#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wmz n GLN 2 N 0.00 2.33 -2.82 -3.83 3.00 -1.26 -5.00 117.38 109.80 1wmz n GLN 2 Ca 0.00 -3.02 -0.35 0.00 -0.01 0.00 0.00 57.00 53.62 1wmz n GLN 2 Cb 0.00 -1.85 -0.07 0.00 0.00 0.00 0.00 30.24 28.32 1wmz n GLN 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1wmz n PRO 4 N -0.04 0.66 -1.64 0.00 -0.02 -1.26 -4.89 135.00 127.81 1wmz n PRO 4 Ca 0.04 0.28 -0.46 0.00 -2.02 0.00 0.00 63.50 61.34 1wmz n PRO 4 Cb 0.52 -2.26 -0.03 0.00 -0.02 0.00 0.00 33.50 31.72 1wmz n PRO 4 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1wmz n THR 5 N -2.29 1.08 -0.99 3.45 -1.04 -1.26 -1.75 114.28 111.48 1wmz n THR 5 Ca 0.14 -0.27 0.00 0.00 -2.04 0.00 0.00 64.05 61.88 1wmz n THR 5 Cb 0.49 -1.25 0.00 0.00 -1.82 0.00 0.00 70.33 67.75 1wmz n THR 5 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1wmz n ASP 6 N 1.96 -1.12 -4.70 8.00 8.00 -1.26 -5.03 116.55 122.40 1wmz n ASP 6 Ca 0.12 0.00 -0.30 0.00 0.71 0.00 0.00 54.79 55.32 1wmz n ASP 6 Cb 0.30 -0.28 -0.08 0.00 -0.02 0.00 0.00 41.12 41.04 1wmz n ASP 6 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 1wmz s TRP 7 N -3.20 3.02 0.04 1.24 0.52 -0.71 -4.77 118.94 115.07 1wmz s TRP 7 Ca 0.00 -0.01 0.03 0.00 0.02 0.00 0.00 56.10 56.14 1wmz s TRP 7 Cb 0.00 -1.55 -0.04 0.00 -1.15 0.00 0.00 33.47 30.73 1wmz s TRP 7 CO 0.00 0.49 -0.01 -1.21 0.02 0.00 0.00 176.95 176.24 1wmz s GLU 8 N -2.33 2.65 -0.07 4.98 0.41 0.22 -4.76 118.70 119.81 1wmz s GLU 8 Ca 0.26 -0.72 -0.09 0.00 -0.41 0.00 0.00 54.97 54.01 1wmz s GLU 8 Cb -0.12 -2.59 -0.05 0.00 -1.78 0.00 0.00 34.13 29.59 1wmz s GLU 8 CO 0.19 0.59 0.24 0.00 -0.49 0.00 0.00 175.26 175.79 1wmz s ALA 9 N -1.16 3.82 -0.27 5.21 0.00 -1.26 -0.56 121.76 127.53 1wmz s ALA 9 Ca 0.22 -0.50 -0.09 0.00 0.00 0.00 0.00 51.96 51.59 1wmz s ALA 9 Cb -0.12 -2.11 0.12 0.00 0.00 0.00 0.00 23.12 21.02 1wmz s ALA 9 CO 0.13 0.58 0.59 -2.00 0.00 0.00 0.00 175.76 175.06 1wmz s GLU 10 N -1.13 0.51 7.18 0.00 2.56 -0.95 -4.99 118.70 121.88 1wmz s GLU 10 Ca 0.19 1.32 0.00 0.00 0.00 0.00 0.00 54.97 56.49 1wmz s GLU 10 Cb -0.14 0.71 0.00 0.00 2.00 0.00 0.00 34.13 36.71 1wmz s GLU 10 CO 0.08 -0.24 0.00 0.41 -0.56 0.00 0.00 175.26 174.96 1wmz n GLY 11 N 5.43 3.05 1.10 -1.50 0.00 -1.26 -2.23 105.19 109.78 1wmz n GLY 11 Ca -0.11 -0.25 0.05 0.00 0.00 0.00 0.00 46.02 45.72 1wmz n GLY 11 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1wmz n ASP 12 N 4.14 3.15 -4.19 1.61 9.92 -1.26 -4.94 116.55 124.99 1wmz n ASP 12 Ca 0.00 -2.32 -0.11 0.00 -0.53 0.00 0.00 54.79 51.83 1wmz n ASP 12 Cb 0.00 -0.48 -0.10 0.00 -0.64 0.00 0.00 41.12 39.90 1wmz n ASP 12 CO 0.00 0.00 0.00 -1.00 0.13 0.00 0.00 177.20 176.33 1wmz s HIS 13 N -1.78 0.98 0.13 1.24 3.76 -0.95 -4.63 115.29 114.05 1wmz s HIS 13 Ca 0.30 -1.09 0.11 0.00 -0.15 0.00 0.00 55.06 54.23 1wmz s HIS 13 Cb 0.20 -0.57 -0.04 0.00 1.11 0.00 0.00 32.58 33.29 1wmz s HIS 13 CO 0.13 -0.33 -0.26 0.00 -0.85 0.00 0.00 174.74 173.43 1wmz s TYR 15 N -1.11 1.25 -0.16 0.00 1.51 0.27 -0.76 117.35 118.35 1wmz s TYR 15 Ca 0.14 -0.59 -0.08 0.00 -1.01 0.00 0.00 57.07 55.53 1wmz s TYR 15 Cb -0.10 -0.67 0.07 0.00 -0.11 0.00 0.00 41.96 41.15 1wmz s TYR 15 CO 0.06 0.08 0.37 0.50 -1.11 0.00 0.00 175.55 175.46 1wmz s ARG 16 N -2.70 0.32 -0.13 -0.62 3.52 -0.67 -0.61 118.95 118.07 1wmz s ARG 16 Ca 0.07 0.82 -0.16 0.00 -0.13 0.00 0.00 55.73 56.33 1wmz s ARG 16 Cb -0.04 0.06 -0.04 0.00 -1.56 0.00 0.00 34.95 33.36 1wmz s ARG 16 CO 0.02 -0.20 0.40 0.12 -0.81 0.00 0.00 175.30 174.83 1wmz s PHE 17 N 1.84 3.51 -0.27 5.12 5.36 -1.26 -1.15 117.98 131.13 1wmz s PHE 17 Ca -0.06 0.79 -0.04 0.00 -0.96 0.00 0.00 56.93 56.66 1wmz s PHE 17 Cb -0.10 -2.45 0.02 0.00 -0.34 0.00 0.00 43.02 40.14 1wmz s PHE 17 CO -0.12 0.23 -0.00 -0.06 -1.46 0.00 0.00 175.22 173.81 1wmz s PHE 18 N 0.44 3.10 -1.19 10.12 0.08 -0.30 -5.02 117.98 125.21 1wmz s PHE 18 Ca 0.22 -1.30 -0.05 0.00 0.12 0.00 0.00 56.93 55.93 1wmz s PHE 18 Cb -0.14 -2.14 0.12 0.00 -0.57 0.00 0.00 43.02 40.29 1wmz s PHE 18 CO 0.08 -0.66 2.41 -1.71 -0.10 0.00 0.00 175.22 175.24 1wmz n ASN 19 N 4.75 7.80 -3.79 1.36 5.15 -1.26 -2.88 115.26 126.39 1wmz n ASN 19 Ca -0.16 -3.18 -0.15 0.00 -0.60 0.00 0.00 54.58 50.49 1wmz n ASN 19 Cb 0.48 -1.33 -0.16 0.00 -0.53 0.00 0.00 39.78 38.23 1wmz n ASN 19 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1wmz s THR 20 N -1.49 -0.01 0.05 -0.44 2.01 -1.26 -5.08 115.64 109.43 1wmz s THR 20 Ca 0.54 0.18 -0.31 0.00 0.31 0.00 0.00 61.69 62.41 1wmz s THR 20 Cb 0.21 -0.12 -0.06 0.00 0.01 0.00 0.00 72.50 72.55 1wmz s THR 20 CO -0.12 0.10 1.22 -0.76 -0.69 0.00 0.00 174.62 174.37 1wmz s LEU 21 N 1.00 4.36 0.36 4.42 1.43 -1.26 -4.12 118.68 124.87 1wmz s LEU 21 Ca -0.09 2.02 -0.14 0.00 -1.03 0.00 0.00 54.13 54.90 1wmz s LEU 21 Cb -0.12 -3.58 0.04 0.00 0.03 0.00 0.00 46.19 42.56 1wmz s LEU 21 CO -0.03 -0.50 0.71 0.28 0.23 0.00 0.00 176.35 177.05 1wmz s THR 22 N 1.18 0.00 0.65 5.49 -1.32 -0.41 -4.88 115.64 116.36 1wmz s THR 22 Ca 0.59 -1.12 -0.09 0.00 -1.21 0.00 0.00 61.69 59.86 1wmz s THR 22 Cb -0.30 -2.70 0.01 0.00 -1.51 0.00 0.00 72.50 68.01 1wmz s THR 22 CO 0.29 0.00 1.01 0.42 -2.21 0.00 0.00 174.62 174.13 1wmz s THR 23 N -2.72 3.58 0.18 5.08 -4.23 -1.26 -1.10 115.64 115.16 1wmz s THR 23 Ca 0.18 0.28 -0.12 0.00 -1.18 0.00 0.00 61.69 60.85 1wmz s THR 23 Cb -0.04 -3.47 0.09 0.00 1.34 0.00 0.00 72.50 70.42 1wmz s THR 23 CO 0.12 -0.57 1.79 -0.25 -0.54 0.00 0.00 174.62 175.18 1wmz h TRP 24 N -0.44 0.87 -0.28 3.99 7.01 -1.84 -0.96 115.95 124.29 1wmz h TRP 24 Ca -0.45 -0.03 0.02 0.00 2.11 0.00 0.00 58.89 60.54 1wmz h TRP 24 Cb 1.25 -0.28 -0.02 0.00 -2.10 0.00 0.00 29.16 28.01 1wmz h TRP 24 CO 0.49 0.63 0.13 1.49 -2.79 0.00 0.00 178.44 178.39 1wmz h GLU 25 N 0.85 0.27 -0.50 2.65 4.57 -1.94 0.11 114.58 120.59 1wmz h GLU 25 Ca 0.22 -0.02 -0.12 0.00 -1.18 0.00 0.00 59.36 58.26 1wmz h GLU 25 Cb 0.06 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.57 1wmz h GLU 25 CO -0.03 0.18 -0.17 -0.97 -1.18 0.00 0.00 179.01 176.83 1wmz h ASN 26 N 0.27 1.02 -0.68 1.04 -1.24 -1.91 -2.41 115.58 111.68 1wmz h ASN 26 Ca 0.12 -0.38 0.05 0.00 0.71 0.00 0.00 56.30 56.79 1wmz h ASN 26 Cb 0.05 -0.28 -0.05 0.00 0.73 0.00 0.00 38.32 38.77 1wmz h ASN 26 CO -0.09 1.17 0.40 0.00 -1.29 0.00 0.00 177.43 177.62 1wmz h ALA 27 N 0.89 0.90 0.12 1.57 0.00 -0.86 0.11 119.26 121.99 1wmz h ALA 27 Ca 0.12 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.04 1wmz h ALA 27 Cb 0.75 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 1wmz h ALA 27 CO 0.06 0.12 -0.24 1.25 0.00 0.00 0.00 179.25 180.45 1wmz h HIS 28 N 0.76 -0.63 -0.30 0.00 -0.00 -0.51 -1.12 115.15 113.35 1wmz h HIS 28 Ca 0.29 0.01 0.03 0.00 -0.00 0.00 0.00 60.37 60.70 1wmz h HIS 28 Cb 0.11 0.26 -0.03 0.00 -0.00 0.00 0.00 27.41 27.75 1wmz h HIS 28 CO -0.06 -0.34 0.11 0.45 -0.00 0.00 0.00 177.93 178.10 1wmz h HIS 29 N -0.44 0.20 -0.68 5.26 -0.00 -1.18 -0.96 115.15 117.35 1wmz h HIS 29 Ca 0.03 0.01 0.06 0.00 -0.00 0.00 0.00 60.37 60.48 1wmz h HIS 29 Cb 0.46 -0.05 -0.06 0.00 -0.00 0.00 0.00 27.41 27.77 1wmz h HIS 29 CO -0.22 0.10 0.37 0.93 -0.00 0.00 0.00 177.93 179.11 1wmz h GLU 30 N 0.25 0.66 -0.37 2.45 4.39 -0.55 -0.49 114.58 120.92 1wmz h GLU 30 Ca 0.13 -0.04 -0.10 0.00 0.34 0.00 0.00 59.36 59.69 1wmz h GLU 30 Cb 0.09 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 28.58 1wmz h GLU 30 CO -0.13 0.44 -0.16 0.00 -1.16 0.00 0.00 179.01 178.00 1wmz h VAL 32 N 0.56 0.72 0.00 0.00 2.07 -0.53 -2.34 116.25 116.72 1wmz h VAL 32 Ca 0.09 -0.68 0.00 0.00 0.82 0.00 0.00 66.70 66.93 1wmz h VAL 32 Cb 0.69 1.42 0.00 0.00 -1.52 0.00 0.00 31.29 31.88 1wmz h VAL 32 CO 0.05 0.16 0.00 0.77 0.02 0.00 0.00 177.57 178.57 1wmz h SER 33 N 0.00 0.00 -0.33 0.57 4.64 -0.71 -1.36 113.55 116.36 1wmz h SER 33 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1wmz h SER 33 Cb 0.40 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 1wmz h SER 33 CO 0.02 0.00 0.00 -1.22 -0.87 0.00 0.00 176.83 174.76 1wmz n TYR 34 N -2.37 0.43 -1.90 4.77 4.02 -0.88 -4.94 117.16 116.29 1wmz n TYR 34 Ca -0.00 -0.21 -0.34 0.00 -0.01 0.00 0.00 57.90 57.33 1wmz n TYR 34 Cb 0.11 0.00 0.04 0.00 -0.02 0.00 0.00 39.34 39.47 1wmz n TYR 34 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 1wmz s SER 35 N -1.25 5.17 -0.35 7.72 0.01 -0.51 -4.66 113.70 119.83 1wmz s SER 35 Ca 0.31 2.16 -0.00 0.00 1.31 0.00 0.00 55.95 59.72 1wmz s SER 35 Cb 0.16 -2.57 0.11 0.00 0.21 0.00 0.00 66.02 63.93 1wmz s SER 35 CO 0.23 -1.59 0.15 0.00 0.41 0.00 0.00 173.24 172.43 1wmz h SER 37 N 7.66 0.27 0.40 0.00 4.64 -1.96 -1.61 113.55 122.95 1wmz h SER 37 Ca -0.09 -0.05 -0.02 0.00 -0.47 0.00 0.00 61.79 61.17 1wmz h SER 37 Cb 0.99 -0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 63.00 1wmz h SER 37 CO 0.45 0.38 -0.08 0.71 -0.87 0.00 0.00 176.83 177.42 1wmz h THR 38 N 0.28 0.40 -0.19 2.95 1.35 -1.95 -2.69 112.91 113.08 1wmz h THR 38 Ca 0.06 -0.44 0.00 0.00 -0.55 0.00 0.00 66.41 65.48 1wmz h THR 38 Cb 0.30 1.31 0.00 0.00 -1.73 0.00 0.00 68.15 68.03 1wmz h THR 38 CO 0.01 0.08 0.00 0.18 -0.25 0.00 0.00 175.52 175.54 1wmz n LEU 39 N -3.49 2.48 -3.37 3.87 4.77 -1.04 -4.98 117.00 115.23 1wmz n LEU 39 Ca -0.02 -1.97 -0.24 0.00 -0.03 0.00 0.00 56.01 53.75 1wmz n LEU 39 Cb 0.22 -0.12 0.03 0.00 -2.33 0.00 0.00 43.42 41.22 1wmz n LEU 39 CO 0.28 0.62 0.05 0.59 -1.33 0.00 0.00 177.39 177.59 1wmz n ASN 40 N 0.07 -5.25 -4.60 -1.43 3.02 -0.94 -4.81 115.26 101.32 1wmz n ASN 40 Ca 0.06 -0.45 -0.39 0.00 -0.03 0.00 0.00 54.58 53.77 1wmz n ASN 40 Cb 0.34 -4.23 -0.09 0.00 -0.61 0.00 0.00 39.78 35.19 1wmz n ASN 40 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1wmz s VAL 41 N -3.15 5.18 -0.26 2.41 1.01 -0.65 -1.69 120.40 123.24 1wmz s VAL 41 Ca 0.44 0.48 -0.09 0.00 0.00 0.00 0.00 61.98 62.82 1wmz s VAL 41 Cb -0.21 -3.71 -0.04 0.00 0.00 0.00 0.00 36.38 32.42 1wmz s VAL 41 CO 0.55 0.12 0.12 -0.13 0.00 0.00 0.00 175.10 175.76 1wmz s ARG 42 N 2.06 3.79 -0.10 2.72 1.81 -0.17 -0.90 118.95 128.15 1wmz s ARG 42 Ca 0.14 -0.41 -0.04 0.00 -1.72 0.00 0.00 55.73 53.71 1wmz s ARG 42 Cb -0.16 -3.47 -0.04 0.00 -0.45 0.00 0.00 34.95 30.84 1wmz s ARG 42 CO 0.10 -0.18 0.04 0.45 -0.68 0.00 0.00 175.30 175.03 1wmz s SER 43 N 1.67 5.57 0.33 0.23 0.15 -1.26 -0.99 113.70 119.40 1wmz s SER 43 Ca 0.07 0.23 -0.10 0.00 0.70 0.00 0.00 55.95 56.84 1wmz s SER 43 Cb -0.15 -1.67 0.02 0.00 -1.71 0.00 0.00 66.02 62.50 1wmz s SER 43 CO 0.07 0.37 0.59 -0.62 1.20 0.00 0.00 173.24 174.85 1wmz s ASP 44 N -0.84 0.30 0.52 5.45 3.68 -0.58 -3.78 116.67 121.42 1wmz s ASP 44 Ca 0.13 -1.18 -0.23 0.00 2.13 0.00 0.00 52.55 53.41 1wmz s ASP 44 Cb -0.12 0.71 -0.06 0.00 -1.45 0.00 0.00 42.92 42.00 1wmz s ASP 44 CO 0.03 -1.38 1.37 -0.76 0.13 0.00 0.00 175.17 174.55 1wmz s LEU 45 N -3.11 3.92 0.27 -1.34 1.43 -1.26 -0.69 118.68 117.90 1wmz s LEU 45 Ca 0.22 2.78 -0.31 0.00 -1.03 0.00 0.00 54.13 55.80 1wmz s LEU 45 Cb -0.02 -4.19 -0.12 0.00 0.03 0.00 0.00 46.19 41.88 1wmz s LEU 45 CO 0.14 -1.44 1.51 0.55 0.23 0.00 0.00 176.35 177.33 1wmz n VAL 46 N -0.80 0.99 -4.14 -1.59 3.14 -0.43 -4.25 118.33 111.25 1wmz n VAL 46 Ca 0.09 -0.25 -0.30 0.00 -2.96 0.00 0.00 64.34 60.92 1wmz n VAL 46 Cb 0.44 -1.73 -0.08 0.00 -1.06 0.00 0.00 33.84 31.41 1wmz n VAL 46 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 1wmz s SER 47 N 0.40 5.04 -0.11 6.55 1.04 -1.26 -0.67 113.70 124.68 1wmz s SER 47 Ca 0.66 -0.16 0.00 0.00 0.48 0.00 0.00 55.95 56.93 1wmz s SER 47 Cb -0.57 -1.21 0.02 0.00 0.10 0.00 0.00 66.02 64.36 1wmz s SER 47 CO 0.49 0.18 -0.10 -0.69 0.98 0.00 0.00 173.24 174.11 1wmz s VAL 48 N -1.29 1.13 0.00 5.02 1.01 -1.26 -5.02 120.40 119.99 1wmz s VAL 48 Ca 0.25 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 61.85 1wmz s VAL 48 Cb -0.12 -1.11 0.00 0.00 0.00 0.00 0.00 36.38 35.15 1wmz s VAL 48 CO 0.18 0.38 0.68 1.41 0.00 0.00 0.00 175.10 177.75 1wmz n HIS 49 N 4.68 0.00 -3.60 5.22 8.25 -1.26 -4.70 115.22 123.81 1wmz n HIS 49 Ca -0.15 -0.21 -0.06 0.00 -0.26 0.00 0.00 57.72 57.04 1wmz n HIS 49 Cb 0.50 -0.02 -0.02 0.00 1.12 0.00 0.00 29.99 31.58 1wmz n HIS 49 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1wmz s SER 50 N -0.41 -0.27 0.45 0.41 1.04 -1.26 -4.36 113.70 109.30 1wmz s SER 50 Ca 0.00 -0.15 0.12 0.00 0.48 0.00 0.00 55.95 56.40 1wmz s SER 50 Cb 0.00 0.40 1.04 0.00 0.10 0.00 0.00 66.02 67.55 1wmz s SER 50 CO 0.00 -0.68 2.07 0.00 0.98 0.00 0.00 173.24 175.61 1wmz h ALA 51 N 2.00 1.88 -0.32 5.32 0.00 -1.98 -0.36 119.26 125.80 1wmz h ALA 51 Ca -0.23 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.57 1wmz h ALA 51 Cb 1.23 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 1wmz h ALA 51 CO 0.28 0.08 -0.17 0.00 0.00 0.00 0.00 179.25 179.44 1wmz h ALA 52 N 1.81 0.46 -0.35 0.00 0.00 -1.99 -1.22 119.26 117.97 1wmz h ALA 52 Ca 0.13 -0.35 -0.16 0.00 0.00 0.00 0.00 54.91 54.54 1wmz h ALA 52 Cb 0.11 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1wmz h ALA 52 CO -0.03 0.38 -0.41 1.49 0.00 0.00 0.00 179.25 180.68 1wmz h GLU 53 N 0.46 0.88 -0.25 0.00 4.81 -1.86 0.39 114.58 119.00 1wmz h GLU 53 Ca 0.07 -0.47 0.06 0.00 -0.13 0.00 0.00 59.36 58.88 1wmz h GLU 53 Cb 0.71 0.02 -0.05 0.00 0.63 0.00 0.00 28.75 30.06 1wmz h GLU 53 CO 0.05 1.12 -0.10 0.37 -0.73 0.00 0.00 179.01 179.72 1wmz h GLN 54 N 0.71 -0.06 -0.60 1.92 5.75 -1.00 -0.26 115.11 121.58 1wmz h GLN 54 Ca 0.05 0.00 -0.10 0.00 -0.15 0.00 0.00 58.65 58.46 1wmz h GLN 54 Cb 1.00 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 29.54 1wmz h GLN 54 CO 0.10 -0.04 -0.01 0.00 -2.65 0.00 0.00 178.83 176.22 1wmz h ALA 55 N 1.16 0.81 -0.19 3.38 0.00 -1.08 -0.45 119.26 122.90 1wmz h ALA 55 Ca 0.13 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 54.73 1wmz h ALA 55 Cb 0.26 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1wmz h ALA 55 CO -0.29 0.66 0.10 -0.92 0.00 0.00 0.00 179.25 178.79 1wmz h TYR 56 N 0.96 0.18 -0.19 0.00 5.03 -0.55 0.85 116.97 123.26 1wmz h TYR 56 Ca 0.17 0.01 -0.03 0.00 2.58 0.00 0.00 58.73 61.45 1wmz h TYR 56 Cb 0.58 -0.05 -0.01 0.00 1.55 0.00 0.00 36.73 38.80 1wmz h TYR 56 CO 0.04 0.11 -0.01 0.28 -1.32 0.00 0.00 178.16 177.25 1wmz h VAL 57 N 0.21 1.26 -0.41 1.81 2.07 -0.96 -0.78 116.25 119.46 1wmz h VAL 57 Ca 0.08 -0.91 0.00 0.00 0.82 0.00 0.00 66.70 66.69 1wmz h VAL 57 Cb 0.01 1.49 -0.02 0.00 -1.52 0.00 0.00 31.29 31.25 1wmz h VAL 57 CO -0.05 0.28 0.26 0.15 0.02 0.00 0.00 177.57 178.23 1wmz h PHE 58 N 0.09 0.53 0.00 1.57 3.57 -0.98 -1.79 116.94 119.93 1wmz h PHE 58 Ca 0.05 0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.45 1wmz h PHE 58 Cb 0.42 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.97 1wmz h PHE 58 CO 0.04 0.36 -0.49 -0.91 -2.23 0.00 0.00 178.31 175.08 1wmz h ASN 59 N 0.55 0.00 0.12 0.41 2.35 -0.68 -0.34 115.58 117.98 1wmz h ASN 59 Ca 0.15 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.89 1wmz h ASN 59 Cb -0.03 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.34 1wmz h ASN 59 CO -0.03 0.49 -0.06 0.22 -1.65 0.00 0.00 177.43 176.40 1wmz h TYR 60 N 0.00 -0.15 -0.15 1.19 3.20 -0.92 0.09 116.97 120.23 1wmz h TYR 60 Ca -0.00 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 61.90 1wmz h TYR 60 Cb 0.93 0.05 -0.04 0.00 1.54 0.00 0.00 36.73 39.21 1wmz h TYR 60 CO 0.00 0.21 -0.11 2.35 -1.64 0.00 0.00 178.16 178.97 1wmz h TRP 61 N -0.53 -0.27 -0.00 -3.82 7.01 -1.20 -2.23 115.95 114.92 1wmz h TRP 61 Ca -0.02 0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.00 1wmz h TRP 61 Cb 0.43 0.14 0.00 0.00 -2.10 0.00 0.00 29.16 27.63 1wmz h TRP 61 CO 0.04 -0.17 -0.01 0.54 -2.79 0.00 0.00 178.44 176.06 1wmz n ARG 62 N -5.26 0.59 0.23 2.65 5.12 -0.15 -1.36 116.66 118.49 1wmz n ARG 62 Ca -0.03 -0.02 0.11 0.00 -1.93 0.00 0.00 57.85 55.98 1wmz n ARG 62 Cb 0.18 -1.50 0.46 0.00 -1.16 0.00 0.00 32.46 30.44 1wmz n ARG 62 CO 0.00 0.00 0.00 0.78 -1.93 0.00 0.00 177.63 176.48 1wmz h GLY 63 N 5.00 0.00 0.00 -0.13 0.00 -0.32 -3.37 103.07 104.25 1wmz h GLY 63 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 47.11 1wmz h GLY 63 CO 0.00 0.00 -1.81 1.39 0.00 0.00 0.00 176.54 176.12 1wmz n ILE 64 N -3.33 0.81 -3.72 2.60 5.41 -0.87 -5.01 119.36 115.26 1wmz n ILE 64 Ca 0.00 -0.28 -0.37 0.00 1.00 0.00 0.00 62.75 63.11 1wmz n ILE 64 Cb 0.43 -1.22 -0.11 0.00 -0.71 0.00 0.00 39.64 38.03 1wmz n ILE 64 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1wmz s ASP 65 N -5.67 5.66 0.03 4.38 3.68 -0.46 -4.97 116.67 119.32 1wmz s ASP 65 Ca -0.20 -0.05 0.23 0.00 2.13 0.00 0.00 52.55 54.66 1wmz s ASP 65 Cb 0.06 -2.03 0.09 0.00 -1.45 0.00 0.00 42.92 39.60 1wmz s ASP 65 CO 0.31 0.00 1.09 -1.54 0.13 0.00 0.00 175.17 175.15 1wmz n SER 66 N 4.69 0.66 -4.78 -0.34 3.41 -1.26 -4.56 113.62 111.43 1wmz n SER 66 Ca -0.15 -0.38 -0.37 0.00 -0.26 0.00 0.00 58.87 57.72 1wmz n SER 66 Cb 0.52 0.72 -0.04 0.00 -0.26 0.00 0.00 64.21 65.15 1wmz n SER 66 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1wmz s GLN 67 N -3.11 4.16 0.28 4.33 -0.21 -1.26 -5.00 119.66 118.84 1wmz s GLN 67 Ca 0.06 1.53 -0.30 0.00 0.02 0.00 0.00 55.36 56.67 1wmz s GLN 67 Cb 0.15 -2.55 -0.10 0.00 1.00 0.00 0.00 33.01 31.51 1wmz s GLN 67 CO 0.79 -0.15 1.46 0.00 -2.12 0.00 0.00 175.29 175.27 1wmz s ALA 68 N -1.65 3.63 0.00 6.09 0.00 -1.26 -4.88 121.76 123.69 1wmz s ALA 68 Ca 0.58 1.39 0.00 0.00 0.00 0.00 0.00 51.96 53.92 1wmz s ALA 68 Cb -0.22 -3.57 0.00 0.00 0.00 0.00 0.00 23.12 19.33 1wmz s ALA 68 CO 0.28 -0.80 0.00 0.41 0.00 0.00 0.00 175.76 175.65 1wmz n GLY 69 N 1.88 -0.72 3.49 0.00 0.00 -1.26 -5.09 105.19 103.49 1wmz n GLY 69 Ca 0.06 -1.26 -0.23 0.00 0.00 0.00 0.00 46.02 44.59 1wmz n GLY 69 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1wmz s GLN 70 N -2.00 1.72 -0.20 1.61 1.11 -1.26 -2.57 119.66 118.06 1wmz s GLN 70 Ca 0.00 -1.94 -0.01 0.00 0.01 0.00 0.00 55.36 53.42 1wmz s GLN 70 Cb 0.00 -1.16 0.06 0.00 -1.01 0.00 0.00 33.01 30.90 1wmz s GLN 70 CO 0.00 -0.09 -0.02 -1.17 0.01 0.00 0.00 175.29 174.01 1wmz s LEU 71 N -3.54 1.87 0.33 2.90 2.96 -0.57 -1.47 118.68 121.16 1wmz s LEU 71 Ca 0.35 -0.93 -0.29 0.00 -0.22 0.00 0.00 54.13 53.03 1wmz s LEU 71 Cb 0.08 -0.92 -0.11 0.00 0.50 0.00 0.00 46.19 45.74 1wmz s LEU 71 CO 0.15 -0.25 1.55 0.79 -1.32 0.00 0.00 176.35 177.28 1wmz n TRP 72 N 4.85 2.92 -4.52 5.38 5.03 0.39 -0.72 117.44 130.77 1wmz n TRP 72 Ca -0.11 0.34 -0.24 0.00 3.03 0.00 0.00 57.50 60.52 1wmz n TRP 72 Cb 0.46 -2.57 -0.11 0.00 -1.03 0.00 0.00 31.31 28.06 1wmz n TRP 72 CO 0.00 0.00 0.00 0.96 -0.03 0.00 0.00 177.69 178.62 1wmz s ILE 73 N -0.50 1.66 -0.72 -0.99 -4.36 -0.81 -3.38 121.20 112.10 1wmz s ILE 73 Ca 0.59 -2.04 0.00 0.00 -0.26 0.00 0.00 60.65 58.94 1wmz s ILE 73 Cb -0.49 -2.80 0.00 0.00 1.25 0.00 0.00 42.46 40.43 1wmz s ILE 73 CO 0.55 -0.07 0.60 0.61 0.24 0.00 0.00 174.94 176.88 1wmz n GLY 74 N -0.78 1.55 3.79 6.27 0.00 0.15 -4.47 105.19 111.69 1wmz n GLY 74 Ca -0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.61 1wmz n GLY 74 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1wmz s LEU 75 N 0.00 4.35 0.09 0.99 2.96 -1.26 -0.75 118.68 125.06 1wmz s LEU 75 Ca 0.00 0.72 -0.23 0.00 -0.22 0.00 0.00 54.13 54.41 1wmz s LEU 75 Cb 0.00 -2.47 0.06 0.00 0.50 0.00 0.00 46.19 44.28 1wmz s LEU 75 CO 0.00 0.21 0.55 -0.72 -1.32 0.00 0.00 176.35 175.07 1wmz s TYR 76 N -0.26 -0.46 -0.09 5.38 -0.00 0.02 -0.08 117.35 121.86 1wmz s TYR 76 Ca 0.20 0.40 0.14 0.00 -0.00 0.00 0.00 57.07 57.82 1wmz s TYR 76 Cb -0.15 0.42 0.28 0.00 -0.00 0.00 0.00 41.96 42.51 1wmz s TYR 76 CO 0.08 -0.73 1.13 -0.40 -0.00 0.00 0.00 175.55 175.64 1wmz n ASP 77 N 0.07 1.29 -0.33 -0.18 5.75 -0.44 -1.18 116.55 121.54 1wmz n ASP 77 Ca -0.18 -2.76 0.15 0.00 -0.01 0.00 0.00 54.79 51.99 1wmz n ASP 77 Cb 0.62 -0.37 0.35 0.00 -1.03 0.00 0.00 41.12 40.70 1wmz n ASP 77 CO 0.00 0.00 0.00 0.50 -0.11 0.00 0.00 177.20 177.59 1wmz h LYS 78 N 0.46 0.53 -0.02 0.11 3.64 -1.90 -2.21 116.57 117.17 1wmz h LYS 78 Ca -0.05 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 1wmz h LYS 78 Cb 1.30 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 1wmz h LYS 78 CO 0.02 0.35 -0.33 0.66 -2.27 0.00 0.00 179.45 177.88 1wmz n TYR 79 N -4.92 0.00 -3.13 1.91 4.02 -1.26 -4.74 117.16 109.04 1wmz n TYR 79 Ca 0.25 0.00 0.01 0.00 -0.01 0.00 0.00 57.90 58.15 1wmz n TYR 79 Cb 0.69 -0.03 -0.01 0.00 -0.02 0.00 0.00 39.34 39.97 1wmz n TYR 79 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 176.86 177.06 1wmz s ASN 80 N -2.39 -1.31 0.15 7.72 2.47 -0.84 -5.13 114.94 115.61 1wmz s ASN 80 Ca 0.22 -0.66 -0.34 0.00 0.42 0.00 0.00 52.86 52.51 1wmz s ASN 80 Cb 0.19 1.68 -0.14 0.00 -1.45 0.00 0.00 41.25 41.53 1wmz s ASN 80 CO 0.51 -0.15 1.61 1.21 -3.72 0.00 0.00 177.10 176.56 1wmz n GLU 81 N 4.29 2.18 0.00 0.43 4.07 -1.16 -1.54 120.64 128.91 1wmz n GLU 81 Ca 0.10 0.79 0.00 0.00 -0.06 0.00 0.00 57.16 57.99 1wmz n GLU 81 Cb 0.58 -2.57 0.00 0.00 -0.06 0.00 0.00 31.44 29.40 1wmz n GLU 81 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1wmz n GLY 82 N 3.51 1.68 3.16 8.31 0.00 -1.26 -4.99 105.19 115.59 1wmz n GLY 82 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 1wmz n GLY 82 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1wmz s ASP 83 N -2.26 5.64 0.01 1.61 3.68 -0.59 -5.08 116.67 119.69 1wmz s ASP 83 Ca 0.00 -2.70 -0.30 0.00 2.13 0.00 0.00 52.55 51.67 1wmz s ASP 83 Cb 0.00 -1.95 -0.05 0.00 -1.45 0.00 0.00 42.92 39.47 1wmz s ASP 83 CO 0.00 -0.45 1.29 -0.36 0.13 0.00 0.00 175.17 175.77 1wmz s PHE 84 N 0.16 3.15 0.22 -5.34 0.08 -1.26 -4.49 117.98 110.50 1wmz s PHE 84 Ca 0.16 1.08 0.05 0.00 0.12 0.00 0.00 56.93 58.34 1wmz s PHE 84 Cb -0.18 -3.53 -0.05 0.00 -0.57 0.00 0.00 43.02 38.69 1wmz s PHE 84 CO -0.04 -1.79 -0.07 0.96 -0.10 0.00 0.00 175.22 174.18 1wmz s ILE 85 N 1.85 1.38 0.02 0.64 -4.36 -0.32 -4.87 121.20 115.54 1wmz s ILE 85 Ca 0.60 -2.10 -0.22 0.00 -0.26 0.00 0.00 60.65 58.67 1wmz s ILE 85 Cb -0.29 -2.21 -0.06 0.00 1.25 0.00 0.00 42.46 41.15 1wmz s ILE 85 CO 0.26 -0.46 0.67 0.26 0.24 0.00 0.00 174.94 175.91 1wmz s TRP 86 N -3.19 3.72 0.54 1.37 0.52 -1.26 -0.80 118.94 119.84 1wmz s TRP 86 Ca 0.25 1.32 0.26 0.00 0.02 0.00 0.00 56.10 57.96 1wmz s TRP 86 Cb 0.03 -2.69 1.63 0.00 -1.15 0.00 0.00 33.47 31.29 1wmz s TRP 86 CO 0.08 0.34 2.20 1.79 0.02 0.00 0.00 176.95 181.37 1wmz h THR 87 N 4.07 0.64 -0.03 2.01 1.35 -1.30 -2.28 112.91 117.37 1wmz h THR 87 Ca -0.45 -0.12 0.00 0.00 -0.55 0.00 0.00 66.41 65.29 1wmz h THR 87 Cb 1.20 1.08 0.00 0.00 -1.73 0.00 0.00 68.15 68.70 1wmz h THR 87 CO 0.70 0.03 0.00 -0.90 -0.25 0.00 0.00 175.52 175.10 1wmz n ASP 88 N -3.95 0.59 0.00 5.36 3.85 -1.26 -4.90 116.55 116.24 1wmz n ASP 88 Ca -0.03 -1.34 0.00 0.00 -0.71 0.00 0.00 54.79 52.71 1wmz n ASP 88 Cb 0.12 -0.02 0.00 0.00 -1.35 0.00 0.00 41.12 39.87 1wmz n ASP 88 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1wmz n GLY 89 N 1.00 1.44 3.78 6.12 0.00 -0.86 -5.04 105.19 111.63 1wmz n GLY 89 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 1wmz n GLY 89 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wmz s SER 90 N -3.20 5.09 0.23 1.61 1.04 -1.26 -5.01 113.70 112.20 1wmz s SER 90 Ca 0.00 1.84 -0.15 0.00 0.48 0.00 0.00 55.95 58.12 1wmz s SER 90 Cb 0.00 -2.53 -0.08 0.00 0.10 0.00 0.00 66.02 63.51 1wmz s SER 90 CO 0.00 -1.64 0.64 -0.54 0.98 0.00 0.00 173.24 172.68 1wmz s LYS 91 N -4.52 4.01 -0.28 4.02 -0.14 -1.26 -4.28 119.74 117.30 1wmz s LYS 91 Ca 0.63 0.58 -0.28 0.00 -1.36 0.00 0.00 55.97 55.54 1wmz s LYS 91 Cb -0.17 -2.71 0.01 0.00 -1.68 0.00 0.00 37.83 33.27 1wmz s LYS 91 CO 0.48 0.33 1.01 0.08 -0.76 0.00 0.00 175.35 176.49 1wmz s VAL 92 N -1.70 4.63 0.00 3.17 1.01 -1.26 -4.87 120.40 121.38 1wmz s VAL 92 Ca 0.46 1.77 0.00 0.00 0.00 0.00 0.00 61.98 64.20 1wmz s VAL 92 Cb -0.13 -4.32 0.00 0.00 0.00 0.00 0.00 36.38 31.93 1wmz s VAL 92 CO 0.19 -0.31 0.00 0.61 0.00 0.00 0.00 175.10 175.60 1wmz n GLY 93 N 3.70 0.14 3.65 4.51 0.00 -1.26 -5.06 105.19 110.87 1wmz n GLY 93 Ca 0.10 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.66 1wmz n GLY 93 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1wmz n TYR 94 N -0.64 1.98 -4.14 1.61 9.36 -1.26 -5.03 117.16 119.05 1wmz n TYR 94 Ca 0.00 0.47 -0.10 0.00 3.32 0.00 0.00 57.90 61.59 1wmz n TYR 94 Cb 0.00 -2.43 -0.10 0.00 -0.63 0.00 0.00 39.34 36.18 1wmz n TYR 94 CO 0.00 0.00 0.00 0.95 0.22 0.00 0.00 176.86 178.03 1wmz s THR 95 N 0.08 0.54 -0.36 2.97 -4.23 -1.26 -4.86 115.64 108.53 1wmz s THR 95 Ca 0.71 -1.81 0.14 0.00 -1.18 0.00 0.00 61.69 59.56 1wmz s THR 95 Cb -0.71 -1.52 0.41 0.00 1.34 0.00 0.00 72.50 72.02 1wmz s THR 95 CO 0.48 -0.86 0.97 1.17 -0.54 0.00 0.00 174.62 175.85 1wmz n LYS 96 N 0.16 1.09 -1.79 3.99 4.81 -1.26 -5.08 118.16 120.09 1wmz n LYS 96 Ca -0.14 -2.94 -0.41 0.00 -0.87 0.00 0.00 58.31 53.95 1wmz n LYS 96 Cb 0.60 -1.15 -0.01 0.00 0.02 0.00 0.00 35.03 34.49 1wmz n LYS 96 CO 0.00 0.00 0.00 -1.58 1.17 0.00 0.00 177.40 176.99 1wmz s TRP 97 N -2.10 2.63 0.62 5.64 0.52 -1.26 -0.13 118.94 124.86 1wmz s TRP 97 Ca 0.29 1.03 -0.18 0.00 0.02 0.00 0.00 56.10 57.26 1wmz s TRP 97 Cb 0.41 -4.05 -0.02 0.00 -1.15 0.00 0.00 33.47 28.66 1wmz s TRP 97 CO -0.02 -3.23 1.23 0.00 0.02 0.00 0.00 176.95 174.95 1wmz s ALA 98 N -0.75 2.45 0.12 0.98 0.00 -0.12 -4.62 121.76 119.83 1wmz s ALA 98 Ca 0.56 1.04 -0.35 0.00 0.00 0.00 0.00 51.96 53.21 1wmz s ALA 98 Cb -0.47 -3.48 -0.16 0.00 0.00 0.00 0.00 23.12 19.01 1wmz s ALA 98 CO 0.58 -1.36 1.39 0.41 0.00 0.00 0.00 175.76 176.78 1wmz n GLY 99 N 0.57 0.61 2.27 0.00 0.00 -1.26 -1.16 105.19 106.23 1wmz n GLY 99 Ca 0.14 0.66 0.00 0.00 0.00 0.00 0.00 46.02 46.82 1wmz n GLY 99 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wmz n GLY 100 N 2.68 1.54 3.57 -0.02 0.00 -1.26 -5.03 105.19 106.67 1wmz n GLY 100 Ca 0.17 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.94 1wmz n GLY 100 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1wmz s GLN 101 N -0.24 2.05 0.51 1.61 -1.52 -0.30 -4.10 119.66 117.67 1wmz s GLN 101 Ca 0.00 -1.37 -0.19 0.00 -1.95 0.00 0.00 55.36 51.85 1wmz s GLN 101 Cb 0.00 -2.10 -0.07 0.00 -0.22 0.00 0.00 33.01 30.61 1wmz s GLN 101 CO 0.00 0.40 1.03 -1.25 -0.25 0.00 0.00 175.29 175.22 1wmz s PRO 102 N -3.09 3.73 0.00 2.91 0.04 -1.26 -4.62 135.00 132.70 1wmz s PRO 102 Ca 0.27 1.26 0.00 0.00 0.04 0.00 0.00 61.00 62.56 1wmz s PRO 102 Cb -0.08 -2.09 0.00 0.00 0.04 0.00 0.00 34.50 32.37 1wmz s PRO 102 CO 0.16 -0.47 0.45 -0.40 0.04 0.00 0.00 177.00 176.78 1wmz n ASP 103 N -1.27 0.89 -4.02 6.66 3.85 -1.26 -5.03 116.55 116.37 1wmz n ASP 103 Ca 0.09 -1.07 -0.26 0.00 -0.71 0.00 0.00 54.79 52.84 1wmz n ASP 103 Cb 0.53 0.00 -0.04 0.00 -1.35 0.00 0.00 41.12 40.26 1wmz n ASP 103 CO 0.00 0.00 0.00 -3.20 -1.01 0.00 0.00 177.20 172.99 1wmz n ASN 104 N -0.03 -0.07 -4.73 -1.12 5.15 -1.26 -4.78 115.26 108.41 1wmz n ASN 104 Ca 0.00 -1.06 -0.42 0.00 -0.60 0.00 0.00 54.58 52.50 1wmz n ASN 104 Cb 0.07 -2.77 -0.01 0.00 -0.53 0.00 0.00 39.78 36.53 1wmz n ASN 104 CO 0.00 0.00 0.00 1.87 1.40 0.00 0.00 177.26 180.53 1wmz n TRP 105 N -4.44 2.69 -2.52 1.20 -0.00 -1.26 -1.28 117.44 111.83 1wmz n TRP 105 Ca -0.32 0.35 -0.11 0.00 -0.00 0.00 0.00 57.50 57.42 1wmz n TRP 105 Cb 0.69 -2.54 -0.00 0.00 -0.00 0.00 0.00 31.31 29.45 1wmz n TRP 105 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 177.69 177.78 1wmz n ASN 106 N 1.70 -3.47 -2.61 5.87 3.02 -1.26 -1.76 115.26 116.76 1wmz n ASN 106 Ca 0.07 0.19 -0.15 0.00 -0.03 0.00 0.00 54.58 54.66 1wmz n ASN 106 Cb 0.36 -2.96 -0.00 0.00 -0.61 0.00 0.00 39.78 36.56 1wmz n ASN 106 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1wmz n ASN 107 N -1.80 -4.24 -0.01 6.41 5.15 -0.40 -4.85 115.26 115.52 1wmz n ASN 107 Ca -0.11 0.06 0.00 0.00 -0.60 0.00 0.00 54.58 53.92 1wmz n ASN 107 Cb 0.59 -3.56 0.00 0.00 -0.53 0.00 0.00 39.78 36.28 1wmz n ASN 107 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1wmz n ALA 108 N -2.47 1.19 -3.38 5.20 0.00 -0.72 -5.03 120.51 115.30 1wmz n ALA 108 Ca -0.14 -0.60 -0.38 0.00 0.00 0.00 0.00 53.44 52.33 1wmz n ALA 108 Cb 0.61 -0.01 -0.12 0.00 0.00 0.00 0.00 19.45 19.93 1wmz n ALA 108 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1wmz s GLU 109 N -0.17 2.50 -0.00 0.00 2.02 -1.24 -4.13 118.70 117.67 1wmz s GLU 109 Ca 0.00 -1.35 0.01 0.00 0.02 0.00 0.00 54.97 53.65 1wmz s GLU 109 Cb 0.00 -3.51 0.01 0.00 0.10 0.00 0.00 34.13 30.73 1wmz s GLU 109 CO 0.00 -0.79 0.84 -0.25 0.02 0.00 0.00 175.26 175.08 1wmz n ASP 110 N 4.78 1.32 -3.92 -0.19 8.00 -0.62 -4.47 116.55 121.44 1wmz n ASP 110 Ca -0.10 -1.70 -0.26 0.00 0.71 0.00 0.00 54.79 53.43 1wmz n ASP 110 Cb 0.44 -0.02 -0.17 0.00 -0.02 0.00 0.00 41.12 41.35 1wmz n ASP 110 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1wmz s TYR 111 N -0.71 1.44 0.50 1.24 1.51 -0.87 -1.32 117.35 119.14 1wmz s TYR 111 Ca 0.01 -0.67 -0.19 0.00 -1.01 0.00 0.00 57.07 55.21 1wmz s TYR 111 Cb 0.01 -1.18 -0.08 0.00 -0.11 0.00 0.00 41.96 40.60 1wmz s TYR 111 CO 0.00 -0.46 1.01 0.20 -1.11 0.00 0.00 175.55 175.20 1wmz s GLY 112 N 1.49 2.33 -0.05 0.71 0.00 0.88 -0.40 107.32 112.29 1wmz s GLY 112 Ca 0.01 0.45 -0.30 0.00 0.00 0.00 0.00 44.72 44.87 1wmz s GLY 112 CO -0.06 0.75 0.67 -0.86 0.00 0.00 0.00 173.10 173.60 1wmz s GLN 113 N -3.52 1.05 0.26 2.90 -2.07 -0.52 -1.93 119.66 115.83 1wmz s GLN 113 Ca 0.64 0.24 -0.29 0.00 -1.82 0.00 0.00 55.36 54.12 1wmz s GLN 113 Cb -0.13 0.49 -0.09 0.00 -1.09 0.00 0.00 33.01 32.19 1wmz s GLN 113 CO 0.23 -0.33 1.01 -0.06 -1.32 0.00 0.00 175.29 174.82 1wmz s PHE 114 N -1.22 3.80 0.74 9.60 2.99 0.10 -0.94 117.98 133.05 1wmz s PHE 114 Ca -0.11 1.82 -0.11 0.00 0.00 0.00 0.00 56.93 58.53 1wmz s PHE 114 Cb -0.00 -3.10 0.03 0.00 0.00 0.00 0.00 43.02 39.95 1wmz s PHE 114 CO 0.10 0.02 1.08 1.03 -0.00 0.00 0.00 175.22 177.45 1wmz s ARG 115 N -1.36 2.60 0.00 0.44 0.52 -0.42 -1.51 118.95 119.22 1wmz s ARG 115 Ca 0.43 0.67 0.29 0.00 -0.52 0.00 0.00 55.73 56.61 1wmz s ARG 115 Cb -0.28 -1.97 1.35 0.00 0.52 0.00 0.00 34.95 34.56 1wmz s ARG 115 CO 0.35 -1.26 1.92 -2.39 0.02 0.00 0.00 175.30 173.94 1wmz n HIS 116 N -3.20 0.00 -4.16 -0.53 1.44 -1.06 -3.66 115.22 104.05 1wmz n HIS 116 Ca 0.07 0.00 -0.26 0.00 -2.01 0.00 0.00 57.72 55.52 1wmz n HIS 116 Cb 0.56 -0.12 -0.06 0.00 0.12 0.00 0.00 29.99 30.48 1wmz n HIS 116 CO 0.00 0.00 0.00 0.95 -2.81 0.00 0.00 176.34 174.48 1wmz s THR 117 N -2.30 2.11 -1.49 0.61 -4.23 -1.26 -4.76 115.64 104.31 1wmz s THR 117 Ca 0.34 -1.70 -0.09 0.00 -1.18 0.00 0.00 61.69 59.06 1wmz s THR 117 Cb 0.21 -2.81 0.06 0.00 1.34 0.00 0.00 72.50 71.30 1wmz s THR 117 CO 0.43 0.00 0.78 -0.62 -0.54 0.00 0.00 174.62 174.67 1wmz n GLU 118 N -1.31 -4.53 -1.95 3.99 4.71 -1.26 -1.42 120.64 118.87 1wmz n GLU 118 Ca -0.03 0.52 -0.19 0.00 -0.01 0.00 0.00 57.16 57.45 1wmz n GLU 118 Cb 0.65 -5.16 -0.05 0.00 -1.01 0.00 0.00 31.44 25.87 1wmz n GLU 118 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1wmz n GLY 119 N -1.67 0.78 1.33 0.62 0.00 -1.26 -2.65 105.19 102.34 1wmz n GLY 119 Ca -0.10 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1wmz n GLY 119 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wmz n GLY 120 N -0.79 0.77 3.60 -0.02 0.00 -0.51 -4.82 105.19 103.42 1wmz n GLY 120 Ca -0.21 -0.66 -0.45 0.00 0.00 0.00 0.00 46.02 44.70 1wmz n GLY 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wmz n ALA 121 N -0.56 -0.18 -2.03 4.61 0.00 -1.08 -3.94 120.51 117.33 1wmz n ALA 121 Ca 0.00 0.41 -0.35 0.00 0.00 0.00 0.00 53.44 53.50 1wmz n ALA 121 Cb 0.19 -2.05 -0.06 0.00 0.00 0.00 0.00 19.45 17.52 1wmz n ALA 121 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1wmz s TRP 122 N -0.79 3.55 0.07 0.00 0.51 0.82 -1.30 118.94 121.80 1wmz s TRP 122 Ca 0.62 1.43 0.06 0.00 -2.12 0.00 0.00 56.10 56.09 1wmz s TRP 122 Cb -0.72 -2.67 -0.03 0.00 -0.81 0.00 0.00 33.47 29.24 1wmz s TRP 122 CO 0.58 0.21 -0.15 1.21 -0.51 0.00 0.00 176.95 178.28 1wmz s ASN 123 N -1.86 1.79 -0.05 2.95 2.47 -0.12 -0.94 114.94 119.19 1wmz s ASN 123 Ca 0.49 -0.60 -0.17 0.00 0.42 0.00 0.00 52.86 53.00 1wmz s ASN 123 Cb -0.15 -0.07 -0.05 0.00 -1.45 0.00 0.00 41.25 39.53 1wmz s ASN 123 CO 0.20 -0.04 0.46 1.51 -3.72 0.00 0.00 177.10 175.51 1wmz s ASP 124 N -1.67 6.77 0.37 -4.21 -4.77 -1.26 -1.44 116.67 110.46 1wmz s ASP 124 Ca -0.00 0.92 0.05 0.00 -3.30 0.00 0.00 52.55 50.22 1wmz s ASP 124 Cb -0.10 -2.28 -0.03 0.00 -1.09 0.00 0.00 42.92 39.42 1wmz s ASP 124 CO 0.02 0.15 0.20 0.21 0.70 0.00 0.00 175.17 176.45 1wmz s ASN 125 N -0.19 2.18 0.58 2.11 3.84 0.46 -4.85 114.94 119.07 1wmz s ASN 125 Ca 0.25 -1.71 0.01 0.00 0.21 0.00 0.00 52.86 51.62 1wmz s ASN 125 Cb -0.16 0.54 0.05 0.00 -0.55 0.00 0.00 41.25 41.12 1wmz s ASN 125 CO 0.12 -1.00 0.81 -0.94 -2.79 0.00 0.00 177.10 173.31 1wmz s SER 126 N -3.48 5.15 0.27 -4.21 1.04 -1.26 -1.59 113.70 109.61 1wmz s SER 126 Ca 0.32 -0.03 0.25 0.00 0.48 0.00 0.00 55.95 56.96 1wmz s SER 126 Cb 0.02 -0.78 0.97 0.00 0.10 0.00 0.00 66.02 66.33 1wmz s SER 126 CO 0.21 -1.25 1.74 0.00 0.98 0.00 0.00 173.24 174.91 1wmz n ALA 127 N -2.43 1.78 0.16 5.32 0.00 -1.26 -2.76 120.51 121.32 1wmz n ALA 127 Ca 0.09 0.07 0.11 0.00 0.00 0.00 0.00 53.44 53.72 1wmz n ALA 127 Cb 0.60 -1.41 -0.02 0.00 0.00 0.00 0.00 19.45 18.62 1wmz n ALA 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wmz n ALA 128 N -1.79 2.68 -1.33 0.00 0.00 -1.26 -4.71 120.51 114.10 1wmz n ALA 128 Ca 0.03 -0.30 -0.32 0.00 0.00 0.00 0.00 53.44 52.85 1wmz n ALA 128 Cb 0.27 -1.04 0.08 0.00 0.00 0.00 0.00 19.45 18.76 1wmz n ALA 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wmz s ALA 129 N -3.36 2.30 0.02 0.00 0.00 -1.11 -4.98 121.76 114.62 1wmz s ALA 129 Ca -0.01 0.38 0.08 0.00 0.00 0.00 0.00 51.96 52.41 1wmz s ALA 129 Cb 0.11 -3.30 -0.03 0.00 0.00 0.00 0.00 23.12 19.91 1wmz s ALA 129 CO 0.81 -1.64 -0.23 -0.65 0.00 0.00 0.00 175.76 174.05 1wmz s GLN 130 N -4.62 1.99 0.25 0.00 -1.52 -1.26 -4.23 119.66 110.27 1wmz s GLN 130 Ca 0.63 -1.01 -0.16 0.00 -1.95 0.00 0.00 55.36 52.88 1wmz s GLN 130 Cb -0.19 -2.08 0.01 0.00 -0.22 0.00 0.00 33.01 30.53 1wmz s GLN 130 CO 0.51 0.54 0.56 0.00 -0.25 0.00 0.00 175.29 176.65 1wmz s ALA 131 N -0.80 -0.66 1.03 6.09 0.00 -0.26 -4.79 121.76 122.38 1wmz s ALA 131 Ca 0.12 -0.59 -0.17 0.00 0.00 0.00 0.00 51.96 51.32 1wmz s ALA 131 Cb -0.10 0.96 0.22 0.00 0.00 0.00 0.00 23.12 24.20 1wmz s ALA 131 CO 0.02 -0.90 1.24 0.15 0.00 0.00 0.00 175.76 176.28 1wmz s LYS 132 N -3.96 0.09 0.09 0.00 -0.14 -0.54 -1.29 119.74 113.99 1wmz s LYS 132 Ca 0.17 -0.26 -0.14 0.00 -1.36 0.00 0.00 55.97 54.37 1wmz s LYS 132 Cb -0.02 -1.77 0.02 0.00 -1.68 0.00 0.00 37.83 34.38 1wmz s LYS 132 CO 0.06 -2.80 0.34 1.52 -0.76 0.00 0.00 175.35 173.70 1wmz s TYR 133 N -3.58 -0.11 -0.06 3.18 1.13 -1.14 -0.46 117.35 116.31 1wmz s TYR 133 Ca 0.72 -0.16 0.02 0.00 -1.41 0.00 0.00 57.07 56.24 1wmz s TYR 133 Cb -0.06 0.15 0.02 0.00 -1.10 0.00 0.00 41.96 40.97 1wmz s TYR 133 CO 0.54 -0.61 -0.09 1.41 -2.51 0.00 0.00 175.55 174.29 1wmz s MET 134 N -3.42 1.33 0.28 -3.49 1.75 -1.22 -1.15 119.30 113.38 1wmz s MET 134 Ca 0.01 -0.28 0.06 0.00 -1.25 0.00 0.00 55.69 54.23 1wmz s MET 134 Cb 0.02 -1.17 -0.03 0.00 2.84 0.00 0.00 34.83 36.49 1wmz s MET 134 CO -0.09 -0.03 0.31 0.00 -0.65 0.00 0.00 175.02 174.57 1wmz s LYS 136 N -3.97 0.14 -0.11 0.00 2.20 0.13 -1.66 119.74 116.47 1wmz s LYS 136 Ca 0.37 0.34 -0.13 0.00 -0.36 0.00 0.00 55.97 56.19 1wmz s LYS 136 Cb -0.08 -0.07 -0.05 0.00 -1.51 0.00 0.00 37.83 36.12 1wmz s LYS 136 CO 0.28 -0.11 0.31 -0.51 -0.36 0.00 0.00 175.35 174.95 1wmz s LEU 137 N 0.77 4.34 -0.12 5.43 1.43 0.06 -1.53 118.68 129.06 1wmz s LEU 137 Ca -0.06 0.64 0.03 0.00 -1.03 0.00 0.00 54.13 53.72 1wmz s LEU 137 Cb -0.07 -2.40 0.00 0.00 0.03 0.00 0.00 46.19 43.76 1wmz s LEU 137 CO -0.04 0.21 -0.23 -0.89 0.23 0.00 0.00 176.35 175.63 1wmz s THR 138 N -0.22 2.07 -0.70 5.49 2.01 -0.16 -3.53 115.64 120.59 1wmz s THR 138 Ca 0.19 -1.00 -0.18 0.00 0.31 0.00 0.00 61.69 61.01 1wmz s THR 138 Cb -0.14 -1.80 0.13 0.00 0.01 0.00 0.00 72.50 70.70 1wmz s THR 138 CO 0.07 0.55 0.81 -0.36 -0.69 0.00 0.00 174.62 175.00 1wmz s PHE 139 N 0.57 3.15 -2.00 4.92 0.40 -1.26 -1.00 117.98 122.76 1wmz s PHE 139 Ca -0.13 -1.23 0.27 0.00 -0.60 0.00 0.00 56.93 55.24 1wmz s PHE 139 Cb -0.17 -4.04 1.58 0.00 0.51 0.00 0.00 43.02 40.91 1wmz s PHE 139 CO 0.04 -1.29 1.93 -1.91 0.70 0.00 0.00 175.22 174.69