#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wm4 n ASN 4 N 0.00 0.00 0.15 -1.43 5.15 -1.26 -4.13 115.26 113.74 2wm4 n ASN 4 Ca 0.00 0.00 0.13 0.00 -0.60 0.00 0.00 54.58 54.11 2wm4 n ASN 4 Cb 0.00 0.00 0.46 0.00 -0.53 0.00 0.00 39.78 39.71 2wm4 n ASN 4 CO 0.00 0.00 0.00 0.71 1.40 0.00 0.00 177.26 179.37 2wm4 h THR 5 N 0.00 0.00 -4.18 -0.44 1.35 -1.97 -3.48 112.91 104.19 2wm4 h THR 5 Ca 0.00 -0.43 -0.51 0.00 -0.55 0.00 0.00 66.41 64.91 2wm4 h THR 5 Cb 0.00 1.32 0.11 0.00 -1.73 0.00 0.00 68.15 67.86 2wm4 h THR 5 CO 0.00 0.00 0.38 0.00 -0.25 0.00 0.00 175.52 175.65 2wm4 s ALA 6 N -3.28 2.40 0.42 6.62 0.00 -1.26 -4.53 121.76 122.14 2wm4 s ALA 6 Ca 0.06 0.65 -0.21 0.00 0.00 0.00 0.00 51.96 52.47 2wm4 s ALA 6 Cb 0.10 -3.36 -0.15 0.00 0.00 0.00 0.00 23.12 19.71 2wm4 s ALA 6 CO 0.51 -1.38 0.16 1.51 0.00 0.00 0.00 175.76 176.57 2wm4 n ILE 7 N -2.39 0.85 -1.93 0.00 3.06 0.42 -4.91 119.36 114.46 2wm4 n ILE 7 Ca 0.11 -0.50 -0.40 0.00 -2.50 0.00 0.00 62.75 59.46 2wm4 n ILE 7 Cb 0.51 -0.11 0.00 0.00 0.54 0.00 0.00 39.64 40.58 2wm4 n ILE 7 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2wm4 s ALA 8 N -1.67 3.37 0.92 1.51 0.00 -1.26 -4.97 121.76 119.66 2wm4 s ALA 8 Ca 0.60 1.39 -0.11 0.00 0.00 0.00 0.00 51.96 53.84 2wm4 s ALA 8 Cb -0.61 -3.55 0.15 0.00 0.00 0.00 0.00 23.12 19.11 2wm4 s ALA 8 CO 0.62 -0.96 1.11 0.99 0.00 0.00 0.00 175.76 177.52 2wm4 s THR 9 N -1.19 2.39 0.00 0.00 2.01 -1.26 -4.70 115.64 112.89 2wm4 s THR 9 Ca 0.56 0.13 0.02 0.00 0.31 0.00 0.00 61.69 62.70 2wm4 s THR 9 Cb -0.42 -2.31 -0.01 0.00 0.01 0.00 0.00 72.50 69.77 2wm4 s THR 9 CO 0.55 -0.17 -0.05 -0.60 -0.69 0.00 0.00 174.62 173.66 2wm4 s ARG 10 N -4.71 0.40 0.20 4.92 3.52 -0.21 -5.03 118.95 118.04 2wm4 s ARG 10 Ca 0.65 -0.26 -0.32 0.00 -0.13 0.00 0.00 55.73 55.68 2wm4 s ARG 10 Cb -0.21 -0.35 -0.11 0.00 -1.56 0.00 0.00 34.95 32.72 2wm4 s ARG 10 CO 0.58 0.09 1.66 0.08 -0.81 0.00 0.00 175.30 176.91 2wm4 s VAL 11 N -0.31 2.21 0.29 7.11 1.01 -1.26 -4.55 120.40 124.90 2wm4 s VAL 11 Ca -0.00 0.15 -0.29 0.00 0.00 0.00 0.00 61.98 61.84 2wm4 s VAL 11 Cb -0.03 -3.10 -0.10 0.00 0.00 0.00 0.00 36.38 33.15 2wm4 s VAL 11 CO -0.00 0.01 1.11 0.21 0.00 0.00 0.00 175.10 176.43 2wm4 s ASN 12 N 1.09 7.22 0.00 3.32 3.84 -1.26 -3.68 114.94 125.47 2wm4 s ASN 12 Ca 0.72 2.29 0.00 0.00 0.21 0.00 0.00 52.86 56.08 2wm4 s ASN 12 Cb -0.48 -2.63 0.00 0.00 -0.55 0.00 0.00 41.25 37.60 2wm4 s ASN 12 CO 0.33 -0.18 0.00 0.61 -2.79 0.00 0.00 177.10 175.08 2wm4 n GLY 13 N 1.14 0.64 3.65 1.21 0.00 -1.07 -4.92 105.19 105.84 2wm4 n GLY 13 Ca -0.01 -0.41 -0.43 0.00 0.00 0.00 0.00 46.02 45.17 2wm4 n GLY 13 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wm4 s THR 14 N -2.00 4.07 0.59 2.61 2.01 -1.24 -4.76 115.64 116.92 2wm4 s THR 14 Ca 0.00 1.27 -0.13 0.00 0.31 0.00 0.00 61.69 63.14 2wm4 s THR 14 Cb 0.00 -3.90 -0.05 0.00 0.01 0.00 0.00 72.50 68.56 2wm4 s THR 14 CO 0.00 -0.21 1.02 -2.16 -0.69 0.00 0.00 174.62 172.58 2wm4 s PRO 15 N 3.86 3.65 0.80 4.92 0.04 -1.26 -4.88 135.00 142.13 2wm4 s PRO 15 Ca 0.60 0.84 -0.11 0.00 0.04 0.00 0.00 61.00 62.37 2wm4 s PRO 15 Cb -0.23 -2.09 0.07 0.00 0.04 0.00 0.00 34.50 32.29 2wm4 s PRO 15 CO 0.20 -0.52 1.09 -1.25 0.04 0.00 0.00 177.00 176.56 2wm4 s PRO 16 N -4.80 2.08 0.76 0.56 0.04 -1.26 -5.00 135.00 127.38 2wm4 s PRO 16 Ca 0.57 0.88 -0.15 0.00 0.04 0.00 0.00 61.00 62.34 2wm4 s PRO 16 Cb -0.11 -1.90 0.02 0.00 0.04 0.00 0.00 34.50 32.56 2wm4 s PRO 16 CO 0.47 -1.69 0.93 -0.35 0.04 0.00 0.00 177.00 176.40 2wm4 n PRO 17 N -3.52 0.33 -2.01 0.56 -0.04 -1.26 -4.89 135.00 124.17 2wm4 n PRO 17 Ca 0.08 0.17 -0.42 0.00 -0.04 0.00 0.00 63.50 63.28 2wm4 n PRO 17 Cb 0.55 -2.20 -0.03 0.00 -0.04 0.00 0.00 33.50 31.78 2wm4 n PRO 17 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2wm4 s GLU 18 N -3.49 4.20 -0.30 0.54 2.56 -1.26 -4.47 118.70 116.48 2wm4 s GLU 18 Ca 0.71 2.20 0.03 0.00 0.00 0.00 0.00 54.97 57.91 2wm4 s GLU 18 Cb -0.32 -3.80 0.08 0.00 2.00 0.00 0.00 34.13 32.09 2wm4 s GLU 18 CO 0.53 -0.77 -0.00 0.08 -0.56 0.00 0.00 175.26 174.54 2wm4 s VAL 19 N 3.34 1.96 0.45 3.70 1.01 -1.26 -5.04 120.40 124.56 2wm4 s VAL 19 Ca 0.72 -1.87 -0.24 0.00 0.00 0.00 0.00 61.98 60.60 2wm4 s VAL 19 Cb -0.35 -2.31 -0.09 0.00 0.00 0.00 0.00 36.38 33.62 2wm4 s VAL 19 CO 0.30 -0.38 1.15 -2.65 0.00 0.00 0.00 175.10 173.52 2wm4 n PRO 20 N 4.44 1.58 -0.06 2.72 -0.02 -1.26 -4.77 135.00 137.62 2wm4 n PRO 20 Ca -0.04 0.57 0.14 0.00 -2.02 0.00 0.00 63.50 62.15 2wm4 n PRO 20 Cb 0.42 -2.26 0.54 0.00 -0.02 0.00 0.00 33.50 32.19 2wm4 n PRO 20 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 2wm4 h ILE 21 N 1.65 0.86 0.00 4.25 2.10 -1.97 -1.09 117.51 123.31 2wm4 h ILE 21 Ca -0.47 -0.11 0.00 0.00 1.08 0.00 0.00 64.86 65.36 2wm4 h ILE 21 Cb 1.32 0.51 0.00 0.00 -1.09 0.00 0.00 36.82 37.56 2wm4 h ILE 21 CO 0.57 0.06 0.00 0.00 -1.08 0.00 0.00 178.15 177.70 2wm4 h ALA 22 N 1.71 1.00 -0.14 0.18 0.00 -2.04 -1.40 119.26 118.57 2wm4 h ALA 22 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.18 2wm4 h ALA 22 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2wm4 h ALA 22 CO -0.06 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 178.94 2wm4 n ASP 23 N -3.06 2.04 -4.48 0.00 8.00 -0.41 -4.86 116.55 113.77 2wm4 n ASP 23 Ca -0.03 -1.72 -0.38 0.00 0.71 0.00 0.00 54.79 53.37 2wm4 n ASP 23 Cb 0.09 -0.08 -0.11 0.00 -0.02 0.00 0.00 41.12 41.00 2wm4 n ASP 23 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2wm4 s ILE 24 N -1.84 4.80 -0.42 0.53 1.01 -0.53 -5.01 121.20 119.74 2wm4 s ILE 24 Ca 0.34 -0.25 0.02 0.00 0.00 0.00 0.00 60.65 60.76 2wm4 s ILE 24 Cb 0.20 -3.40 0.15 0.00 0.01 0.00 0.00 42.46 39.42 2wm4 s ILE 24 CO 0.30 0.12 0.29 -0.70 0.00 0.00 0.00 174.94 174.94 2wm4 s GLU 25 N 1.66 1.00 0.58 2.79 2.56 -1.26 -4.99 118.70 121.04 2wm4 s GLU 25 Ca 0.05 -1.92 0.27 0.00 0.00 0.00 0.00 54.97 53.37 2wm4 s GLU 25 Cb -0.17 -1.76 1.71 0.00 2.00 0.00 0.00 34.13 35.92 2wm4 s GLU 25 CO 0.07 -1.27 2.23 -0.07 -0.56 0.00 0.00 175.26 175.67 2wm4 h LEU 26 N 6.34 0.00 -1.04 2.70 3.38 -1.94 -1.13 115.31 123.62 2wm4 h LEU 26 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2wm4 h LEU 26 Cb 0.92 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.67 2wm4 h LEU 26 CO 0.39 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.53 2wm4 n GLY 27 N -1.37 0.30 3.57 0.83 0.00 -1.26 -4.77 105.19 102.50 2wm4 n GLY 27 Ca -0.03 -0.33 -0.34 0.00 0.00 0.00 0.00 46.02 45.33 2wm4 n GLY 27 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2wm4 s SER 28 N -1.12 5.05 0.53 1.61 0.15 -0.43 -4.24 113.70 115.27 2wm4 s SER 28 Ca 0.22 -0.03 0.23 0.00 0.70 0.00 0.00 55.95 57.08 2wm4 s SER 28 Cb 0.12 -1.74 1.39 0.00 -1.71 0.00 0.00 66.02 64.08 2wm4 s SER 28 CO 0.16 0.22 2.05 0.25 1.20 0.00 0.00 173.24 177.12 2wm4 h LEU 29 N 6.33 0.00 -1.67 3.45 5.85 -1.86 -1.82 115.31 125.60 2wm4 h LEU 29 Ca -0.37 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.32 2wm4 h LEU 29 Cb 1.19 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.21 2wm4 h LEU 29 CO 0.62 0.00 -0.17 0.44 -0.34 0.00 0.00 178.44 179.00 2wm4 h ASP 30 N 0.00 0.00 -0.39 1.25 3.32 -1.93 -2.37 116.42 116.29 2wm4 h ASP 30 Ca 0.16 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.15 2wm4 h ASP 30 Cb 0.68 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.21 2wm4 h ASP 30 CO -0.00 0.17 0.02 0.15 -1.72 0.00 0.00 179.24 177.85 2wm4 h PHE 31 N 0.00 0.74 0.00 4.55 3.57 -1.54 -2.96 116.94 121.30 2wm4 h PHE 31 Ca -0.00 -0.12 -0.00 0.00 3.53 0.00 0.00 57.97 61.37 2wm4 h PHE 31 Cb 0.46 -0.20 -0.00 0.00 2.79 0.00 0.00 35.95 39.00 2wm4 h PHE 31 CO 0.00 0.76 -0.01 -1.49 -2.23 0.00 0.00 178.31 175.34 2wm4 h TRP 32 N 0.52 0.00 0.00 0.41 4.06 -1.52 -0.49 115.95 118.93 2wm4 h TRP 32 Ca 0.11 0.00 -0.06 0.00 2.06 0.00 0.00 58.89 61.00 2wm4 h TRP 32 Cb 0.45 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.60 2wm4 h TRP 32 CO 0.03 0.01 -0.30 0.00 -3.56 0.00 0.00 178.44 174.63 2wm4 h ALA 33 N 1.99 1.11 -2.67 1.49 0.00 -1.33 -3.42 119.26 116.43 2wm4 h ALA 33 Ca -0.00 -0.27 -0.52 0.00 0.00 0.00 0.00 54.91 54.11 2wm4 h ALA 33 Cb 0.26 -0.05 0.13 0.00 0.00 0.00 0.00 17.79 18.12 2wm4 h ALA 33 CO 0.00 0.37 0.41 -0.51 0.00 0.00 0.00 179.25 179.53 2wm4 s LEU 34 N -7.23 3.46 0.88 0.00 1.43 -0.19 -4.93 118.68 112.10 2wm4 s LEU 34 Ca -0.01 2.27 -0.10 0.00 -1.03 0.00 0.00 54.13 55.26 2wm4 s LEU 34 Cb 0.12 -4.58 0.12 0.00 0.03 0.00 0.00 46.19 41.88 2wm4 s LEU 34 CO 0.66 -1.85 1.12 1.51 0.23 0.00 0.00 176.35 178.02 2wm4 s ASP 35 N -2.02 3.38 0.36 2.29 1.47 -1.26 -4.72 116.67 116.17 2wm4 s ASP 35 Ca 0.73 1.98 0.11 0.00 1.18 0.00 0.00 52.55 56.55 2wm4 s ASP 35 Cb -0.27 -2.51 0.88 0.00 -0.34 0.00 0.00 42.92 40.68 2wm4 s ASP 35 CO 0.40 -2.78 1.85 0.44 0.68 0.00 0.00 175.17 175.76 2wm4 h ASP 36 N -1.64 0.61 -0.83 2.11 5.19 -1.95 -2.35 116.42 117.56 2wm4 h ASP 36 Ca -0.45 0.05 -0.01 0.00 -0.62 0.00 0.00 57.03 56.00 2wm4 h ASP 36 Cb 1.26 -0.06 -0.04 0.00 0.18 0.00 0.00 39.33 40.67 2wm4 h ASP 36 CO 0.46 0.27 0.48 0.44 -3.12 0.00 0.00 179.24 177.78 2wm4 h ASP 37 N 0.63 1.01 -0.14 6.45 3.32 -1.99 -0.78 116.42 124.91 2wm4 h ASP 37 Ca 0.48 -0.08 -0.11 0.00 0.02 0.00 0.00 57.03 57.34 2wm4 h ASP 37 Cb 0.89 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 40.18 2wm4 h ASP 37 CO -0.23 0.80 -0.35 0.58 -1.72 0.00 0.00 179.24 178.31 2wm4 h VAL 38 N 1.15 1.36 -0.38 -1.35 2.07 -1.79 -0.92 116.25 116.39 2wm4 h VAL 38 Ca 0.30 -1.63 0.08 0.00 0.82 0.00 0.00 66.70 66.26 2wm4 h VAL 38 Cb -0.02 2.04 -0.08 0.00 -1.52 0.00 0.00 31.29 31.71 2wm4 h VAL 38 CO -0.05 0.49 -0.13 -0.09 0.02 0.00 0.00 177.57 177.81 2wm4 h ARG 39 N 0.11 -0.05 -0.85 1.57 2.43 -1.31 0.39 114.38 116.67 2wm4 h ARG 39 Ca -0.00 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 2wm4 h ARG 39 Cb 0.96 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.49 2wm4 h ARG 39 CO 0.08 -0.03 0.46 -0.44 -1.51 0.00 0.00 179.97 178.52 2wm4 h ASP 40 N -0.05 1.07 -0.60 -3.80 3.32 -1.09 -0.97 116.42 114.31 2wm4 h ASP 40 Ca 0.19 -0.11 -0.00 0.00 0.02 0.00 0.00 57.03 57.13 2wm4 h ASP 40 Cb 0.34 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.58 2wm4 h ASP 40 CO -0.42 0.87 0.37 1.23 -1.72 0.00 0.00 179.24 179.57 2wm4 h GLY 41 N 1.19 0.86 0.96 2.75 0.00 -0.53 -0.55 103.07 107.75 2wm4 h GLY 41 Ca 0.30 -0.34 -0.02 0.00 0.00 0.00 0.00 47.33 47.26 2wm4 h GLY 41 CO -0.05 0.33 0.20 0.00 0.00 0.00 0.00 176.54 177.03 2wm4 h ALA 42 N 1.19 0.59 -0.23 3.60 0.00 0.47 -1.47 119.26 123.43 2wm4 h ALA 42 Ca 0.22 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 2wm4 h ALA 42 Cb -0.05 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 2wm4 h ALA 42 CO -0.04 0.18 -0.28 0.74 0.00 0.00 0.00 179.25 179.85 2wm4 h PHE 43 N 0.59 0.50 -0.47 0.00 0.04 -1.07 -1.53 116.94 115.01 2wm4 h PHE 43 Ca 0.15 -0.11 0.06 0.00 2.80 0.00 0.00 57.97 60.87 2wm4 h PHE 43 Cb 0.16 -0.12 -0.05 0.00 2.20 0.00 0.00 35.95 38.14 2wm4 h PHE 43 CO -0.00 0.68 0.18 0.00 -0.60 0.00 0.00 178.31 178.57 2wm4 h ALA 44 N 1.32 0.57 -0.05 2.45 0.00 -0.77 -1.35 119.26 121.43 2wm4 h ALA 44 Ca 0.05 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2wm4 h ALA 44 Cb 0.69 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 2wm4 h ALA 44 CO 0.05 -0.20 0.03 1.15 0.00 0.00 0.00 179.25 180.29 2wm4 h THR 45 N 0.37 1.02 -0.92 0.00 2.02 -0.85 -2.70 112.91 111.86 2wm4 h THR 45 Ca 0.22 -0.06 0.07 0.00 0.77 0.00 0.00 66.41 67.41 2wm4 h THR 45 Cb 0.20 0.97 -0.07 0.00 -1.74 0.00 0.00 68.15 67.51 2wm4 h THR 45 CO -0.20 0.02 0.57 -0.07 0.37 0.00 0.00 175.52 176.21 2wm4 h LEU 46 N 0.05 0.90 -0.85 2.58 3.38 -1.11 0.63 115.31 120.89 2wm4 h LEU 46 Ca 0.02 0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 2wm4 h LEU 46 Cb 0.01 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 2wm4 h LEU 46 CO -0.00 0.56 -0.04 0.03 0.09 0.00 0.00 178.44 179.08 2wm4 h ARG 47 N 1.03 0.81 0.05 1.13 3.08 -0.94 0.12 114.38 119.65 2wm4 h ARG 47 Ca 0.41 -0.24 -0.00 0.00 0.07 0.00 0.00 59.98 60.21 2wm4 h ARG 47 Cb 0.21 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.18 2wm4 h ARG 47 CO -0.19 0.84 -0.02 -0.09 -1.07 0.00 0.00 179.97 179.44 2wm4 h ARG 48 N 0.75 -0.06 0.00 0.04 2.43 -1.32 -3.38 114.38 112.84 2wm4 h ARG 48 Ca 0.14 0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 59.17 2wm4 h ARG 48 Cb 0.51 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.05 2wm4 h ARG 48 CO 0.03 0.54 -1.83 0.39 -1.51 0.00 0.00 179.97 177.59 2wm4 n GLU 49 N -4.75 0.65 -2.92 0.20 1.02 0.20 -4.70 120.64 110.34 2wm4 n GLU 49 Ca -0.07 -0.00 -0.14 0.00 -0.02 0.00 0.00 57.16 56.92 2wm4 n GLU 49 Cb 0.31 -1.63 0.01 0.00 -0.02 0.00 0.00 31.44 30.11 2wm4 n GLU 49 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2wm4 n ALA 50 N -2.41 0.15 -0.36 0.62 0.00 0.28 -5.01 120.51 113.78 2wm4 n ALA 50 Ca -0.12 -2.19 0.06 0.00 0.00 0.00 0.00 53.44 51.18 2wm4 n ALA 50 Cb 0.79 -1.12 0.22 0.00 0.00 0.00 0.00 19.45 19.34 2wm4 n ALA 50 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2wm4 h PRO 51 N 3.75 1.01 -5.05 0.00 0.13 -1.38 -3.32 132.00 127.14 2wm4 h PRO 51 Ca -0.05 -0.06 -0.67 0.00 -0.87 0.00 0.00 66.00 64.35 2wm4 h PRO 51 Cb 0.99 -0.23 -0.32 0.00 0.13 0.00 0.00 31.00 31.57 2wm4 h PRO 51 CO 0.35 0.67 -0.81 0.42 -0.23 0.00 0.00 178.00 178.40 2wm4 s ILE 52 N -5.98 2.56 0.05 -3.56 1.01 -1.26 -2.52 121.20 111.50 2wm4 s ILE 52 Ca -0.12 -0.77 -0.02 0.00 0.00 0.00 0.00 60.65 59.73 2wm4 s ILE 52 Cb 0.22 -2.11 -0.03 0.00 0.01 0.00 0.00 42.46 40.54 2wm4 s ILE 52 CO 0.81 0.50 0.01 -0.94 0.00 0.00 0.00 174.94 175.32 2wm4 s SER 53 N 1.31 0.38 0.03 3.58 1.04 -1.17 -4.97 113.70 113.91 2wm4 s SER 53 Ca 0.04 -0.86 -0.00 0.00 0.48 0.00 0.00 55.95 55.62 2wm4 s SER 53 Cb -0.14 0.21 -0.04 0.00 0.10 0.00 0.00 66.02 66.16 2wm4 s SER 53 CO -0.08 -0.58 0.14 0.12 0.98 0.00 0.00 173.24 173.82 2wm4 s PHE 54 N -3.53 3.39 -0.05 5.02 5.36 -1.26 -0.81 117.98 126.10 2wm4 s PHE 54 Ca 0.03 0.23 -0.03 0.00 -0.96 0.00 0.00 56.93 56.20 2wm4 s PHE 54 Cb 0.05 -1.74 0.02 0.00 -0.34 0.00 0.00 43.02 41.01 2wm4 s PHE 54 CO -0.09 0.58 0.12 -1.58 -1.46 0.00 0.00 175.22 172.79 2wm4 s TRP 55 N -1.35 -0.13 0.50 10.12 0.52 -0.35 -4.97 118.94 123.29 2wm4 s TRP 55 Ca 0.28 0.35 -0.23 0.00 0.02 0.00 0.00 56.10 56.52 2wm4 s TRP 55 Cb -0.12 -0.02 -0.06 0.00 -1.15 0.00 0.00 33.47 32.11 2wm4 s TRP 55 CO 0.20 -0.10 1.36 -2.14 0.02 0.00 0.00 176.95 176.30 2wm4 s PRO 56 N 0.52 3.40 0.21 4.98 0.02 -1.26 -0.79 135.00 142.08 2wm4 s PRO 56 Ca -0.04 2.26 -0.26 0.00 0.02 0.00 0.00 61.00 62.98 2wm4 s PRO 56 Cb -0.05 -2.42 -0.08 0.00 0.02 0.00 0.00 34.50 31.96 2wm4 s PRO 56 CO -0.02 -0.99 0.82 -0.08 -0.33 0.00 0.00 177.00 176.39 2wm4 s THR 57 N -1.28 4.32 0.29 0.99 -1.32 -1.26 -4.03 115.64 113.34 2wm4 s THR 57 Ca 0.67 1.74 -0.29 0.00 -1.21 0.00 0.00 61.69 62.59 2wm4 s THR 57 Cb -0.41 -4.12 -0.13 0.00 -1.51 0.00 0.00 72.50 66.33 2wm4 s THR 57 CO 0.50 0.43 1.26 -0.38 -2.21 0.00 0.00 174.62 174.22 2wm4 n ILE 58 N 1.34 1.61 0.00 5.08 5.41 -1.26 -4.88 119.36 126.65 2wm4 n ILE 58 Ca -0.04 -0.40 0.00 0.00 1.00 0.00 0.00 62.75 63.31 2wm4 n ILE 58 Cb 0.49 -1.37 0.00 0.00 -0.71 0.00 0.00 39.64 38.05 2wm4 n ILE 58 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 176.55 174.71 2wm4 n GLU 59 N 1.12 0.00 -0.98 0.38 -0.00 -1.26 -4.60 120.64 115.29 2wm4 n GLU 59 Ca 0.09 0.06 0.00 0.00 -0.00 0.00 0.00 57.16 57.31 2wm4 n GLU 59 Cb 0.33 -1.01 0.00 0.00 -0.00 0.00 0.00 31.44 30.76 2wm4 n GLU 59 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.13 178.60 2wm4 n LEU 60 N -0.69 0.00 -4.71 -1.84 -0.00 -1.26 -4.55 117.00 103.94 2wm4 n LEU 60 Ca 0.00 0.45 -0.42 0.00 -0.00 0.00 0.00 56.01 56.04 2wm4 n LEU 60 Cb 0.00 -1.14 -0.03 0.00 -0.00 0.00 0.00 43.42 42.25 2wm4 n LEU 60 CO 0.00 0.00 1.41 -2.65 -0.00 0.00 0.00 177.39 176.15 2wm4 n PRO 61 N -0.08 2.80 0.00 1.47 -0.02 -1.26 -2.54 135.00 135.36 2wm4 n PRO 61 Ca 0.00 1.01 0.00 0.00 -2.02 0.00 0.00 63.50 62.49 2wm4 n PRO 61 Cb 0.00 -2.88 0.00 0.00 -0.02 0.00 0.00 33.50 30.60 2wm4 n PRO 61 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wm4 n GLY 62 N 4.07 2.63 3.96 -1.23 0.00 -1.26 -4.36 105.19 108.99 2wm4 n GLY 62 Ca 0.17 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.96 2wm4 n GLY 62 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2wm4 s PHE 63 N -2.43 3.29 -0.28 1.61 0.40 -1.05 -5.08 117.98 114.43 2wm4 s PHE 63 Ca 0.00 0.17 -0.02 0.00 -0.60 0.00 0.00 56.93 56.48 2wm4 s PHE 63 Cb 0.00 -2.10 0.04 0.00 0.51 0.00 0.00 43.02 41.47 2wm4 s PHE 63 CO 0.00 -0.12 -0.02 0.08 0.70 0.00 0.00 175.22 175.86 2wm4 s VAL 64 N -2.39 3.01 0.04 -0.44 1.01 -1.26 -4.92 120.40 115.45 2wm4 s VAL 64 Ca 0.45 -1.19 -0.25 0.00 0.00 0.00 0.00 61.98 60.99 2wm4 s VAL 64 Cb -0.10 -2.64 -0.17 0.00 0.00 0.00 0.00 36.38 33.47 2wm4 s VAL 64 CO 0.36 0.03 1.50 0.00 0.00 0.00 0.00 175.10 176.99 2wm4 h ALA 65 N 8.02 -0.13 -0.96 5.51 0.00 -1.83 0.42 119.26 130.29 2wm4 h ALA 65 Ca -0.27 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2wm4 h ALA 65 Cb 1.08 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2wm4 h ALA 65 CO 0.55 -0.47 0.00 0.41 0.00 0.00 0.00 179.25 179.75 2wm4 n GLY 66 N -0.57 1.54 3.74 0.00 0.00 -1.26 -3.96 105.19 104.68 2wm4 n GLY 66 Ca -0.08 -0.54 -0.31 0.00 0.00 0.00 0.00 46.02 45.09 2wm4 n GLY 66 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wm4 s ASN 67 N -4.00 4.08 0.28 1.61 0.01 -1.26 -4.66 114.94 111.00 2wm4 s ASN 67 Ca 0.00 1.98 0.00 0.00 -0.71 0.00 0.00 52.86 54.13 2wm4 s ASN 67 Cb 0.00 -2.54 0.00 0.00 0.41 0.00 0.00 41.25 39.12 2wm4 s ASN 67 CO 0.00 -2.32 0.00 0.61 -1.51 0.00 0.00 177.10 173.88 2wm4 n GLY 68 N -0.65 -0.18 3.13 0.66 0.00 -1.26 -4.45 105.19 102.45 2wm4 n GLY 68 Ca 0.10 -1.75 -0.11 0.00 0.00 0.00 0.00 46.02 44.26 2wm4 n GLY 68 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2wm4 s HIS 69 N 0.13 0.02 -0.39 1.61 -3.43 0.03 -4.18 115.29 109.08 2wm4 s HIS 69 Ca 0.00 -0.11 -0.24 0.00 -0.80 0.00 0.00 55.06 53.91 2wm4 s HIS 69 Cb 0.00 -0.03 0.02 0.00 -1.43 0.00 0.00 32.58 31.13 2wm4 s HIS 69 CO 0.00 -0.32 0.83 -1.58 -2.00 0.00 0.00 174.74 171.68 2wm4 s TRP 70 N -1.54 3.06 -0.27 0.38 0.52 -0.08 -1.21 118.94 119.80 2wm4 s TRP 70 Ca -0.13 0.51 -0.22 0.00 0.02 0.00 0.00 56.10 56.28 2wm4 s TRP 70 Cb -0.06 -3.58 -0.01 0.00 -1.15 0.00 0.00 33.47 28.67 2wm4 s TRP 70 CO 0.01 -0.85 0.72 0.00 0.02 0.00 0.00 176.95 176.85 2wm4 s ALA 71 N 3.30 3.60 -0.40 0.98 0.00 0.00 -0.99 121.76 128.25 2wm4 s ALA 71 Ca 0.33 -0.37 -0.21 0.00 0.00 0.00 0.00 51.96 51.71 2wm4 s ALA 71 Cb -0.12 -3.16 0.01 0.00 0.00 0.00 0.00 23.12 19.85 2wm4 s ALA 71 CO 0.20 -0.94 0.69 -0.51 0.00 0.00 0.00 175.76 175.19 2wm4 s LEU 72 N 2.70 4.31 -0.01 0.00 1.43 0.48 -3.04 118.68 124.55 2wm4 s LEU 72 Ca 0.30 -0.02 0.13 0.00 -1.03 0.00 0.00 54.13 53.51 2wm4 s LEU 72 Cb -0.15 -2.84 -0.16 0.00 0.03 0.00 0.00 46.19 43.07 2wm4 s LEU 72 CO 0.09 -0.74 0.48 0.35 0.23 0.00 0.00 176.35 176.77 2wm4 n THR 73 N 5.81 0.00 -3.23 5.49 -2.24 -1.05 -1.55 114.28 117.52 2wm4 n THR 73 Ca -0.00 -0.23 -0.38 0.00 -2.27 0.00 0.00 64.05 61.18 2wm4 n THR 73 Cb 0.48 0.75 -0.06 0.00 -2.10 0.00 0.00 70.33 69.41 2wm4 n THR 73 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2wm4 s LYS 74 N -2.46 4.21 0.14 -0.78 -0.14 -1.26 -3.70 119.74 115.75 2wm4 s LYS 74 Ca 0.02 0.76 -0.29 0.00 -1.36 0.00 0.00 55.97 55.11 2wm4 s LYS 74 Cb 0.10 -3.13 -0.04 0.00 -1.68 0.00 0.00 37.83 33.07 2wm4 s LYS 74 CO 0.55 0.57 1.58 -0.92 -0.76 0.00 0.00 175.35 176.36 2wm4 h TYR 75 N 4.17 -1.27 -0.85 3.18 3.20 -1.87 -1.86 116.97 121.67 2wm4 h TYR 75 Ca -0.49 0.06 0.03 0.00 3.14 0.00 0.00 58.73 61.47 2wm4 h TYR 75 Cb 1.21 0.59 -0.05 0.00 1.54 0.00 0.00 36.73 40.02 2wm4 h TYR 75 CO 0.66 -0.47 0.56 -0.44 -1.64 0.00 0.00 178.16 176.84 2wm4 h ASP 76 N -0.43 0.93 -0.32 -2.11 3.32 -1.95 0.09 116.42 115.94 2wm4 h ASP 76 Ca 0.10 -0.01 -0.13 0.00 0.02 0.00 0.00 57.03 57.01 2wm4 h ASP 76 Cb 0.61 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 2wm4 h ASP 76 CO -0.47 0.65 -0.29 0.44 -1.72 0.00 0.00 179.24 177.85 2wm4 h ASP 77 N 1.08 0.81 -0.70 6.45 3.32 -1.93 -1.03 116.42 124.42 2wm4 h ASP 77 Ca 0.33 -0.46 0.01 0.00 0.02 0.00 0.00 57.03 56.93 2wm4 h ASP 77 Cb -0.01 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 39.28 2wm4 h ASP 77 CO -0.09 1.10 0.47 0.58 -1.72 0.00 0.00 179.24 179.57 2wm4 h VAL 78 N 0.54 1.18 -0.25 -1.35 2.07 -0.77 -0.45 116.25 117.21 2wm4 h VAL 78 Ca 0.06 -0.33 -0.03 0.00 0.82 0.00 0.00 66.70 67.22 2wm4 h VAL 78 Cb 0.86 0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 2wm4 h VAL 78 CO 0.07 0.17 0.03 0.15 0.02 0.00 0.00 177.57 178.02 2wm4 h PHE 79 N 0.95 0.45 -0.66 1.57 3.57 -0.97 -1.18 116.94 120.68 2wm4 h PHE 79 Ca 0.26 -0.07 -0.00 0.00 3.53 0.00 0.00 57.97 61.69 2wm4 h PHE 79 Cb -0.10 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 38.48 2wm4 h PHE 79 CO -0.03 0.55 0.40 -0.92 -2.23 0.00 0.00 178.31 176.09 2wm4 h TYR 80 N 0.22 0.86 -0.46 0.41 3.20 -0.95 -2.42 116.97 117.82 2wm4 h TYR 80 Ca 0.08 0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.90 2wm4 h TYR 80 Cb 0.35 -0.28 -0.02 0.00 1.54 0.00 0.00 36.73 38.32 2wm4 h TYR 80 CO 0.02 0.57 0.11 0.00 -1.64 0.00 0.00 178.16 177.23 2wm4 h ALA 81 N 1.21 0.61 -0.64 1.82 0.00 -0.92 -2.44 119.26 118.90 2wm4 h ALA 81 Ca 0.24 -0.20 0.07 0.00 0.00 0.00 0.00 54.91 55.02 2wm4 h ALA 81 Cb -0.04 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.53 2wm4 h ALA 81 CO -0.05 0.30 0.43 0.77 0.00 0.00 0.00 179.25 180.70 2wm4 h SER 82 N 0.62 0.52 0.11 0.00 0.02 -0.82 -2.76 113.55 111.23 2wm4 h SER 82 Ca 0.14 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 2wm4 h SER 82 Cb 0.33 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.76 2wm4 h SER 82 CO 0.00 0.33 -0.17 0.54 -1.14 0.00 0.00 176.83 176.40 2wm4 n ARG 83 N -4.48 1.27 -3.21 3.45 5.12 -0.95 -4.29 116.66 113.58 2wm4 n ARG 83 Ca 0.10 -0.81 -0.27 0.00 -1.93 0.00 0.00 57.85 54.94 2wm4 n ARG 83 Cb 0.28 -1.48 -0.06 0.00 -1.16 0.00 0.00 32.46 30.03 2wm4 n ARG 83 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 2wm4 n HIS 84 N -0.16 3.56 0.35 -1.55 8.25 -0.95 -4.93 115.22 119.79 2wm4 n HIS 84 Ca 0.14 -4.06 0.14 0.00 -0.26 0.00 0.00 57.72 53.69 2wm4 n HIS 84 Cb 0.38 -0.52 0.54 0.00 1.12 0.00 0.00 29.99 31.52 2wm4 n HIS 84 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2wm4 h PRO 85 N 3.64 0.00 0.00 -0.41 0.13 -1.73 -0.07 132.00 133.55 2wm4 h PRO 85 Ca 0.16 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.26 2wm4 h PRO 85 Cb 0.61 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.74 2wm4 h PRO 85 CO 0.81 0.00 -0.15 -0.44 -0.23 0.00 0.00 178.00 177.99 2wm4 h ASP 86 N 0.00 0.00 0.00 1.44 3.32 -1.94 -3.26 116.42 115.98 2wm4 h ASP 86 Ca 0.00 0.00 -0.39 0.00 0.02 0.00 0.00 57.03 56.66 2wm4 h ASP 86 Cb 0.51 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.00 2wm4 h ASP 86 CO 0.00 0.15 -2.28 -0.38 -1.72 0.00 0.00 179.24 175.01 2wm4 n ILE 87 N -3.46 1.45 -3.30 0.35 5.41 -0.91 -4.70 119.36 114.21 2wm4 n ILE 87 Ca -0.01 -0.30 -0.46 0.00 1.00 0.00 0.00 62.75 62.98 2wm4 n ILE 87 Cb 0.32 -1.92 -0.04 0.00 -0.71 0.00 0.00 39.64 37.29 2wm4 n ILE 87 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 2wm4 s PHE 88 N -2.53 3.39 0.24 1.39 0.08 -0.09 -1.08 117.98 119.38 2wm4 s PHE 88 Ca -0.36 -1.49 -0.10 0.00 0.12 0.00 0.00 56.93 55.10 2wm4 s PHE 88 Cb 0.13 -3.83 -0.07 0.00 -0.57 0.00 0.00 43.02 38.68 2wm4 s PHE 88 CO 0.46 -1.03 0.57 0.45 -0.10 0.00 0.00 175.22 175.56 2wm4 s SER 89 N 3.15 6.65 0.00 1.36 0.15 0.24 -4.22 113.70 121.04 2wm4 s SER 89 Ca 0.09 0.96 0.26 0.00 0.70 0.00 0.00 55.95 57.96 2wm4 s SER 89 Cb -0.23 -2.24 0.76 0.00 -1.71 0.00 0.00 66.02 62.59 2wm4 s SER 89 CO -0.01 -0.08 1.58 -1.20 1.20 0.00 0.00 173.24 174.73 2wm4 n SER 90 N -0.14 0.48 -4.79 5.45 7.64 -1.26 -0.67 113.62 120.33 2wm4 n SER 90 Ca 0.01 -0.24 -0.37 0.00 1.01 0.00 0.00 58.87 59.28 2wm4 n SER 90 Cb 0.52 0.06 -0.06 0.00 -1.01 0.00 0.00 64.21 63.72 2wm4 n SER 90 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 2wm4 s TYR 91 N -2.87 3.60 -2.69 1.43 5.04 -1.25 -2.47 117.35 118.13 2wm4 s TYR 91 Ca 0.15 0.80 0.24 0.00 -2.44 0.00 0.00 57.07 55.82 2wm4 s TYR 91 Cb 0.18 -2.30 0.38 0.00 0.35 0.00 0.00 41.96 40.57 2wm4 s TYR 91 CO 0.62 0.46 1.37 -0.35 -1.34 0.00 0.00 175.55 176.31 2wm4 n PRO 92 N 2.67 2.34 -3.56 4.97 -0.04 -1.26 -4.58 135.00 135.53 2wm4 n PRO 92 Ca -0.13 -1.98 -0.15 0.00 -0.04 0.00 0.00 63.50 61.20 2wm4 n PRO 92 Cb 0.52 -1.48 -0.06 0.00 -0.04 0.00 0.00 33.50 32.44 2wm4 n PRO 92 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 2wm4 s ASN 93 N -1.74 -0.58 0.00 3.54 2.47 -1.03 -4.77 114.94 112.82 2wm4 s ASN 93 Ca 0.34 0.75 0.11 0.00 0.42 0.00 0.00 52.86 54.48 2wm4 s ASN 93 Cb 0.21 0.64 0.08 0.00 -1.45 0.00 0.00 41.25 40.73 2wm4 s ASN 93 CO 0.31 -0.45 0.83 2.30 -3.72 0.00 0.00 177.10 176.37 2wm4 n ILE 94 N 1.22 0.00 -3.22 -5.21 -6.64 -1.26 -4.47 119.36 99.77 2wm4 n ILE 94 Ca -0.15 -0.49 -0.21 0.00 -1.77 0.00 0.00 62.75 60.12 2wm4 n ILE 94 Cb 0.57 1.22 0.00 0.00 -1.44 0.00 0.00 39.64 39.99 2wm4 n ILE 94 CO 0.00 0.00 0.00 0.42 -1.77 0.00 0.00 176.55 175.20 2wm4 s THR 95 N -0.93 4.00 0.18 7.28 -4.23 -1.26 -0.43 115.64 120.26 2wm4 s THR 95 Ca 0.12 -0.75 -0.10 0.00 -1.18 0.00 0.00 61.69 59.79 2wm4 s THR 95 Cb 0.09 -3.43 0.08 0.00 1.34 0.00 0.00 72.50 70.57 2wm4 s THR 95 CO 0.14 -0.24 1.67 0.40 -0.54 0.00 0.00 174.62 176.05 2wm4 h ILE 96 N 0.63 1.26 -3.71 2.99 2.04 -1.96 -3.45 117.51 115.32 2wm4 h ILE 96 Ca -0.46 -1.03 -0.57 0.00 1.00 0.00 0.00 64.86 63.81 2wm4 h ILE 96 Cb 1.26 0.71 0.16 0.00 -0.74 0.00 0.00 36.82 38.20 2wm4 h ILE 96 CO 0.55 0.38 0.29 -0.46 0.00 0.00 0.00 178.15 178.91 2wm4 n ASN 97 N -4.26 1.40 -4.77 1.72 0.23 -1.26 -4.95 115.26 103.37 2wm4 n ASN 97 Ca 0.03 0.86 -0.41 0.00 -0.53 0.00 0.00 54.58 54.54 2wm4 n ASN 97 Cb 0.29 -1.45 -0.01 0.00 -2.08 0.00 0.00 39.78 36.53 2wm4 n ASN 97 CO 0.00 0.00 0.00 -1.81 -0.93 0.00 0.00 177.26 174.52 2wm4 s ASP 98 N -1.17 6.57 0.22 0.53 1.11 0.14 -4.95 116.67 119.12 2wm4 s ASP 98 Ca 0.75 2.82 -0.30 0.00 0.18 0.00 0.00 52.55 56.00 2wm4 s ASP 98 Cb -0.42 -2.66 -0.09 0.00 1.07 0.00 0.00 42.92 40.82 2wm4 s ASP 98 CO 0.47 -0.69 1.32 -1.58 1.18 0.00 0.00 175.17 175.87 2wm4 s GLN 99 N -1.95 4.38 0.21 8.23 2.00 -1.26 -4.58 119.66 126.69 2wm4 s GLN 99 Ca 0.51 2.10 0.11 0.00 -2.00 0.00 0.00 55.36 56.07 2wm4 s GLN 99 Cb -0.42 -3.17 -0.04 0.00 0.80 0.00 0.00 33.01 30.18 2wm4 s GLN 99 CO 0.56 -0.25 -0.17 0.95 -0.50 0.00 0.00 175.29 175.88 2wm4 s THR 100 N -0.10 2.72 0.42 -0.34 -4.23 -1.26 -5.01 115.64 107.84 2wm4 s THR 100 Ca 0.56 -1.99 0.10 0.00 -1.18 0.00 0.00 61.69 59.18 2wm4 s THR 100 Cb -0.37 -2.35 0.29 0.00 1.34 0.00 0.00 72.50 71.40 2wm4 s THR 100 CO 0.41 -0.19 2.03 1.55 -0.54 0.00 0.00 174.62 177.87 2wm4 h PRO 101 N 2.82 0.48 -0.48 3.99 0.13 -1.98 0.90 132.00 137.86 2wm4 h PRO 101 Ca -0.45 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 64.64 2wm4 h PRO 101 Cb 1.22 -0.11 -0.02 0.00 0.13 0.00 0.00 31.00 32.22 2wm4 h PRO 101 CO 0.53 0.31 0.24 0.93 -0.23 0.00 0.00 178.00 179.79 2wm4 h GLU 102 N 0.49 0.68 -0.44 0.86 3.07 -2.02 -2.78 114.58 114.44 2wm4 h GLU 102 Ca 0.20 -0.09 -0.08 0.00 -0.50 0.00 0.00 59.36 58.89 2wm4 h GLU 102 Cb 0.19 -0.13 -0.02 0.00 -0.84 0.00 0.00 28.75 27.96 2wm4 h GLU 102 CO -0.05 0.56 -0.02 -0.07 -1.40 0.00 0.00 179.01 178.03 2wm4 h LEU 103 N 0.63 0.78 -1.84 1.33 4.07 -1.82 -3.07 115.31 115.39 2wm4 h LEU 103 Ca 0.17 -0.32 0.04 0.00 0.08 0.00 0.00 57.88 57.85 2wm4 h LEU 103 Cb 0.10 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 41.62 2wm4 h LEU 103 CO -0.02 0.91 0.43 0.00 -1.08 0.00 0.00 178.44 178.68 2wm4 h ALA 104 N 0.89 1.64 -0.57 1.53 0.00 -0.57 -1.06 119.26 121.13 2wm4 h ALA 104 Ca 0.12 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 2wm4 h ALA 104 Cb 0.53 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 2wm4 h ALA 104 CO 0.03 -0.51 0.34 0.93 0.00 0.00 0.00 179.25 180.04 2wm4 h GLU 105 N 0.00 0.76 0.00 0.00 4.39 -1.42 -2.81 114.58 115.51 2wm4 h GLU 105 Ca 0.07 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.71 2wm4 h GLU 105 Cb 0.93 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 29.42 2wm4 h GLU 105 CO -0.00 0.53 -1.05 0.66 -1.16 0.00 0.00 179.01 177.99 2wm4 n TYR 106 N -4.42 0.00 -2.06 4.33 4.01 -0.52 -4.58 117.16 113.92 2wm4 n TYR 106 Ca 0.05 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 57.84 2wm4 n TYR 106 Cb 0.07 -0.13 0.11 0.00 -0.31 0.00 0.00 39.34 39.09 2wm4 n TYR 106 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 2wm4 n PHE 107 N -1.59 0.00 -2.46 -0.72 3.72 -0.54 -4.29 117.46 111.58 2wm4 n PHE 107 Ca -0.01 -0.97 -0.35 0.00 -0.05 0.00 0.00 57.45 56.08 2wm4 n PHE 107 Cb 0.18 -0.20 0.01 0.00 -0.94 0.00 0.00 39.48 38.54 2wm4 n PHE 107 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2wm4 n GLY 108 N -0.29 5.83 1.03 1.37 0.00 -1.06 -4.76 105.19 107.31 2wm4 n GLY 108 Ca 0.12 -2.63 -0.06 0.00 0.00 0.00 0.00 46.02 43.45 2wm4 n GLY 108 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2wm4 n SER 109 N -0.32 0.36 0.21 1.61 3.41 -1.26 -4.92 113.62 112.70 2wm4 n SER 109 Ca 0.44 -1.30 0.15 0.00 -0.26 0.00 0.00 58.87 57.90 2wm4 n SER 109 Cb 0.36 -0.17 0.63 0.00 -0.26 0.00 0.00 64.21 64.77 2wm4 n SER 109 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wm4 h MET 110 N 0.00 0.00 0.00 4.33 -0.00 -1.93 -2.31 114.93 115.02 2wm4 h MET 110 Ca -0.09 0.00 -0.00 0.00 -0.00 0.00 0.00 59.70 59.61 2wm4 h MET 110 Cb 0.32 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 31.92 2wm4 h MET 110 CO 0.09 0.00 -0.01 0.97 -0.00 0.00 0.00 176.91 177.96 2wm4 h ILE 111 N 0.00 0.06 -0.38 -0.10 2.10 -1.96 -2.00 117.51 115.23 2wm4 h ILE 111 Ca 0.00 -0.35 -0.18 0.00 1.08 0.00 0.00 64.86 65.41 2wm4 h ILE 111 Cb 0.38 1.33 -0.11 0.00 -1.09 0.00 0.00 36.82 37.33 2wm4 h ILE 111 CO 0.00 0.01 -0.03 1.33 -1.08 0.00 0.00 178.15 178.39 2wm4 n VAL 112 N -3.14 2.56 -4.32 2.19 0.24 -0.87 -4.72 118.33 110.27 2wm4 n VAL 112 Ca -0.01 -2.61 -0.18 0.00 -2.04 0.00 0.00 64.34 59.50 2wm4 n VAL 112 Cb 0.22 -0.32 -0.10 0.00 -1.47 0.00 0.00 33.84 32.17 2wm4 n VAL 112 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2wm4 s LEU 113 N -3.21 2.53 0.42 1.34 1.43 -0.75 -3.88 118.68 116.56 2wm4 s LEU 113 Ca 0.45 -0.99 0.08 0.00 -1.03 0.00 0.00 54.13 52.64 2wm4 s LEU 113 Cb 0.40 -0.63 -0.01 0.00 0.03 0.00 0.00 46.19 45.98 2wm4 s LEU 113 CO 0.01 -0.18 0.41 -1.81 0.23 0.00 0.00 176.35 175.02 2wm4 s ASP 114 N -3.17 5.15 0.64 2.29 1.01 -1.26 -4.71 116.67 116.61 2wm4 s ASP 114 Ca 0.20 -0.70 -0.16 0.00 0.71 0.00 0.00 52.55 52.60 2wm4 s ASP 114 Cb -0.01 -0.56 -0.01 0.00 1.01 0.00 0.00 42.92 43.35 2wm4 s ASP 114 CO 0.06 -0.69 1.11 -1.81 0.21 0.00 0.00 175.17 174.05 2wm4 s ASP 115 N -4.17 5.23 0.32 0.27 1.01 -1.26 -1.12 116.67 116.95 2wm4 s ASP 115 Ca 0.49 2.00 0.24 0.00 0.71 0.00 0.00 52.55 56.00 2wm4 s ASP 115 Cb -0.04 -2.55 0.50 0.00 1.01 0.00 0.00 42.92 41.83 2wm4 s ASP 115 CO 0.29 -1.54 1.62 1.55 0.21 0.00 0.00 175.17 177.29 2wm4 h PRO 116 N 0.20 0.00 -0.86 8.23 0.13 -2.02 -3.45 132.00 134.22 2wm4 h PRO 116 Ca -0.47 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.70 2wm4 h PRO 116 Cb 1.25 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.33 2wm4 h PRO 116 CO 0.55 0.00 0.57 -0.09 -0.23 0.00 0.00 178.00 178.79 2wm4 h ARG 117 N 0.00 1.02 -0.40 0.86 2.43 -1.96 -2.46 114.38 113.87 2wm4 h ARG 117 Ca 0.00 -0.06 0.04 0.00 -0.81 0.00 0.00 59.98 59.15 2wm4 h ARG 117 Cb 0.89 -0.23 -0.04 0.00 -0.42 0.00 0.00 29.97 30.16 2wm4 h ARG 117 CO 0.00 0.68 0.16 1.25 -1.51 0.00 0.00 179.97 180.55 2wm4 h HIS 118 N 1.05 0.30 -0.61 2.20 2.76 -1.41 -1.65 115.15 117.80 2wm4 h HIS 118 Ca 0.35 0.02 -0.06 0.00 -2.20 0.00 0.00 60.37 58.48 2wm4 h HIS 118 Cb 0.07 -0.07 -0.03 0.00 1.55 0.00 0.00 27.41 28.93 2wm4 h HIS 118 CO -0.00 0.13 0.16 0.37 -1.30 0.00 0.00 177.93 177.30 2wm4 h GLN 119 N 0.34 0.96 -0.77 5.26 5.75 -1.77 0.20 115.11 125.08 2wm4 h GLN 119 Ca 0.18 -0.22 -0.03 0.00 -0.15 0.00 0.00 58.65 58.43 2wm4 h GLN 119 Cb 0.14 -0.13 -0.04 0.00 1.07 0.00 0.00 27.48 28.52 2wm4 h GLN 119 CO -0.16 0.87 0.38 0.00 -2.65 0.00 0.00 178.83 177.27 2wm4 h ARG 120 N 0.88 1.11 -0.25 1.69 3.08 -1.16 0.10 114.38 119.83 2wm4 h ARG 120 Ca 0.19 -0.16 -0.04 0.00 0.07 0.00 0.00 59.98 60.05 2wm4 h ARG 120 Cb 0.33 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 2wm4 h ARG 120 CO -0.00 0.85 0.02 -0.07 -1.07 0.00 0.00 179.97 179.70 2wm4 h LEU 121 N 1.09 0.42 -1.00 3.04 3.38 -1.07 -3.21 115.31 117.96 2wm4 h LEU 121 Ca 0.27 -0.29 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 2wm4 h LEU 121 Cb 0.10 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 40.69 2wm4 h LEU 121 CO -0.04 0.61 0.58 -0.09 0.09 0.00 0.00 178.44 179.59 2wm4 h ARG 122 N 0.23 1.26 0.00 1.13 2.43 0.12 -2.17 114.38 117.38 2wm4 h ARG 122 Ca 0.07 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2wm4 h ARG 122 Cb 0.38 -0.27 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 2wm4 h ARG 122 CO 0.01 0.87 0.00 0.43 -1.51 0.00 0.00 179.97 179.77 2wm4 n SER 123 N -4.36 0.00 0.07 -3.80 7.64 0.29 -1.58 113.62 111.87 2wm4 n SER 123 Ca 0.11 0.23 -0.04 0.00 1.01 0.00 0.00 58.87 60.18 2wm4 n SER 123 Cb 0.05 -0.34 0.18 0.00 -1.01 0.00 0.00 64.21 63.09 2wm4 n SER 123 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 2wm4 h ILE 124 N 0.00 1.32 0.00 0.44 2.04 -1.43 -3.38 117.51 116.50 2wm4 h ILE 124 Ca 0.00 -1.63 0.00 0.00 1.00 0.00 0.00 64.86 64.23 2wm4 h ILE 124 Cb 0.11 1.73 0.00 0.00 -0.74 0.00 0.00 36.82 37.91 2wm4 h ILE 124 CO 0.00 0.49 0.00 1.33 0.00 0.00 0.00 178.15 179.97 2wm4 n VAL 125 N -3.99 0.00 0.22 1.67 0.24 -0.74 -4.82 118.33 110.91 2wm4 n VAL 125 Ca -0.02 -0.40 0.09 0.00 -2.04 0.00 0.00 64.34 61.97 2wm4 n VAL 125 Cb 0.51 1.06 0.51 0.00 -1.47 0.00 0.00 33.84 34.45 2wm4 n VAL 125 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 2wm4 h SER 126 N 0.00 0.00 -0.91 -1.34 4.64 -1.48 -2.62 113.55 111.85 2wm4 h SER 126 Ca 0.00 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.36 2wm4 h SER 126 Cb 0.03 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.07 2wm4 h SER 126 CO 0.00 0.25 0.60 -0.09 -0.87 0.00 0.00 176.83 176.71 2wm4 h ARG 127 N 0.00 1.08 0.00 4.77 2.43 -1.87 -2.21 114.38 118.58 2wm4 h ARG 127 Ca -0.00 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 2wm4 h ARG 127 Cb 0.63 -0.24 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 2wm4 h ARG 127 CO 0.03 0.72 0.00 0.00 -1.51 0.00 0.00 179.97 179.21 2wm4 n ALA 128 N -2.39 1.28 0.30 2.80 0.00 -0.99 -2.68 120.51 118.83 2wm4 n ALA 128 Ca 0.12 0.10 0.03 0.00 0.00 0.00 0.00 53.44 53.70 2wm4 n ALA 128 Cb 0.12 -1.26 0.01 0.00 0.00 0.00 0.00 19.45 18.32 2wm4 n ALA 128 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2wm4 n PHE 129 N -2.01 0.00 -1.63 0.00 3.72 -0.84 -4.45 117.46 112.25 2wm4 n PHE 129 Ca 0.00 0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 57.01 2wm4 n PHE 129 Cb 0.10 0.00 0.03 0.00 -0.94 0.00 0.00 39.48 38.67 2wm4 n PHE 129 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 176.76 174.34 2wm4 n THR 130 N -0.02 3.14 -0.30 4.37 5.66 -1.09 -4.59 114.28 121.45 2wm4 n THR 130 Ca 0.03 -0.50 0.04 0.00 -3.05 0.00 0.00 64.05 60.58 2wm4 n THR 130 Cb 0.16 -1.23 0.19 0.00 -1.55 0.00 0.00 70.33 67.90 2wm4 n THR 130 CO 0.00 0.00 0.00 -0.65 -3.05 0.00 0.00 175.07 171.37 2wm4 h PRO 131 N 1.06 0.76 -0.70 1.09 0.11 -1.95 0.07 132.00 132.45 2wm4 h PRO 131 Ca -0.47 -0.05 0.11 0.00 0.11 0.00 0.00 66.00 65.71 2wm4 h PRO 131 Cb 1.34 -0.17 -0.08 0.00 0.11 0.00 0.00 31.00 32.20 2wm4 h PRO 131 CO 0.54 0.51 0.29 0.87 -0.21 0.00 0.00 178.00 179.99 2wm4 h LYS 132 N 0.79 0.46 0.15 1.05 1.79 -1.94 -1.68 116.57 117.18 2wm4 h LYS 132 Ca 0.42 -0.03 -0.22 0.00 -2.18 0.00 0.00 60.65 58.65 2wm4 h LYS 132 Cb 0.43 -0.10 0.02 0.00 -1.58 0.00 0.00 32.23 31.00 2wm4 h LYS 132 CO -0.27 0.30 -0.94 0.28 -1.08 0.00 0.00 179.45 177.75 2wm4 h VAL 133 N 0.47 1.45 0.00 0.50 2.07 -1.71 -3.22 116.25 115.82 2wm4 h VAL 133 Ca 0.36 -2.52 -0.03 0.00 0.82 0.00 0.00 66.70 65.33 2wm4 h VAL 133 Cb 0.48 3.10 -0.00 0.00 -1.52 0.00 0.00 31.29 33.35 2wm4 h VAL 133 CO -0.34 0.73 -0.12 -0.37 0.02 0.00 0.00 177.57 177.48 2wm4 h VAL 134 N -0.22 0.82 0.00 2.57 -1.51 -0.98 0.16 116.25 117.08 2wm4 h VAL 134 Ca -0.16 -0.47 -0.02 0.00 -1.23 0.00 0.00 66.70 64.82 2wm4 h VAL 134 Cb 1.72 1.28 -0.00 0.00 -2.13 0.00 0.00 31.29 32.16 2wm4 h VAL 134 CO 0.18 0.12 -0.09 0.00 -1.23 0.00 0.00 177.57 176.55 2wm4 h ALA 135 N 1.88 1.59 -0.00 5.19 0.00 -1.32 -2.71 119.26 123.89 2wm4 h ALA 135 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2wm4 h ALA 135 Cb 0.27 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2wm4 h ALA 135 CO 0.02 0.11 -0.21 0.54 0.00 0.00 0.00 179.25 179.71 2wm4 n ARG 136 N -4.05 0.37 -0.23 0.00 1.74 0.56 -3.31 116.66 111.73 2wm4 n ARG 136 Ca -0.03 -0.15 0.06 0.00 -0.77 0.00 0.00 57.85 56.97 2wm4 n ARG 136 Cb 0.17 -1.50 0.17 0.00 -1.02 0.00 0.00 32.46 30.28 2wm4 n ARG 136 CO 0.00 0.00 0.00 0.44 -1.52 0.00 0.00 177.63 176.55 2wm4 n ILE 137 N -1.19 1.45 -0.31 0.55 -5.35 -1.03 -4.54 119.36 108.95 2wm4 n ILE 137 Ca 0.10 -1.35 0.13 0.00 -0.27 0.00 0.00 62.75 61.36 2wm4 n ILE 137 Cb 0.31 0.22 0.28 0.00 -1.74 0.00 0.00 39.64 38.71 2wm4 n ILE 137 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 2wm4 h GLU 138 N 1.61 0.07 -0.76 6.28 4.57 -1.58 -0.93 114.58 123.84 2wm4 h GLU 138 Ca 0.00 -0.00 0.02 0.00 -1.18 0.00 0.00 59.36 58.19 2wm4 h GLU 138 Cb 0.94 -0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 29.48 2wm4 h GLU 138 CO 0.07 0.05 0.49 0.00 -1.18 0.00 0.00 179.01 178.44 2wm4 h ALA 139 N 1.88 0.97 -0.32 2.92 0.00 -1.88 0.21 119.26 123.04 2wm4 h ALA 139 Ca 0.56 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 55.32 2wm4 h ALA 139 Cb 1.15 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 2wm4 h ALA 139 CO -0.80 0.33 -0.25 0.00 0.00 0.00 0.00 179.25 178.53 2wm4 h ALA 140 N 1.29 0.96 -0.18 0.00 0.00 -1.68 -2.21 119.26 117.44 2wm4 h ALA 140 Ca 0.29 -0.37 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 2wm4 h ALA 140 Cb -0.06 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 2wm4 h ALA 140 CO -0.08 0.61 -0.22 0.28 0.00 0.00 0.00 179.25 179.84 2wm4 h VAL 141 N 0.56 1.34 -0.68 0.00 2.07 -0.58 -2.63 116.25 116.32 2wm4 h VAL 141 Ca 0.08 -1.41 0.04 0.00 0.82 0.00 0.00 66.70 66.23 2wm4 h VAL 141 Cb 0.73 1.84 -0.05 0.00 -1.52 0.00 0.00 31.29 32.30 2wm4 h VAL 141 CO 0.06 0.42 0.41 -0.09 0.02 0.00 0.00 177.57 178.39 2wm4 h ARG 142 N 0.11 0.77 0.00 1.57 9.65 -0.62 -0.64 114.38 125.23 2wm4 h ARG 142 Ca 0.02 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.86 2wm4 h ARG 142 Cb 0.77 -0.17 0.00 0.00 -1.39 0.00 0.00 29.97 29.18 2wm4 h ARG 142 CO 0.05 0.51 -1.01 -0.40 2.80 0.00 0.00 179.97 181.92 2wm4 n ASP 143 N -4.71 0.62 0.05 -3.80 5.75 -0.84 -1.06 116.55 112.57 2wm4 n ASP 143 Ca 0.07 -0.18 -0.12 0.00 -0.01 0.00 0.00 54.79 54.55 2wm4 n ASP 143 Cb 0.11 0.76 -0.06 0.00 -1.03 0.00 0.00 41.12 40.90 2wm4 n ASP 143 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 2wm4 h ARG 144 N 0.00 -0.08 -0.40 0.11 3.08 -1.42 -1.09 114.38 114.57 2wm4 h ARG 144 Ca 0.00 0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.08 2wm4 h ARG 144 Cb 0.73 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.77 2wm4 h ARG 144 CO 0.00 -0.05 0.22 0.00 -1.07 0.00 0.00 179.97 179.07 2wm4 h ALA 145 N 0.89 0.51 -0.26 0.04 0.00 -1.06 -0.61 119.26 118.77 2wm4 h ALA 145 Ca 0.01 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2wm4 h ALA 145 Cb 0.10 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2wm4 h ALA 145 CO -0.03 -0.12 0.03 1.25 0.00 0.00 0.00 179.25 180.38 2wm4 h HIS 146 N 0.45 0.48 -0.76 0.00 6.17 -1.10 -1.13 115.15 119.26 2wm4 h HIS 146 Ca 0.17 -0.07 -0.00 0.00 0.71 0.00 0.00 60.37 61.17 2wm4 h HIS 146 Cb 0.04 -0.13 -0.04 0.00 2.52 0.00 0.00 27.41 29.80 2wm4 h HIS 146 CO -0.08 0.57 0.46 0.00 0.71 0.00 0.00 177.93 179.58 2wm4 h ARG 147 N 0.24 1.02 -0.30 5.26 3.08 -1.10 0.18 114.38 122.77 2wm4 h ARG 147 Ca 0.08 -0.09 -0.08 0.00 0.07 0.00 0.00 59.98 59.96 2wm4 h ARG 147 Cb 0.36 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.19 2wm4 h ARG 147 CO 0.01 0.71 -0.11 -0.07 -1.07 0.00 0.00 179.97 179.44 2wm4 h LEU 148 N 1.04 0.61 -0.69 3.04 3.38 -0.76 0.12 115.31 122.06 2wm4 h LEU 148 Ca 0.27 -0.39 -0.04 0.00 0.09 0.00 0.00 57.88 57.81 2wm4 h LEU 148 Cb -0.05 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 2wm4 h LEU 148 CO -0.05 0.87 0.26 0.58 0.09 0.00 0.00 178.44 180.18 2wm4 h VAL 149 N 0.36 1.25 -0.09 1.22 2.07 -1.03 0.14 116.25 120.16 2wm4 h VAL 149 Ca 0.07 -0.80 0.01 0.00 0.82 0.00 0.00 66.70 66.81 2wm4 h VAL 149 Cb 0.62 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 2wm4 h VAL 149 CO 0.04 0.32 0.00 0.28 0.02 0.00 0.00 177.57 178.22 2wm4 h SER 150 N 0.99 -0.03 0.31 0.57 0.02 -0.78 -1.47 113.55 113.16 2wm4 h SER 150 Ca 0.23 0.02 -0.09 0.00 -0.84 0.00 0.00 61.79 61.10 2wm4 h SER 150 Cb 0.23 0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.79 2wm4 h SER 150 CO -0.02 -0.00 -0.40 0.77 -1.14 0.00 0.00 176.83 176.04 2wm4 h SER 151 N 0.03 0.12 -0.74 3.07 4.64 -0.63 0.88 113.55 120.93 2wm4 h SER 151 Ca 0.04 -0.05 0.10 0.00 -0.47 0.00 0.00 61.79 61.41 2wm4 h SER 151 Cb 0.05 -0.03 -0.07 0.00 -0.31 0.00 0.00 62.40 62.03 2wm4 h SER 151 CO -0.07 0.52 0.38 -0.03 -0.87 0.00 0.00 176.83 176.76 2wm4 h MET 152 N 0.10 0.62 0.14 4.77 -1.53 -0.27 0.61 114.93 119.38 2wm4 h MET 152 Ca 0.01 -0.04 -0.01 0.00 -3.44 0.00 0.00 59.70 56.22 2wm4 h MET 152 Cb 0.76 -0.14 0.00 0.00 -0.55 0.00 0.00 31.60 31.67 2wm4 h MET 152 CO 0.06 0.41 -0.07 0.82 0.14 0.00 0.00 176.91 178.27 2wm4 h ILE 153 N 0.64 1.01 -0.89 1.77 2.04 -0.20 -3.09 117.51 118.80 2wm4 h ILE 153 Ca 0.36 -0.81 -0.00 0.00 1.00 0.00 0.00 64.86 65.41 2wm4 h ILE 153 Cb 0.38 1.50 -0.04 0.00 -0.74 0.00 0.00 36.82 37.91 2wm4 h ILE 153 CO -0.27 0.19 0.55 0.00 0.00 0.00 0.00 178.15 178.62 2wm4 h ALA 154 N 0.18 1.14 0.00 1.87 0.00 -0.42 -1.69 119.26 120.34 2wm4 h ALA 154 Ca -0.02 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2wm4 h ALA 154 Cb 0.45 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2wm4 h ALA 154 CO 0.03 0.58 0.00 -0.91 0.00 0.00 0.00 179.25 178.95 2wm4 h ASN 155 N 1.22 0.00 -2.46 0.00 2.35 0.16 -3.38 115.58 113.47 2wm4 h ASN 155 Ca 0.32 0.00 -0.59 0.00 -0.55 0.00 0.00 56.30 55.48 2wm4 h ASN 155 Cb -0.07 0.00 -0.40 0.00 0.05 0.00 0.00 38.32 37.90 2wm4 h ASN 155 CO -0.06 0.00 -0.82 0.59 -1.65 0.00 0.00 177.43 175.49 2wm4 n ASN 156 N -2.66 1.46 -0.06 5.81 3.02 -0.63 -4.93 115.26 117.27 2wm4 n ASN 156 Ca -0.00 -2.88 0.08 0.00 -0.03 0.00 0.00 54.58 51.74 2wm4 n ASN 156 Cb 0.16 -0.65 0.45 0.00 -0.61 0.00 0.00 39.78 39.12 2wm4 n ASN 156 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 2wm4 h PRO 157 N 4.95 0.50 0.00 3.52 0.11 -1.76 -0.16 132.00 139.16 2wm4 h PRO 157 Ca 0.18 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.26 2wm4 h PRO 157 Cb 0.81 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.81 2wm4 h PRO 157 CO 0.58 0.33 0.00 -0.40 -0.21 0.00 0.00 178.00 178.30 2wm4 n ASP 158 N -4.47 0.00 -3.06 -2.05 5.68 -1.26 -4.88 116.55 106.50 2wm4 n ASP 158 Ca 0.07 0.44 -0.22 0.00 -0.50 0.00 0.00 54.79 54.58 2wm4 n ASP 158 Cb 0.22 -0.46 0.03 0.00 -1.14 0.00 0.00 41.12 39.77 2wm4 n ASP 158 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2wm4 n ARG 159 N -1.46 -4.50 -3.80 0.11 1.74 -0.07 -4.98 116.66 103.70 2wm4 n ARG 159 Ca 0.02 0.82 -0.27 0.00 -0.77 0.00 0.00 57.85 57.65 2wm4 n ARG 159 Cb 0.08 -5.65 -0.17 0.00 -1.02 0.00 0.00 32.46 25.71 2wm4 n ARG 159 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2wm4 s GLN 160 N -5.74 0.96 0.17 5.56 -0.21 -1.26 -3.40 119.66 115.73 2wm4 s GLN 160 Ca 0.31 -0.42 0.01 0.00 0.02 0.00 0.00 55.36 55.27 2wm4 s GLN 160 Cb -0.14 -1.96 -0.04 0.00 1.00 0.00 0.00 33.01 31.86 2wm4 s GLN 160 CO 0.38 -0.53 0.03 0.00 -2.12 0.00 0.00 175.29 173.06 2wm4 s ALA 161 N 1.77 1.21 -0.37 6.09 0.00 -0.55 -4.89 121.76 125.02 2wm4 s ALA 161 Ca -0.00 -1.58 -0.21 0.00 0.00 0.00 0.00 51.96 50.17 2wm4 s ALA 161 Cb -0.16 0.72 0.01 0.00 0.00 0.00 0.00 23.12 23.69 2wm4 s ALA 161 CO -0.07 -0.40 0.66 0.34 0.00 0.00 0.00 175.76 176.29 2wm4 s ASP 162 N -3.14 6.43 0.40 0.00 3.68 -1.26 0.30 116.67 123.07 2wm4 s ASP 162 Ca 0.25 0.09 0.11 0.00 2.13 0.00 0.00 52.55 55.13 2wm4 s ASP 162 Cb 0.07 -2.34 0.90 0.00 -1.45 0.00 0.00 42.92 40.10 2wm4 s ASP 162 CO 0.04 -0.66 1.95 0.25 0.13 0.00 0.00 175.17 176.88 2wm4 h LEU 163 N 9.51 0.52 0.41 -1.34 5.85 -1.53 -1.81 115.31 126.92 2wm4 h LEU 163 Ca -0.26 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.45 2wm4 h LEU 163 Cb 1.10 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.04 2wm4 h LEU 163 CO 0.86 0.31 -0.20 0.58 -0.34 0.00 0.00 178.44 179.65 2wm4 h VAL 164 N 0.57 0.46 0.00 1.05 2.07 -1.89 -1.04 116.25 117.47 2wm4 h VAL 164 Ca 0.33 -0.55 0.00 0.00 0.82 0.00 0.00 66.70 67.30 2wm4 h VAL 164 Cb 0.51 0.66 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 2wm4 h VAL 164 CO -0.11 0.08 0.00 0.77 0.02 0.00 0.00 177.57 178.33 2wm4 h SER 165 N -0.93 0.00 0.50 0.57 4.64 -1.85 0.17 113.55 116.66 2wm4 h SER 165 Ca -0.06 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.09 2wm4 h SER 165 Cb 0.56 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.62 2wm4 h SER 165 CO 0.09 0.00 -1.64 -0.62 -0.87 0.00 0.00 176.83 173.80 2wm4 n GLU 166 N -2.59 0.64 0.11 4.77 -0.58 -0.68 -4.54 120.64 117.75 2wm4 n GLU 166 Ca 0.03 0.12 0.00 0.00 -0.42 0.00 0.00 57.16 56.90 2wm4 n GLU 166 Cb 0.38 -1.72 0.00 0.00 -0.57 0.00 0.00 31.44 29.53 2wm4 n GLU 166 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 2wm4 n LEU 167 N -2.77 -0.63 -0.22 -4.62 7.94 -0.49 -4.71 117.00 111.50 2wm4 n LEU 167 Ca -0.12 0.38 -0.09 0.00 -1.11 0.00 0.00 56.01 55.07 2wm4 n LEU 167 Cb 0.84 0.74 0.03 0.00 0.53 0.00 0.00 43.42 45.56 2wm4 n LEU 167 CO 0.43 -0.56 0.86 0.00 -1.11 0.00 0.00 177.39 177.01 2wm4 h ALA 168 N 0.00 0.83 0.56 1.96 0.00 -1.29 -1.84 119.26 119.47 2wm4 h ALA 168 Ca 0.00 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.60 2wm4 h ALA 168 Cb 0.00 -0.23 0.01 0.00 0.00 0.00 0.00 17.79 17.56 2wm4 h ALA 168 CO 0.00 0.63 -0.27 0.78 0.00 0.00 0.00 179.25 180.39 2wm4 h GLY 169 N 0.97 -0.78 2.00 0.00 0.00 -0.87 -3.36 103.07 101.02 2wm4 h GLY 169 Ca 0.18 0.29 -0.02 0.00 0.00 0.00 0.00 47.33 47.78 2wm4 h GLY 169 CO 0.02 -0.28 -0.12 -0.56 0.00 0.00 0.00 176.54 175.60 2wm4 h PRO 170 N -0.96 0.00 0.56 4.80 0.13 -1.70 -3.10 132.00 131.73 2wm4 h PRO 170 Ca -0.08 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.03 2wm4 h PRO 170 Cb 0.57 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.71 2wm4 h PRO 170 CO 0.13 0.12 -0.27 1.25 -0.23 0.00 0.00 178.00 178.99 2wm4 h LEU 171 N 0.00 -0.63 -1.64 1.56 5.85 -1.49 0.42 115.31 119.38 2wm4 h LEU 171 Ca -0.00 -0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.64 2wm4 h LEU 171 Cb 0.55 0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.74 2wm4 h LEU 171 CO 0.02 -0.31 -0.18 -0.65 -0.34 0.00 0.00 178.44 176.97 2wm4 h PRO 172 N -0.97 0.00 0.56 5.25 0.11 -1.71 -2.15 132.00 133.09 2wm4 h PRO 172 Ca -0.08 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.01 2wm4 h PRO 172 Cb 0.64 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.76 2wm4 h PRO 172 CO 0.13 0.18 -0.27 1.25 -0.21 0.00 0.00 178.00 179.08 2wm4 h LEU 173 N 0.00 -0.64 -0.41 2.35 5.85 -1.45 -2.21 115.31 118.81 2wm4 h LEU 173 Ca -0.00 -0.04 0.07 0.00 0.84 0.00 0.00 57.88 58.75 2wm4 h LEU 173 Cb 0.47 0.17 -0.06 0.00 0.37 0.00 0.00 40.66 41.61 2wm4 h LEU 173 CO 0.02 -0.33 0.05 1.56 -0.34 0.00 0.00 178.44 179.40 2wm4 h GLN 174 N -0.95 0.16 0.02 1.25 4.20 -0.74 -0.46 115.11 118.59 2wm4 h GLN 174 Ca -0.08 -0.01 0.02 0.00 0.06 0.00 0.00 58.65 58.65 2wm4 h GLN 174 Cb 0.64 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.35 2wm4 h GLN 174 CO 0.13 0.11 -0.17 0.82 -0.67 0.00 0.00 178.83 179.04 2wm4 h ILE 175 N 0.17 0.58 -0.53 2.54 2.04 -1.44 -0.36 117.51 120.52 2wm4 h ILE 175 Ca 0.20 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 66.02 2wm4 h ILE 175 Cb 0.26 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 36.90 2wm4 h ILE 175 CO -0.29 0.00 0.18 -0.29 0.00 0.00 0.00 178.15 177.75 2wm4 h ILE 176 N -0.29 1.23 -0.77 -0.67 6.09 -1.22 -0.82 117.51 121.06 2wm4 h ILE 176 Ca 0.05 -0.77 -0.00 0.00 -1.37 0.00 0.00 64.86 62.77 2wm4 h ILE 176 Cb 0.35 0.73 -0.04 0.00 0.47 0.00 0.00 36.82 38.34 2wm4 h ILE 176 CO -0.15 0.29 0.46 0.00 -3.07 0.00 0.00 178.15 175.68 2wm4 h ASP 178 N 1.05 0.87 -0.37 0.00 3.32 -0.82 0.60 116.42 121.08 2wm4 h ASP 178 Ca 0.28 -0.02 -0.10 0.00 0.02 0.00 0.00 57.03 57.21 2wm4 h ASP 178 Cb -0.04 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.28 2wm4 h ASP 178 CO -0.05 0.62 -0.11 0.24 -1.72 0.00 0.00 179.24 178.22 2wm4 h MET 179 N 1.03 0.82 0.00 3.56 2.86 -0.17 -2.24 114.93 120.79 2wm4 h MET 179 Ca 0.29 -0.28 -0.05 0.00 -2.06 0.00 0.00 59.70 57.60 2wm4 h MET 179 Cb -0.09 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.50 2wm4 h MET 179 CO -0.07 0.90 -0.26 0.52 1.06 0.00 0.00 176.91 179.06 2wm4 h MET 180 N 0.74 0.00 -0.02 1.72 2.86 -0.43 0.21 114.93 120.01 2wm4 h MET 180 Ca 0.12 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.76 2wm4 h MET 180 Cb 0.61 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.27 2wm4 h MET 180 CO 0.04 0.26 0.00 0.41 1.06 0.00 0.00 176.91 178.68 2wm4 n GLY 181 N 0.09 0.93 3.70 8.32 0.00 0.54 -2.81 105.19 115.95 2wm4 n GLY 181 Ca -0.00 -0.58 -0.39 0.00 0.00 0.00 0.00 46.02 45.05 2wm4 n GLY 181 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wm4 s ILE 182 N -2.02 5.10 0.67 -0.61 1.01 0.18 -4.99 121.20 120.54 2wm4 s ILE 182 Ca 0.00 1.15 -0.15 0.00 0.00 0.00 0.00 60.65 61.65 2wm4 s ILE 182 Cb 0.00 -3.91 0.01 0.00 0.01 0.00 0.00 42.46 38.56 2wm4 s ILE 182 CO 0.00 0.24 1.15 -2.16 0.00 0.00 0.00 174.94 174.16 2wm4 s PRO 183 N 1.08 2.63 0.33 2.79 0.04 -1.26 -4.39 135.00 136.22 2wm4 s PRO 183 Ca 0.30 1.54 0.13 0.00 0.04 0.00 0.00 61.00 63.01 2wm4 s PRO 183 Cb -0.16 -1.92 1.03 0.00 0.04 0.00 0.00 34.50 33.50 2wm4 s PRO 183 CO 0.12 -1.41 1.67 1.57 0.04 0.00 0.00 177.00 178.99 2wm4 h LYS 184 N 0.04 0.33 0.00 4.56 -0.00 -1.97 -1.17 116.57 118.35 2wm4 h LYS 184 Ca -0.47 -0.02 -0.00 0.00 -0.00 0.00 0.00 60.65 60.15 2wm4 h LYS 184 Cb 1.27 -0.07 -0.00 0.00 -0.00 0.00 0.00 32.23 33.42 2wm4 h LYS 184 CO 0.53 0.22 -0.01 0.00 -0.00 0.00 0.00 179.45 180.18 2wm4 h ALA 185 N 1.83 1.02 -0.01 0.07 0.00 -2.04 -2.34 119.26 117.78 2wm4 h ALA 185 Ca 0.71 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.60 2wm4 h ALA 185 Cb 1.57 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.36 2wm4 h ALA 185 CO -0.60 0.02 -0.51 -0.25 0.00 0.00 0.00 179.25 177.90 2wm4 n ASP 186 N -3.13 1.61 -0.14 0.00 8.00 -0.45 -4.52 116.55 117.92 2wm4 n ASP 186 Ca -0.01 -1.26 -0.04 0.00 0.71 0.00 0.00 54.79 54.20 2wm4 n ASP 186 Cb 0.24 0.48 0.05 0.00 -0.02 0.00 0.00 41.12 41.87 2wm4 n ASP 186 CO 0.00 0.00 0.00 0.45 -0.39 0.00 0.00 177.20 177.26 2wm4 h HIS 187 N 1.72 0.20 -0.39 1.24 3.86 -1.40 -2.06 115.15 118.32 2wm4 h HIS 187 Ca 0.00 0.03 -0.07 0.00 -1.16 0.00 0.00 60.37 59.17 2wm4 h HIS 187 Cb 0.66 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 29.09 2wm4 h HIS 187 CO 0.00 0.04 -0.03 1.96 0.86 0.00 0.00 177.93 180.76 2wm4 h GLN 188 N 0.27 0.63 -0.09 2.45 7.50 -1.79 0.81 115.11 124.89 2wm4 h GLN 188 Ca 0.22 -0.16 -0.12 0.00 0.50 0.00 0.00 58.65 59.09 2wm4 h GLN 188 Cb 0.26 -0.08 0.01 0.00 0.05 0.00 0.00 27.48 27.72 2wm4 h GLN 188 CO -0.26 0.68 -0.42 -0.09 -1.50 0.00 0.00 178.83 177.24 2wm4 h ARG 189 N 0.60 0.43 -0.33 1.46 2.43 -1.78 -1.00 114.38 116.18 2wm4 h ARG 189 Ca 0.12 -0.35 0.06 0.00 -0.81 0.00 0.00 59.98 59.00 2wm4 h ARG 189 Cb 0.42 0.07 -0.06 0.00 -0.42 0.00 0.00 29.97 29.99 2wm4 h ARG 189 CO 0.02 0.99 -0.05 0.82 -1.51 0.00 0.00 179.97 180.23 2wm4 h ILE 190 N -0.01 0.70 -0.53 1.20 1.08 -1.13 -0.80 117.51 118.01 2wm4 h ILE 190 Ca -0.03 -0.01 0.05 0.00 -0.39 0.00 0.00 64.86 64.48 2wm4 h ILE 190 Cb 1.06 0.66 -0.05 0.00 -3.07 0.00 0.00 36.82 35.43 2wm4 h ILE 190 CO 0.09 0.01 0.27 0.15 -0.69 0.00 0.00 178.15 177.97 2wm4 h PHE 191 N 0.03 0.49 -0.42 1.37 3.57 -0.67 -1.28 116.94 120.03 2wm4 h PHE 191 Ca 0.16 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.65 2wm4 h PHE 191 Cb 0.24 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 38.81 2wm4 h PHE 191 CO -0.28 0.24 0.11 1.25 -2.23 0.00 0.00 178.31 177.40 2wm4 h HIS 192 N 0.52 0.63 -0.16 0.41 2.76 -0.93 -1.19 115.15 117.19 2wm4 h HIS 192 Ca 0.24 -0.04 -0.04 0.00 -2.20 0.00 0.00 60.37 58.33 2wm4 h HIS 192 Cb 0.15 -0.19 -0.00 0.00 1.55 0.00 0.00 27.41 28.91 2wm4 h HIS 192 CO -0.10 0.54 -0.06 -1.49 -1.30 0.00 0.00 177.93 175.52 2wm4 h TRP 193 N 0.61 0.36 -0.04 5.26 6.55 -0.50 -2.68 115.95 125.51 2wm4 h TRP 193 Ca 0.14 -0.08 -0.12 0.00 0.95 0.00 0.00 58.89 59.78 2wm4 h TRP 193 Cb 0.22 -0.09 -0.01 0.00 -0.86 0.00 0.00 29.16 28.42 2wm4 h TRP 193 CO 0.01 0.62 -0.52 1.79 -1.05 0.00 0.00 178.44 179.28 2wm4 h THR 194 N 0.00 1.37 -0.94 1.49 1.35 -1.11 -0.51 112.91 114.56 2wm4 h THR 194 Ca 0.04 -1.80 0.02 0.00 -0.55 0.00 0.00 66.41 64.13 2wm4 h THR 194 Cb 0.51 1.93 -0.05 0.00 -1.73 0.00 0.00 68.15 68.81 2wm4 h THR 194 CO 0.02 0.52 0.62 0.78 -0.25 0.00 0.00 175.52 177.21 2wm4 h ASN 195 N 0.08 1.05 0.07 5.36 -0.26 -1.22 -0.30 115.58 120.35 2wm4 h ASN 195 Ca -0.00 -0.02 -0.17 0.00 -0.56 0.00 0.00 56.30 55.55 2wm4 h ASN 195 Cb 0.95 -0.25 0.02 0.00 -1.06 0.00 0.00 38.32 37.98 2wm4 h ASN 195 CO 0.07 0.74 -0.70 0.58 -1.06 0.00 0.00 177.43 177.06 2wm4 h VAL 196 N 1.22 1.48 -0.68 2.81 2.07 -1.09 -0.92 116.25 121.13 2wm4 h VAL 196 Ca 0.36 -2.31 0.14 0.00 0.82 0.00 0.00 66.70 65.71 2wm4 h VAL 196 Cb -0.06 2.91 -0.10 0.00 -1.52 0.00 0.00 31.29 32.53 2wm4 h VAL 196 CO -0.10 0.66 0.17 0.40 0.02 0.00 0.00 177.57 178.73 2wm4 h ILE 197 N -0.26 0.59 -0.36 4.57 2.04 -0.92 -2.24 117.51 120.92 2wm4 h ILE 197 Ca -0.11 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.65 2wm4 h ILE 197 Cb 1.47 0.27 0.00 0.00 -0.74 0.00 0.00 36.82 37.82 2wm4 h ILE 197 CO 0.13 0.05 0.00 0.18 0.00 0.00 0.00 178.15 178.52 2wm4 n LEU 198 N -5.12 4.36 -0.00 1.44 4.32 -0.14 -4.03 117.00 117.83 2wm4 n LEU 198 Ca 0.12 -2.92 0.00 0.00 -0.02 0.00 0.00 56.01 53.19 2wm4 n LEU 198 Cb 0.39 -0.57 0.00 0.00 -1.62 0.00 0.00 43.42 41.63 2wm4 n LEU 198 CO 0.15 0.67 0.49 0.61 -1.22 0.00 0.00 177.39 178.09 2wm4 n GLY 199 N -0.09 2.75 3.70 -0.72 0.00 -0.35 -4.90 105.19 105.58 2wm4 n GLY 199 Ca 0.23 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 2wm4 n GLY 199 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2wm4 s PHE 200 N -0.98 2.71 0.00 1.61 2.19 -0.98 -1.78 117.98 120.75 2wm4 s PHE 200 Ca 0.00 0.41 0.00 0.00 0.33 0.00 0.00 56.93 57.68 2wm4 s PHE 200 Cb 0.00 -3.99 0.00 0.00 -1.31 0.00 0.00 43.02 37.72 2wm4 s PHE 200 CO 0.00 -3.83 0.00 0.41 1.83 0.00 0.00 175.22 173.63 2wm4 n GLY 201 N 3.92 2.34 3.55 13.12 0.00 0.32 -4.96 105.19 123.47 2wm4 n GLY 201 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 2wm4 n GLY 201 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2wm4 s ASP 202 N -1.70 6.10 0.65 1.61 -1.08 -0.73 -4.90 116.67 116.62 2wm4 s ASP 202 Ca 0.00 -0.25 0.33 0.00 -0.52 0.00 0.00 52.55 52.11 2wm4 s ASP 202 Cb 0.00 -2.16 1.79 0.00 -1.46 0.00 0.00 42.92 41.09 2wm4 s ASP 202 CO 0.00 -0.23 2.03 -0.65 0.52 0.00 0.00 175.17 176.84 2wm4 h PRO 203 N 8.44 0.00 0.00 4.34 0.11 -1.88 0.40 132.00 143.42 2wm4 h PRO 203 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 2wm4 h PRO 203 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2wm4 h PRO 203 CO 0.64 0.00 0.00 -0.44 -0.21 0.00 0.00 178.00 177.99 2wm4 h ASP 204 N 0.00 0.00 0.00 -2.05 3.32 -1.93 -3.39 116.42 112.37 2wm4 h ASP 204 Ca 0.03 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.08 2wm4 h ASP 204 Cb 0.55 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.10 2wm4 h ASP 204 CO -0.00 0.00 -0.14 0.18 -1.72 0.00 0.00 179.24 177.55 2wm4 n LEU 205 N -2.79 0.36 -3.61 1.55 7.99 0.11 -5.12 117.00 115.49 2wm4 n LEU 205 Ca 0.03 0.06 -0.08 0.00 -0.01 0.00 0.00 56.01 56.01 2wm4 n LEU 205 Cb 0.42 -0.39 -0.06 0.00 -0.11 0.00 0.00 43.42 43.27 2wm4 n LEU 205 CO 0.30 -0.49 0.85 0.00 -1.51 0.00 0.00 177.39 176.55 2wm4 s ALA 206 N -2.66 -2.00 0.00 -1.18 0.00 0.32 -4.94 121.76 111.30 2wm4 s ALA 206 Ca -0.04 1.72 0.00 0.00 0.00 0.00 0.00 51.96 53.64 2wm4 s ALA 206 Cb 0.01 -1.14 0.00 0.00 0.00 0.00 0.00 23.12 21.99 2wm4 s ALA 206 CO 0.06 -0.26 0.03 0.25 0.00 0.00 0.00 175.76 175.84 2wm4 n THR 207 N 1.22 0.00 -3.53 0.00 -2.24 -1.26 -0.53 114.28 107.95 2wm4 n THR 207 Ca -0.10 -0.08 -0.39 0.00 -2.27 0.00 0.00 64.05 61.22 2wm4 n THR 207 Cb 0.57 1.31 -0.10 0.00 -2.10 0.00 0.00 70.33 70.01 2wm4 n THR 207 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2wm4 s ASP 208 N -0.10 6.08 0.58 3.42 2.15 -1.26 -4.71 116.67 122.83 2wm4 s ASP 208 Ca 0.00 -0.07 0.27 0.00 0.43 0.00 0.00 52.55 53.18 2wm4 s ASP 208 Cb 0.00 -2.15 1.63 0.00 -0.30 0.00 0.00 42.92 42.11 2wm4 s ASP 208 CO 0.00 -0.14 2.14 0.15 -0.17 0.00 0.00 175.17 177.15 2wm4 h PHE 209 N 8.37 0.00 -0.54 -5.34 3.57 -1.97 -1.49 116.94 119.54 2wm4 h PHE 209 Ca -0.33 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.17 2wm4 h PHE 209 Cb 1.17 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.89 2wm4 h PHE 209 CO 0.73 0.00 0.35 -0.44 -2.23 0.00 0.00 178.31 176.72 2wm4 h ASP 210 N 0.00 0.63 -0.57 0.41 3.32 -1.94 -0.52 116.42 117.75 2wm4 h ASP 210 Ca 0.07 -0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.04 2wm4 h ASP 210 Cb 0.34 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.70 2wm4 h ASP 210 CO -0.00 0.46 0.17 -0.08 -1.72 0.00 0.00 179.24 178.08 2wm4 h GLU 211 N 0.73 0.93 -0.44 3.56 4.81 -1.70 -1.03 114.58 121.44 2wm4 h GLU 211 Ca 0.20 -0.19 -0.07 0.00 -0.13 0.00 0.00 59.36 59.17 2wm4 h GLU 211 Cb -0.07 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.15 2wm4 h GLU 211 CO -0.04 0.82 0.02 0.35 -0.73 0.00 0.00 179.01 179.42 2wm4 h PHE 212 N 0.90 0.84 -0.59 0.92 3.57 -1.29 -1.27 116.94 120.02 2wm4 h PHE 212 Ca 0.20 -0.14 -0.10 0.00 3.53 0.00 0.00 57.97 61.46 2wm4 h PHE 212 Cb 0.28 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.78 2wm4 h PHE 212 CO 0.02 0.81 -0.01 0.52 -2.23 0.00 0.00 178.31 177.42 2wm4 h MET 213 N 0.62 1.04 -0.21 1.11 2.86 -0.96 -1.04 114.93 118.35 2wm4 h MET 213 Ca 0.13 -0.33 -0.00 0.00 -2.06 0.00 0.00 59.70 57.44 2wm4 h MET 213 Cb 0.47 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.02 2wm4 h MET 213 CO 0.02 1.02 0.12 0.37 1.06 0.00 0.00 176.91 179.50 2wm4 h GLN 214 N 0.95 0.28 -0.65 1.72 5.75 -0.99 -0.68 115.11 121.50 2wm4 h GLN 214 Ca 0.17 -0.03 -0.04 0.00 -0.15 0.00 0.00 58.65 58.60 2wm4 h GLN 214 Cb 0.56 -0.06 -0.03 0.00 1.07 0.00 0.00 27.48 29.02 2wm4 h GLN 214 CO 0.03 0.23 0.23 0.28 -2.65 0.00 0.00 178.83 176.96 2wm4 h VAL 215 N 0.25 1.24 -0.28 2.39 2.07 -1.10 0.13 116.25 120.96 2wm4 h VAL 215 Ca 0.07 -0.79 0.01 0.00 0.82 0.00 0.00 66.70 66.82 2wm4 h VAL 215 Cb 0.03 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.32 2wm4 h VAL 215 CO -0.01 0.31 0.15 0.28 0.02 0.00 0.00 177.57 178.31 2wm4 h SER 216 N 0.92 0.23 -0.48 0.57 0.02 -1.05 0.82 113.55 114.58 2wm4 h SER 216 Ca 0.21 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.16 2wm4 h SER 216 Cb 0.24 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.72 2wm4 h SER 216 CO -0.01 0.17 0.27 0.00 -1.14 0.00 0.00 176.83 176.11 2wm4 h ALA 217 N 1.13 0.62 -0.62 3.77 0.00 -0.76 0.14 119.26 123.54 2wm4 h ALA 217 Ca 0.11 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 2wm4 h ALA 217 Cb 0.02 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 2wm4 h ALA 217 CO -0.07 0.14 0.27 -0.44 0.00 0.00 0.00 179.25 179.16 2wm4 h ASP 218 N 0.64 0.83 -0.06 0.00 3.32 -0.32 0.37 116.42 121.19 2wm4 h ASP 218 Ca 0.17 -0.15 -0.19 0.00 0.02 0.00 0.00 57.03 56.89 2wm4 h ASP 218 Cb 0.05 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.39 2wm4 h ASP 218 CO -0.03 0.75 -0.63 -0.29 -1.72 0.00 0.00 179.24 177.32 2wm4 h ILE 219 N 0.85 1.31 -0.15 0.35 2.10 -0.75 0.47 117.51 121.69 2wm4 h ILE 219 Ca 0.21 -1.87 -0.00 0.00 1.08 0.00 0.00 64.86 64.28 2wm4 h ILE 219 Cb 0.16 1.83 -0.01 0.00 -1.09 0.00 0.00 36.82 37.71 2wm4 h ILE 219 CO -0.02 0.59 0.08 1.23 -1.08 0.00 0.00 178.15 178.95 2wm4 h GLY 220 N 0.89 0.22 0.71 8.18 0.00 -0.65 0.11 103.07 112.53 2wm4 h GLY 220 Ca -0.01 -0.10 0.05 0.00 0.00 0.00 0.00 47.33 47.27 2wm4 h GLY 220 CO 0.12 0.09 0.26 0.00 0.00 0.00 0.00 176.54 177.02 2wm4 h ALA 221 N 0.99 0.66 -0.27 3.60 0.00 -0.20 -1.67 119.26 122.37 2wm4 h ALA 221 Ca 0.05 0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.02 2wm4 h ALA 221 Cb 0.06 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2wm4 h ALA 221 CO -0.01 -0.09 0.09 -0.92 0.00 0.00 0.00 179.25 178.32 2wm4 h TYR 222 N 0.51 0.16 -0.81 0.00 3.20 -0.61 -1.82 116.97 117.60 2wm4 h TYR 222 Ca 0.23 0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.15 2wm4 h TYR 222 Cb 0.14 -0.03 -0.05 0.00 1.54 0.00 0.00 36.73 38.34 2wm4 h TYR 222 CO -0.10 0.07 0.53 0.00 -1.64 0.00 0.00 178.16 177.02 2wm4 h ALA 223 N 1.17 1.53 -0.46 1.82 0.00 -0.42 -2.04 119.26 120.86 2wm4 h ALA 223 Ca 0.12 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 2wm4 h ALA 223 Cb 0.09 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2wm4 h ALA 223 CO -0.13 0.38 -0.05 1.15 0.00 0.00 0.00 179.25 180.61 2wm4 h THR 224 N 0.97 1.27 -0.49 0.00 2.02 -0.66 -0.27 112.91 115.75 2wm4 h THR 224 Ca 0.33 -1.13 -0.11 0.00 0.77 0.00 0.00 66.41 66.27 2wm4 h THR 224 Cb 0.08 1.07 -0.02 0.00 -1.74 0.00 0.00 68.15 67.54 2wm4 h THR 224 CO -0.10 0.39 -0.11 0.00 0.37 0.00 0.00 175.52 176.07 2wm4 h ALA 225 N 0.90 0.87 -0.15 6.16 0.00 -0.92 -1.01 119.26 125.10 2wm4 h ALA 225 Ca 0.12 -0.34 -0.07 0.00 0.00 0.00 0.00 54.91 54.63 2wm4 h ALA 225 Cb 0.57 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 2wm4 h ALA 225 CO 0.03 0.64 -0.18 1.25 0.00 0.00 0.00 179.25 181.00 2wm4 h LEU 226 N 0.82 0.42 -0.88 0.00 5.85 -1.21 -2.35 115.31 117.96 2wm4 h LEU 226 Ca 0.13 -0.50 0.11 0.00 0.84 0.00 0.00 57.88 58.47 2wm4 h LEU 226 Cb 0.64 -0.12 -0.08 0.00 0.37 0.00 0.00 40.66 41.47 2wm4 h LEU 226 CO 0.04 0.83 0.51 0.00 -0.34 0.00 0.00 178.44 179.49 2wm4 h ALA 227 N 0.60 1.29 -0.25 1.25 0.00 -0.87 -0.58 119.26 120.71 2wm4 h ALA 227 Ca 0.02 0.04 -0.16 0.00 0.00 0.00 0.00 54.91 54.81 2wm4 h ALA 227 Cb 0.72 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.38 2wm4 h ALA 227 CO 0.04 0.10 -0.46 0.93 0.00 0.00 0.00 179.25 179.86 2wm4 h GLU 228 N 0.82 0.76 -0.49 0.00 4.39 -1.07 0.11 114.58 119.10 2wm4 h GLU 228 Ca 0.44 -0.48 0.08 0.00 0.34 0.00 0.00 59.36 59.74 2wm4 h GLU 228 Cb 0.45 0.06 -0.10 0.00 -0.10 0.00 0.00 28.75 29.06 2wm4 h GLU 228 CO -0.27 1.11 -0.40 -0.44 -1.16 0.00 0.00 179.01 177.84 2wm4 h ASP 229 N 0.50 -1.35 0.80 1.42 3.32 -1.04 -2.45 116.42 117.62 2wm4 h ASP 229 Ca 0.01 0.22 -0.06 0.00 0.02 0.00 0.00 57.03 57.23 2wm4 h ASP 229 Cb 1.07 0.62 -0.01 0.00 0.22 0.00 0.00 39.33 41.23 2wm4 h ASP 229 CO 0.10 -0.34 -0.28 0.03 -1.72 0.00 0.00 179.24 177.03 2wm4 h ARG 230 N -0.26 0.00 -0.49 3.56 2.47 -0.36 -1.39 114.38 117.91 2wm4 h ARG 230 Ca 0.17 0.00 0.10 0.00 -1.26 0.00 0.00 59.98 58.99 2wm4 h ARG 230 Cb 0.57 0.00 -0.09 0.00 -1.65 0.00 0.00 29.97 28.80 2wm4 h ARG 230 CO -0.62 0.28 -0.05 -0.09 0.56 0.00 0.00 179.97 180.05 2wm4 h ARG 231 N 0.00 0.07 0.18 0.04 2.43 -0.30 -3.02 114.38 113.78 2wm4 h ARG 231 Ca -0.00 -0.00 -0.31 0.00 -0.81 0.00 0.00 59.98 58.85 2wm4 h ARG 231 Cb 0.76 -0.01 0.02 0.00 -0.42 0.00 0.00 29.97 30.31 2wm4 h ARG 231 CO 0.04 0.04 -1.41 -0.24 -1.51 0.00 0.00 179.97 176.89 2wm4 h VAL 232 N 0.07 1.33 -3.37 0.20 3.04 -1.37 -3.43 116.25 112.72 2wm4 h VAL 232 Ca 0.24 -2.85 -0.62 0.00 -1.01 0.00 0.00 66.70 62.46 2wm4 h VAL 232 Cb 0.37 2.95 -0.40 0.00 -2.01 0.00 0.00 31.29 32.20 2wm4 h VAL 232 CO -0.44 0.85 -0.72 0.20 -1.01 0.00 0.00 177.57 176.44 2wm4 s ASN 233 N -7.31 4.30 0.27 3.17 -0.87 -0.57 -5.11 114.94 108.83 2wm4 s ASN 233 Ca -0.07 -2.16 -0.30 0.00 -1.57 0.00 0.00 52.86 48.75 2wm4 s ASN 233 Cb 0.06 -1.29 -0.13 0.00 -0.02 0.00 0.00 41.25 39.87 2wm4 s ASN 233 CO 0.90 -0.36 1.47 1.57 -2.57 0.00 0.00 177.10 178.12 2wm4 n HIS 234 N 4.20 2.45 0.00 2.20 -0.00 -1.19 -4.26 115.22 118.61 2wm4 n HIS 234 Ca 0.03 0.38 0.00 0.00 -0.00 0.00 0.00 57.72 58.13 2wm4 n HIS 234 Cb 0.40 -2.51 0.00 0.00 -0.00 0.00 0.00 29.99 27.88 2wm4 n HIS 234 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2wm4 n HIS 235 N 1.83 0.00 -2.13 1.57 8.25 -1.26 -5.04 115.22 118.44 2wm4 n HIS 235 Ca 0.10 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.56 2wm4 n HIS 235 Cb 0.34 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.45 2wm4 n HIS 235 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 2wm4 n ASP 236 N -1.00 -1.95 -4.18 0.41 2.03 -1.26 -5.06 116.55 105.53 2wm4 n ASP 236 Ca 0.00 0.00 -0.14 0.00 0.52 0.00 0.00 54.79 55.17 2wm4 n ASP 236 Cb 0.00 -0.49 -0.10 0.00 -0.72 0.00 0.00 41.12 39.81 2wm4 n ASP 236 CO 0.00 0.00 0.00 1.51 -1.92 0.00 0.00 177.20 176.79 2wm4 s ASP 237 N -2.96 0.68 0.36 1.67 1.47 -1.26 -4.98 116.67 111.65 2wm4 s ASP 237 Ca 0.00 -1.42 0.07 0.00 1.18 0.00 0.00 52.55 52.38 2wm4 s ASP 237 Cb 0.00 0.32 0.69 0.00 -0.34 0.00 0.00 42.92 43.59 2wm4 s ASP 237 CO 0.00 -0.82 1.90 -0.07 0.68 0.00 0.00 175.17 176.86 2wm4 h LEU 238 N 2.49 0.37 -1.34 2.11 3.38 -0.72 -2.43 115.31 119.16 2wm4 h LEU 238 Ca -0.36 -0.07 0.08 0.00 0.09 0.00 0.00 57.88 57.62 2wm4 h LEU 238 Cb 1.25 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 41.85 2wm4 h LEU 238 CO 0.55 0.48 0.50 0.74 0.09 0.00 0.00 178.44 180.80 2wm4 h THR 239 N 0.38 1.00 -0.32 0.22 2.02 -1.75 -0.26 112.91 114.20 2wm4 h THR 239 Ca 0.08 -0.27 -0.18 0.00 0.77 0.00 0.00 66.41 66.82 2wm4 h THR 239 Cb 0.33 0.16 -0.00 0.00 -1.74 0.00 0.00 68.15 66.90 2wm4 h THR 239 CO 0.01 0.14 -0.50 0.28 0.37 0.00 0.00 175.52 175.83 2wm4 h SER 240 N 0.77 1.00 -1.01 4.18 0.02 -1.72 -2.56 113.55 114.23 2wm4 h SER 240 Ca 0.34 -0.51 0.03 0.00 -0.84 0.00 0.00 61.79 60.80 2wm4 h SER 240 Cb 0.32 -0.28 -0.06 0.00 0.14 0.00 0.00 62.40 62.52 2wm4 h SER 240 CO -0.12 1.31 0.66 0.28 -1.14 0.00 0.00 176.83 177.83 2wm4 h SER 241 N 0.71 1.12 -0.11 3.07 0.02 -1.06 -0.52 113.55 116.78 2wm4 h SER 241 Ca 0.03 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2wm4 h SER 241 Cb 1.10 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 63.37 2wm4 h SER 241 CO 0.11 0.79 0.07 -0.07 -1.14 0.00 0.00 176.83 176.60 2wm4 h LEU 242 N 1.31 0.13 -0.23 5.07 3.38 -0.91 -1.28 115.31 122.78 2wm4 h LEU 242 Ca 0.39 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.35 2wm4 h LEU 242 Cb -0.06 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.66 2wm4 h LEU 242 CO -0.11 0.10 0.00 -0.37 0.09 0.00 0.00 178.44 178.15 2wm4 h VAL 243 N 0.15 0.00 0.00 1.22 -1.51 -1.04 -3.14 116.25 111.93 2wm4 h VAL 243 Ca 0.04 -0.71 -0.13 0.00 -1.23 0.00 0.00 66.70 64.67 2wm4 h VAL 243 Cb -0.01 1.69 -0.02 0.00 -2.13 0.00 0.00 31.29 30.81 2wm4 h VAL 243 CO -0.01 0.00 -1.21 -0.33 -1.23 0.00 0.00 177.57 174.79 2wm4 h GLU 244 N 0.00 0.00 -7.11 5.19 5.08 -1.03 -3.46 114.58 113.24 2wm4 h GLU 244 Ca 0.00 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 57.81 2wm4 h GLU 244 Cb 0.81 0.00 0.15 0.00 0.50 0.00 0.00 28.75 30.20 2wm4 h GLU 244 CO 0.00 0.27 0.50 0.00 -1.00 0.00 0.00 179.01 178.78 2wm4 s ALA 245 N -2.99 2.39 -0.21 3.43 0.00 -0.49 -5.04 121.76 118.85 2wm4 s ALA 245 Ca -0.02 1.15 0.01 0.00 0.00 0.00 0.00 51.96 53.11 2wm4 s ALA 245 Cb 0.09 -3.53 0.04 0.00 0.00 0.00 0.00 23.12 19.72 2wm4 s ALA 245 CO 0.80 -1.52 -0.13 -1.21 0.00 0.00 0.00 175.76 173.69 2wm4 s GLU 246 N -3.41 2.33 -0.63 0.00 2.02 -1.26 -4.04 118.70 113.71 2wm4 s GLU 246 Ca 0.81 -0.98 0.03 0.00 0.02 0.00 0.00 54.97 54.84 2wm4 s GLU 246 Cb -0.35 -2.59 0.38 0.00 0.10 0.00 0.00 34.13 31.66 2wm4 s GLU 246 CO 0.39 -0.41 1.37 1.33 0.02 0.00 0.00 175.26 177.95 2wm4 n VAL 247 N 4.60 3.24 -0.73 2.63 0.24 -0.57 -4.70 118.33 123.03 2wm4 n VAL 247 Ca -0.16 -5.05 0.00 0.00 -2.04 0.00 0.00 64.34 57.09 2wm4 n VAL 247 Cb 0.46 -1.32 0.00 0.00 -1.47 0.00 0.00 33.84 31.51 2wm4 n VAL 247 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 2wm4 n ASP 248 N -0.40 0.00 -1.13 -1.34 3.85 -1.26 -4.82 116.55 111.45 2wm4 n ASP 248 Ca 0.42 0.00 0.03 0.00 -0.71 0.00 0.00 54.79 54.53 2wm4 n ASP 248 Cb 0.46 0.00 0.25 0.00 -1.35 0.00 0.00 41.12 40.48 2wm4 n ASP 248 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2wm4 n GLY 249 N 0.00 4.19 3.28 6.12 0.00 -1.26 -5.03 105.19 112.50 2wm4 n GLY 249 Ca 0.00 -1.08 -0.27 0.00 0.00 0.00 0.00 46.02 44.67 2wm4 n GLY 249 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wm4 s GLU 250 N -2.96 1.49 0.71 1.61 0.41 -1.26 -5.04 118.70 113.65 2wm4 s GLU 250 Ca 0.45 -1.02 -0.12 0.00 -0.41 0.00 0.00 54.97 53.88 2wm4 s GLU 250 Cb 0.37 -1.64 0.02 0.00 -1.78 0.00 0.00 34.13 31.10 2wm4 s GLU 250 CO 0.07 0.42 1.07 1.03 -0.49 0.00 0.00 175.26 177.37 2wm4 s ARG 251 N -1.27 2.72 0.29 1.61 0.52 -1.26 -1.51 118.95 120.05 2wm4 s ARG 251 Ca 0.09 1.09 -0.29 0.00 -0.52 0.00 0.00 55.73 56.10 2wm4 s ARG 251 Cb -0.09 -1.96 -0.10 0.00 0.52 0.00 0.00 34.95 33.32 2wm4 s ARG 251 CO 0.02 -1.28 1.28 -0.51 0.02 0.00 0.00 175.30 174.83 2wm4 s LEU 252 N -5.52 4.45 0.87 2.53 1.43 -1.26 -4.87 118.68 116.32 2wm4 s LEU 252 Ca 0.60 2.56 -0.11 0.00 -1.03 0.00 0.00 54.13 56.15 2wm4 s LEU 252 Cb -0.16 -3.64 0.12 0.00 0.03 0.00 0.00 46.19 42.54 2wm4 s LEU 252 CO 0.52 -0.47 1.10 -0.94 0.23 0.00 0.00 176.35 176.79 2wm4 s SER 253 N -0.36 3.59 0.25 2.29 1.04 -1.26 -4.76 113.70 114.50 2wm4 s SER 253 Ca 0.50 1.70 -0.06 0.00 0.48 0.00 0.00 55.95 58.58 2wm4 s SER 253 Cb -0.38 -2.36 0.47 0.00 0.10 0.00 0.00 66.02 63.86 2wm4 s SER 253 CO 0.47 -2.60 1.63 0.28 0.98 0.00 0.00 173.24 174.01 2wm4 h SER 254 N -1.52 -0.35 -0.45 7.02 0.02 -1.99 0.58 113.55 116.86 2wm4 h SER 254 Ca -0.47 0.20 -0.10 0.00 -0.84 0.00 0.00 61.79 60.58 2wm4 h SER 254 Cb 1.27 0.36 -0.01 0.00 0.14 0.00 0.00 62.40 64.15 2wm4 h SER 254 CO 0.51 -0.19 -0.12 -0.09 -1.14 0.00 0.00 176.83 175.80 2wm4 h ARG 255 N 0.10 0.87 -0.62 3.45 2.43 -1.92 0.71 114.38 119.40 2wm4 h ARG 255 Ca 0.43 -0.34 -0.04 0.00 -0.81 0.00 0.00 59.98 59.23 2wm4 h ARG 255 Cb 0.78 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.25 2wm4 h ARG 255 CO -0.69 0.98 0.25 0.93 -1.51 0.00 0.00 179.97 179.92 2wm4 h GLU 256 N 0.71 0.93 0.27 0.20 5.08 -1.75 0.17 114.58 120.18 2wm4 h GLU 256 Ca 0.11 -0.17 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 2wm4 h GLU 256 Cb 0.66 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.76 2wm4 h GLU 256 CO 0.05 0.79 -0.13 0.82 -1.00 0.00 0.00 179.01 179.53 2wm4 h ILE 257 N 0.86 0.78 -0.78 3.13 1.08 -0.76 -1.58 117.51 120.24 2wm4 h ILE 257 Ca 0.21 -0.40 0.14 0.00 -0.39 0.00 0.00 64.86 64.41 2wm4 h ILE 257 Cb 0.21 1.01 -0.09 0.00 -3.07 0.00 0.00 36.82 34.87 2wm4 h ILE 257 CO -0.02 0.09 0.35 0.00 -0.69 0.00 0.00 178.15 177.88 2wm4 h ALA 258 N 0.10 1.13 -0.28 1.87 0.00 -0.77 0.16 119.26 121.46 2wm4 h ALA 258 Ca -0.04 0.10 -0.14 0.00 0.00 0.00 0.00 54.91 54.83 2wm4 h ALA 258 Cb 0.42 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2wm4 h ALA 258 CO 0.06 -0.15 -0.41 0.77 0.00 0.00 0.00 179.25 179.52 2wm4 h SER 259 N 0.52 0.73 -0.20 0.00 0.02 -0.52 -1.43 113.55 112.66 2wm4 h SER 259 Ca 0.43 -0.33 -0.05 0.00 -0.84 0.00 0.00 61.79 60.99 2wm4 h SER 259 Cb 0.61 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.94 2wm4 h SER 259 CO -0.38 1.05 -0.08 0.15 -1.14 0.00 0.00 176.83 176.43 2wm4 h PHE 260 N 0.56 0.47 -0.76 3.45 3.04 -0.69 -1.00 116.94 122.02 2wm4 h PHE 260 Ca 0.05 -0.11 0.04 0.00 3.98 0.00 0.00 57.97 61.93 2wm4 h PHE 260 Cb 0.94 -0.11 -0.05 0.00 2.56 0.00 0.00 35.95 39.29 2wm4 h PHE 260 CO 0.05 0.69 0.47 0.35 -2.02 0.00 0.00 178.31 177.84 2wm4 h PHE 261 N 0.12 0.87 -0.20 0.41 3.57 -0.52 -2.17 116.94 119.03 2wm4 h PHE 261 Ca 0.05 0.02 -0.19 0.00 3.53 0.00 0.00 57.97 61.39 2wm4 h PHE 261 Cb 0.55 -0.28 -0.00 0.00 2.79 0.00 0.00 35.95 39.01 2wm4 h PHE 261 CO 0.06 0.48 -0.62 0.82 -2.23 0.00 0.00 178.31 176.81 2wm4 h ILE 262 N 0.90 1.30 -0.00 1.41 2.04 -1.19 -1.87 117.51 120.10 2wm4 h ILE 262 Ca 0.32 -1.86 0.01 0.00 1.00 0.00 0.00 64.86 64.33 2wm4 h ILE 262 Cb 0.08 1.81 -0.02 0.00 -0.74 0.00 0.00 36.82 37.95 2wm4 h ILE 262 CO -0.13 0.59 -0.07 0.25 0.00 0.00 0.00 178.15 178.78 2wm4 h LEU 263 N 0.51 -0.20 0.12 1.44 5.85 -0.92 -1.30 115.31 120.80 2wm4 h LEU 263 Ca -0.01 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.74 2wm4 h LEU 263 Cb 1.21 0.09 -0.00 0.00 0.37 0.00 0.00 40.66 42.32 2wm4 h LEU 263 CO 0.12 -0.10 -0.07 -0.07 -0.34 0.00 0.00 178.44 177.98 2wm4 h LEU 264 N -0.12 -0.18 -0.60 2.25 3.38 -1.25 0.03 115.31 118.82 2wm4 h LEU 264 Ca 0.03 0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.91 2wm4 h LEU 264 Cb 0.16 0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 2wm4 h LEU 264 CO -0.08 -0.12 -0.03 0.58 0.09 0.00 0.00 178.44 178.88 2wm4 h VAL 265 N -0.19 1.27 0.08 1.22 2.07 -1.34 0.39 116.25 119.74 2wm4 h VAL 265 Ca -0.01 -1.20 -0.00 0.00 0.82 0.00 0.00 66.70 66.31 2wm4 h VAL 265 Cb 0.16 0.84 0.00 0.00 -1.52 0.00 0.00 31.29 30.77 2wm4 h VAL 265 CO 0.01 0.43 -0.04 0.58 0.02 0.00 0.00 177.57 178.57 2wm4 h VAL 266 N 0.97 1.17 -0.48 2.57 2.07 -1.17 0.50 116.25 121.88 2wm4 h VAL 266 Ca 0.16 -0.93 0.04 0.00 0.82 0.00 0.00 66.70 66.79 2wm4 h VAL 266 Cb 0.60 1.76 -0.04 0.00 -1.52 0.00 0.00 31.29 32.09 2wm4 h VAL 266 CO 0.04 0.23 0.24 0.00 0.02 0.00 0.00 177.57 178.10 2wm4 h ALA 267 N 0.34 0.61 -0.15 1.67 0.00 -0.94 -0.39 119.26 120.40 2wm4 h ALA 267 Ca -0.01 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2wm4 h ALA 267 Cb 0.45 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2wm4 h ALA 267 CO 0.02 -0.10 -0.02 0.78 0.00 0.00 0.00 179.25 179.92 2wm4 h GLY 268 N 0.48 0.23 0.63 0.00 0.00 -0.09 -3.20 103.07 101.12 2wm4 h GLY 268 Ca 0.21 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.43 2wm4 h GLY 268 CO -0.14 0.11 -1.16 0.70 0.00 0.00 0.00 176.54 176.04 2wm4 n ASN 269 N -4.39 0.58 -1.30 0.19 3.02 0.16 -4.51 115.26 109.02 2wm4 n ASN 269 Ca -0.01 -0.01 -0.04 0.00 -0.03 0.00 0.00 54.58 54.49 2wm4 n ASN 269 Cb 0.18 0.87 0.12 0.00 -0.61 0.00 0.00 39.78 40.34 2wm4 n ASN 269 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2wm4 n GLU 270 N -2.22 2.06 0.00 3.52 -0.58 -0.25 -4.73 120.64 118.44 2wm4 n GLU 270 Ca 0.00 -3.45 0.00 0.00 -0.42 0.00 0.00 57.16 53.29 2wm4 n GLU 270 Cb 0.49 -1.65 0.00 0.00 -0.57 0.00 0.00 31.44 29.71 2wm4 n GLU 270 CO 0.00 0.00 0.00 -2.37 -0.48 0.00 0.00 177.13 174.28 2wm4 n THR 271 N -0.78 0.00 0.15 2.62 5.66 -1.25 -4.84 114.28 115.84 2wm4 n THR 271 Ca 0.25 0.00 0.06 0.00 -3.05 0.00 0.00 64.05 61.31 2wm4 n THR 271 Cb 0.84 0.00 0.54 0.00 -1.55 0.00 0.00 70.33 70.16 2wm4 n THR 271 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2wm4 h THR 272 N 0.00 1.05 -0.91 1.09 1.03 -1.83 -1.38 112.91 111.97 2wm4 h THR 272 Ca 0.00 -0.12 0.16 0.00 -0.01 0.00 0.00 66.41 66.44 2wm4 h THR 272 Cb 0.00 0.81 -0.07 0.00 -1.07 0.00 0.00 68.15 67.81 2wm4 h THR 272 CO 0.00 0.05 0.58 0.08 -0.01 0.00 0.00 175.52 176.23 2wm4 h ARG 273 N 0.24 0.62 0.09 0.00 0.11 -1.85 0.13 114.38 113.72 2wm4 h ARG 273 Ca 0.06 -0.04 -0.28 0.00 0.10 0.00 0.00 59.98 59.83 2wm4 h ARG 273 Cb -0.01 -0.14 0.02 0.00 1.11 0.00 0.00 29.97 30.95 2wm4 h ARG 273 CO -0.01 0.41 -1.17 -0.91 0.10 0.00 0.00 179.97 178.39 2wm4 h ASN 274 N 0.64 0.75 -0.51 0.08 -0.26 -1.58 -1.52 115.58 113.18 2wm4 h ASN 274 Ca 0.47 -0.68 0.09 0.00 -0.56 0.00 0.00 56.30 55.62 2wm4 h ASN 274 Cb 0.84 -0.24 -0.07 0.00 -1.06 0.00 0.00 38.32 37.79 2wm4 h ASN 274 CO -0.22 1.50 0.11 0.00 -1.06 0.00 0.00 177.43 177.75 2wm4 h ALA 275 N 0.43 0.59 -0.31 -0.83 0.00 -1.04 -0.19 119.26 117.91 2wm4 h ALA 275 Ca -0.16 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2wm4 h ALA 275 Cb 1.84 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.76 2wm4 h ALA 275 CO 0.22 -0.30 0.10 0.82 0.00 0.00 0.00 179.25 180.09 2wm4 h ILE 276 N 0.25 1.20 -0.20 0.00 2.04 -0.73 0.12 117.51 120.19 2wm4 h ILE 276 Ca 0.26 -0.63 -0.08 0.00 1.00 0.00 0.00 64.86 65.40 2wm4 h ILE 276 Cb 0.35 1.03 -0.00 0.00 -0.74 0.00 0.00 36.82 37.45 2wm4 h ILE 276 CO -0.33 0.21 -0.20 0.74 0.00 0.00 0.00 178.15 178.57 2wm4 h THR 277 N 0.35 1.33 -0.83 -0.27 2.02 -1.04 -1.99 112.91 112.48 2wm4 h THR 277 Ca 0.10 -1.36 0.04 0.00 0.77 0.00 0.00 66.41 65.96 2wm4 h THR 277 Cb 0.23 1.75 -0.05 0.00 -1.74 0.00 0.00 68.15 68.34 2wm4 h THR 277 CO -0.00 0.42 0.55 0.45 0.37 0.00 0.00 175.52 177.30 2wm4 h HIS 278 N 0.17 0.97 -0.32 3.16 3.86 -1.03 -1.44 115.15 120.52 2wm4 h HIS 278 Ca 0.03 0.02 0.04 0.00 -1.16 0.00 0.00 60.37 59.31 2wm4 h HIS 278 Cb 0.75 -0.32 -0.04 0.00 1.06 0.00 0.00 27.41 28.85 2wm4 h HIS 278 CO 0.08 0.55 0.07 0.78 0.86 0.00 0.00 177.93 180.27 2wm4 h GLY 279 N 0.99 0.38 1.06 2.45 0.00 -0.37 0.45 103.07 108.04 2wm4 h GLY 279 Ca 0.34 -0.03 -0.09 0.00 0.00 0.00 0.00 47.33 47.55 2wm4 h GLY 279 CO -0.11 -0.01 -0.02 -2.08 0.00 0.00 0.00 176.54 174.32 2wm4 h VAL 280 N 0.19 1.27 -0.58 4.60 2.07 -0.85 0.82 116.25 123.76 2wm4 h VAL 280 Ca 0.15 -1.15 0.02 0.00 0.82 0.00 0.00 66.70 66.54 2wm4 h VAL 280 Cb 0.16 0.89 -0.04 0.00 -1.52 0.00 0.00 31.29 30.78 2wm4 h VAL 280 CO -0.19 0.41 0.36 0.25 0.02 0.00 0.00 177.57 178.42 2wm4 h LEU 281 N 0.88 0.60 -0.30 2.57 5.85 -1.13 0.75 115.31 124.53 2wm4 h LEU 281 Ca 0.16 -0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.84 2wm4 h LEU 281 Cb 0.57 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 2wm4 h LEU 281 CO 0.03 0.42 0.06 0.00 -0.34 0.00 0.00 178.44 178.61 2wm4 h ALA 282 N 1.25 0.40 -0.98 1.25 0.00 -0.41 -0.59 119.26 120.17 2wm4 h ALA 282 Ca 0.23 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 55.00 2wm4 h ALA 282 Cb 0.00 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 17.62 2wm4 h ALA 282 CO -0.09 0.08 0.64 -0.07 0.00 0.00 0.00 179.25 179.81 2wm4 h LEU 283 N 0.32 1.05 -1.30 0.00 3.38 -0.67 -0.37 115.31 117.71 2wm4 h LEU 283 Ca 0.09 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 2wm4 h LEU 283 Cb 0.32 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.81 2wm4 h LEU 283 CO 0.00 0.70 0.36 0.28 0.09 0.00 0.00 178.44 179.88 2wm4 h SER 284 N 1.21 0.74 0.27 -0.43 0.02 -0.30 -3.14 113.55 111.91 2wm4 h SER 284 Ca 0.40 -0.04 -0.27 0.00 -0.84 0.00 0.00 61.79 61.04 2wm4 h SER 284 Cb 0.06 -0.19 0.02 0.00 0.14 0.00 0.00 62.40 62.43 2wm4 h SER 284 CO -0.14 0.58 -1.13 0.03 -1.14 0.00 0.00 176.83 175.04 2wm4 h ARG 285 N 0.85 0.50 -3.10 3.45 3.08 -0.45 -3.41 114.38 115.30 2wm4 h ARG 285 Ca 0.22 -0.64 -0.65 0.00 0.07 0.00 0.00 59.98 58.98 2wm4 h ARG 285 Cb -0.02 0.20 -0.39 0.00 0.08 0.00 0.00 29.97 29.84 2wm4 h ARG 285 CO -0.04 1.26 -0.38 0.66 -1.07 0.00 0.00 179.97 180.40 2wm4 n TYR 286 N -3.74 3.63 0.26 3.04 4.01 -0.21 -1.04 117.16 123.11 2wm4 n TYR 286 Ca -0.10 -4.22 0.15 0.00 -0.16 0.00 0.00 57.90 53.58 2wm4 n TYR 286 Cb 0.93 -0.82 0.60 0.00 -0.31 0.00 0.00 39.34 39.74 2wm4 n TYR 286 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 2wm4 h PRO 287 N 5.51 0.00 -0.71 -0.72 0.11 -1.78 -1.31 132.00 133.10 2wm4 h PRO 287 Ca 0.16 0.00 0.12 0.00 0.11 0.00 0.00 66.00 66.39 2wm4 h PRO 287 Cb 0.76 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 31.79 2wm4 h PRO 287 CO 0.79 0.04 0.27 1.49 -0.21 0.00 0.00 178.00 180.38 2wm4 h GLU 288 N 0.00 0.42 -0.51 1.05 4.57 -1.93 0.18 114.58 118.36 2wm4 h GLU 288 Ca -0.00 -0.03 0.01 0.00 -1.18 0.00 0.00 59.36 58.16 2wm4 h GLU 288 Cb 0.60 -0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 29.07 2wm4 h GLU 288 CO 0.01 0.28 0.34 1.96 -1.18 0.00 0.00 179.01 180.41 2wm4 h GLN 289 N 0.44 0.66 -0.52 1.92 1.08 -1.59 -0.83 115.11 116.28 2wm4 h GLN 289 Ca 0.38 -0.04 0.07 0.00 -1.45 0.00 0.00 58.65 57.61 2wm4 h GLN 289 Cb 0.53 -0.15 -0.06 0.00 -0.05 0.00 0.00 27.48 27.75 2wm4 h GLN 289 CO -0.37 0.44 0.19 -0.09 -0.95 0.00 0.00 178.83 178.05 2wm4 h ARG 290 N 0.68 0.36 0.00 1.46 2.43 -1.33 -2.18 114.38 115.81 2wm4 h ARG 290 Ca 0.19 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.35 2wm4 h ARG 290 Cb -0.07 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.39 2wm4 h ARG 290 CO -0.05 0.24 -0.07 -0.44 -1.51 0.00 0.00 179.97 178.14 2wm4 h ASP 291 N 0.37 -0.19 -0.91 -3.80 3.32 -0.38 -1.74 116.42 113.09 2wm4 h ASP 291 Ca 0.25 0.03 0.05 0.00 0.02 0.00 0.00 57.03 57.37 2wm4 h ASP 291 Cb 0.27 0.08 -0.06 0.00 0.22 0.00 0.00 39.33 39.84 2wm4 h ASP 291 CO -0.25 -0.10 0.58 0.03 -1.72 0.00 0.00 179.24 177.78 2wm4 h ARG 292 N -0.12 1.07 -0.09 3.56 2.47 -1.02 -1.87 114.38 118.38 2wm4 h ARG 292 Ca 0.03 -0.06 -0.23 0.00 -1.26 0.00 0.00 59.98 58.46 2wm4 h ARG 292 Cb 0.15 -0.24 0.01 0.00 -1.65 0.00 0.00 29.97 28.24 2wm4 h ARG 292 CO -0.07 0.71 -0.84 2.35 0.56 0.00 0.00 179.97 182.68 2wm4 h TRP 293 N 1.10 0.91 0.00 3.04 7.01 -1.24 -2.98 115.95 123.79 2wm4 h TRP 293 Ca 0.37 -0.43 -0.08 0.00 2.11 0.00 0.00 58.89 60.87 2wm4 h TRP 293 Cb 0.07 -0.13 -0.01 0.00 -2.10 0.00 0.00 29.16 26.99 2wm4 h TRP 293 CO -0.02 1.25 -0.38 -1.49 -2.79 0.00 0.00 178.44 175.01 2wm4 h TRP 294 N 0.42 0.00 0.00 2.65 -0.00 -1.20 -0.57 115.95 117.25 2wm4 h TRP 294 Ca -0.07 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.82 2wm4 h TRP 294 Cb 1.47 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.63 2wm4 h TRP 294 CO 0.08 0.38 0.00 0.77 -0.00 0.00 0.00 178.44 179.67 2wm4 h SER 295 N 0.00 0.00 -0.29 -3.49 0.02 -1.28 -3.37 113.55 105.14 2wm4 h SER 295 Ca -0.00 0.00 -0.27 0.00 -0.84 0.00 0.00 61.79 60.67 2wm4 h SER 295 Cb 0.70 0.00 -0.18 0.00 0.14 0.00 0.00 62.40 63.06 2wm4 h SER 295 CO 0.05 0.00 -0.57 -0.67 -1.14 0.00 0.00 176.83 174.50 2wm4 n ASP 296 N -2.50 -2.27 0.42 3.07 2.03 -0.73 -5.04 116.55 111.54 2wm4 n ASP 296 Ca 0.04 -3.35 -0.19 0.00 0.52 0.00 0.00 54.79 51.81 2wm4 n ASP 296 Cb 0.37 1.50 -0.09 0.00 -0.72 0.00 0.00 41.12 42.18 2wm4 n ASP 296 CO 0.00 0.00 0.00 0.15 -1.92 0.00 0.00 177.20 175.43 2wm4 h PHE 297 N 3.67 -0.98 -0.14 -0.67 3.57 -1.31 -0.64 116.94 120.43 2wm4 h PHE 297 Ca -0.10 -0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.32 2wm4 h PHE 297 Cb 1.03 0.32 -0.01 0.00 2.79 0.00 0.00 35.95 40.08 2wm4 h PHE 297 CO 0.16 -0.60 -0.18 -0.44 -2.23 0.00 0.00 178.31 175.02 2wm4 h ASP 298 N -1.08 0.22 0.16 0.41 3.32 -1.96 0.21 116.42 117.70 2wm4 h ASP 298 Ca -0.11 -0.05 -0.17 0.00 0.02 0.00 0.00 57.03 56.72 2wm4 h ASP 298 Cb 0.81 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.30 2wm4 h ASP 298 CO 0.18 0.43 -0.64 1.23 -1.72 0.00 0.00 179.24 178.71 2wm4 h GLY 299 N 0.83 0.51 0.23 2.75 0.00 -1.88 -3.29 103.07 102.22 2wm4 h GLY 299 Ca 0.04 -0.65 0.00 0.00 0.00 0.00 0.00 47.33 46.72 2wm4 h GLY 299 CO 0.03 0.59 -1.25 -0.10 0.00 0.00 0.00 176.54 175.81 2wm4 n LEU 300 N -3.90 0.60 -0.33 3.11 7.94 -0.27 -4.59 117.00 119.56 2wm4 n LEU 300 Ca -0.04 -0.20 0.10 0.00 -1.11 0.00 0.00 56.01 54.77 2wm4 n LEU 300 Cb 0.66 -0.04 0.28 0.00 0.53 0.00 0.00 43.42 44.85 2wm4 n LEU 300 CO 0.47 0.11 1.16 0.00 -1.11 0.00 0.00 177.39 178.03 2wm4 h ALA 301 N 2.59 1.51 -0.22 1.96 0.00 -0.64 -0.30 119.26 124.17 2wm4 h ALA 301 Ca 0.00 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 2wm4 h ALA 301 Cb 0.70 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2wm4 h ALA 301 CO 0.00 -0.05 0.06 -1.35 0.00 0.00 0.00 179.25 177.91 2wm4 h PRO 302 N 0.72 0.34 0.00 0.00 0.11 -1.81 -1.35 132.00 130.01 2wm4 h PRO 302 Ca 0.53 -0.08 -0.12 0.00 0.11 0.00 0.00 66.00 66.44 2wm4 h PRO 302 Cb 0.78 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.83 2wm4 h PRO 302 CO -0.37 0.44 -0.58 1.79 -0.21 0.00 0.00 178.00 179.07 2wm4 h THR 303 N 0.17 1.23 -0.45 -1.15 1.35 -1.74 -3.06 112.91 109.26 2wm4 h THR 303 Ca 0.07 -2.14 -0.08 0.00 -0.55 0.00 0.00 66.41 63.71 2wm4 h THR 303 Cb 0.25 2.22 -0.02 0.00 -1.73 0.00 0.00 68.15 68.87 2wm4 h THR 303 CO -0.00 0.57 -0.02 0.00 -0.25 0.00 0.00 175.52 175.83 2wm4 h ALA 304 N 1.42 0.60 -0.31 6.62 0.00 -0.41 -1.96 119.26 125.22 2wm4 h ALA 304 Ca -0.01 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.57 2wm4 h ALA 304 Cb 1.17 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 2wm4 h ALA 304 CO 0.08 0.41 -0.01 0.28 0.00 0.00 0.00 179.25 180.01 2wm4 h VAL 305 N 0.64 1.26 -0.75 0.00 2.07 -1.28 -0.70 116.25 117.49 2wm4 h VAL 305 Ca 0.12 -0.98 -0.02 0.00 0.82 0.00 0.00 66.70 66.65 2wm4 h VAL 305 Cb 0.52 1.29 -0.04 0.00 -1.52 0.00 0.00 31.29 31.54 2wm4 h VAL 305 CO 0.03 0.32 0.40 -0.33 0.02 0.00 0.00 177.57 178.01 2wm4 h GLU 306 N 0.35 1.04 -0.03 1.57 4.39 -1.46 -2.09 114.58 118.35 2wm4 h GLU 306 Ca 0.09 -0.12 -0.16 0.00 0.34 0.00 0.00 59.36 59.51 2wm4 h GLU 306 Cb 0.46 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 28.89 2wm4 h GLU 306 CO 0.02 0.76 -0.72 1.49 -1.16 0.00 0.00 179.01 179.40 2wm4 h GLU 307 N 1.04 0.19 -0.80 2.33 4.57 -1.11 -0.41 114.58 120.39 2wm4 h GLU 307 Ca 0.26 -0.16 -0.04 0.00 -1.18 0.00 0.00 59.36 58.25 2wm4 h GLU 307 Cb 0.03 0.03 -0.04 0.00 -0.16 0.00 0.00 28.75 28.62 2wm4 h GLU 307 CO -0.04 0.82 0.34 0.82 -1.18 0.00 0.00 179.01 179.77 2wm4 h ILE 308 N 0.12 1.26 -0.24 2.32 2.04 -0.84 -0.55 117.51 121.62 2wm4 h ILE 308 Ca -0.02 -0.79 -0.05 0.00 1.00 0.00 0.00 64.86 65.00 2wm4 h ILE 308 Cb 1.27 0.28 -0.01 0.00 -0.74 0.00 0.00 36.82 37.62 2wm4 h ILE 308 CO 0.11 0.33 -0.06 0.58 0.00 0.00 0.00 178.15 179.11 2wm4 h VAL 309 N 1.16 1.28 -0.89 1.67 2.07 -0.98 -0.42 116.25 120.15 2wm4 h VAL 309 Ca 0.27 -1.06 0.08 0.00 0.82 0.00 0.00 66.70 66.81 2wm4 h VAL 309 Cb 0.19 1.49 -0.07 0.00 -1.52 0.00 0.00 31.29 31.38 2wm4 h VAL 309 CO -0.03 0.33 0.54 -0.09 0.02 0.00 0.00 177.57 178.34 2wm4 h ARG 310 N 0.20 0.92 -0.03 1.57 2.43 -0.97 0.06 114.38 118.56 2wm4 h ARG 310 Ca 0.06 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 59.16 2wm4 h ARG 310 Cb 0.52 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 2wm4 h ARG 310 CO 0.02 0.61 -0.06 2.35 -1.51 0.00 0.00 179.97 181.38 2wm4 h TRP 311 N 0.94 0.11 -0.12 2.20 2.91 -0.92 -3.25 115.95 117.82 2wm4 h TRP 311 Ca 0.41 -0.04 -0.10 0.00 1.13 0.00 0.00 58.89 60.28 2wm4 h TRP 311 Cb 0.28 -0.02 -0.01 0.00 -0.51 0.00 0.00 29.16 28.89 2wm4 h TRP 311 CO -0.03 0.65 -0.38 0.00 -1.03 0.00 0.00 178.44 177.64 2wm4 h ALA 312 N 0.44 1.12 -5.89 2.65 0.00 -0.96 -3.48 119.26 113.14 2wm4 h ALA 312 Ca 0.00 -0.40 -0.25 0.00 0.00 0.00 0.00 54.91 54.27 2wm4 h ALA 312 Cb 0.64 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 2wm4 h ALA 312 CO 0.01 0.57 -0.56 0.43 0.00 0.00 0.00 179.25 179.71 2wm4 n SER 313 N -4.05 -2.38 -0.06 0.00 7.64 -0.00 -4.81 113.62 109.96 2wm4 n SER 313 Ca -0.01 -0.49 0.10 0.00 1.01 0.00 0.00 58.87 59.48 2wm4 n SER 313 Cb 0.46 -0.79 0.49 0.00 -1.01 0.00 0.00 64.21 63.36 2wm4 n SER 313 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 2wm4 h PRO 314 N 0.35 0.41 -4.78 1.43 0.11 -1.86 -3.35 132.00 124.32 2wm4 h PRO 314 Ca -0.32 -0.02 -0.67 0.00 0.11 0.00 0.00 66.00 65.09 2wm4 h PRO 314 Cb 0.70 -0.09 -0.22 0.00 0.11 0.00 0.00 31.00 31.50 2wm4 h PRO 314 CO 0.18 0.27 -0.55 0.08 -0.21 0.00 0.00 178.00 177.78 2wm4 s VAL 315 N -5.40 4.65 0.03 3.15 1.01 -1.26 -0.01 120.40 122.56 2wm4 s VAL 315 Ca -0.08 -0.40 -0.19 0.00 0.00 0.00 0.00 61.98 61.32 2wm4 s VAL 315 Cb 0.19 -3.37 -0.20 0.00 0.00 0.00 0.00 36.38 33.00 2wm4 s VAL 315 CO 0.74 0.07 1.18 0.58 0.00 0.00 0.00 175.10 177.67 2wm4 h VAL 316 N 5.65 1.39 -3.23 2.92 2.07 -1.21 -3.42 116.25 120.42 2wm4 h VAL 316 Ca -0.32 -1.93 -0.08 0.00 0.82 0.00 0.00 66.70 65.20 2wm4 h VAL 316 Cb 1.15 2.35 -0.16 0.00 -1.52 0.00 0.00 31.29 33.12 2wm4 h VAL 316 CO 0.61 0.57 -0.15 -0.72 0.02 0.00 0.00 177.57 177.90 2wm4 s TYR 317 N -3.49 -0.18 0.17 1.57 -0.85 -1.26 -0.93 117.35 112.38 2wm4 s TYR 317 Ca -0.13 0.03 0.09 0.00 -0.52 0.00 0.00 57.07 56.54 2wm4 s TYR 317 Cb 0.05 0.18 -0.04 0.00 0.38 0.00 0.00 41.96 42.52 2wm4 s TYR 317 CO 0.82 -0.58 -0.18 -1.64 -1.52 0.00 0.00 175.55 172.45 2wm4 s MET 318 N -2.89 1.30 0.08 -3.49 1.00 -1.09 -4.94 119.30 109.27 2wm4 s MET 318 Ca -0.03 -1.44 0.02 0.00 0.00 0.00 0.00 55.69 54.24 2wm4 s MET 318 Cb 0.00 -1.33 -0.04 0.00 0.00 0.00 0.00 34.83 33.46 2wm4 s MET 318 CO -0.05 0.26 0.16 0.50 0.00 0.00 0.00 175.02 175.89 2wm4 s ARG 319 N -2.91 3.17 0.36 2.03 3.52 0.43 -0.65 118.95 124.89 2wm4 s ARG 319 Ca 0.17 -0.58 0.04 0.00 -0.13 0.00 0.00 55.73 55.23 2wm4 s ARG 319 Cb -0.05 -2.88 -0.05 0.00 -1.56 0.00 0.00 34.95 30.41 2wm4 s ARG 319 CO 0.07 0.58 0.07 1.03 -0.81 0.00 0.00 175.30 176.24 2wm4 s ARG 320 N -2.55 1.76 -0.03 5.12 1.81 0.94 -4.38 118.95 121.62 2wm4 s ARG 320 Ca 0.32 -2.01 0.01 0.00 -1.72 0.00 0.00 55.73 52.33 2wm4 s ARG 320 Cb -0.12 -0.85 0.02 0.00 -0.45 0.00 0.00 34.95 33.54 2wm4 s ARG 320 CO 0.25 -0.27 -0.03 0.99 -0.68 0.00 0.00 175.30 175.56 2wm4 s THR 321 N -3.24 0.39 0.27 0.02 2.01 0.16 -1.27 115.64 113.98 2wm4 s THR 321 Ca 0.32 -0.07 -0.29 0.00 0.31 0.00 0.00 61.69 61.95 2wm4 s THR 321 Cb 0.07 -0.42 -0.09 0.00 0.01 0.00 0.00 72.50 72.06 2wm4 s THR 321 CO 0.15 0.18 1.10 -0.76 -0.69 0.00 0.00 174.62 174.60 2wm4 s LEU 322 N 0.73 4.54 0.00 4.42 1.43 -0.71 -0.59 118.68 128.50 2wm4 s LEU 322 Ca -0.09 2.26 0.21 0.00 -1.03 0.00 0.00 54.13 55.49 2wm4 s LEU 322 Cb -0.12 -3.62 0.12 0.00 0.03 0.00 0.00 46.19 42.60 2wm4 s LEU 322 CO -0.00 -0.16 1.14 0.35 0.23 0.00 0.00 176.35 177.91 2wm4 n THR 323 N 1.31 0.00 -3.51 5.49 -2.24 -0.25 -0.52 114.28 114.57 2wm4 n THR 323 Ca -0.01 -0.44 -0.11 0.00 -2.27 0.00 0.00 64.05 61.23 2wm4 n THR 323 Cb 0.45 1.39 -0.03 0.00 -2.10 0.00 0.00 70.33 70.04 2wm4 n THR 323 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wm4 s GLN 324 N -1.94 0.89 0.53 -0.78 -2.07 -1.26 -4.85 119.66 110.17 2wm4 s GLN 324 Ca 0.23 -0.17 -0.22 0.00 -1.82 0.00 0.00 55.36 53.38 2wm4 s GLN 324 Cb 0.18 0.41 -0.05 0.00 -1.09 0.00 0.00 33.01 32.45 2wm4 s GLN 324 CO 0.34 -0.36 1.38 -0.25 -1.32 0.00 0.00 175.29 175.08 2wm4 n ASP 325 N 0.07 2.83 -3.62 12.60 8.00 -1.26 -3.56 116.55 131.61 2wm4 n ASP 325 Ca -0.12 1.00 -0.15 0.00 0.71 0.00 0.00 54.79 56.23 2wm4 n ASP 325 Cb 0.61 -1.59 -0.07 0.00 -0.02 0.00 0.00 41.12 40.05 2wm4 n ASP 325 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 2wm4 s ILE 326 N -1.27 0.01 -0.10 0.53 1.10 -0.24 -4.88 121.20 116.35 2wm4 s ILE 326 Ca 0.70 -0.06 0.03 0.00 -0.51 0.00 0.00 60.65 60.81 2wm4 s ILE 326 Cb -0.42 -0.89 -0.01 0.00 0.15 0.00 0.00 42.46 41.29 2wm4 s ILE 326 CO 0.50 -0.03 -0.20 -0.70 -2.11 0.00 0.00 174.94 172.40 2wm4 s GLU 327 N -0.50 3.07 -0.01 3.50 2.12 -1.26 -0.59 118.70 125.02 2wm4 s GLU 327 Ca -0.06 -0.82 0.03 0.00 0.36 0.00 0.00 54.97 54.48 2wm4 s GLU 327 Cb -0.03 -2.39 -0.00 0.00 0.26 0.00 0.00 34.13 31.97 2wm4 s GLU 327 CO 0.05 0.24 -0.09 -0.51 -0.54 0.00 0.00 175.26 174.41 2wm4 s LEU 328 N 0.23 1.91 -1.43 2.70 1.43 -0.53 -4.83 118.68 118.16 2wm4 s LEU 328 Ca -0.13 -0.16 -0.07 0.00 -1.03 0.00 0.00 54.13 52.73 2wm4 s LEU 328 Cb -0.16 -0.48 0.04 0.00 0.03 0.00 0.00 46.19 45.62 2wm4 s LEU 328 CO 0.07 0.09 0.60 -1.14 0.23 0.00 0.00 176.35 176.19 2wm4 n ARG 329 N 3.05 -4.38 -0.96 1.70 0.63 -1.26 -0.48 116.66 114.96 2wm4 n ARG 329 Ca -0.15 0.70 0.00 0.00 -0.92 0.00 0.00 57.85 57.47 2wm4 n ARG 329 Cb 0.56 -5.50 0.00 0.00 0.45 0.00 0.00 32.46 27.97 2wm4 n ARG 329 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2wm4 n GLY 330 N -1.39 0.66 3.45 5.14 0.00 -1.26 -4.96 105.19 106.82 2wm4 n GLY 330 Ca -0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.60 2wm4 n GLY 330 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wm4 s THR 331 N -2.78 4.32 -0.09 2.61 2.01 0.36 -5.07 115.64 117.00 2wm4 s THR 331 Ca 0.00 -0.17 -0.30 0.00 0.31 0.00 0.00 61.69 61.53 2wm4 s THR 331 Cb 0.00 -3.02 -0.02 0.00 0.01 0.00 0.00 72.50 69.47 2wm4 s THR 331 CO 0.00 0.34 1.02 -0.54 -0.69 0.00 0.00 174.62 174.74 2wm4 s LYS 332 N 1.62 4.44 0.13 4.92 1.02 -1.26 -1.45 119.74 129.15 2wm4 s LYS 332 Ca 0.06 1.42 0.11 0.00 0.02 0.00 0.00 55.97 57.58 2wm4 s LYS 332 Cb -0.15 -3.53 -0.04 0.00 -0.52 0.00 0.00 37.83 33.59 2wm4 s LYS 332 CO 0.04 -0.29 -0.25 -1.64 -0.92 0.00 0.00 175.35 172.29 2wm4 s MET 333 N 1.88 1.50 0.05 1.68 -1.94 0.25 -5.00 119.30 117.71 2wm4 s MET 333 Ca 0.49 -1.33 0.02 0.00 -1.71 0.00 0.00 55.69 53.17 2wm4 s MET 333 Cb -0.19 -1.94 -0.04 0.00 2.01 0.00 0.00 34.83 34.67 2wm4 s MET 333 CO 0.20 0.45 0.06 0.00 -0.01 0.00 0.00 175.02 175.72 2wm4 s ALA 334 N -1.13 3.51 0.05 3.03 0.00 -1.26 -1.08 121.76 124.89 2wm4 s ALA 334 Ca 0.15 -0.98 -0.37 0.00 0.00 0.00 0.00 51.96 50.76 2wm4 s ALA 334 Cb -0.10 -1.44 -0.19 0.00 0.00 0.00 0.00 23.12 21.39 2wm4 s ALA 334 CO 0.07 0.72 1.04 0.00 0.00 0.00 0.00 175.76 177.59 2wm4 n ALA 335 N 0.76 -2.97 0.00 0.00 0.00 -1.23 -1.20 120.51 115.87 2wm4 n ALA 335 Ca -0.11 0.56 0.00 0.00 0.00 0.00 0.00 53.44 53.89 2wm4 n ALA 335 Cb 0.52 -1.80 0.00 0.00 0.00 0.00 0.00 19.45 18.17 2wm4 n ALA 335 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wm4 n GLY 336 N 1.74 2.93 3.77 0.00 0.00 0.32 -4.91 105.19 109.04 2wm4 n GLY 336 Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.83 2wm4 n GLY 336 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2wm4 s ASP 337 N -1.35 6.29 0.27 1.61 1.01 -0.34 -4.70 116.67 119.46 2wm4 s ASP 337 Ca 0.00 2.48 -0.23 0.00 0.71 0.00 0.00 52.55 55.50 2wm4 s ASP 337 Cb 0.00 -2.62 -0.09 0.00 1.01 0.00 0.00 42.92 41.22 2wm4 s ASP 337 CO 0.00 -0.85 0.84 -0.54 0.21 0.00 0.00 175.17 174.83 2wm4 s LYS 338 N -2.39 4.44 -0.03 8.23 1.02 -1.26 -1.74 119.74 128.01 2wm4 s LYS 338 Ca 0.59 1.12 0.01 0.00 0.02 0.00 0.00 55.97 57.71 2wm4 s LYS 338 Cb -0.34 -2.86 0.02 0.00 -0.52 0.00 0.00 37.83 34.13 2wm4 s LYS 338 CO 0.42 0.35 -0.01 0.08 -0.92 0.00 0.00 175.35 175.27 2wm4 s VAL 339 N -1.55 0.23 -0.09 3.17 1.01 -0.39 -0.91 120.40 121.87 2wm4 s VAL 339 Ca 0.46 0.04 0.03 0.00 0.00 0.00 0.00 61.98 62.51 2wm4 s VAL 339 Cb -0.18 -0.30 -0.01 0.00 0.00 0.00 0.00 36.38 35.88 2wm4 s VAL 339 CO 0.23 0.15 -0.19 -0.94 0.00 0.00 0.00 175.10 174.34 2wm4 s SER 340 N 0.91 3.54 -0.45 3.32 1.04 -0.16 -0.04 113.70 121.86 2wm4 s SER 340 Ca -0.10 -0.42 -0.15 0.00 0.48 0.00 0.00 55.95 55.77 2wm4 s SER 340 Cb -0.13 -1.26 0.05 0.00 0.10 0.00 0.00 66.02 64.79 2wm4 s SER 340 CO -0.01 0.21 0.35 -0.76 0.98 0.00 0.00 173.24 174.01 2wm4 s LEU 341 N 0.07 5.41 -0.91 2.42 1.02 0.17 -0.39 118.68 126.47 2wm4 s LEU 341 Ca -0.08 -1.18 -0.21 0.00 0.02 0.00 0.00 54.13 52.68 2wm4 s LEU 341 Cb -0.15 -2.16 0.10 0.00 0.02 0.00 0.00 46.19 44.00 2wm4 s LEU 341 CO 0.05 -0.57 1.19 0.26 0.02 0.00 0.00 176.35 177.30 2wm4 s TRP 342 N 1.64 2.89 0.33 0.29 0.52 -0.60 -2.66 118.94 121.36 2wm4 s TRP 342 Ca 0.04 -1.11 0.02 0.00 0.02 0.00 0.00 56.10 55.07 2wm4 s TRP 342 Cb -0.22 -4.40 0.59 0.00 -1.15 0.00 0.00 33.47 28.29 2wm4 s TRP 342 CO 0.08 -1.64 1.96 1.88 0.02 0.00 0.00 176.95 179.25 2wm4 h TYR 343 N 9.20 0.91 -0.18 -1.98 0.05 -1.30 -1.32 116.97 122.36 2wm4 h TYR 343 Ca 0.10 0.02 -0.05 0.00 0.05 0.00 0.00 58.73 58.85 2wm4 h TYR 343 Cb 1.03 -0.30 -0.01 0.00 1.01 0.00 0.00 36.73 38.45 2wm4 h TYR 343 CO 1.17 0.52 -0.09 0.00 -1.05 0.00 0.00 178.16 178.71 2wm4 h SER 345 N 0.27 0.62 -0.65 0.00 0.87 -1.67 -3.31 113.55 109.68 2wm4 h SER 345 Ca 0.06 -0.88 0.08 0.00 -1.23 0.00 0.00 61.79 59.81 2wm4 h SER 345 Cb 0.33 -0.20 -0.04 0.00 -0.44 0.00 0.00 62.40 62.06 2wm4 h SER 345 CO 0.02 1.45 0.43 0.00 -0.53 0.00 0.00 176.83 178.20 2wm4 h ALA 346 N 0.18 1.83 0.00 6.23 0.00 -0.86 -0.64 119.26 126.00 2wm4 h ALA 346 Ca -0.15 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2wm4 h ALA 346 Cb 1.70 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.35 2wm4 h ALA 346 CO 0.18 0.05 0.00 0.09 0.00 0.00 0.00 179.25 179.57 2wm4 n ASN 347 N -4.48 0.00 0.00 0.00 3.02 -0.25 -2.52 115.26 111.03 2wm4 n ASN 347 Ca 0.10 -0.67 0.00 0.00 -0.03 0.00 0.00 54.58 53.98 2wm4 n ASN 347 Cb 0.28 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.45 2wm4 n ASN 347 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2wm4 n ARG 348 N -0.99 2.05 -1.80 3.52 5.12 -0.28 -4.93 116.66 119.35 2wm4 n ARG 348 Ca 0.15 -1.19 -0.42 0.00 -1.93 0.00 0.00 57.85 54.46 2wm4 n ARG 348 Cb 0.07 -0.86 -0.03 0.00 -1.16 0.00 0.00 32.46 30.49 2wm4 n ARG 348 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 2wm4 s ASP 349 N -0.69 6.22 0.53 0.55 -1.08 -1.03 -4.83 116.67 116.34 2wm4 s ASP 349 Ca 0.00 2.20 0.28 0.00 -0.52 0.00 0.00 52.55 54.51 2wm4 s ASP 349 Cb 0.00 -2.53 1.49 0.00 -1.46 0.00 0.00 42.92 40.42 2wm4 s ASP 349 CO 0.00 -1.30 2.09 -0.33 0.52 0.00 0.00 175.17 176.15 2wm4 h GLU 350 N 11.57 0.00 -0.00 4.34 3.07 -1.92 0.35 114.58 131.99 2wm4 h GLU 350 Ca -0.43 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.43 2wm4 h GLU 350 Cb 1.21 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.12 2wm4 h GLU 350 CO 0.96 0.10 -0.34 -1.13 -1.40 0.00 0.00 179.01 177.20 2wm4 n SER 351 N -3.66 0.55 -0.05 1.42 3.41 -1.26 -4.08 113.62 109.95 2wm4 n SER 351 Ca -0.02 -0.34 -0.04 0.00 -0.26 0.00 0.00 58.87 58.21 2wm4 n SER 351 Cb 0.22 0.10 -0.09 0.00 -0.26 0.00 0.00 64.21 64.18 2wm4 n SER 351 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2wm4 n LYS 352 N -1.25 1.89 -4.29 4.33 3.00 -0.53 -4.97 118.16 116.34 2wm4 n LYS 352 Ca 0.08 -0.02 -0.34 0.00 -0.00 0.00 0.00 58.31 58.03 2wm4 n LYS 352 Cb 0.33 -1.30 -0.15 0.00 0.00 0.00 0.00 35.03 33.92 2wm4 n LYS 352 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.40 177.34 2wm4 s PHE 353 N -2.35 2.85 0.27 5.64 0.08 0.00 -5.00 117.98 119.47 2wm4 s PHE 353 Ca -0.06 -1.01 -0.30 0.00 0.12 0.00 0.00 56.93 55.69 2wm4 s PHE 353 Cb 0.04 -1.96 -0.10 0.00 -0.57 0.00 0.00 43.02 40.42 2wm4 s PHE 353 CO 0.48 -0.49 1.48 0.00 -0.10 0.00 0.00 175.22 176.59 2wm4 s ALA 354 N 1.03 3.66 -1.24 5.36 0.00 -1.26 -3.86 121.76 125.44 2wm4 s ALA 354 Ca -0.01 1.41 -0.07 0.00 0.00 0.00 0.00 51.96 53.29 2wm4 s ALA 354 Cb -0.15 -3.58 -0.01 0.00 0.00 0.00 0.00 23.12 19.38 2wm4 s ALA 354 CO -0.02 -0.83 0.72 -0.25 0.00 0.00 0.00 175.76 175.38 2wm4 n ASP 355 N 2.15 -2.92 0.31 0.00 8.00 -1.26 -4.83 116.55 118.01 2wm4 n ASP 355 Ca 0.07 -0.89 0.19 0.00 0.71 0.00 0.00 54.79 54.87 2wm4 n ASP 355 Cb 0.39 -3.88 1.06 0.00 -0.02 0.00 0.00 41.12 38.67 2wm4 n ASP 355 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 2wm4 h PRO 356 N -1.78 0.00 -0.01 -0.24 0.13 -1.88 -1.18 132.00 127.04 2wm4 h PRO 356 Ca -0.63 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.50 2wm4 h PRO 356 Cb 1.36 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.49 2wm4 h PRO 356 CO 0.53 0.00 -0.20 0.91 -0.23 0.00 0.00 178.00 179.01 2wm4 n TRP 357 N -3.44 0.00 -3.23 1.56 7.02 -1.26 -4.81 117.44 113.27 2wm4 n TRP 357 Ca -0.03 0.00 -0.40 0.00 -1.02 0.00 0.00 57.50 56.06 2wm4 n TRP 357 Cb 0.10 -0.12 -0.07 0.00 -2.42 0.00 0.00 31.31 28.79 2wm4 n TRP 357 CO 0.00 0.00 0.00 0.99 -2.02 0.00 0.00 177.69 176.66 2wm4 s THR 358 N -2.45 5.08 -0.66 -0.99 2.01 -0.45 -2.58 115.64 115.60 2wm4 s THR 358 Ca 0.27 0.92 -0.26 0.00 0.31 0.00 0.00 61.69 62.92 2wm4 s THR 358 Cb 0.20 -3.84 0.04 0.00 0.01 0.00 0.00 72.50 68.90 2wm4 s THR 358 CO 0.49 0.11 1.17 0.12 -0.69 0.00 0.00 174.62 175.83 2wm4 s PHE 359 N 2.08 2.49 -0.29 4.92 5.36 -1.26 -4.94 117.98 126.34 2wm4 s PHE 359 Ca 0.22 0.01 0.01 0.00 -0.96 0.00 0.00 56.93 56.22 2wm4 s PHE 359 Cb -0.16 -4.48 0.09 0.00 -0.34 0.00 0.00 43.02 38.13 2wm4 s PHE 359 CO 0.09 -1.79 0.03 0.34 -1.46 0.00 0.00 175.22 172.43 2wm4 s ASP 360 N 3.40 4.19 0.23 6.13 2.15 -1.26 -4.95 116.67 126.57 2wm4 s ASP 360 Ca 0.35 -1.63 0.21 0.00 0.43 0.00 0.00 52.55 51.91 2wm4 s ASP 360 Cb -0.10 -1.22 0.94 0.00 -0.30 0.00 0.00 42.92 42.24 2wm4 s ASP 360 CO 0.18 -0.34 1.64 0.18 -0.17 0.00 0.00 175.17 176.66 2wm4 n LEU 361 N 4.59 0.54 -0.60 -1.34 4.77 -1.26 -0.60 117.00 123.11 2wm4 n LEU 361 Ca -0.04 0.66 0.13 0.00 -0.03 0.00 0.00 56.01 56.74 2wm4 n LEU 361 Cb 0.43 -0.62 0.42 0.00 -2.33 0.00 0.00 43.42 41.32 2wm4 n LEU 361 CO 0.17 -0.61 0.81 0.00 -1.33 0.00 0.00 177.39 176.44 2wm4 n ALA 362 N -1.73 2.55 -1.70 -1.18 0.00 -1.26 -2.00 120.51 115.19 2wm4 n ALA 362 Ca 0.01 -0.51 -0.58 0.00 0.00 0.00 0.00 53.44 52.37 2wm4 n ALA 362 Cb 0.17 -1.08 -0.07 0.00 0.00 0.00 0.00 19.45 18.47 2wm4 n ALA 362 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2wm4 n ARG 363 N 0.46 1.12 -3.69 0.00 0.63 0.23 -4.95 116.66 110.47 2wm4 n ARG 363 Ca 0.18 0.41 -0.11 0.00 -0.92 0.00 0.00 57.85 57.41 2wm4 n ARG 363 Cb 0.41 -2.10 -0.11 0.00 0.45 0.00 0.00 32.46 31.11 2wm4 n ARG 363 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 2wm4 s ASN 364 N 3.77 -0.29 1.09 6.15 2.47 -1.26 -4.41 114.94 122.47 2wm4 s ASN 364 Ca 0.99 0.80 -0.16 0.00 0.42 0.00 0.00 52.86 54.91 2wm4 s ASN 364 Cb -1.08 0.81 0.24 0.00 -1.45 0.00 0.00 41.25 39.77 2wm4 s ASN 364 CO 0.66 -0.20 1.13 -2.16 -3.72 0.00 0.00 177.10 172.80 2wm4 s PRO 365 N 1.77 -0.36 -0.45 0.43 0.04 -1.26 -5.15 135.00 130.02 2wm4 s PRO 365 Ca -0.06 0.08 0.05 0.00 0.04 0.00 0.00 61.00 61.10 2wm4 s PRO 365 Cb -0.10 -1.68 0.18 0.00 0.04 0.00 0.00 34.50 32.94 2wm4 s PRO 365 CO -0.11 -3.17 0.51 -1.71 0.04 0.00 0.00 177.00 172.55 2wm4 n ASN 366 N -4.40 -1.63 -1.42 6.66 2.85 -1.26 -5.02 115.26 111.03 2wm4 n ASN 366 Ca 0.11 -2.61 -0.00 0.00 -0.11 0.00 0.00 54.58 51.96 2wm4 n ASN 366 Cb 0.59 0.36 0.00 0.00 1.24 0.00 0.00 39.78 41.97 2wm4 n ASN 366 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 2wm4 n PRO 367 N 2.79 1.00 -0.90 1.20 -0.04 -1.26 -4.95 135.00 132.84 2wm4 n PRO 367 Ca 0.25 -0.01 -0.32 0.00 -0.04 0.00 0.00 63.50 63.38 2wm4 n PRO 367 Cb 0.52 -1.00 0.14 0.00 -0.04 0.00 0.00 33.50 33.12 2wm4 n PRO 367 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 2wm4 n HIS 368 N 1.34 0.77 -1.65 0.54 1.44 -1.26 -4.94 115.22 111.45 2wm4 n HIS 368 Ca 0.00 0.39 -0.33 0.00 -2.01 0.00 0.00 57.72 55.77 2wm4 n HIS 368 Cb 0.50 -2.02 0.05 0.00 0.12 0.00 0.00 29.99 28.64 2wm4 n HIS 368 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2wm4 n LEU 369 N -3.40 6.83 0.18 2.39 4.77 -1.26 -4.68 117.00 121.83 2wm4 n LEU 369 Ca 0.12 -4.54 0.03 0.00 -0.03 0.00 0.00 56.01 51.60 2wm4 n LEU 369 Cb 0.51 -0.81 0.32 0.00 -2.33 0.00 0.00 43.42 41.12 2wm4 n LEU 369 CO 0.49 1.71 0.66 1.23 -1.33 0.00 0.00 177.39 180.15 2wm4 h GLY 370 N 2.22 0.00 -3.08 -0.72 0.00 -1.89 -2.29 103.07 97.31 2wm4 h GLY 370 Ca 0.53 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.86 2wm4 h GLY 370 CO 1.33 0.00 0.00 0.69 0.00 0.00 0.00 176.54 178.56 2wm4 n PHE 371 N -3.81 1.58 -0.96 5.60 3.72 -1.26 -4.67 117.46 117.67 2wm4 n PHE 371 Ca -0.01 -0.60 0.00 0.00 -0.05 0.00 0.00 57.45 56.79 2wm4 n PHE 371 Cb 0.49 -0.31 0.00 0.00 -0.94 0.00 0.00 39.48 38.71 2wm4 n PHE 371 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2wm4 n GLY 372 N 0.95 -2.22 0.90 1.37 0.00 -0.86 -3.06 105.19 102.27 2wm4 n GLY 372 Ca 0.25 -1.88 0.10 0.00 0.00 0.00 0.00 46.02 44.49 2wm4 n GLY 372 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wm4 n GLY 373 N -0.06 1.16 0.00 -0.02 0.00 -1.26 -4.53 105.19 100.47 2wm4 n GLY 373 Ca 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.44 2wm4 n GLY 373 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wm4 n GLY 374 N 1.33 0.51 2.11 -0.02 0.00 -1.26 -4.77 105.19 103.10 2wm4 n GLY 374 Ca 0.18 -1.95 0.00 0.00 0.00 0.00 0.00 46.02 44.25 2wm4 n GLY 374 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wm4 n GLY 375 N 0.69 -1.55 0.33 -0.02 0.00 -1.26 -4.43 105.19 98.94 2wm4 n GLY 375 Ca 0.00 -1.77 0.05 0.00 0.00 0.00 0.00 46.02 44.30 2wm4 n GLY 375 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wm4 h ALA 376 N 0.00 1.71 -0.44 4.61 0.00 -1.96 -1.77 119.26 121.40 2wm4 h ALA 376 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2wm4 h ALA 376 Cb 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.61 2wm4 h ALA 376 CO 0.00 0.23 0.00 0.72 0.00 0.00 0.00 179.25 180.20 2wm4 n HIS 377 N -4.47 1.40 -1.55 0.00 -0.00 -1.26 -5.01 115.22 104.33 2wm4 n HIS 377 Ca 0.06 -0.75 -0.52 0.00 -0.00 0.00 0.00 57.72 56.52 2wm4 n HIS 377 Cb 0.13 -0.35 -0.05 0.00 -0.00 0.00 0.00 29.99 29.72 2wm4 n HIS 377 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 2wm4 n PHE 378 N 0.25 1.04 -1.68 4.41 7.35 -0.67 -4.58 117.46 123.58 2wm4 n PHE 378 Ca 0.24 0.78 -0.60 0.00 -0.76 0.00 0.00 57.45 57.11 2wm4 n PHE 378 Cb 0.96 -2.22 -0.08 0.00 0.35 0.00 0.00 39.48 38.49 2wm4 n PHE 378 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2wm4 h LEU 380 N 5.64 0.26 -0.91 0.00 5.85 -1.95 -2.79 115.31 121.41 2wm4 h LEU 380 Ca -0.46 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.13 2wm4 h LEU 380 Cb 1.35 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.31 2wm4 h LEU 380 CO 0.90 0.70 0.00 0.61 -0.34 0.00 0.00 178.44 180.31 2wm4 n GLY 381 N -0.03 0.34 0.32 3.75 0.00 -1.26 -4.55 105.19 103.76 2wm4 n GLY 381 Ca -0.02 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.79 2wm4 n GLY 381 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wm4 h ALA 382 N 3.15 1.16 -0.03 4.61 0.00 -1.84 0.31 119.26 126.61 2wm4 h ALA 382 Ca 0.00 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.68 2wm4 h ALA 382 Cb 0.40 -0.24 0.02 0.00 0.00 0.00 0.00 17.79 17.96 2wm4 h ALA 382 CO 0.03 0.30 -0.82 -0.91 0.00 0.00 0.00 179.25 177.85 2wm4 h ASN 383 N 0.99 0.77 -0.29 0.00 4.21 -1.81 -1.76 115.58 117.69 2wm4 h ASN 383 Ca 0.36 -0.72 0.07 0.00 1.21 0.00 0.00 56.30 57.22 2wm4 h ASN 383 Cb 0.13 -0.23 -0.07 0.00 -1.12 0.00 0.00 38.32 37.03 2wm4 h ASN 383 CO -0.16 1.39 -0.19 0.25 -1.29 0.00 0.00 177.43 177.42 2wm4 h LEU 384 N 0.23 -0.64 -0.41 1.61 5.85 -1.73 -2.25 115.31 117.98 2wm4 h LEU 384 Ca -0.09 0.13 0.06 0.00 0.84 0.00 0.00 57.88 58.82 2wm4 h LEU 384 Cb 1.48 0.32 -0.05 0.00 0.37 0.00 0.00 40.66 42.78 2wm4 h LEU 384 CO 0.16 -0.23 0.09 0.00 -0.34 0.00 0.00 178.44 178.12 2wm4 h ALA 385 N 0.99 0.45 -0.75 1.25 0.00 -0.33 0.96 119.26 121.84 2wm4 h ALA 385 Ca 0.15 0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.18 2wm4 h ALA 385 Cb 0.40 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.24 2wm4 h ALA 385 CO -0.39 -0.31 0.47 0.00 0.00 0.00 0.00 179.25 179.02 2wm4 h ARG 386 N 0.23 0.87 -0.38 0.00 3.08 -1.19 0.19 114.38 117.17 2wm4 h ARG 386 Ca 0.20 -0.05 -0.14 0.00 0.07 0.00 0.00 59.98 60.05 2wm4 h ARG 386 Cb 0.23 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 2wm4 h ARG 386 CO -0.25 0.58 -0.32 -0.09 -1.07 0.00 0.00 179.97 178.82 2wm4 h ARG 387 N 0.90 0.89 -0.82 0.04 9.65 -1.18 0.62 114.38 124.47 2wm4 h ARG 387 Ca 0.31 -0.45 0.03 0.00 -1.10 0.00 0.00 59.98 58.77 2wm4 h ARG 387 Cb 0.05 0.01 -0.05 0.00 -1.39 0.00 0.00 29.97 28.59 2wm4 h ARG 387 CO -0.12 1.10 0.53 0.93 2.80 0.00 0.00 179.97 185.20 2wm4 h GLU 388 N 0.69 1.01 -0.21 0.20 5.08 -0.07 -0.08 114.58 121.21 2wm4 h GLU 388 Ca 0.07 -0.06 -0.08 0.00 -1.00 0.00 0.00 59.36 58.29 2wm4 h GLU 388 Cb 0.91 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 29.92 2wm4 h GLU 388 CO 0.08 0.67 -0.16 0.82 -1.00 0.00 0.00 179.01 179.42 2wm4 h ILE 389 N 1.04 1.32 0.34 3.13 2.04 -0.35 -1.31 117.51 123.73 2wm4 h ILE 389 Ca 0.32 -1.29 -0.02 0.00 1.00 0.00 0.00 64.86 64.87 2wm4 h ILE 389 Cb -0.03 1.69 0.00 0.00 -0.74 0.00 0.00 36.82 37.74 2wm4 h ILE 389 CO -0.10 0.40 -0.16 -0.09 0.00 0.00 0.00 178.15 178.19 2wm4 h ARG 390 N 0.18 -0.44 -0.40 2.37 2.43 -0.69 -2.62 114.38 115.21 2wm4 h ARG 390 Ca 0.04 0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.21 2wm4 h ARG 390 Cb 0.69 0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 30.32 2wm4 h ARG 390 CO 0.04 -0.27 0.12 0.28 -1.51 0.00 0.00 179.97 178.63 2wm4 h VAL 391 N -0.50 1.17 -0.31 0.20 2.07 -0.98 -0.76 116.25 117.15 2wm4 h VAL 391 Ca -0.05 -0.58 -0.02 0.00 0.82 0.00 0.00 66.70 66.87 2wm4 h VAL 391 Cb 0.38 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 2wm4 h VAL 391 CO 0.08 0.22 0.13 0.00 0.02 0.00 0.00 177.57 178.01 2wm4 h ALA 392 N 1.56 0.40 -0.01 1.67 0.00 -0.96 -0.60 119.26 121.32 2wm4 h ALA 392 Ca 0.14 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 2wm4 h ALA 392 Cb 0.18 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2wm4 h ALA 392 CO -0.01 -0.01 -0.57 0.74 0.00 0.00 0.00 179.25 179.41 2wm4 h PHE 393 N 0.35 0.05 -0.42 0.00 0.04 -1.27 -1.70 116.94 113.99 2wm4 h PHE 393 Ca 0.10 -0.02 -0.03 0.00 2.80 0.00 0.00 57.97 60.82 2wm4 h PHE 393 Cb 0.18 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 38.30 2wm4 h PHE 393 CO -0.01 0.60 0.14 0.22 -0.60 0.00 0.00 178.31 178.66 2wm4 h ASP 394 N 0.03 0.61 -0.15 2.17 3.58 -0.83 0.38 116.42 122.21 2wm4 h ASP 394 Ca -0.00 -0.20 -0.10 0.00 0.42 0.00 0.00 57.03 57.14 2wm4 h ASP 394 Cb 1.02 -0.16 -0.01 0.00 1.72 0.00 0.00 39.33 41.89 2wm4 h ASP 394 CO 0.08 0.65 -0.23 -0.33 -2.88 0.00 0.00 179.24 176.52 2wm4 h GLU 395 N 0.54 0.59 -0.57 0.28 4.39 -0.94 -2.03 114.58 116.84 2wm4 h GLU 395 Ca 0.14 -0.23 -0.06 0.00 0.34 0.00 0.00 59.36 59.55 2wm4 h GLU 395 Cb 0.25 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.84 2wm4 h GLU 395 CO -0.01 0.78 0.11 -0.07 -1.16 0.00 0.00 179.01 178.66 2wm4 h LEU 396 N 0.52 0.89 -1.01 1.33 3.38 -1.21 -2.08 115.31 117.14 2wm4 h LEU 396 Ca 0.08 -0.25 -0.05 0.00 0.09 0.00 0.00 57.88 57.74 2wm4 h LEU 396 Cb 0.68 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 2wm4 h LEU 396 CO 0.05 0.91 0.11 -0.09 0.09 0.00 0.00 178.44 179.51 2wm4 h ARG 397 N 0.83 0.83 0.00 1.13 2.43 -0.59 0.48 114.38 119.49 2wm4 h ARG 397 Ca 0.17 -0.18 -0.27 0.00 -0.81 0.00 0.00 59.98 58.90 2wm4 h ARG 397 Cb 0.39 -0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 29.78 2wm4 h ARG 397 CO 0.01 0.76 -1.50 0.07 -1.51 0.00 0.00 179.97 177.80 2wm4 h ARG 398 N 0.79 0.00 0.02 0.20 0.11 -1.26 -3.31 114.38 110.94 2wm4 h ARG 398 Ca 0.17 0.00 -0.33 0.00 0.10 0.00 0.00 59.98 59.93 2wm4 h ARG 398 Cb 0.32 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 31.35 2wm4 h ARG 398 CO 0.00 0.64 -1.94 1.04 0.10 0.00 0.00 179.97 179.81 2wm4 n GLN 399 N -3.13 0.67 -3.12 0.08 6.02 -0.79 -4.73 117.38 112.36 2wm4 n GLN 399 Ca -0.12 0.22 -0.20 0.00 -0.01 0.00 0.00 57.00 56.89 2wm4 n GLN 399 Cb 1.02 -1.71 -0.05 0.00 1.02 0.00 0.00 30.24 30.52 2wm4 n GLN 399 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2wm4 n MET 400 N -3.06 0.53 0.30 -1.09 0.00 0.15 -5.01 117.12 108.94 2wm4 n MET 400 Ca -0.24 -2.80 0.18 0.00 0.00 0.00 0.00 57.70 54.84 2wm4 n MET 400 Cb 1.07 -1.43 0.95 0.00 0.00 0.00 0.00 33.22 33.81 2wm4 n MET 400 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 175.97 174.97 2wm4 h PRO 401 N 4.64 0.00 -0.52 3.17 0.13 -1.61 -1.68 132.00 136.14 2wm4 h PRO 401 Ca 0.10 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.18 2wm4 h PRO 401 Cb 0.94 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.05 2wm4 h PRO 401 CO 0.35 0.03 0.05 -0.40 -0.23 0.00 0.00 178.00 177.80 2wm4 n ASP 402 N -3.31 5.05 -4.66 1.44 5.75 -1.26 -4.89 116.55 114.67 2wm4 n ASP 402 Ca -0.02 -3.03 -0.45 0.00 -0.01 0.00 0.00 54.79 51.28 2wm4 n ASP 402 Cb 0.16 -0.66 -0.02 0.00 -1.03 0.00 0.00 41.12 39.57 2wm4 n ASP 402 CO 0.00 0.00 0.00 0.55 -0.11 0.00 0.00 177.20 177.64 2wm4 n VAL 403 N 0.15 1.31 -3.63 2.12 3.14 -0.63 -4.66 118.33 116.13 2wm4 n VAL 403 Ca 0.29 -0.33 -0.14 0.00 -2.96 0.00 0.00 64.34 61.20 2wm4 n VAL 403 Cb 1.16 -1.37 -0.07 0.00 -1.06 0.00 0.00 33.84 32.49 2wm4 n VAL 403 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 2wm4 s VAL 404 N -0.43 0.00 0.36 1.55 0.11 0.11 -4.84 120.40 117.25 2wm4 s VAL 404 Ca 0.65 -0.01 -0.28 0.00 -2.93 0.00 0.00 61.98 59.41 2wm4 s VAL 404 Cb -0.66 -0.95 -0.10 0.00 -1.53 0.00 0.00 36.38 33.15 2wm4 s VAL 404 CO 0.54 -0.00 1.31 0.00 -3.33 0.00 0.00 175.10 173.62 2wm4 s ALA 405 N 0.13 3.42 -0.21 1.54 0.00 -1.26 -0.29 121.76 125.09 2wm4 s ALA 405 Ca -0.02 1.26 0.08 0.00 0.00 0.00 0.00 51.96 53.28 2wm4 s ALA 405 Cb -0.04 -3.48 -0.11 0.00 0.00 0.00 0.00 23.12 19.49 2wm4 s ALA 405 CO 0.02 -0.71 0.27 0.25 0.00 0.00 0.00 175.76 175.59 2wm4 n THR 406 N 0.56 0.00 -4.09 0.00 -2.24 -0.10 -0.44 114.28 107.97 2wm4 n THR 406 Ca 0.01 -0.25 -0.11 0.00 -2.27 0.00 0.00 64.05 61.44 2wm4 n THR 406 Cb 0.42 0.66 -0.11 0.00 -2.10 0.00 0.00 70.33 69.21 2wm4 n THR 406 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2wm4 s GLU 407 N -2.17 0.61 0.67 -0.78 2.02 -1.25 -4.34 118.70 113.46 2wm4 s GLU 407 Ca 0.00 -1.01 -0.17 0.00 0.02 0.00 0.00 54.97 53.82 2wm4 s GLU 407 Cb 0.06 -0.12 -0.03 0.00 0.10 0.00 0.00 34.13 34.14 2wm4 s GLU 407 CO 0.35 -0.01 0.79 0.39 0.02 0.00 0.00 175.26 176.79 2wm4 n GLU 408 N 0.76 0.55 -1.68 1.61 -0.58 -1.26 -4.60 120.64 115.44 2wm4 n GLU 408 Ca -0.18 0.23 -0.32 0.00 -0.42 0.00 0.00 57.16 56.47 2wm4 n GLU 408 Cb 0.58 -2.03 0.05 0.00 -0.57 0.00 0.00 31.44 29.47 2wm4 n GLU 408 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 2wm4 s PRO 409 N -2.85 2.87 -0.28 3.49 0.04 -1.26 -4.82 135.00 132.19 2wm4 s PRO 409 Ca 0.72 1.17 -0.26 0.00 0.04 0.00 0.00 61.00 62.66 2wm4 s PRO 409 Cb -0.38 -1.97 0.01 0.00 0.04 0.00 0.00 34.50 32.19 2wm4 s PRO 409 CO 0.52 -1.17 0.93 0.00 0.04 0.00 0.00 177.00 177.32 2wm4 s ALA 410 N -2.69 3.58 -0.03 8.56 0.00 -0.89 -5.02 121.76 125.27 2wm4 s ALA 410 Ca 0.62 -0.13 -0.14 0.00 0.00 0.00 0.00 51.96 52.31 2wm4 s ALA 410 Cb -0.17 -3.46 -0.05 0.00 0.00 0.00 0.00 23.12 19.44 2wm4 s ALA 410 CO 0.47 -1.19 0.38 1.03 0.00 0.00 0.00 175.76 176.45 2wm4 s ARG 411 N 3.18 3.91 0.18 0.00 0.52 -1.26 -0.57 118.95 124.92 2wm4 s ARG 411 Ca 0.39 0.34 -0.31 0.00 -0.52 0.00 0.00 55.73 55.63 2wm4 s ARG 411 Cb -0.14 -3.24 -0.10 0.00 0.52 0.00 0.00 34.95 31.99 2wm4 s ARG 411 CO 0.11 0.64 1.55 -1.17 0.02 0.00 0.00 175.30 176.45 2wm4 s LEU 412 N -0.88 4.37 -0.63 2.53 2.96 -0.17 -4.82 118.68 122.04 2wm4 s LEU 412 Ca 0.22 2.64 -0.26 0.00 -0.22 0.00 0.00 54.13 56.51 2wm4 s LEU 412 Cb -0.16 -3.60 0.04 0.00 0.50 0.00 0.00 46.19 42.97 2wm4 s LEU 412 CO 0.12 -0.81 1.12 -0.22 -1.32 0.00 0.00 176.35 175.24 2wm4 s LEU 413 N 0.89 3.67 -0.22 -0.68 2.96 -1.26 -4.65 118.68 119.39 2wm4 s LEU 413 Ca 0.68 -0.34 -0.27 0.00 -0.22 0.00 0.00 54.13 53.99 2wm4 s LEU 413 Cb -0.44 -2.79 0.10 0.00 0.50 0.00 0.00 46.19 43.56 2wm4 s LEU 413 CO 0.33 -1.52 0.86 -0.55 -1.32 0.00 0.00 176.35 174.16 2wm4 s SER 414 N 3.27 -0.57 0.11 3.68 0.15 -1.26 -4.08 113.70 115.00 2wm4 s SER 414 Ca 0.34 0.97 0.23 0.00 0.70 0.00 0.00 55.95 58.18 2wm4 s SER 414 Cb -0.10 0.93 -0.06 0.00 -1.71 0.00 0.00 66.02 65.08 2wm4 s SER 414 CO 0.18 -0.29 0.91 1.67 1.20 0.00 0.00 173.24 176.91 2wm4 n GLN 415 N 1.92 0.54 -0.08 5.44 7.27 -1.26 -4.47 117.38 126.75 2wm4 n GLN 415 Ca -0.14 0.02 -0.08 0.00 0.07 0.00 0.00 57.00 56.87 2wm4 n GLN 415 Cb 0.56 -1.70 -0.12 0.00 2.41 0.00 0.00 30.24 31.39 2wm4 n GLN 415 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 2wm4 n PHE 416 N -2.41 0.00 -4.27 3.69 7.35 -1.26 -4.57 117.46 115.99 2wm4 n PHE 416 Ca -0.00 0.00 -0.28 0.00 -0.76 0.00 0.00 57.45 56.41 2wm4 n PHE 416 Cb 0.53 -0.76 -0.17 0.00 0.35 0.00 0.00 39.48 39.43 2wm4 n PHE 416 CO 0.00 0.00 0.00 0.42 -0.76 0.00 0.00 176.76 176.42 2wm4 s ILE 417 N -2.37 1.32 -1.42 -2.13 -1.09 -1.26 -1.02 121.20 113.22 2wm4 s ILE 417 Ca -0.09 -0.52 -0.13 0.00 -2.23 0.00 0.00 60.65 57.67 2wm4 s ILE 417 Cb 0.05 -1.24 0.07 0.00 -1.58 0.00 0.00 42.46 39.76 2wm4 s ILE 417 CO 0.61 0.41 2.13 1.57 -1.23 0.00 0.00 174.94 178.43 2wm4 n HIS 418 N 4.41 3.49 -3.55 3.97 -0.00 0.98 -4.65 115.22 119.86 2wm4 n HIS 418 Ca -0.18 -2.94 -0.34 0.00 0.46 0.00 0.00 57.72 54.72 2wm4 n HIS 418 Cb 0.51 -2.44 -0.05 0.00 -0.12 0.00 0.00 29.99 27.88 2wm4 n HIS 418 CO 0.00 0.00 0.00 0.20 0.46 0.00 0.00 176.34 177.00 2wm4 s GLY 419 N 2.80 2.33 -0.13 1.57 0.00 -1.26 -4.84 107.32 107.78 2wm4 s GLY 419 Ca 0.46 -0.37 0.02 0.00 0.00 0.00 0.00 44.72 44.82 2wm4 s GLY 419 CO -0.06 -0.18 -0.20 -0.42 0.00 0.00 0.00 173.10 172.24 2wm4 s ILE 420 N -1.49 2.33 0.03 0.90 1.01 -1.26 -1.00 121.20 121.71 2wm4 s ILE 420 Ca 0.36 -0.90 -0.03 0.00 0.00 0.00 0.00 60.65 60.09 2wm4 s ILE 420 Cb -0.13 -1.94 -0.28 0.00 0.01 0.00 0.00 42.46 40.12 2wm4 s ILE 420 CO 0.20 0.54 0.95 0.11 0.00 0.00 0.00 174.94 176.74 2wm4 h LYS 421 N 7.11 0.24 -2.34 2.79 1.57 -1.15 -3.47 116.57 121.32 2wm4 h LYS 421 Ca -0.29 -0.42 -0.08 0.00 -1.87 0.00 0.00 60.65 58.00 2wm4 h LYS 421 Cb 1.20 0.15 -0.22 0.00 0.08 0.00 0.00 32.23 33.45 2wm4 h LYS 421 CO 0.54 1.13 -0.03 0.95 -0.57 0.00 0.00 179.45 181.47 2wm4 s THR 422 N -2.63 0.00 -0.28 -0.16 -4.23 -1.24 -4.76 115.64 102.34 2wm4 s THR 422 Ca -0.07 -0.02 -0.04 0.00 -1.18 0.00 0.00 61.69 60.38 2wm4 s THR 422 Cb 0.07 -0.81 0.10 0.00 1.34 0.00 0.00 72.50 73.20 2wm4 s THR 422 CO 0.86 -0.01 0.13 -0.22 -0.54 0.00 0.00 174.62 174.84 2wm4 s LEU 423 N 0.11 0.50 0.18 4.79 2.96 -1.26 -2.09 118.68 123.87 2wm4 s LEU 423 Ca -0.01 -1.23 -0.31 0.00 -0.22 0.00 0.00 54.13 52.35 2wm4 s LEU 423 Cb -0.04 -0.31 -0.10 0.00 0.50 0.00 0.00 46.19 46.24 2wm4 s LEU 423 CO 0.02 -0.43 1.56 -2.84 -1.32 0.00 0.00 176.35 173.34 2wm4 s PRO 424 N 2.11 4.21 0.19 0.98 0.02 -1.26 -1.28 135.00 139.97 2wm4 s PRO 424 Ca 0.09 2.38 0.08 0.00 0.02 0.00 0.00 61.00 63.56 2wm4 s PRO 424 Cb -0.16 -3.14 -0.04 0.00 0.02 0.00 0.00 34.50 31.18 2wm4 s PRO 424 CO -0.35 -0.60 -0.15 0.14 -0.33 0.00 0.00 177.00 175.71 2wm4 s VAL 425 N 0.96 1.73 0.25 3.83 -7.23 0.15 -0.92 120.40 119.16 2wm4 s VAL 425 Ca 0.69 -2.09 0.03 0.00 -1.81 0.00 0.00 61.98 58.79 2wm4 s VAL 425 Cb -0.44 -1.95 -0.05 0.00 0.56 0.00 0.00 36.38 34.50 2wm4 s VAL 425 CO 0.33 -0.50 0.03 0.28 -0.31 0.00 0.00 175.10 174.93 2wm4 s THR 426 N -2.65 0.89 0.25 5.32 -1.32 0.60 -1.48 115.64 117.25 2wm4 s THR 426 Ca 0.19 -2.01 -0.17 0.00 -1.21 0.00 0.00 61.69 58.50 2wm4 s THR 426 Cb -0.02 -2.46 0.01 0.00 -1.51 0.00 0.00 72.50 68.51 2wm4 s THR 426 CO 0.06 -0.21 0.58 -1.66 -2.21 0.00 0.00 174.62 171.19 2wm4 s TRP 427 N -3.52 0.08 -0.13 9.09 -2.14 -1.22 -0.71 118.94 120.39 2wm4 s TRP 427 Ca 0.32 -0.48 0.01 0.00 2.66 0.00 0.00 56.10 58.61 2wm4 s TRP 427 Cb 0.07 0.42 0.01 0.00 -3.10 0.00 0.00 33.47 30.87 2wm4 s TRP 427 CO 0.10 -1.08 0.53 -1.13 -2.66 0.00 0.00 176.95 172.72