h LYS 470 CO -0.11 0.53 0.00 0.66 -2.27 0.00 0.00 179.45 178.25 3mw9 n TYR 471 N -4.45 0.67 -4.00 1.91 4.02 -1.05 -4.98 117.16 109.29 3mw9 n TYR 471 Ca 0.07 -0.72 -0.41 0.00 -0.01 0.00 0.00 57.90 56.82 3mw9 n TYR 471 Cb 0.06 -0.19 0.01 0.00 -0.02 0.00 0.00 39.34 39.21 3mw9 n TYR 471 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 3mw9 n ASN 472 N -0.17 -3.77 -0.31 7.72 3.02 -0.30 -4.85 115.26 116.60 3mw9 n ASN 472 Ca 0.16 -1.22 0.13 0.00 -0.03 0.00 0.00 54.58 53.62 3mw9 n ASN 472 Cb 0.67 -2.15 0.30 0.00 -0.61 0.00 0.00 39.78 38.00 3mw9 n ASN 472 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3mw9 n LEU 473 N -4.78 1.27 0.00 3.41 4.77 0.50 -5.00 117.00 117.17 3mw9 n LEU 473 Ca -0.14 -0.38 0.00 0.00 -0.03 0.00 0.00 56.01 55.46 3mw9 n LEU 473 Cb 0.59 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 3mw9 n LEU 473 CO 0.74 0.24 0.00 0.61 -1.33 0.00 0.00 177.39 177.64 3mw9 n GLY 474 N 1.35 3.43 1.04 -0.72 0.00 -1.26 -0.67 105.19 108.37 3mw9 n GLY 474 Ca 0.12 0.12 0.11 0.00 0.00 0.00 0.00 46.02 46.37 3mw9 n GLY 474 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3mw9 n LEU 475 N 0.00 3.08 -3.73 0.99 4.77 -1.26 -4.69 117.00 116.16 3mw9 n LEU 475 Ca 0.00 -1.41 -0.42 0.00 -0.03 0.00 0.00 56.01 54.15 3mw9 n LEU 475 Cb 0.00 -0.29 -0.00 0.00 -2.33 0.00 0.00 43.42 40.80 3mw9 n LEU 475 CO 0.00 0.71 2.55 -0.67 -1.33 0.00 0.00 177.39 178.64 3mw9 n ASP 476 N 1.21 4.60 0.05 -1.43 4.64 0.16 -4.40 116.55 121.39 3mw9 n ASP 476 Ca 0.19 -2.90 -0.02 0.00 -1.38 0.00 0.00 54.79 50.69 3mw9 n ASP 476 Cb 0.52 -1.60 0.25 0.00 -1.04 0.00 0.00 41.12 39.25 3mw9 n ASP 476 CO 0.00 0.00 0.00 -0.07 -0.82 0.00 0.00 177.20 176.31 3mw9 h LEU 477 N 9.16 0.38 -0.48 -2.67 3.38 -1.84 -3.01 115.31 120.23 3mw9 h LEU 477 Ca 0.55 -0.12 0.06 0.00 0.09 0.00 0.00 57.88 58.46 3mw9 h LEU 477 Cb 0.60 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 41.20 3mw9 h LEU 477 CO 1.81 0.63 0.18 -0.09 0.09 0.00 0.00 178.44 181.06 3mw9 h ARG 478 N 0.34 0.35 0.00 1.13 2.43 -1.84 0.11 114.38 116.91 3mw9 h ARG 478 Ca 0.05 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 3mw9 h ARG 478 Cb 0.63 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 3mw9 h ARG 478 CO 0.04 0.23 0.00 0.25 -1.51 0.00 0.00 179.97 178.99 3mw9 n THR 479 N -4.99 0.48 -0.03 0.20 -2.24 -1.14 -1.90 114.28 104.66 3mw9 n THR 479 Ca 0.04 -0.18 -0.14 0.00 -2.27 0.00 0.00 64.05 61.50 3mw9 n THR 479 Cb 0.18 -0.60 -0.10 0.00 -2.10 0.00 0.00 70.33 67.70 3mw9 n THR 479 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3mw9 h ALA 480 N 2.62 0.08 0.13 6.98 0.00 -1.18 -2.38 119.26 125.51 3mw9 h ALA 480 Ca 0.00 -0.41 0.02 0.00 0.00 0.00 0.00 54.91 54.52 3mw9 h ALA 480 Cb 0.65 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.40 3mw9 h ALA 480 CO 0.00 0.05 -0.31 0.00 0.00 0.00 0.00 179.25 178.99 3mw9 h ALA 481 N 0.38 -0.54 -0.14 0.00 0.00 -0.56 -1.89 119.26 116.51 3mw9 h ALA 481 Ca -0.01 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 54.88 3mw9 h ALA 481 Cb 0.87 0.50 -0.01 0.00 0.00 0.00 0.00 17.79 19.16 3mw9 h ALA 481 CO 0.04 -0.86 0.20 1.88 0.00 0.00 0.00 179.25 180.51 3mw9 h TYR 482 N -0.54 0.00 -0.11 0.00 -1.99 -1.45 -0.33 116.97 112.55 3mw9 h TYR 482 Ca 0.03 0.00 -0.23 0.00 2.00 0.00 0.00 58.73 60.53 3mw9 h TYR 482 Cb 0.56 0.00 0.01 0.00 2.00 0.00 0.00 36.73 39.31 3mw9 h TYR 482 CO -0.27 0.00 -0.83 0.28 -0.00 0.00 0.00 178.16 177.33 3mw9 h VAL 483 N 0.00 1.29 0.17 -2.88 2.07 -0.80 -1.81 116.25 114.28 3mw9 h VAL 483 Ca 0.07 -2.06 -0.01 0.00 0.82 0.00 0.00 66.70 65.52 3mw9 h VAL 483 Cb 0.46 2.09 0.00 0.00 -1.52 0.00 0.00 31.29 32.32 3mw9 h VAL 483 CO -0.00 0.65 -0.08 0.78 0.02 0.00 0.00 177.57 178.93 3mw9 h ASN 484 N 0.48 -0.19 -0.81 0.57 2.35 -0.53 -1.58 115.58 115.86 3mw9 h ASN 484 Ca -0.07 -0.19 0.10 0.00 -0.55 0.00 0.00 56.30 55.59 3mw9 h ASN 484 Cb 1.46 0.05 -0.07 0.00 0.05 0.00 0.00 38.32 39.81 3mw9 h ASN 484 CO 0.17 0.08 0.46 0.00 -1.65 0.00 0.00 177.43 176.49 3mw9 h ALA 485 N 0.31 1.16 -0.33 -0.83 0.00 -1.33 -1.88 119.26 116.36 3mw9 h ALA 485 Ca -0.02 0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.78 3mw9 h ALA 485 Cb 0.36 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3mw9 h ALA 485 CO 0.04 0.08 -0.38 0.82 0.00 0.00 0.00 179.25 179.80 3mw9 h ILE 486 N 0.76 1.28 0.04 0.00 2.04 -1.29 -1.18 117.51 119.17 3mw9 h ILE 486 Ca 0.39 -1.55 0.01 0.00 1.00 0.00 0.00 64.86 64.71 3mw9 h ILE 486 Cb 0.37 1.44 -0.01 0.00 -0.74 0.00 0.00 36.82 37.88 3mw9 h ILE 486 CO -0.25 0.51 -0.08 -0.08 0.00 0.00 0.00 178.15 178.25 3mw9 h GLU 487 N 0.63 -0.14 0.96 2.37 4.81 -0.60 -0.58 114.58 122.02 3mw9 h GLU 487 Ca 0.06 0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.25 3mw9 h GLU 487 Cb 0.93 0.03 0.01 0.00 0.63 0.00 0.00 28.75 30.35 3mw9 h GLU 487 CO 0.09 -0.10 -0.46 0.87 -0.73 0.00 0.00 179.01 178.68 3mw9 h LYS 488 N -0.15 -1.24 -0.48 1.92 1.57 -1.29 -2.56 116.57 114.33 3mw9 h LYS 488 Ca 0.02 0.08 0.03 0.00 -1.87 0.00 0.00 60.65 58.91 3mw9 h LYS 488 Cb 0.17 0.28 -0.03 0.00 0.08 0.00 0.00 32.23 32.73 3mw9 h LYS 488 CO -0.05 -0.83 0.32 0.28 -0.57 0.00 0.00 179.45 178.60 3mw9 h VAL 489 N -1.29 1.06 -0.49 0.50 2.07 -1.25 -2.18 116.25 114.67 3mw9 h VAL 489 Ca -0.13 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 67.17 3mw9 h VAL 489 Cb 0.99 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 3mw9 h VAL 489 CO 0.22 0.10 0.22 0.15 0.02 0.00 0.00 177.57 178.28 3mw9 h PHE 490 N 0.56 0.73 -0.57 1.57 3.57 -0.95 -2.85 116.94 119.00 3mw9 h PHE 490 Ca 0.19 -0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.63 3mw9 h PHE 490 Cb 0.08 -0.22 -0.03 0.00 2.79 0.00 0.00 35.95 38.57 3mw9 h PHE 490 CO -0.00 0.59 0.29 -0.09 -2.23 0.00 0.00 178.31 176.87 3mw9 h ARG 491 N 0.65 0.79 -0.35 1.11 2.43 -0.98 0.28 114.38 118.32 3mw9 h ARG 491 Ca 0.17 -0.09 -0.08 0.00 -0.81 0.00 0.00 59.98 59.17 3mw9 h ARG 491 Cb 0.15 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 3mw9 h ARG 491 CO -0.02 0.60 -0.10 0.28 -1.51 0.00 0.00 179.97 179.22 3mw9 h VAL 492 N 0.79 1.28 -0.31 0.20 2.07 -1.43 0.82 116.25 119.67 3mw9 h VAL 492 Ca 0.20 -1.17 -0.10 0.00 0.82 0.00 0.00 66.70 66.45 3mw9 h VAL 492 Cb 0.06 1.32 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 3mw9 h VAL 492 CO -0.03 0.38 -0.21 1.88 0.02 0.00 0.00 177.57 179.61 3mw9 h TYR 493 N 0.47 0.81 0.61 1.57 -1.99 -1.19 -2.41 116.97 114.84 3mw9 h TYR 493 Ca 0.09 -0.22 -0.03 0.00 2.00 0.00 0.00 58.73 60.57 3mw9 h TYR 493 Cb 0.61 -0.18 0.00 0.00 2.00 0.00 0.00 36.73 39.16 3mw9 h TYR 493 CO 0.05 0.94 -0.32 -0.97 -0.00 0.00 0.00 178.16 177.86 3mw9 h ASN 494 N 0.45 -0.79 0.36 3.88 -0.00 -0.88 0.25 115.58 118.85 3mw9 h ASN 494 Ca 0.06 0.04 0.00 0.00 -0.00 0.00 0.00 56.30 56.40 3mw9 h ASN 494 Cb 0.76 0.22 0.00 0.00 -0.00 0.00 0.00 38.32 39.30 3mw9 h ASN 494 CO 0.06 -0.53 0.00 -0.62 -0.00 0.00 0.00 177.43 176.34 3mw9 n GLU 495 N -5.47 0.21 -0.07 6.67 1.02 0.27 -2.44 120.64 120.82 3mw9 n GLU 495 Ca -0.13 0.14 0.12 0.00 -0.02 0.00 0.00 57.16 57.27 3mw9 n GLU 495 Cb 0.36 -1.50 0.28 0.00 -0.02 0.00 0.00 31.44 30.56 3mw9 n GLU 495 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3mw9 n ALA 496 N -1.32 2.49 -1.70 0.62 0.00 -0.91 -4.89 120.51 114.80 3mw9 n ALA 496 Ca 0.07 -0.69 -0.12 0.00 0.00 0.00 0.00 53.44 52.70 3mw9 n ALA 496 Cb 0.14 -0.97 -0.03 0.00 0.00 0.00 0.00 19.45 18.59 3mw9 n ALA 496 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3mw9 n GLY 497 N 1.31 0.75 5.19 0.00 0.00 -1.02 -4.42 105.19 107.00 3mw9 n GLY 497 Ca 0.17 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.76 3mw9 n GLY 497 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3mw9 n VAL 498 N -3.18 0.00 -3.90 1.61 0.31 0.05 -4.70 118.33 108.51 3mw9 n VAL 498 Ca -0.13 0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.10 3mw9 n VAL 498 Cb 0.48 0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 33.36 3mw9 n VAL 498 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 3mw9 s THR 499 N 0.00 0.03 -1.17 2.52 -1.32 -1.26 -4.97 115.64 109.47 3mw9 s THR 499 Ca 0.00 -1.21 -0.18 0.00 -1.21 0.00 0.00 61.69 59.09 3mw9 s THR 499 Cb 0.00 -1.86 0.09 0.00 -1.51 0.00 0.00 72.50 69.22 3mw9 s THR 499 CO 0.00 -0.16 1.54 0.72 -2.21 0.00 0.00 174.62 174.52 3mw9 s PHE 500 N -3.95 2.90 -2.00 9.09 -0.12 -1.26 -5.19 117.98 117.45 3mw9 s PHE 500 Ca 0.16 -1.51 0.16 0.00 -0.05 0.00 0.00 56.93 55.69 3mw9 s PHE 500 Cb 0.01 -4.61 0.97 0.00 -0.63 0.00 0.00 43.02 38.76 3mw9 s PHE 500 CO 0.02 -1.73 1.38 2.41 -0.05 0.00 0.00 175.22 177.25