#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wmy n GLN 2 N 0.00 1.89 -2.68 1.20 3.00 -1.26 -5.04 117.38 114.49 1wmy n GLN 2 Ca 0.00 -3.14 -0.37 0.00 -0.01 0.00 0.00 57.00 53.48 1wmy n GLN 2 Cb 0.00 -1.77 -0.06 0.00 0.00 0.00 0.00 30.24 28.41 1wmy n GLN 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1wmy n PRO 4 N 0.46 0.21 -1.72 0.00 -0.02 -1.26 -4.89 135.00 127.78 1wmy n PRO 4 Ca 0.02 0.12 -0.42 0.00 -2.02 0.00 0.00 63.50 61.20 1wmy n PRO 4 Cb 0.49 -1.92 -0.01 0.00 -0.02 0.00 0.00 33.50 32.05 1wmy n PRO 4 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1wmy n THR 5 N -2.67 1.76 -0.92 3.45 -1.04 -1.26 -1.94 114.28 111.67 1wmy n THR 5 Ca 0.10 -0.44 0.00 0.00 -2.04 0.00 0.00 64.05 61.67 1wmy n THR 5 Cb 0.50 -1.71 0.00 0.00 -1.82 0.00 0.00 70.33 67.31 1wmy n THR 5 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1wmy n ASP 6 N 1.01 -1.03 -4.74 8.00 8.00 -1.26 -5.03 116.55 121.51 1wmy n ASP 6 Ca 0.05 0.00 -0.35 0.00 0.71 0.00 0.00 54.79 55.20 1wmy n ASP 6 Cb 0.36 -0.71 -0.08 0.00 -0.02 0.00 0.00 41.12 40.67 1wmy n ASP 6 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 1wmy s TRP 7 N -2.91 3.26 -0.05 1.24 0.52 -0.82 -4.77 118.94 115.41 1wmy s TRP 7 Ca 0.00 0.24 -0.11 0.00 0.02 0.00 0.00 56.10 56.26 1wmy s TRP 7 Cb 0.00 -1.79 -0.05 0.00 -1.15 0.00 0.00 33.47 30.48 1wmy s TRP 7 CO 0.00 0.53 0.28 -1.21 0.02 0.00 0.00 176.95 176.58 1wmy s GLU 8 N -1.17 3.69 -0.10 4.98 0.41 0.79 -4.75 118.70 122.55 1wmy s GLU 8 Ca 0.16 0.15 -0.16 0.00 -0.41 0.00 0.00 54.97 54.71 1wmy s GLU 8 Cb -0.12 -3.20 -0.05 0.00 -1.78 0.00 0.00 34.13 28.99 1wmy s GLU 8 CO 0.06 0.73 0.41 0.00 -0.49 0.00 0.00 175.26 175.96 1wmy s ALA 9 N -1.07 3.57 -0.29 5.21 0.00 -1.26 0.10 121.76 128.01 1wmy s ALA 9 Ca 0.20 -0.27 -0.07 0.00 0.00 0.00 0.00 51.96 51.82 1wmy s ALA 9 Cb -0.14 -2.50 0.14 0.00 0.00 0.00 0.00 23.12 20.61 1wmy s ALA 9 CO 0.09 0.15 0.60 -2.00 0.00 0.00 0.00 175.76 174.61 1wmy s GLU 10 N 0.14 0.54 5.65 0.00 2.56 -0.71 -4.98 118.70 121.89 1wmy s GLU 10 Ca 0.23 1.26 0.00 0.00 0.00 0.00 0.00 54.97 56.46 1wmy s GLU 10 Cb -0.15 0.69 0.00 0.00 2.00 0.00 0.00 34.13 36.67 1wmy s GLU 10 CO 0.09 -0.33 0.00 0.41 -0.56 0.00 0.00 175.26 174.87 1wmy n GLY 11 N 5.44 1.47 1.29 -1.50 0.00 -1.26 -2.16 105.19 108.46 1wmy n GLY 11 Ca -0.08 -0.61 0.05 0.00 0.00 0.00 0.00 46.02 45.38 1wmy n GLY 11 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1wmy n ASP 12 N 4.28 3.71 -4.22 1.61 8.00 -1.26 -4.95 116.55 123.73 1wmy n ASP 12 Ca 0.00 -2.50 -0.13 0.00 0.71 0.00 0.00 54.79 52.87 1wmy n ASP 12 Cb 0.00 -0.58 -0.10 0.00 -0.02 0.00 0.00 41.12 40.42 1wmy n ASP 12 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 1wmy s HIS 13 N -1.99 1.11 0.03 1.24 3.76 -0.92 -4.64 115.29 113.88 1wmy s HIS 13 Ca 0.33 -0.90 0.08 0.00 -0.15 0.00 0.00 55.06 54.42 1wmy s HIS 13 Cb 0.24 -0.61 -0.03 0.00 1.11 0.00 0.00 32.58 33.29 1wmy s HIS 13 CO 0.11 -0.10 -0.24 0.00 -0.85 0.00 0.00 174.74 173.66 1wmy s TYR 15 N -0.80 1.69 -0.13 0.00 1.51 0.11 -0.63 117.35 119.10 1wmy s TYR 15 Ca 0.12 -0.45 -0.06 0.00 -1.01 0.00 0.00 57.07 55.67 1wmy s TYR 15 Cb -0.10 -0.90 0.06 0.00 -0.11 0.00 0.00 41.96 40.91 1wmy s TYR 15 CO 0.02 0.21 0.29 0.50 -1.11 0.00 0.00 175.55 175.46 1wmy s ARG 16 N -2.21 0.22 -0.11 -0.62 3.52 -0.44 -0.15 118.95 119.16 1wmy s ARG 16 Ca 0.08 0.69 -0.17 0.00 -0.13 0.00 0.00 55.73 56.20 1wmy s ARG 16 Cb -0.08 -0.04 -0.04 0.00 -1.56 0.00 0.00 34.95 33.22 1wmy s ARG 16 CO 0.04 -0.22 0.44 0.12 -0.81 0.00 0.00 175.30 174.88 1wmy s PHE 17 N 1.83 3.53 -0.27 5.12 5.36 -1.26 -0.90 117.98 131.39 1wmy s PHE 17 Ca -0.05 0.86 -0.02 0.00 -0.96 0.00 0.00 56.93 56.77 1wmy s PHE 17 Cb -0.11 -2.49 0.04 0.00 -0.34 0.00 0.00 43.02 40.12 1wmy s PHE 17 CO -0.09 0.24 -0.03 -0.06 -1.46 0.00 0.00 175.22 173.81 1wmy s PHE 18 N 0.39 3.16 -1.51 10.12 0.08 -0.19 -5.01 117.98 125.01 1wmy s PHE 18 Ca 0.24 -1.70 -0.09 0.00 0.12 0.00 0.00 56.93 55.51 1wmy s PHE 18 Cb -0.15 -2.08 -0.00 0.00 -0.57 0.00 0.00 43.02 40.22 1wmy s PHE 18 CO 0.10 -0.76 2.66 -1.71 -0.10 0.00 0.00 175.22 175.41 1wmy n ASN 19 N 4.65 7.83 -3.69 1.36 2.85 -1.26 -2.79 115.26 124.20 1wmy n ASN 19 Ca -0.15 -2.79 -0.16 0.00 -0.11 0.00 0.00 54.58 51.37 1wmy n ASN 19 Cb 0.45 -1.51 -0.15 0.00 1.24 0.00 0.00 39.78 39.81 1wmy n ASN 19 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 1wmy s THR 20 N 1.25 -0.21 0.17 -0.44 2.01 -1.26 -5.09 115.64 112.07 1wmy s THR 20 Ca 0.61 0.30 -0.32 0.00 0.31 0.00 0.00 61.69 62.60 1wmy s THR 20 Cb 0.17 -0.29 -0.11 0.00 0.01 0.00 0.00 72.50 72.28 1wmy s THR 20 CO -0.07 0.12 1.70 -0.76 -0.69 0.00 0.00 174.62 174.92 1wmy s LEU 21 N 1.98 4.38 0.34 4.42 1.43 -1.26 -4.02 118.68 125.95 1wmy s LEU 21 Ca -0.01 2.76 -0.16 0.00 -1.03 0.00 0.00 54.13 55.69 1wmy s LEU 21 Cb -0.12 -3.59 0.04 0.00 0.03 0.00 0.00 46.19 42.55 1wmy s LEU 21 CO -0.06 -0.93 0.73 0.28 0.23 0.00 0.00 176.35 176.59 1wmy s THR 22 N 1.55 0.00 0.73 5.49 -1.32 0.11 -4.85 115.64 117.35 1wmy s THR 22 Ca 0.75 -1.06 -0.11 0.00 -1.21 0.00 0.00 61.69 60.05 1wmy s THR 22 Cb -0.47 -2.54 0.03 0.00 -1.51 0.00 0.00 72.50 68.02 1wmy s THR 22 CO 0.33 0.00 1.08 0.42 -2.21 0.00 0.00 174.62 174.24 1wmy s THR 23 N -2.98 3.52 0.12 5.08 -4.23 -1.26 -1.22 115.64 114.66 1wmy s THR 23 Ca 0.15 0.49 -0.20 0.00 -1.18 0.00 0.00 61.69 60.95 1wmy s THR 23 Cb -0.05 -3.34 -0.07 0.00 1.34 0.00 0.00 72.50 70.39 1wmy s THR 23 CO 0.10 -0.64 1.74 -0.25 -0.54 0.00 0.00 174.62 175.03 1wmy h TRP 24 N -0.82 0.05 -0.85 3.99 7.01 -1.86 0.07 115.95 123.54 1wmy h TRP 24 Ca -0.46 0.01 0.04 0.00 2.11 0.00 0.00 58.89 60.60 1wmy h TRP 24 Cb 1.25 0.00 -0.05 0.00 -2.10 0.00 0.00 29.16 28.25 1wmy h TRP 24 CO 0.52 0.02 0.54 0.93 -2.79 0.00 0.00 178.44 177.66 1wmy h GLU 25 N 0.10 1.01 -0.44 2.65 3.07 -1.94 0.12 114.58 119.14 1wmy h GLU 25 Ca 0.07 -0.06 -0.06 0.00 -0.50 0.00 0.00 59.36 58.82 1wmy h GLU 25 Cb 0.07 -0.23 -0.02 0.00 -0.84 0.00 0.00 28.75 27.73 1wmy h GLU 25 CO -0.10 0.67 0.05 -0.97 -1.40 0.00 0.00 179.01 177.26 1wmy h ASN 26 N 1.04 0.72 -0.66 1.42 -1.24 -1.90 -1.26 115.58 113.71 1wmy h ASN 26 Ca 0.35 -0.27 0.08 0.00 0.71 0.00 0.00 56.30 57.16 1wmy h ASN 26 Cb 0.05 -0.19 -0.06 0.00 0.73 0.00 0.00 38.32 38.85 1wmy h ASN 26 CO -0.13 0.82 0.33 0.00 -1.29 0.00 0.00 177.43 177.15 1wmy h ALA 27 N 0.93 0.89 0.14 1.57 0.00 -0.53 0.13 119.26 122.39 1wmy h ALA 27 Ca 0.13 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1wmy h ALA 27 Cb 0.41 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1wmy h ALA 27 CO 0.01 -0.05 -0.07 1.25 0.00 0.00 0.00 179.25 180.39 1wmy h HIS 28 N 0.58 -0.17 -0.74 0.00 -0.00 -0.67 -1.61 115.15 112.53 1wmy h HIS 28 Ca 0.32 -0.00 0.10 0.00 -0.00 0.00 0.00 60.37 60.78 1wmy h HIS 28 Cb 0.30 0.06 -0.07 0.00 -0.00 0.00 0.00 27.41 27.69 1wmy h HIS 28 CO -0.11 -0.06 0.38 1.25 -0.00 0.00 0.00 177.93 179.39 1wmy h HIS 29 N -0.24 0.68 0.13 5.26 6.17 -1.04 -2.11 115.15 124.00 1wmy h HIS 29 Ca -0.02 0.03 -0.01 0.00 0.71 0.00 0.00 60.37 61.08 1wmy h HIS 29 Cb 0.19 -0.19 0.00 0.00 2.52 0.00 0.00 27.41 29.93 1wmy h HIS 29 CO -0.05 0.25 -0.06 0.93 0.71 0.00 0.00 177.93 179.70 1wmy h GLU 30 N 0.64 -0.17 -0.28 5.26 4.39 -0.47 -1.94 114.58 122.00 1wmy h GLU 30 Ca 0.37 0.01 0.06 0.00 0.34 0.00 0.00 59.36 60.13 1wmy h GLU 30 Cb 0.38 0.04 -0.05 0.00 -0.10 0.00 0.00 28.75 29.02 1wmy h GLU 30 CO -0.27 0.10 -0.07 0.00 -1.16 0.00 0.00 179.01 177.60 1wmy h VAL 32 N -0.00 1.09 0.00 0.00 2.07 -1.32 -2.48 116.25 115.61 1wmy h VAL 32 Ca 0.13 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.29 1wmy h VAL 32 Cb 0.21 1.02 0.00 0.00 -1.52 0.00 0.00 31.29 31.00 1wmy h VAL 32 CO -0.29 0.12 0.00 0.77 0.02 0.00 0.00 177.57 178.19 1wmy h SER 33 N 0.17 0.00 0.74 0.57 4.64 -0.88 -0.42 113.55 118.37 1wmy h SER 33 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1wmy h SER 33 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 1wmy h SER 33 CO 0.00 0.00 0.00 -1.22 -0.87 0.00 0.00 176.83 174.74 1wmy n TYR 34 N -2.63 0.00 -1.25 4.77 4.02 -0.93 -4.94 117.16 116.20 1wmy n TYR 34 Ca -0.00 0.00 -0.35 0.00 -0.01 0.00 0.00 57.90 57.54 1wmy n TYR 34 Cb 0.17 -0.43 0.11 0.00 -0.02 0.00 0.00 39.34 39.16 1wmy n TYR 34 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 1wmy n SER 35 N -1.43 0.75 -3.62 7.72 7.64 -0.17 -4.76 113.62 119.75 1wmy n SER 35 Ca 0.08 0.63 -0.27 0.00 1.01 0.00 0.00 58.87 60.32 1wmy n SER 35 Cb 0.27 -1.46 -0.16 0.00 -1.01 0.00 0.00 64.21 61.85 1wmy n SER 35 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1wmy h SER 37 N 8.37 0.00 0.46 0.00 0.87 -1.95 0.49 113.55 121.79 1wmy h SER 37 Ca -0.17 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.34 1wmy h SER 37 Cb 1.09 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.04 1wmy h SER 37 CO 0.36 0.40 -0.26 0.71 -0.53 0.00 0.00 176.83 177.50 1wmy h THR 38 N 0.00 0.91 -0.17 2.23 1.35 -1.95 -3.00 112.91 112.28 1wmy h THR 38 Ca -0.00 -0.99 0.00 0.00 -0.55 0.00 0.00 66.41 64.86 1wmy h THR 38 Cb 0.82 1.58 0.00 0.00 -1.73 0.00 0.00 68.15 68.82 1wmy h THR 38 CO 0.05 0.26 0.00 0.18 -0.25 0.00 0.00 175.52 175.76 1wmy n LEU 39 N -3.83 2.68 -3.83 3.87 4.77 -1.14 -5.00 117.00 114.51 1wmy n LEU 39 Ca -0.02 -2.30 -0.27 0.00 -0.03 0.00 0.00 56.01 53.40 1wmy n LEU 39 Cb 0.35 -0.23 0.03 0.00 -2.33 0.00 0.00 43.42 41.25 1wmy n LEU 39 CO 0.35 0.64 0.05 0.59 -1.33 0.00 0.00 177.39 177.69 1wmy n ASN 40 N -0.24 -3.61 -4.46 -1.43 3.02 -0.76 -4.76 115.26 103.01 1wmy n ASN 40 Ca 0.10 -0.78 -0.42 0.00 -0.03 0.00 0.00 54.58 53.45 1wmy n ASN 40 Cb 0.46 -3.98 -0.10 0.00 -0.61 0.00 0.00 39.78 35.55 1wmy n ASN 40 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1wmy s VAL 41 N -3.43 5.11 -0.07 2.41 1.01 0.09 -1.06 120.40 124.45 1wmy s VAL 41 Ca 0.43 -0.56 -0.25 0.00 0.00 0.00 0.00 61.98 61.60 1wmy s VAL 41 Cb -0.22 -3.77 -0.03 0.00 0.00 0.00 0.00 36.38 32.36 1wmy s VAL 41 CO 0.82 -0.19 0.77 -0.60 0.00 0.00 0.00 175.10 175.90 1wmy s ARG 42 N 1.67 4.43 -0.11 2.72 3.52 -0.29 -0.78 118.95 130.11 1wmy s ARG 42 Ca 0.05 0.99 -0.02 0.00 -0.13 0.00 0.00 55.73 56.62 1wmy s ARG 42 Cb -0.18 -3.47 -0.03 0.00 -1.56 0.00 0.00 34.95 29.70 1wmy s ARG 42 CO 0.09 -0.03 -0.03 0.45 -0.81 0.00 0.00 175.30 174.98 1wmy s SER 43 N 0.90 4.94 0.28 -2.12 0.15 -1.26 -0.63 113.70 115.96 1wmy s SER 43 Ca 0.40 0.00 -0.21 0.00 0.70 0.00 0.00 55.95 56.84 1wmy s SER 43 Cb -0.18 -1.52 0.03 0.00 -1.71 0.00 0.00 66.02 62.63 1wmy s SER 43 CO 0.19 0.29 0.74 -0.62 1.20 0.00 0.00 173.24 175.04 1wmy s ASP 44 N -0.37 -0.23 0.70 5.45 3.68 -0.82 -3.34 116.67 121.75 1wmy s ASP 44 Ca 0.06 -0.65 -0.16 0.00 2.13 0.00 0.00 52.55 53.94 1wmy s ASP 44 Cb -0.12 0.73 0.02 0.00 -1.45 0.00 0.00 42.92 42.09 1wmy s ASP 44 CO 0.02 -1.35 1.21 -0.76 0.13 0.00 0.00 175.17 174.42 1wmy s LEU 45 N -2.94 3.39 0.24 -1.34 1.43 -1.26 -0.51 118.68 117.69 1wmy s LEU 45 Ca 0.12 2.36 -0.30 0.00 -1.03 0.00 0.00 54.13 55.28 1wmy s LEU 45 Cb -0.06 -4.59 -0.10 0.00 0.03 0.00 0.00 46.19 41.48 1wmy s LEU 45 CO 0.07 -2.10 1.39 0.54 0.23 0.00 0.00 176.35 176.48 1wmy s VAL 46 N -1.90 2.84 0.05 -1.59 0.11 -0.63 -4.33 120.40 114.95 1wmy s VAL 46 Ca 0.75 0.71 0.03 0.00 -2.93 0.00 0.00 61.98 60.54 1wmy s VAL 46 Cb -0.30 -3.45 -0.04 0.00 -1.53 0.00 0.00 36.38 31.07 1wmy s VAL 46 CO 0.43 0.11 0.01 -0.94 -3.33 0.00 0.00 175.10 171.39 1wmy s SER 47 N 0.30 5.16 -0.16 3.54 1.04 -1.26 -0.98 113.70 121.33 1wmy s SER 47 Ca 0.58 -0.08 0.00 0.00 0.48 0.00 0.00 55.95 56.93 1wmy s SER 47 Cb -0.40 -1.31 0.03 0.00 0.10 0.00 0.00 66.02 64.44 1wmy s SER 47 CO 0.42 0.22 -0.13 -0.69 0.98 0.00 0.00 173.24 174.04 1wmy s VAL 48 N -1.23 1.58 0.00 5.02 1.01 -1.26 -5.02 120.40 120.50 1wmy s VAL 48 Ca 0.24 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.51 1wmy s VAL 48 Cb -0.12 -1.52 0.00 0.00 0.00 0.00 0.00 36.38 34.74 1wmy s VAL 48 CO 0.16 0.39 0.83 1.41 0.00 0.00 0.00 175.10 177.88 1wmy n HIS 49 N 4.76 0.00 -3.59 5.22 8.25 -1.26 -4.65 115.22 123.95 1wmy n HIS 49 Ca -0.16 -0.33 -0.07 0.00 -0.26 0.00 0.00 57.72 56.89 1wmy n HIS 49 Cb 0.49 -0.03 -0.02 0.00 1.12 0.00 0.00 29.99 31.55 1wmy n HIS 49 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1wmy s SER 50 N -0.67 -0.32 0.41 0.41 1.04 -1.26 -4.47 113.70 108.83 1wmy s SER 50 Ca 0.00 -0.16 0.07 0.00 0.48 0.00 0.00 55.95 56.35 1wmy s SER 50 Cb 0.00 0.45 0.86 0.00 0.10 0.00 0.00 66.02 67.43 1wmy s SER 50 CO 0.00 -0.78 2.04 0.00 0.98 0.00 0.00 173.24 175.48 1wmy h ALA 51 N 2.00 1.73 -0.39 5.32 0.00 -1.98 -0.95 119.26 125.00 1wmy h ALA 51 Ca -0.24 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 1wmy h ALA 51 Cb 1.25 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 1wmy h ALA 51 CO 0.29 0.22 0.08 0.00 0.00 0.00 0.00 179.25 179.84 1wmy h ALA 52 N 1.72 0.52 -0.41 0.00 0.00 -1.99 -0.14 119.26 118.95 1wmy h ALA 52 Ca 0.18 -0.20 -0.14 0.00 0.00 0.00 0.00 54.91 54.75 1wmy h ALA 52 Cb 0.03 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1wmy h ALA 52 CO -0.04 0.21 -0.28 1.49 0.00 0.00 0.00 179.25 180.63 1wmy h GLU 53 N 0.49 0.89 -0.07 0.00 4.81 -1.89 -0.53 114.58 118.28 1wmy h GLU 53 Ca 0.12 -0.41 0.04 0.00 -0.13 0.00 0.00 59.36 58.98 1wmy h GLU 53 Cb 0.34 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.65 1wmy h GLU 53 CO 0.01 1.05 -0.39 0.37 -0.73 0.00 0.00 179.01 179.32 1wmy h GLN 54 N 0.76 -0.48 -0.83 1.92 5.75 -1.05 0.52 115.11 121.70 1wmy h GLN 54 Ca 0.09 0.03 -0.03 0.00 -0.15 0.00 0.00 58.65 58.59 1wmy h GLN 54 Cb 0.84 0.11 -0.04 0.00 1.07 0.00 0.00 27.48 29.47 1wmy h GLN 54 CO 0.07 -0.32 0.39 0.00 -2.65 0.00 0.00 178.83 176.32 1wmy h ALA 55 N 0.13 1.07 -0.22 3.38 0.00 -0.90 0.24 119.26 122.95 1wmy h ALA 55 Ca 0.07 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.83 1wmy h ALA 55 Cb 0.62 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1wmy h ALA 55 CO -0.35 0.64 0.11 -0.92 0.00 0.00 0.00 179.25 178.73 1wmy h TYR 56 N 1.18 0.21 -0.16 0.00 5.03 -0.77 0.14 116.97 122.59 1wmy h TYR 56 Ca 0.28 0.01 -0.08 0.00 2.58 0.00 0.00 58.73 61.53 1wmy h TYR 56 Cb 0.13 -0.06 -0.00 0.00 1.55 0.00 0.00 36.73 38.35 1wmy h TYR 56 CO 0.01 0.12 -0.20 0.28 -1.32 0.00 0.00 178.16 177.06 1wmy h VAL 57 N 0.24 1.35 0.21 1.81 2.07 -0.56 -1.38 116.25 119.99 1wmy h VAL 57 Ca 0.09 -1.38 -0.00 0.00 0.82 0.00 0.00 66.70 66.22 1wmy h VAL 57 Cb 0.02 1.87 -0.01 0.00 -1.52 0.00 0.00 31.29 31.65 1wmy h VAL 57 CO -0.06 0.41 -0.16 0.15 0.02 0.00 0.00 177.57 177.93 1wmy h PHE 58 N 0.06 -0.41 -0.33 1.57 3.57 -0.83 -1.52 116.94 119.04 1wmy h PHE 58 Ca 0.02 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.46 1wmy h PHE 58 Cb 0.75 0.15 -0.02 0.00 2.79 0.00 0.00 35.95 39.62 1wmy h PHE 58 CO 0.09 -0.25 -0.03 -0.91 -2.23 0.00 0.00 178.31 174.98 1wmy h ASN 59 N -0.38 0.50 0.06 0.41 2.35 -0.73 -0.82 115.58 116.97 1wmy h ASN 59 Ca -0.01 -0.11 -0.00 0.00 -0.55 0.00 0.00 56.30 55.63 1wmy h ASN 59 Cb 0.33 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.57 1wmy h ASN 59 CO -0.01 0.60 -0.03 0.22 -1.65 0.00 0.00 177.43 176.56 1wmy h TYR 60 N 0.50 -0.08 0.11 1.19 3.20 -1.06 0.43 116.97 121.28 1wmy h TYR 60 Ca 0.10 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 61.98 1wmy h TYR 60 Cb 0.38 0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.65 1wmy h TYR 60 CO 0.01 0.04 -0.17 2.35 -1.64 0.00 0.00 178.16 178.75 1wmy h TRP 61 N -0.17 -0.45 0.00 -3.82 7.01 -0.97 -3.08 115.95 114.47 1wmy h TRP 61 Ca -0.01 0.01 -0.04 0.00 2.11 0.00 0.00 58.89 60.96 1wmy h TRP 61 Cb 0.15 0.18 -0.01 0.00 -2.10 0.00 0.00 29.16 27.39 1wmy h TRP 61 CO -0.04 -0.26 -0.17 0.00 -2.79 0.00 0.00 178.44 175.18 1wmy h ARG 62 N -0.34 0.00 0.00 2.65 2.47 -1.14 0.82 114.38 118.83 1wmy h ARG 62 Ca 0.02 0.00 -0.05 0.00 -1.26 0.00 0.00 59.98 58.69 1wmy h ARG 62 Cb 0.35 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.67 1wmy h ARG 62 CO -0.08 0.17 -0.23 0.78 0.56 0.00 0.00 179.97 181.17 1wmy h GLY 63 N 2.62 0.00 0.00 0.04 0.00 -0.81 -3.30 103.07 101.62 1wmy h GLY 63 Ca -0.00 0.00 -0.40 0.00 0.00 0.00 0.00 47.33 46.93 1wmy h GLY 63 CO 0.02 0.00 -2.49 1.39 0.00 0.00 0.00 176.54 175.46 1wmy n ILE 64 N -3.71 1.50 -3.68 2.60 5.41 -0.85 -4.92 119.36 115.71 1wmy n ILE 64 Ca -0.01 -0.54 -0.39 0.00 1.00 0.00 0.00 62.75 62.81 1wmy n ILE 64 Cb 0.34 -1.50 -0.12 0.00 -0.71 0.00 0.00 39.64 37.66 1wmy n ILE 64 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1wmy s ASP 65 N -6.69 5.50 0.00 4.38 3.68 0.22 -4.92 116.67 118.84 1wmy s ASP 65 Ca -0.36 -1.20 0.26 0.00 2.13 0.00 0.00 52.55 53.38 1wmy s ASP 65 Cb 0.10 -1.94 0.55 0.00 -1.45 0.00 0.00 42.92 40.19 1wmy s ASP 65 CO 0.58 -0.39 1.47 -1.54 0.13 0.00 0.00 175.17 175.41 1wmy n SER 66 N 4.88 2.37 -4.78 -0.34 3.41 -1.26 -4.39 113.62 113.51 1wmy n SER 66 Ca -0.11 -1.79 -0.36 0.00 -0.26 0.00 0.00 58.87 56.34 1wmy n SER 66 Cb 0.45 -0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.38 1wmy n SER 66 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1wmy s GLN 67 N -2.00 3.78 0.24 4.33 -0.21 -1.26 -5.01 119.66 119.53 1wmy s GLN 67 Ca 0.32 1.63 -0.30 0.00 0.02 0.00 0.00 55.36 57.03 1wmy s GLN 67 Cb 0.20 -2.32 -0.10 0.00 1.00 0.00 0.00 33.01 31.79 1wmy s GLN 67 CO 0.31 -0.50 1.50 0.00 -2.12 0.00 0.00 175.29 174.48 1wmy s ALA 68 N -1.67 3.69 0.00 6.09 0.00 -1.26 -4.89 121.76 123.72 1wmy s ALA 68 Ca 0.64 1.39 0.00 0.00 0.00 0.00 0.00 51.96 53.99 1wmy s ALA 68 Cb -0.25 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.28 1wmy s ALA 68 CO 0.30 -0.80 0.00 0.41 0.00 0.00 0.00 175.76 175.67 1wmy n GLY 69 N 2.53 -1.29 3.36 0.00 0.00 -1.26 -5.08 105.19 103.44 1wmy n GLY 69 Ca 0.09 -1.25 -0.18 0.00 0.00 0.00 0.00 46.02 44.68 1wmy n GLY 69 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1wmy s GLN 70 N -2.00 1.42 -0.13 1.61 1.11 -1.26 -2.21 119.66 118.20 1wmy s GLN 70 Ca 0.00 -1.74 -0.00 0.00 0.01 0.00 0.00 55.36 53.63 1wmy s GLN 70 Cb 0.00 -0.64 0.03 0.00 -1.01 0.00 0.00 33.01 31.39 1wmy s GLN 70 CO 0.00 -0.14 -0.09 -1.17 0.01 0.00 0.00 175.29 173.90 1wmy s LEU 71 N -3.35 1.38 0.32 2.90 2.96 -0.75 -1.87 118.68 120.27 1wmy s LEU 71 Ca 0.32 -0.40 -0.29 0.00 -0.22 0.00 0.00 54.13 53.54 1wmy s LEU 71 Cb 0.07 -0.95 -0.11 0.00 0.50 0.00 0.00 46.19 45.70 1wmy s LEU 71 CO 0.11 -0.11 1.42 0.26 -1.32 0.00 0.00 176.35 176.71 1wmy s TRP 72 N 1.63 2.88 0.43 5.38 0.23 0.10 -0.65 118.94 128.95 1wmy s TRP 72 Ca 0.05 1.18 0.05 0.00 -2.03 0.00 0.00 56.10 55.34 1wmy s TRP 72 Cb -0.13 -3.85 -0.06 0.00 0.03 0.00 0.00 33.47 29.46 1wmy s TRP 72 CO -0.09 -2.57 0.01 0.96 0.96 0.00 0.00 176.95 176.23 1wmy s ILE 73 N -0.71 1.68 -0.07 2.03 -4.36 -0.83 -3.79 121.20 115.15 1wmy s ILE 73 Ca 0.54 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.94 1wmy s ILE 73 Cb -0.43 -2.74 0.11 0.00 1.25 0.00 0.00 42.46 40.65 1wmy s ILE 73 CO 0.53 0.00 1.19 0.61 0.24 0.00 0.00 174.94 177.51 1wmy n GLY 74 N -1.03 2.44 3.66 6.27 0.00 -0.16 -4.48 105.19 111.89 1wmy n GLY 74 Ca -0.09 -0.19 -0.35 0.00 0.00 0.00 0.00 46.02 45.40 1wmy n GLY 74 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1wmy s LEU 75 N -0.54 3.77 0.03 0.99 2.96 -1.26 -0.86 118.68 123.78 1wmy s LEU 75 Ca 0.09 0.12 -0.25 0.00 -0.22 0.00 0.00 54.13 53.88 1wmy s LEU 75 Cb 0.08 -1.92 0.06 0.00 0.50 0.00 0.00 46.19 44.90 1wmy s LEU 75 CO 0.02 0.25 0.57 -0.72 -1.32 0.00 0.00 176.35 175.15 1wmy s TYR 76 N -0.11 -0.50 -0.22 5.38 1.13 -0.80 -0.51 117.35 121.71 1wmy s TYR 76 Ca 0.06 0.63 0.18 0.00 -1.41 0.00 0.00 57.07 56.53 1wmy s TYR 76 Cb -0.12 0.39 0.47 0.00 -1.10 0.00 0.00 41.96 41.60 1wmy s TYR 76 CO 0.01 -0.66 1.15 -0.40 -2.51 0.00 0.00 175.55 173.15 1wmy n ASP 77 N 0.46 2.45 -0.08 -0.18 5.75 -0.68 -1.43 116.55 122.85 1wmy n ASP 77 Ca -0.18 -2.69 -0.08 0.00 -0.01 0.00 0.00 54.79 51.83 1wmy n ASP 77 Cb 0.60 -0.42 -0.00 0.00 -1.03 0.00 0.00 41.12 40.27 1wmy n ASP 77 CO 0.00 0.00 0.00 0.50 -0.11 0.00 0.00 177.20 177.59 1wmy h LYS 78 N 2.09 0.22 -0.14 0.11 3.64 -1.91 -3.04 116.57 117.54 1wmy h LYS 78 Ca 0.00 -0.01 -0.21 0.00 -1.27 0.00 0.00 60.65 59.16 1wmy h LYS 78 Cb 1.42 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.19 1wmy h LYS 78 CO 0.32 0.15 -0.74 1.88 -2.27 0.00 0.00 179.45 178.78 1wmy h TYR 79 N 0.23 0.91 -2.87 1.91 -1.99 -1.93 -3.42 116.97 109.82 1wmy h TYR 79 Ca 0.13 -0.39 -0.55 0.00 2.00 0.00 0.00 58.73 59.91 1wmy h TYR 79 Cb 0.10 -0.14 -0.40 0.00 2.00 0.00 0.00 36.73 38.29 1wmy h TYR 79 CO -0.13 1.20 -0.78 -0.80 -0.00 0.00 0.00 178.16 177.65 1wmy s ASN 80 N -7.05 3.61 0.22 3.88 0.01 -1.23 -5.11 114.94 109.26 1wmy s ASN 80 Ca -0.09 -1.53 -0.32 0.00 -0.71 0.00 0.00 52.86 50.21 1wmy s ASN 80 Cb 0.09 -0.52 -0.13 0.00 0.41 0.00 0.00 41.25 41.11 1wmy s ASN 80 CO 0.88 -0.41 1.59 1.21 -1.51 0.00 0.00 177.10 178.86 1wmy n GLU 81 N 4.94 2.42 0.00 -0.60 4.07 -1.15 -1.23 120.64 129.09 1wmy n GLU 81 Ca -0.02 0.87 0.00 0.00 -0.06 0.00 0.00 57.16 57.95 1wmy n GLU 81 Cb 0.41 -2.64 0.00 0.00 -0.06 0.00 0.00 31.44 29.15 1wmy n GLU 81 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1wmy n GLY 82 N 3.10 2.50 3.11 8.31 0.00 -1.26 -4.96 105.19 115.99 1wmy n GLY 82 Ca 0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 1wmy n GLY 82 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1wmy s ASP 83 N -2.41 5.75 0.34 1.61 1.01 -0.37 -5.08 116.67 117.52 1wmy s ASP 83 Ca 0.00 -3.35 -0.27 0.00 0.71 0.00 0.00 52.55 49.63 1wmy s ASP 83 Cb 0.00 -1.90 -0.09 0.00 1.01 0.00 0.00 42.92 41.93 1wmy s ASP 83 CO 0.00 -0.27 1.15 -0.36 0.21 0.00 0.00 175.17 175.90 1wmy s PHE 84 N -0.80 3.30 0.15 4.23 0.08 -1.26 -4.64 117.98 119.04 1wmy s PHE 84 Ca 0.23 1.60 0.05 0.00 0.12 0.00 0.00 56.93 58.94 1wmy s PHE 84 Cb -0.12 -3.37 -0.04 0.00 -0.57 0.00 0.00 43.02 38.92 1wmy s PHE 84 CO -0.09 -1.01 -0.12 0.96 -0.10 0.00 0.00 175.22 174.87 1wmy s ILE 85 N -1.29 1.30 0.02 0.64 -4.36 -0.51 -4.84 121.20 112.16 1wmy s ILE 85 Ca 0.50 -2.00 -0.20 0.00 -0.26 0.00 0.00 60.65 58.69 1wmy s ILE 85 Cb -0.32 -1.80 -0.06 0.00 1.25 0.00 0.00 42.46 41.53 1wmy s ILE 85 CO 0.41 -0.64 0.57 0.26 0.24 0.00 0.00 174.94 175.77 1wmy s TRP 86 N -2.98 3.72 0.46 1.37 0.52 -1.26 -1.91 118.94 118.86 1wmy s TRP 86 Ca 0.16 1.20 0.13 0.00 0.02 0.00 0.00 56.10 57.61 1wmy s TRP 86 Cb 0.00 -2.55 1.04 0.00 -1.15 0.00 0.00 33.47 30.82 1wmy s TRP 86 CO 0.02 0.45 2.05 1.79 0.02 0.00 0.00 176.95 181.28 1wmy h THR 87 N 3.92 1.09 0.00 2.01 1.35 -1.34 -1.93 112.91 118.00 1wmy h THR 87 Ca -0.47 -0.36 0.00 0.00 -0.55 0.00 0.00 66.41 65.03 1wmy h THR 87 Cb 1.21 1.07 0.00 0.00 -1.73 0.00 0.00 68.15 68.70 1wmy h THR 87 CO 0.67 0.11 0.00 -0.90 -0.25 0.00 0.00 175.52 175.15 1wmy n ASP 88 N -4.42 0.00 0.00 5.36 3.85 -1.26 -4.87 116.55 115.21 1wmy n ASP 88 Ca -0.02 -1.12 0.00 0.00 -0.71 0.00 0.00 54.79 52.94 1wmy n ASP 88 Cb 0.17 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 39.94 1wmy n ASP 88 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1wmy n GLY 89 N 0.33 1.98 3.78 6.12 0.00 -0.73 -5.03 105.19 111.64 1wmy n GLY 89 Ca 0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.76 1wmy n GLY 89 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wmy s SER 90 N -3.48 5.57 0.35 1.61 1.04 -1.26 -4.97 113.70 112.56 1wmy s SER 90 Ca 0.00 2.03 -0.26 0.00 0.48 0.00 0.00 55.95 58.20 1wmy s SER 90 Cb 0.00 -2.56 -0.09 0.00 0.10 0.00 0.00 66.02 63.47 1wmy s SER 90 CO 0.00 -1.32 1.01 -0.54 0.98 0.00 0.00 173.24 173.37 1wmy s LYS 91 N -3.71 4.41 -0.28 4.02 1.02 -1.26 -3.99 119.74 119.96 1wmy s LYS 91 Ca 0.69 1.46 -0.28 0.00 0.02 0.00 0.00 55.97 57.86 1wmy s LYS 91 Cb -0.21 -2.73 0.01 0.00 -0.52 0.00 0.00 37.83 34.38 1wmy s LYS 91 CO 0.33 0.09 0.99 0.08 -0.92 0.00 0.00 175.35 175.92 1wmy s VAL 92 N -1.59 4.65 0.00 3.17 1.01 -1.26 -4.88 120.40 121.51 1wmy s VAL 92 Ca 0.53 1.72 0.00 0.00 0.00 0.00 0.00 61.98 64.23 1wmy s VAL 92 Cb -0.21 -4.30 0.00 0.00 0.00 0.00 0.00 36.38 31.86 1wmy s VAL 92 CO 0.27 -0.30 0.00 0.61 0.00 0.00 0.00 175.10 175.68 1wmy n GLY 93 N 3.73 0.15 3.69 4.51 0.00 -1.26 -5.05 105.19 110.96 1wmy n GLY 93 Ca 0.10 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.68 1wmy n GLY 93 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1wmy n TYR 94 N -1.19 2.36 -4.14 1.61 4.19 -1.26 -5.05 117.16 113.68 1wmy n TYR 94 Ca 0.00 0.33 -0.11 0.00 3.31 0.00 0.00 57.90 61.42 1wmy n TYR 94 Cb 0.00 -2.52 -0.10 0.00 0.49 0.00 0.00 39.34 37.20 1wmy n TYR 94 CO 0.00 0.00 0.00 0.95 0.91 0.00 0.00 176.86 178.72 1wmy s THR 95 N 0.31 0.65 -0.37 2.97 -4.23 -1.26 -4.85 115.64 108.86 1wmy s THR 95 Ca 0.71 -1.69 0.13 0.00 -1.18 0.00 0.00 61.69 59.66 1wmy s THR 95 Cb -0.62 -1.37 0.39 0.00 1.34 0.00 0.00 72.50 72.23 1wmy s THR 95 CO 0.45 -0.73 0.93 1.17 -0.54 0.00 0.00 174.62 175.90 1wmy n LYS 96 N 0.40 1.06 -1.94 3.99 4.81 -1.26 -5.08 118.16 120.13 1wmy n LYS 96 Ca -0.15 -2.96 -0.42 0.00 -0.87 0.00 0.00 58.31 53.91 1wmy n LYS 96 Cb 0.59 -1.27 -0.03 0.00 0.02 0.00 0.00 35.03 34.34 1wmy n LYS 96 CO 0.00 0.00 0.00 -1.58 1.17 0.00 0.00 177.40 176.99 1wmy s TRP 97 N -1.99 3.05 0.84 5.64 0.52 -1.26 -0.38 118.94 125.36 1wmy s TRP 97 Ca 0.31 0.63 -0.12 0.00 0.02 0.00 0.00 56.10 56.94 1wmy s TRP 97 Cb 0.38 -3.92 0.10 0.00 -1.15 0.00 0.00 33.47 28.89 1wmy s TRP 97 CO -0.04 -3.39 1.16 0.00 0.02 0.00 0.00 176.95 174.70 1wmy s ALA 98 N 1.20 1.78 0.25 0.98 0.00 -0.64 -4.71 121.76 120.61 1wmy s ALA 98 Ca 0.70 0.63 -0.31 0.00 0.00 0.00 0.00 51.96 52.98 1wmy s ALA 98 Cb -0.43 -3.43 -0.13 0.00 0.00 0.00 0.00 23.12 19.13 1wmy s ALA 98 CO 0.31 -2.36 1.48 0.41 0.00 0.00 0.00 175.76 175.59 1wmy n GLY 99 N 0.06 0.97 2.00 0.00 0.00 -1.26 -1.41 105.19 105.54 1wmy n GLY 99 Ca 0.12 0.50 0.00 0.00 0.00 0.00 0.00 46.02 46.64 1wmy n GLY 99 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wmy n GLY 100 N 2.27 0.60 3.43 -0.02 0.00 -1.26 -5.04 105.19 105.16 1wmy n GLY 100 Ca 0.11 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.86 1wmy n GLY 100 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1wmy s GLN 101 N -0.07 1.54 0.07 1.61 -1.52 -0.50 -3.93 119.66 116.86 1wmy s GLN 101 Ca 0.00 -1.54 -0.27 0.00 -1.95 0.00 0.00 55.36 51.60 1wmy s GLN 101 Cb 0.00 -1.84 -0.06 0.00 -0.22 0.00 0.00 33.01 30.89 1wmy s GLN 101 CO 0.00 0.39 0.83 -1.25 -0.25 0.00 0.00 175.29 175.01 1wmy s PRO 102 N -2.74 4.56 0.00 2.91 0.04 -1.26 -4.67 135.00 133.84 1wmy s PRO 102 Ca 0.22 1.19 0.10 0.00 0.04 0.00 0.00 61.00 62.55 1wmy s PRO 102 Cb -0.08 -3.36 0.05 0.00 0.04 0.00 0.00 34.50 31.15 1wmy s PRO 102 CO 0.10 0.27 0.76 -0.40 0.04 0.00 0.00 177.00 177.78 1wmy n ASP 103 N 2.76 1.65 -3.93 6.66 3.85 -1.25 -5.00 116.55 121.28 1wmy n ASP 103 Ca -0.01 -1.32 -0.29 0.00 -0.71 0.00 0.00 54.79 52.46 1wmy n ASP 103 Cb 0.50 0.17 0.01 0.00 -1.35 0.00 0.00 41.12 40.45 1wmy n ASP 103 CO 0.00 0.00 0.00 -3.20 -1.01 0.00 0.00 177.20 172.99 1wmy n ASN 104 N 0.29 -3.16 -4.63 -1.12 5.15 -1.26 -4.79 115.26 105.74 1wmy n ASN 104 Ca 0.05 -0.86 -0.47 0.00 -0.60 0.00 0.00 54.58 52.71 1wmy n ASN 104 Cb 0.25 -3.62 -0.03 0.00 -0.53 0.00 0.00 39.78 35.85 1wmy n ASN 104 CO 0.00 0.00 0.00 1.87 1.40 0.00 0.00 177.26 180.53 1wmy n TRP 105 N -4.51 1.78 -2.25 1.20 -0.00 -1.26 -0.83 117.44 111.57 1wmy n TRP 105 Ca -0.07 0.54 -0.20 0.00 -0.00 0.00 0.00 57.50 57.76 1wmy n TRP 105 Cb 0.57 -2.38 -0.02 0.00 -0.00 0.00 0.00 31.31 29.48 1wmy n TRP 105 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 177.69 175.98 1wmy n ASN 106 N 2.14 -5.69 -2.43 5.87 5.15 -1.26 -1.72 115.26 117.32 1wmy n ASN 106 Ca 0.13 0.07 -0.11 0.00 -0.60 0.00 0.00 54.58 54.07 1wmy n ASN 106 Cb 0.28 -4.75 -0.01 0.00 -0.53 0.00 0.00 39.78 34.78 1wmy n ASN 106 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1wmy n ASN 107 N -1.74 -3.53 -1.42 1.20 5.15 -0.01 -4.84 115.26 110.07 1wmy n ASN 107 Ca -0.23 0.23 0.02 0.00 -0.60 0.00 0.00 54.58 54.00 1wmy n ASN 107 Cb 0.68 -3.02 0.00 0.00 -0.53 0.00 0.00 39.78 36.91 1wmy n ASN 107 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1wmy n ALA 108 N -2.21 2.60 -4.01 5.20 0.00 -0.70 -5.03 120.51 116.35 1wmy n ALA 108 Ca -0.13 -2.07 -0.31 0.00 0.00 0.00 0.00 53.44 50.93 1wmy n ALA 108 Cb 0.59 -0.67 -0.15 0.00 0.00 0.00 0.00 19.45 19.22 1wmy n ALA 108 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1wmy s GLU 109 N -0.00 1.76 -0.04 0.00 2.02 -1.25 -4.24 118.70 116.94 1wmy s GLU 109 Ca 0.28 -1.47 0.08 0.00 0.02 0.00 0.00 54.97 53.88 1wmy s GLU 109 Cb 0.32 -2.90 0.20 0.00 0.10 0.00 0.00 34.13 31.85 1wmy s GLU 109 CO -0.14 -0.74 1.15 -0.25 0.02 0.00 0.00 175.26 175.30 1wmy n ASP 110 N 4.43 2.57 -3.83 -0.19 10.43 -0.91 -4.49 116.55 124.56 1wmy n ASP 110 Ca -0.06 -2.30 -0.21 0.00 2.57 0.00 0.00 54.79 54.79 1wmy n ASP 110 Cb 0.42 -0.21 -0.17 0.00 1.84 0.00 0.00 41.12 43.01 1wmy n ASP 110 CO 0.00 0.00 0.00 -0.31 -1.07 0.00 0.00 177.20 175.82 1wmy s TYR 111 N -1.53 0.66 0.30 1.24 1.51 -0.90 -1.68 117.35 116.94 1wmy s TYR 111 Ca 0.17 -0.17 -0.15 0.00 -1.01 0.00 0.00 57.07 55.92 1wmy s TYR 111 Cb 0.12 -0.69 -0.09 0.00 -0.11 0.00 0.00 41.96 41.20 1wmy s TYR 111 CO 0.06 -0.24 0.70 0.20 -1.11 0.00 0.00 175.55 175.17 1wmy s GLY 112 N 1.35 2.35 -0.04 0.71 0.00 0.33 -0.04 107.32 111.98 1wmy s GLY 112 Ca -0.04 0.00 -0.26 0.00 0.00 0.00 0.00 44.72 44.41 1wmy s GLY 112 CO -0.02 0.21 0.57 -0.86 0.00 0.00 0.00 173.10 173.00 1wmy s GLN 113 N -2.85 0.95 0.32 2.90 -2.07 -0.48 -1.97 119.66 116.45 1wmy s GLN 113 Ca 0.52 0.13 -0.28 0.00 -1.82 0.00 0.00 55.36 53.92 1wmy s GLN 113 Cb -0.11 0.44 -0.09 0.00 -1.09 0.00 0.00 33.01 32.16 1wmy s GLN 113 CO 0.18 -0.29 1.07 -0.06 -1.32 0.00 0.00 175.29 174.88 1wmy s PHE 114 N -1.22 3.49 0.61 9.60 2.99 0.17 -0.94 117.98 132.68 1wmy s PHE 114 Ca -0.12 1.69 -0.12 0.00 0.00 0.00 0.00 56.93 58.39 1wmy s PHE 114 Cb -0.02 -3.22 -0.04 0.00 0.00 0.00 0.00 43.02 39.74 1wmy s PHE 114 CO 0.08 -0.53 1.02 1.03 -0.00 0.00 0.00 175.22 176.83 1wmy s ARG 115 N -1.79 3.64 0.05 0.44 0.52 -0.22 -1.82 118.95 119.78 1wmy s ARG 115 Ca 0.49 0.79 0.22 0.00 -0.52 0.00 0.00 55.73 56.71 1wmy s ARG 115 Cb -0.28 -2.09 0.92 0.00 0.52 0.00 0.00 34.95 34.02 1wmy s ARG 115 CO 0.36 -0.54 1.71 -2.39 0.02 0.00 0.00 175.30 174.46 1wmy n HIS 116 N -2.58 0.20 -3.55 -0.53 1.44 -0.94 -3.75 115.22 105.52 1wmy n HIS 116 Ca 0.06 0.07 -0.22 0.00 -2.01 0.00 0.00 57.72 55.62 1wmy n HIS 116 Cb 0.54 -0.61 -0.01 0.00 0.12 0.00 0.00 29.99 30.03 1wmy n HIS 116 CO 0.00 0.00 0.00 0.95 -2.81 0.00 0.00 176.34 174.48 1wmy s THR 117 N -3.05 4.78 -1.28 0.61 -4.23 -1.26 -4.71 115.64 106.51 1wmy s THR 117 Ca 0.10 -0.77 -0.15 0.00 -1.18 0.00 0.00 61.69 59.69 1wmy s THR 117 Cb 0.13 -3.71 0.01 0.00 1.34 0.00 0.00 72.50 70.27 1wmy s THR 117 CO 0.42 -0.36 0.58 -0.62 -0.54 0.00 0.00 174.62 174.10 1wmy n GLU 118 N -1.67 -1.67 -1.61 3.99 1.02 -1.26 -1.46 120.64 117.98 1wmy n GLU 118 Ca -0.04 0.33 -0.20 0.00 -0.02 0.00 0.00 57.16 57.22 1wmy n GLU 118 Cb 0.57 -3.87 -0.09 0.00 -0.02 0.00 0.00 31.44 28.03 1wmy n GLU 118 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1wmy n GLY 119 N -1.94 1.89 1.11 0.62 0.00 -1.26 -3.07 105.19 102.54 1wmy n GLY 119 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1wmy n GLY 119 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wmy n GLY 120 N -0.39 0.96 3.69 -0.02 0.00 -0.54 -4.82 105.19 104.07 1wmy n GLY 120 Ca -0.21 -0.50 -0.40 0.00 0.00 0.00 0.00 46.02 44.92 1wmy n GLY 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wmy n ALA 121 N -1.37 1.10 -2.05 4.61 0.00 -1.17 -4.13 120.51 117.49 1wmy n ALA 121 Ca 0.00 0.17 -0.38 0.00 0.00 0.00 0.00 53.44 53.22 1wmy n ALA 121 Cb 0.33 -2.25 -0.06 0.00 0.00 0.00 0.00 19.45 17.46 1wmy n ALA 121 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1wmy s TRP 122 N -1.29 3.83 0.11 0.00 0.51 0.49 -1.05 118.94 121.54 1wmy s TRP 122 Ca 0.67 1.52 0.07 0.00 -2.12 0.00 0.00 56.10 56.25 1wmy s TRP 122 Cb -0.46 -2.69 -0.04 0.00 -0.81 0.00 0.00 33.47 29.47 1wmy s TRP 122 CO 0.53 0.48 -0.17 1.21 -0.51 0.00 0.00 176.95 178.49 1wmy s ASN 123 N -1.27 2.23 -0.02 2.95 2.47 -0.11 -1.62 114.94 119.57 1wmy s ASN 123 Ca 0.37 -0.73 -0.11 0.00 0.42 0.00 0.00 52.86 52.81 1wmy s ASN 123 Cb -0.21 -0.10 -0.05 0.00 -1.45 0.00 0.00 41.25 39.44 1wmy s ASN 123 CO 0.24 -0.04 0.31 1.51 -3.72 0.00 0.00 177.10 175.40 1wmy s ASP 124 N -2.12 6.63 0.30 -4.21 -4.77 -1.26 -1.38 116.67 109.86 1wmy s ASP 124 Ca 0.07 0.75 0.06 0.00 -3.30 0.00 0.00 52.55 50.12 1wmy s ASP 124 Cb -0.08 -2.17 -0.02 0.00 -1.09 0.00 0.00 42.92 39.56 1wmy s ASP 124 CO 0.04 0.32 0.29 -3.20 0.70 0.00 0.00 175.17 173.32 1wmy n ASN 125 N 1.67 -0.74 -5.02 2.11 2.85 0.94 -4.85 115.26 112.22 1wmy n ASN 125 Ca -0.15 -2.95 -0.20 0.00 -0.11 0.00 0.00 54.58 51.18 1wmy n ASN 125 Cb 0.53 1.65 0.04 0.00 1.24 0.00 0.00 39.78 43.25 1wmy n ASN 125 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 1wmy s SER 126 N -3.09 5.19 0.05 1.20 1.04 -1.26 -2.13 113.70 114.70 1wmy s SER 126 Ca 0.35 -0.78 0.20 0.00 0.48 0.00 0.00 55.95 56.20 1wmy s SER 126 Cb 0.01 0.07 0.84 0.00 0.10 0.00 0.00 66.02 67.05 1wmy s SER 126 CO 0.25 -1.18 1.64 0.00 0.98 0.00 0.00 173.24 174.93 1wmy n ALA 127 N -2.10 1.88 1.00 5.32 0.00 -1.26 -2.76 120.51 122.58 1wmy n ALA 127 Ca 0.12 -0.04 0.10 0.00 0.00 0.00 0.00 53.44 53.62 1wmy n ALA 127 Cb 0.61 -1.33 -0.11 0.00 0.00 0.00 0.00 19.45 18.62 1wmy n ALA 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wmy n ALA 128 N -1.56 4.73 -1.64 0.00 0.00 -1.26 -4.77 120.51 116.01 1wmy n ALA 128 Ca 0.04 -0.60 -0.33 0.00 0.00 0.00 0.00 53.44 52.56 1wmy n ALA 128 Cb 0.24 -0.78 0.02 0.00 0.00 0.00 0.00 19.45 18.93 1wmy n ALA 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wmy s ALA 129 N -2.99 2.66 0.04 0.00 0.00 -1.11 -4.99 121.76 115.36 1wmy s ALA 129 Ca 0.08 0.52 0.09 0.00 0.00 0.00 0.00 51.96 52.66 1wmy s ALA 129 Cb 0.16 -3.28 -0.03 0.00 0.00 0.00 0.00 23.12 19.97 1wmy s ALA 129 CO 0.86 -0.91 -0.26 -0.65 0.00 0.00 0.00 175.76 174.80 1wmy s GLN 130 N -3.89 1.80 0.24 0.00 -0.21 -1.26 -4.22 119.66 112.12 1wmy s GLN 130 Ca 0.66 -1.09 -0.21 0.00 0.02 0.00 0.00 55.36 54.75 1wmy s GLN 130 Cb -0.19 -1.96 0.03 0.00 1.00 0.00 0.00 33.01 31.90 1wmy s GLN 130 CO 0.35 0.51 0.65 0.00 -2.12 0.00 0.00 175.29 174.68 1wmy s ALA 131 N -0.79 -1.23 1.03 6.09 0.00 -0.36 -4.82 121.76 121.68 1wmy s ALA 131 Ca 0.11 -0.12 -0.16 0.00 0.00 0.00 0.00 51.96 51.79 1wmy s ALA 131 Cb -0.10 0.87 0.21 0.00 0.00 0.00 0.00 23.12 24.10 1wmy s ALA 131 CO 0.02 -0.93 1.18 0.15 0.00 0.00 0.00 175.76 176.18 1wmy s LYS 132 N -3.88 0.14 0.13 0.00 -0.14 -0.78 -0.71 119.74 114.50 1wmy s LYS 132 Ca 0.09 -0.02 -0.12 0.00 -1.36 0.00 0.00 55.97 54.56 1wmy s LYS 132 Cb -0.04 -1.75 0.01 0.00 -1.68 0.00 0.00 37.83 34.37 1wmy s LYS 132 CO 0.01 -2.81 0.31 1.52 -0.76 0.00 0.00 175.35 173.62 1wmy s TYR 133 N -3.34 0.09 -0.02 3.18 1.13 -1.12 0.03 117.35 117.29 1wmy s TYR 133 Ca 0.69 -0.46 0.01 0.00 -1.41 0.00 0.00 57.07 55.90 1wmy s TYR 133 Cb -0.10 0.08 0.01 0.00 -1.10 0.00 0.00 41.96 40.85 1wmy s TYR 133 CO 0.54 -0.68 -0.03 1.41 -2.51 0.00 0.00 175.55 174.28 1wmy s MET 134 N -3.88 0.45 0.25 -3.49 1.75 -1.25 -1.03 119.30 112.11 1wmy s MET 134 Ca 0.08 -0.07 0.07 0.00 -1.25 0.00 0.00 55.69 54.53 1wmy s MET 134 Cb 0.03 -0.51 -0.04 0.00 2.84 0.00 0.00 34.83 37.15 1wmy s MET 134 CO -0.07 -0.02 0.17 0.00 -0.65 0.00 0.00 175.02 174.45 1wmy s LYS 136 N -3.80 0.11 -0.10 0.00 2.20 0.33 -1.33 119.74 117.15 1wmy s LYS 136 Ca 0.33 0.13 -0.10 0.00 -0.36 0.00 0.00 55.97 55.96 1wmy s LYS 136 Cb -0.08 0.05 -0.05 0.00 -1.51 0.00 0.00 37.83 36.25 1wmy s LYS 136 CO 0.24 -0.01 0.23 -0.51 -0.36 0.00 0.00 175.35 174.94 1wmy s LEU 137 N 0.05 4.38 -0.11 5.43 1.43 0.20 -1.95 118.68 128.11 1wmy s LEU 137 Ca -0.00 0.59 0.01 0.00 -1.03 0.00 0.00 54.13 53.70 1wmy s LEU 137 Cb -0.01 -2.25 0.02 0.00 0.03 0.00 0.00 46.19 43.99 1wmy s LEU 137 CO 0.00 0.34 -0.13 -0.89 0.23 0.00 0.00 176.35 175.89 1wmy s THR 138 N -0.77 1.40 -0.70 5.49 2.01 0.20 -3.55 115.64 119.72 1wmy s THR 138 Ca 0.17 -0.56 -0.22 0.00 0.31 0.00 0.00 61.69 61.38 1wmy s THR 138 Cb -0.13 -1.31 0.08 0.00 0.01 0.00 0.00 72.50 71.15 1wmy s THR 138 CO 0.06 0.42 0.99 -0.36 -0.69 0.00 0.00 174.62 175.05 1wmy s PHE 139 N 1.19 2.72 -2.82 4.92 0.40 -1.26 -1.14 117.98 121.99 1wmy s PHE 139 Ca -0.03 -0.65 0.25 0.00 -0.60 0.00 0.00 56.93 55.91 1wmy s PHE 139 Cb -0.14 -4.30 0.50 0.00 0.51 0.00 0.00 43.02 39.59 1wmy s PHE 139 CO -0.04 -1.64 1.43 0.39 0.70 0.00 0.00 175.22 176.06