#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 2.72 -2.59 1.20 3.00 -1.26 -5.01 117.38 115.44 1wmy n GLN 2 Ca 0.00 -3.05 -0.35 0.00 -0.01 0.00 0.00 57.00 53.59 1wmy n GLN 2 Cb 0.00 -1.99 -0.04 0.00 0.00 0.00 0.00 30.24 28.20 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 -0.48 0.62 -1.79 0.00 -0.02 -1.26 -4.88 135.00 127.18 1wmy n PRO 4 Ca 0.07 0.27 -0.39 0.00 -2.02 0.00 0.00 63.50 61.42 1wmy n PRO 4 Cb 0.51 -2.27 0.03 0.00 -0.02 0.00 0.00 33.50 31.75 1wmy n PRO 4 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1wmy s THR 5 N -1.74 2.06 0.00 3.45 -4.23 -1.26 -1.64 115.64 112.29 1wmy s THR 5 Ca 0.75 0.05 0.00 0.00 -1.18 0.00 0.00 61.69 61.31 1wmy s THR 5 Cb -0.36 -3.03 0.00 0.00 1.34 0.00 0.00 72.50 70.45 1wmy s THR 5 CO 0.48 0.00 0.00 0.47 -0.54 0.00 0.00 174.62 175.04 1wmy n ASP 6 N -0.49 -3.14 -4.52 3.99 8.00 -1.26 -5.03 116.55 114.09 1wmy n ASP 6 Ca 0.07 0.00 -0.33 0.00 0.71 0.00 0.00 54.79 55.24 1wmy n ASP 6 Cb 0.43 -1.39 -0.12 0.00 -0.02 0.00 0.00 41.12 40.02 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 -1.94 2.80 -0.04 1.24 0.52 -0.65 -4.81 118.94 116.06 1wmy s TRP 7 Ca 0.00 -0.08 -0.14 0.00 0.02 0.00 0.00 56.10 55.90 1wmy s TRP 7 Cb 0.00 -1.66 -0.05 0.00 -1.15 0.00 0.00 33.47 30.61 1wmy s TRP 7 CO 0.00 0.25 0.36 -1.21 0.02 0.00 0.00 176.95 176.37 1wmy s GLU 8 N -0.80 3.89 0.03 4.98 0.41 0.13 -4.72 118.70 122.63 1wmy s GLU 8 Ca 0.12 0.30 -0.18 0.00 -0.41 0.00 0.00 54.97 54.81 1wmy s GLU 8 Cb -0.11 -3.24 -0.06 0.00 -1.78 0.00 0.00 34.13 28.94 1wmy s GLU 8 CO 0.01 0.64 0.51 0.00 -0.49 0.00 0.00 175.26 175.94 1wmy s ALA 9 N -0.86 3.61 -0.30 5.21 0.00 -1.26 -0.41 121.76 127.75 1wmy s ALA 9 Ca 0.22 -0.06 -0.09 0.00 0.00 0.00 0.00 51.96 52.03 1wmy s ALA 9 Cb -0.16 -2.56 0.16 0.00 0.00 0.00 0.00 23.12 20.57 1wmy s ALA 9 CO 0.11 0.39 0.76 -2.00 0.00 0.00 0.00 175.76 175.02 1wmy s GLU 10 N -0.95 0.46 5.50 0.00 2.56 -0.65 -4.99 118.70 120.63 1wmy s GLU 10 Ca 0.27 1.03 0.00 0.00 0.00 0.00 0.00 54.97 56.27 1wmy s GLU 10 Cb -0.18 0.60 0.00 0.00 2.00 0.00 0.00 34.13 36.55 1wmy s GLU 10 CO 0.17 -0.30 0.00 0.41 -0.56 0.00 0.00 175.26 174.98 1wmy n GLY 11 N 5.34 2.23 1.20 -1.50 0.00 -1.26 -2.18 105.19 109.01 1wmy n GLY 11 Ca -0.08 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.43 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 2.10 3.15 -4.25 1.61 8.00 -1.26 -4.92 116.55 120.98 1wmy n ASP 12 Ca 0.00 -2.47 -0.14 0.00 0.71 0.00 0.00 54.79 52.89 1wmy n ASP 12 Cb 0.00 -0.60 -0.10 0.00 -0.02 0.00 0.00 41.12 40.40 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 -1.72 1.25 0.07 1.24 3.76 -0.93 -4.59 115.29 114.37 1wmy s HIS 13 Ca 0.24 -0.91 0.10 0.00 -0.15 0.00 0.00 55.06 54.34 1wmy s HIS 13 Cb 0.19 -0.70 -0.03 0.00 1.11 0.00 0.00 32.58 33.15 1wmy s HIS 13 CO 0.07 -0.08 -0.26 0.00 -0.85 0.00 0.00 174.74 173.61 1wmy s TYR 15 N -0.87 1.15 -0.15 0.00 1.51 0.45 -0.18 117.35 119.27 1wmy s TYR 15 Ca 0.12 -0.43 -0.07 0.00 -1.01 0.00 0.00 57.07 55.69 1wmy s TYR 15 Cb -0.10 -0.66 0.06 0.00 -0.11 0.00 0.00 41.96 41.15 1wmy s TYR 15 CO 0.03 0.04 0.33 0.50 -1.11 0.00 0.00 175.55 175.33 1wmy s ARG 16 N -1.53 0.27 -0.20 -0.62 3.52 -0.47 0.18 118.95 120.10 1wmy s ARG 16 Ca -0.02 0.75 -0.15 0.00 -0.13 0.00 0.00 55.73 56.19 1wmy s ARG 16 Cb -0.09 0.01 -0.04 0.00 -1.56 0.00 0.00 34.95 33.27 1wmy s ARG 16 CO 0.02 -0.21 0.34 0.12 -0.81 0.00 0.00 175.30 174.76 1wmy s PHE 17 N 1.84 3.38 -0.32 5.12 5.36 -1.26 -1.00 117.98 131.10 1wmy s PHE 17 Ca -0.05 0.55 -0.10 0.00 -0.96 0.00 0.00 56.93 56.37 1wmy s PHE 17 Cb -0.11 -2.46 -0.01 0.00 -0.34 0.00 0.00 43.02 40.11 1wmy s PHE 17 CO -0.11 0.04 0.17 -0.06 -1.46 0.00 0.00 175.22 173.80 1wmy s PHE 18 N 1.13 3.19 -1.30 10.12 0.08 -0.05 -5.02 117.98 126.13 1wmy s PHE 18 Ca 0.17 -0.56 -0.07 0.00 0.12 0.00 0.00 56.93 56.59 1wmy s PHE 18 Cb -0.14 -2.38 0.14 0.00 -0.57 0.00 0.00 43.02 40.07 1wmy s PHE 18 CO 0.07 -0.46 2.18 -1.71 -0.10 0.00 0.00 175.22 175.20 1wmy n ASN 19 N 5.00 6.91 -3.70 1.36 5.15 -1.26 -3.12 115.26 125.60 1wmy n ASN 19 Ca -0.14 -3.13 -0.11 0.00 -0.60 0.00 0.00 54.58 50.60 1wmy n ASN 19 Cb 0.49 -1.40 -0.12 0.00 -0.53 0.00 0.00 39.78 38.22 1wmy n ASN 19 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1wmy s THR 20 N -0.60 -0.11 0.20 -0.44 2.01 -1.26 -5.09 115.64 110.35 1wmy s THR 20 Ca 0.48 0.14 -0.30 0.00 0.31 0.00 0.00 61.69 62.32 1wmy s THR 20 Cb 0.15 -0.50 -0.09 0.00 0.01 0.00 0.00 72.50 72.06 1wmy s THR 20 CO -0.05 0.06 1.39 -0.76 -0.69 0.00 0.00 174.62 174.57 1wmy s LEU 21 N 1.51 4.39 0.26 4.42 1.43 -1.26 -4.19 118.68 125.24 1wmy s LEU 21 Ca -0.08 2.51 -0.20 0.00 -1.03 0.00 0.00 54.13 55.32 1wmy s LEU 21 Cb -0.10 -3.61 0.06 0.00 0.03 0.00 0.00 46.19 42.57 1wmy s LEU 21 CO -0.11 -0.64 0.91 0.28 0.23 0.00 0.00 176.35 177.02 1wmy s THR 22 N 0.31 0.00 0.63 5.49 -1.32 -0.30 -4.89 115.64 115.56 1wmy s THR 22 Ca 0.60 -0.79 -0.11 0.00 -1.21 0.00 0.00 61.69 60.18 1wmy s THR 22 Cb -0.39 -2.65 -0.03 0.00 -1.51 0.00 0.00 72.50 67.92 1wmy s THR 22 CO 0.38 0.00 1.04 0.42 -2.21 0.00 0.00 174.62 174.25 1wmy s THR 23 N -2.58 4.52 0.15 5.08 -4.23 -1.26 -1.48 115.64 115.84 1wmy s THR 23 Ca 0.17 0.84 -0.16 0.00 -1.18 0.00 0.00 61.69 61.36 1wmy s THR 23 Cb -0.04 -3.74 0.01 0.00 1.34 0.00 0.00 72.50 70.08 1wmy s THR 23 CO 0.07 -1.04 1.79 -0.25 -0.54 0.00 0.00 174.62 174.65 1wmy h TRP 24 N -0.34 0.39 -0.91 3.99 7.01 -1.83 0.09 115.95 124.34 1wmy h TRP 24 Ca -0.44 0.01 0.01 0.00 2.11 0.00 0.00 58.89 60.59 1wmy h TRP 24 Cb 1.20 -0.12 -0.05 0.00 -2.10 0.00 0.00 29.16 28.09 1wmy h TRP 24 CO 0.65 0.22 0.60 0.93 -2.79 0.00 0.00 178.44 178.05 1wmy h GLU 25 N 0.43 1.19 -0.38 2.65 5.08 -1.94 0.18 114.58 121.78 1wmy h GLU 25 Ca 0.15 -0.07 -0.15 0.00 -1.00 0.00 0.00 59.36 58.29 1wmy h GLU 25 Cb 0.02 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 29.00 1wmy h GLU 25 CO -0.08 0.78 -0.34 -0.97 -1.00 0.00 0.00 179.01 177.40 1wmy h ASN 26 N 1.22 0.92 -0.35 1.42 -1.24 -1.89 -2.19 115.58 113.47 1wmy h ASN 26 Ca 0.34 -0.40 -0.05 0.00 0.71 0.00 0.00 56.30 56.90 1wmy h ASN 26 Cb -0.11 -0.26 -0.02 0.00 0.73 0.00 0.00 38.32 38.66 1wmy h ASN 26 CO -0.08 1.17 0.05 0.00 -1.29 0.00 0.00 177.43 177.28 1wmy h ALA 27 N 0.88 1.28 0.04 1.57 0.00 -0.19 -0.32 119.26 122.52 1wmy h ALA 27 Ca 0.07 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1wmy h ALA 27 Cb 0.91 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1wmy h ALA 27 CO 0.08 0.49 -0.02 1.25 0.00 0.00 0.00 179.25 181.06 1wmy h HIS 28 N 0.65 -0.05 -0.52 0.00 -0.00 -0.48 -1.37 115.15 113.37 1wmy h HIS 28 Ca 0.14 -0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 60.50 1wmy h HIS 28 Cb 0.33 0.02 -0.02 0.00 -0.00 0.00 0.00 27.41 27.73 1wmy h HIS 28 CO 0.01 0.08 0.29 0.45 -0.00 0.00 0.00 177.93 178.76 1wmy h HIS 29 N -0.17 0.72 -0.85 5.26 -0.00 -1.14 -1.29 115.15 117.68 1wmy h HIS 29 Ca -0.01 -0.02 -0.02 0.00 -0.00 0.00 0.00 60.37 60.32 1wmy h HIS 29 Cb 0.15 -0.23 -0.04 0.00 -0.00 0.00 0.00 27.41 27.29 1wmy h HIS 29 CO -0.04 0.53 0.43 0.93 -0.00 0.00 0.00 177.93 179.78 1wmy h GLU 30 N 0.70 1.20 -0.36 2.45 4.39 -0.80 -0.66 114.58 121.50 1wmy h GLU 30 Ca 0.18 -0.16 -0.16 0.00 0.34 0.00 0.00 59.36 59.57 1wmy h GLU 30 Cb 0.05 -0.23 -0.01 0.00 -0.10 0.00 0.00 28.75 28.47 1wmy h GLU 30 CO -0.03 0.90 -0.41 0.00 -1.16 0.00 0.00 179.01 178.31 1wmy h VAL 32 N 0.73 0.99 0.00 0.00 2.07 -0.79 -2.50 116.25 116.74 1wmy h VAL 32 Ca 0.05 -1.29 0.00 0.00 0.82 0.00 0.00 66.70 66.28 1wmy h VAL 32 Cb 1.00 1.75 0.00 0.00 -1.52 0.00 0.00 31.29 32.52 1wmy h VAL 32 CO 0.10 0.33 0.00 -1.54 0.02 0.00 0.00 177.57 176.48 1wmy n SER 33 N -3.76 0.26 -0.84 0.57 3.41 -0.30 -1.81 113.62 111.16 1wmy n SER 33 Ca -0.01 0.60 0.10 0.00 -0.26 0.00 0.00 58.87 59.29 1wmy n SER 33 Cb 0.43 -0.64 0.27 0.00 -0.26 0.00 0.00 64.21 64.01 1wmy n SER 33 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1wmy n TYR 34 N -1.83 0.47 -1.64 7.33 4.02 -0.94 -4.96 117.16 119.61 1wmy n TYR 34 Ca 0.01 -0.23 -0.33 0.00 -0.01 0.00 0.00 57.90 57.33 1wmy n TYR 34 Cb 0.09 0.00 0.06 0.00 -0.02 0.00 0.00 39.34 39.47 1wmy n TYR 34 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 1wmy s SER 35 N -1.30 4.86 -0.31 7.72 0.01 -0.75 -4.65 113.70 119.27 1wmy s SER 35 Ca 0.34 2.05 -0.02 0.00 1.31 0.00 0.00 55.95 59.62 1wmy s SER 35 Cb 0.18 -2.56 0.10 0.00 0.21 0.00 0.00 66.02 63.96 1wmy s SER 35 CO 0.26 -1.80 0.13 0.00 0.41 0.00 0.00 173.24 172.23 1wmy h SER 37 N 8.11 0.50 0.49 0.00 4.64 -1.96 -1.15 113.55 124.17 1wmy h SER 37 Ca -0.15 -0.14 -0.03 0.00 -0.47 0.00 0.00 61.79 61.01 1wmy h SER 37 Cb 1.00 -0.13 -0.00 0.00 -0.31 0.00 0.00 62.40 62.96 1wmy h SER 37 CO 0.44 0.68 -0.13 0.71 -0.87 0.00 0.00 176.83 177.65 1wmy h THR 38 N 0.47 0.52 -0.43 2.95 1.35 -1.95 -2.27 112.91 113.55 1wmy h THR 38 Ca 0.08 -0.63 0.00 0.00 -0.55 0.00 0.00 66.41 65.31 1wmy h THR 38 Cb 0.53 1.42 0.00 0.00 -1.73 0.00 0.00 68.15 68.37 1wmy h THR 38 CO 0.03 0.13 0.00 0.18 -0.25 0.00 0.00 175.52 175.61 1wmy n LEU 39 N -3.55 3.54 -3.42 3.87 4.77 -1.02 -4.98 117.00 116.21 1wmy n LEU 39 Ca -0.01 -2.25 -0.25 0.00 -0.03 0.00 0.00 56.01 53.47 1wmy n LEU 39 Cb 0.27 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 40.99 1wmy n LEU 39 CO 0.30 0.77 -0.01 0.59 -1.33 0.00 0.00 177.39 177.71 1wmy n ASN 40 N 0.59 -4.20 -4.66 -1.43 3.02 -0.85 -4.80 115.26 102.92 1wmy n ASN 40 Ca 0.17 -0.45 -0.37 0.00 -0.03 0.00 0.00 54.58 53.90 1wmy n ASN 40 Cb 0.61 -3.44 -0.09 0.00 -0.61 0.00 0.00 39.78 36.25 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 -3.03 5.29 -0.23 2.41 1.01 -0.49 -1.45 120.40 123.91 1wmy s VAL 41 Ca 0.43 0.41 -0.06 0.00 0.00 0.00 0.00 61.98 62.76 1wmy s VAL 41 Cb -0.22 -3.60 -0.02 0.00 0.00 0.00 0.00 36.38 32.53 1wmy s VAL 41 CO 0.54 0.30 0.04 -0.13 0.00 0.00 0.00 175.10 175.84 1wmy s ARG 42 N 1.22 3.62 -0.05 2.72 1.81 -0.22 -1.51 118.95 126.53 1wmy s ARG 42 Ca 0.12 -0.50 -0.02 0.00 -1.72 0.00 0.00 55.73 53.61 1wmy s ARG 42 Cb -0.14 -3.22 -0.04 0.00 -0.45 0.00 0.00 34.95 31.10 1wmy s ARG 42 CO 0.06 -0.13 0.08 0.45 -0.68 0.00 0.00 175.30 175.08 1wmy s SER 43 N 1.42 5.75 0.25 0.23 0.15 -1.26 -0.50 113.70 119.74 1wmy s SER 43 Ca 0.05 0.22 -0.22 0.00 0.70 0.00 0.00 55.95 56.71 1wmy s SER 43 Cb -0.15 -1.70 0.03 0.00 -1.71 0.00 0.00 66.02 62.49 1wmy s SER 43 CO 0.02 0.33 0.73 -0.62 1.20 0.00 0.00 173.24 174.90 1wmy s ASP 44 N -1.39 -0.29 0.52 5.45 3.68 -0.69 -3.93 116.67 120.03 1wmy s ASP 44 Ca 0.19 -0.52 -0.22 0.00 2.13 0.00 0.00 52.55 54.13 1wmy s ASP 44 Cb -0.12 0.69 -0.06 0.00 -1.45 0.00 0.00 42.92 41.97 1wmy s ASP 44 CO 0.09 -1.25 1.24 0.18 0.13 0.00 0.00 175.17 175.55 1wmy n LEU 45 N -0.45 4.59 -4.66 -1.34 4.77 -1.26 -0.61 117.00 118.03 1wmy n LEU 45 Ca -0.06 0.98 -0.46 0.00 -0.03 0.00 0.00 56.01 56.45 1wmy n LEU 45 Cb 0.60 -1.51 -0.03 0.00 -2.33 0.00 0.00 43.42 40.15 1wmy n LEU 45 CO 0.14 -0.91 1.04 0.55 -1.33 0.00 0.00 177.39 176.89 1wmy n VAL 46 N -0.92 0.61 -4.18 4.08 3.14 -0.54 -4.24 118.33 116.28 1wmy n VAL 46 Ca 0.10 -0.15 -0.31 0.00 -2.96 0.00 0.00 64.34 61.02 1wmy n VAL 46 Cb 0.43 -1.42 -0.08 0.00 -1.06 0.00 0.00 33.84 31.71 1wmy n VAL 46 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 1wmy s SER 47 N 0.47 5.05 -0.14 6.55 1.04 -1.26 -1.10 113.70 124.31 1wmy s SER 47 Ca 0.72 -0.12 0.00 0.00 0.48 0.00 0.00 55.95 57.03 1wmy s SER 47 Cb -0.69 -1.24 0.02 0.00 0.10 0.00 0.00 66.02 64.22 1wmy s SER 47 CO 0.46 0.21 -0.12 -0.69 0.98 0.00 0.00 173.24 174.08 1wmy s VAL 48 N -1.24 1.39 -0.18 5.02 1.01 -1.26 -5.03 120.40 120.12 1wmy s VAL 48 Ca 0.24 -0.52 0.02 0.00 0.00 0.00 0.00 61.98 61.71 1wmy s VAL 48 Cb -0.12 -1.34 0.03 0.00 0.00 0.00 0.00 36.38 34.95 1wmy s VAL 48 CO 0.16 0.43 0.77 1.41 0.00 0.00 0.00 175.10 177.86 1wmy n HIS 49 N 4.83 0.03 -3.54 5.22 8.25 -1.26 -4.47 115.22 124.28 1wmy n HIS 49 Ca -0.15 -0.22 -0.08 0.00 -0.26 0.00 0.00 57.72 57.01 1wmy n HIS 49 Cb 0.50 -0.02 -0.02 0.00 1.12 0.00 0.00 29.99 31.57 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 -0.52 -0.34 0.32 0.41 1.04 -1.26 -4.59 113.70 108.76 1wmy s SER 50 Ca 0.03 -0.07 0.03 0.00 0.48 0.00 0.00 55.95 56.41 1wmy s SER 50 Cb 0.02 0.41 0.62 0.00 0.10 0.00 0.00 66.02 67.17 1wmy s SER 50 CO 0.02 -0.69 1.91 0.00 0.98 0.00 0.00 173.24 175.47 1wmy h ALA 51 N 2.00 1.60 -0.44 5.32 0.00 -1.97 -0.89 119.26 124.87 1wmy h ALA 51 Ca -0.23 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.56 1wmy h ALA 51 Cb 1.24 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 1wmy h ALA 51 CO 0.30 0.25 -0.14 0.00 0.00 0.00 0.00 179.25 179.67 1wmy h ALA 52 N 1.55 0.93 -0.38 0.00 0.00 -1.99 -1.10 119.26 118.27 1wmy h ALA 52 Ca 0.38 -0.34 -0.16 0.00 0.00 0.00 0.00 54.91 54.80 1wmy h ALA 52 Cb 0.29 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1wmy h ALA 52 CO -0.15 0.62 -0.38 1.49 0.00 0.00 0.00 179.25 180.83 1wmy h GLU 53 N 0.73 0.93 -0.23 0.00 4.81 -1.83 -1.11 114.58 117.88 1wmy h GLU 53 Ca 0.12 -0.49 0.06 0.00 -0.13 0.00 0.00 59.36 58.91 1wmy h GLU 53 Cb 0.64 0.02 -0.07 0.00 0.63 0.00 0.00 28.75 29.96 1wmy h GLU 53 CO 0.04 1.15 -0.29 0.37 -0.73 0.00 0.00 179.01 179.55 1wmy h GLN 54 N 0.75 -0.30 -0.51 1.92 5.75 -1.02 -1.09 115.11 120.61 1wmy h GLN 54 Ca 0.06 0.02 0.02 0.00 -0.15 0.00 0.00 58.65 58.60 1wmy h GLN 54 Cb 0.98 0.07 -0.03 0.00 1.07 0.00 0.00 27.48 29.56 1wmy h GLN 54 CO 0.09 -0.20 0.32 0.00 -2.65 0.00 0.00 178.83 176.40 1wmy h ALA 55 N 0.63 0.66 0.23 3.38 0.00 -1.12 0.65 119.26 123.69 1wmy h ALA 55 Ca 0.13 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1wmy h ALA 55 Cb 0.51 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1wmy h ALA 55 CO -0.40 0.05 -0.23 -0.92 0.00 0.00 0.00 179.25 177.74 1wmy h TYR 56 N 0.65 -0.61 -0.13 0.00 5.03 -1.01 0.15 116.97 121.05 1wmy h TYR 56 Ca 0.20 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.51 1wmy h TYR 56 Cb -0.02 0.24 -0.01 0.00 1.55 0.00 0.00 36.73 38.49 1wmy h TYR 56 CO -0.05 -0.34 0.08 0.28 -1.32 0.00 0.00 178.16 176.81 1wmy h VAL 57 N -0.50 1.05 -0.12 1.81 2.07 -1.04 -1.01 116.25 118.51 1wmy h VAL 57 Ca -0.00 -0.10 0.04 0.00 0.82 0.00 0.00 66.70 67.45 1wmy h VAL 57 Cb 0.46 0.89 -0.04 0.00 -1.52 0.00 0.00 31.29 31.08 1wmy h VAL 57 CO -0.06 0.04 -0.12 0.15 0.02 0.00 0.00 177.57 177.61 1wmy h PHE 58 N 0.16 -0.30 0.00 1.57 3.57 -0.73 -0.92 116.94 120.29 1wmy h PHE 58 Ca 0.05 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.49 1wmy h PHE 58 Cb 0.00 0.15 -0.01 0.00 2.79 0.00 0.00 35.95 38.88 1wmy h PHE 58 CO -0.06 -0.18 -0.35 -0.91 -2.23 0.00 0.00 178.31 174.58 1wmy h ASN 59 N -0.14 0.00 0.03 0.41 2.35 -0.57 -0.46 115.58 117.20 1wmy h ASN 59 Ca 0.08 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.83 1wmy h ASN 59 Cb 0.27 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.64 1wmy h ASN 59 CO -0.21 0.35 -0.02 0.22 -1.65 0.00 0.00 177.43 176.13 1wmy h TYR 60 N 0.00 -0.04 0.21 1.19 3.20 -0.95 -0.67 116.97 119.91 1wmy h TYR 60 Ca -0.00 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 61.88 1wmy h TYR 60 Cb 0.69 0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.93 1wmy h TYR 60 CO 0.00 0.48 -0.43 2.35 -1.64 0.00 0.00 178.16 178.92 1wmy h TRP 61 N -0.59 -1.21 0.00 -3.82 7.01 -1.03 -2.75 115.95 113.55 1wmy h TRP 61 Ca -0.00 0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.02 1wmy h TRP 61 Cb 0.54 0.50 0.00 0.00 -2.10 0.00 0.00 29.16 28.11 1wmy h TRP 61 CO 0.11 -0.55 0.00 0.54 -2.79 0.00 0.00 178.44 175.75 1wmy n ARG 62 N -5.48 0.21 0.21 2.65 5.12 -0.19 -0.67 116.66 118.50 1wmy n ARG 62 Ca -0.08 0.34 0.07 0.00 -1.93 0.00 0.00 57.85 56.25 1wmy n ARG 62 Cb 0.39 -1.83 0.46 0.00 -1.16 0.00 0.00 32.46 30.32 1wmy n ARG 62 CO 0.00 0.00 0.00 0.78 -1.93 0.00 0.00 177.63 176.48 1wmy h GLY 63 N 3.04 0.00 0.00 -0.13 0.00 -0.81 -3.34 103.07 101.84 1wmy h GLY 63 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 47.33 46.88 1wmy h GLY 63 CO 0.00 0.00 -2.54 1.39 0.00 0.00 0.00 176.54 175.39 1wmy n ILE 64 N -3.70 1.52 -3.45 2.60 2.08 -0.79 -4.96 119.36 112.66 1wmy n ILE 64 Ca -0.01 -0.44 -0.40 0.00 0.56 0.00 0.00 62.75 62.46 1wmy n ILE 64 Cb 0.40 -1.75 -0.10 0.00 -0.75 0.00 0.00 39.64 37.45 1wmy n ILE 64 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 1wmy s ASP 65 N -7.22 6.15 0.01 4.38 3.68 0.15 -4.95 116.67 118.88 1wmy s ASP 65 Ca -0.38 -0.09 0.22 0.00 2.13 0.00 0.00 52.55 54.44 1wmy s ASP 65 Cb 0.13 -2.18 -0.10 0.00 -1.45 0.00 0.00 42.92 39.33 1wmy s ASP 65 CO 0.52 -0.23 0.92 -1.54 0.13 0.00 0.00 175.17 174.97 1wmy n SER 66 N 5.27 0.67 -4.77 -0.34 3.41 -1.26 -4.50 113.62 112.10 1wmy n SER 66 Ca -0.10 -0.53 -0.39 0.00 -0.26 0.00 0.00 58.87 57.59 1wmy n SER 66 Cb 0.50 1.04 -0.03 0.00 -0.26 0.00 0.00 64.21 65.46 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 -3.15 4.27 0.41 4.33 -0.21 -1.26 -5.02 119.66 119.03 1wmy s GLN 67 Ca 0.04 1.89 -0.27 0.00 0.02 0.00 0.00 55.36 57.05 1wmy s GLN 67 Cb 0.15 -2.88 -0.10 0.00 1.00 0.00 0.00 33.01 31.19 1wmy s GLN 67 CO 0.84 -0.15 1.46 0.00 -2.12 0.00 0.00 175.29 175.32 1wmy s ALA 68 N -1.31 3.41 0.00 6.09 0.00 -1.26 -4.92 121.76 123.77 1wmy s ALA 68 Ca 0.52 1.52 0.00 0.00 0.00 0.00 0.00 51.96 54.00 1wmy s ALA 68 Cb -0.32 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.20 1wmy s ALA 68 CO 0.42 -1.12 0.00 0.41 0.00 0.00 0.00 175.76 175.47 1wmy n GLY 69 N 0.52 -1.52 3.66 0.00 0.00 -1.26 -5.08 105.19 101.51 1wmy n GLY 69 Ca 0.03 -1.44 -0.25 0.00 0.00 0.00 0.00 46.02 44.36 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 -1.86 2.12 -0.19 1.61 1.11 -1.26 -2.16 119.66 119.02 1wmy s GLN 70 Ca 0.00 -1.80 -0.01 0.00 0.01 0.00 0.00 55.36 53.56 1wmy s GLN 70 Cb 0.00 -1.92 0.05 0.00 -1.01 0.00 0.00 33.01 30.13 1wmy s GLN 70 CO 0.00 0.05 -0.02 -1.17 0.01 0.00 0.00 175.29 174.16 1wmy s LEU 71 N -3.77 1.70 0.40 2.90 2.96 -0.54 -1.85 118.68 120.48 1wmy s LEU 71 Ca 0.37 -0.86 -0.27 0.00 -0.22 0.00 0.00 54.13 53.15 1wmy s LEU 71 Cb 0.02 -0.86 -0.10 0.00 0.50 0.00 0.00 46.19 45.75 1wmy s LEU 71 CO 0.20 -0.25 1.47 0.26 -1.32 0.00 0.00 176.35 176.72 1wmy s TRP 72 N 1.66 2.54 0.31 5.38 0.23 0.02 -0.45 118.94 128.63 1wmy s TRP 72 Ca -0.02 1.20 0.03 0.00 -2.03 0.00 0.00 56.10 55.28 1wmy s TRP 72 Cb -0.17 -4.00 -0.05 0.00 0.03 0.00 0.00 33.47 29.29 1wmy s TRP 72 CO -0.07 -2.99 0.09 0.96 0.96 0.00 0.00 176.95 175.91 1wmy s ILE 73 N -1.15 0.78 -0.51 2.03 -4.36 -0.89 -3.51 121.20 113.58 1wmy s ILE 73 Ca 0.55 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.96 1wmy s ILE 73 Cb -0.46 -2.64 0.11 0.00 1.25 0.00 0.00 42.46 40.73 1wmy s ILE 73 CO 0.61 0.00 0.89 0.61 0.24 0.00 0.00 174.94 177.29 1wmy n GLY 74 N -0.63 2.02 3.77 6.27 0.00 -0.26 -4.44 105.19 111.93 1wmy n GLY 74 Ca -0.02 -0.15 -0.37 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.45 4.34 0.03 0.99 2.96 -1.26 -0.58 118.68 124.71 1wmy s LEU 75 Ca 0.08 0.74 -0.28 0.00 -0.22 0.00 0.00 54.13 54.46 1wmy s LEU 75 Cb 0.07 -2.51 0.07 0.00 0.50 0.00 0.00 46.19 44.32 1wmy s LEU 75 CO 0.02 0.17 0.66 -0.72 -1.32 0.00 0.00 176.35 175.17 1wmy s TYR 76 N -0.12 -0.60 -0.09 5.38 -0.00 -0.35 -0.05 117.35 121.53 1wmy s TYR 76 Ca 0.21 0.78 0.14 0.00 -0.00 0.00 0.00 57.07 58.20 1wmy s TYR 76 Cb -0.15 0.47 0.29 0.00 -0.00 0.00 0.00 41.96 42.57 1wmy s TYR 76 CO 0.09 -0.69 1.14 -0.40 -0.00 0.00 0.00 175.55 175.68 1wmy n ASP 77 N 0.37 1.27 -0.32 -0.18 5.75 -0.40 -1.04 116.55 121.99 1wmy n ASP 77 Ca -0.18 -2.76 0.13 0.00 -0.01 0.00 0.00 54.79 51.98 1wmy n ASP 77 Cb 0.60 -0.37 0.32 0.00 -1.03 0.00 0.00 41.12 40.65 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 0.50 0.55 -0.05 0.11 3.64 -1.90 -2.44 116.57 116.98 1wmy h LYS 78 Ca -0.06 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 1wmy h LYS 78 Cb 1.32 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 33.02 1wmy h LYS 78 CO 0.03 0.36 0.00 0.66 -2.27 0.00 0.00 179.45 178.23 1wmy n TYR 79 N -4.91 0.04 -2.87 1.91 4.02 -1.26 -4.65 117.16 109.43 1wmy n TYR 79 Ca 0.23 -0.02 -0.00 0.00 -0.01 0.00 0.00 57.90 58.10 1wmy n TYR 79 Cb 0.63 0.00 0.01 0.00 -0.02 0.00 0.00 39.34 39.96 1wmy n TYR 79 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 176.86 177.06 1wmy s ASN 80 N -1.95 -0.81 0.07 7.72 2.47 -0.93 -5.13 114.94 116.37 1wmy s ASN 80 Ca 0.33 -0.60 -0.37 0.00 0.42 0.00 0.00 52.86 52.63 1wmy s ASN 80 Cb 0.20 1.05 -0.17 0.00 -1.45 0.00 0.00 41.25 40.88 1wmy s ASN 80 CO 0.31 -0.07 1.30 1.21 -3.72 0.00 0.00 177.10 176.14 1wmy n GLU 81 N 3.56 0.98 0.00 0.43 4.07 -1.13 -0.79 120.64 127.76 1wmy n GLU 81 Ca 0.10 0.35 0.00 0.00 -0.06 0.00 0.00 57.16 57.55 1wmy n GLU 81 Cb 0.61 -1.98 0.00 0.00 -0.06 0.00 0.00 31.44 30.01 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 2.38 3.20 3.21 8.31 0.00 -1.26 -5.00 105.19 116.03 1wmy n GLY 82 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 1wmy n GLY 82 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1wmy s ASP 83 N -0.78 5.82 -0.11 1.61 3.68 0.03 -5.06 116.67 121.86 1wmy s ASP 83 Ca 0.00 -2.28 -0.29 0.00 2.13 0.00 0.00 52.55 52.11 1wmy s ASP 83 Cb 0.00 -2.02 -0.01 0.00 -1.45 0.00 0.00 42.92 39.44 1wmy s ASP 83 CO 0.00 -0.60 0.98 -0.36 0.13 0.00 0.00 175.17 175.32 1wmy s PHE 84 N 0.80 3.51 0.34 -5.34 0.08 -1.26 -4.50 117.98 111.60 1wmy s PHE 84 Ca 0.11 1.56 0.06 0.00 0.12 0.00 0.00 56.93 58.77 1wmy s PHE 84 Cb -0.22 -3.16 -0.07 0.00 -0.57 0.00 0.00 43.02 39.00 1wmy s PHE 84 CO -0.03 -0.21 -0.01 0.96 -0.10 0.00 0.00 175.22 175.83 1wmy s ILE 85 N 1.97 1.66 -0.05 0.64 -4.36 -0.21 -4.88 121.20 115.97 1wmy s ILE 85 Ca 0.47 -2.06 -0.15 0.00 -0.26 0.00 0.00 60.65 58.65 1wmy s ILE 85 Cb -0.18 -2.73 -0.05 0.00 1.25 0.00 0.00 42.46 40.74 1wmy s ILE 85 CO 0.18 -0.11 0.40 0.26 0.24 0.00 0.00 174.94 175.90 1wmy s TRP 86 N -2.98 3.64 0.53 1.37 0.52 -1.26 -1.21 118.94 119.55 1wmy s TRP 86 Ca 0.34 0.90 0.24 0.00 0.02 0.00 0.00 56.10 57.60 1wmy s TRP 86 Cb 0.07 -2.34 1.38 0.00 -1.15 0.00 0.00 33.47 31.42 1wmy s TRP 86 CO 0.15 0.49 2.01 1.79 0.02 0.00 0.00 176.95 181.41 1wmy h THR 87 N 4.07 0.77 -0.24 2.01 1.35 -1.20 -1.78 112.91 117.89 1wmy h THR 87 Ca -0.48 -0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.38 1wmy h THR 87 Cb 1.20 0.76 0.00 0.00 -1.73 0.00 0.00 68.15 68.39 1wmy h THR 87 CO 0.66 0.00 0.00 -0.90 -0.25 0.00 0.00 175.52 175.03 1wmy n ASP 88 N -4.40 1.39 0.00 5.36 3.85 -1.26 -4.89 116.55 116.60 1wmy n ASP 88 Ca 0.08 -1.94 0.00 0.00 -0.71 0.00 0.00 54.79 52.22 1wmy n ASP 88 Cb 0.54 -0.16 0.00 0.00 -1.35 0.00 0.00 41.12 40.15 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 0.94 2.06 3.77 6.12 0.00 -0.67 -5.02 105.19 112.39 1wmy n GLY 89 Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 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 -3.47 4.73 0.56 1.61 1.04 -1.26 -4.98 113.70 111.93 1wmy s SER 90 Ca 0.00 1.89 -0.17 0.00 0.48 0.00 0.00 55.95 58.15 1wmy s SER 90 Cb 0.00 -2.53 -0.05 0.00 0.10 0.00 0.00 66.02 63.53 1wmy s SER 90 CO 0.00 -1.88 1.04 -0.54 0.98 0.00 0.00 173.24 172.84 1wmy s LYS 91 N -4.60 3.52 -0.53 4.02 -0.14 -1.26 -4.39 119.74 116.35 1wmy s LYS 91 Ca 0.63 1.21 -0.03 0.00 -1.36 0.00 0.00 55.97 56.42 1wmy s LYS 91 Cb -0.18 -2.06 0.16 0.00 -1.68 0.00 0.00 37.83 34.06 1wmy s LYS 91 CO 0.51 -0.65 2.51 1.33 -0.76 0.00 0.00 175.35 178.29 1wmy n VAL 92 N -1.72 3.34 0.08 3.17 0.24 -1.26 -4.73 118.33 117.45 1wmy n VAL 92 Ca 0.09 -3.13 -0.05 0.00 -2.04 0.00 0.00 64.34 59.21 1wmy n VAL 92 Cb 0.53 -1.47 -0.09 0.00 -1.47 0.00 0.00 33.84 31.34 1wmy n VAL 92 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1wmy h GLY 93 N 3.50 0.00 -5.63 7.63 0.00 -1.93 -3.44 103.07 103.20 1wmy h GLY 93 Ca 0.43 0.00 -0.63 0.00 0.00 0.00 0.00 47.33 47.13 1wmy h GLY 93 CO 1.02 0.00 -0.39 -0.47 0.00 0.00 0.00 176.54 176.70 1wmy s TYR 94 N -2.78 3.58 0.08 5.60 5.04 -1.26 -5.08 117.35 122.53 1wmy s TYR 94 Ca 0.01 0.62 0.03 0.00 -2.44 0.00 0.00 57.07 55.29 1wmy s TYR 94 Cb 0.10 -2.13 -0.03 0.00 0.35 0.00 0.00 41.96 40.25 1wmy s TYR 94 CO 0.81 0.56 -0.09 0.95 -1.34 0.00 0.00 175.55 176.44 1wmy s THR 95 N -0.57 0.77 -0.39 4.34 -4.23 -1.26 -4.90 115.64 109.40 1wmy s THR 95 Ca 0.16 -1.58 0.10 0.00 -1.18 0.00 0.00 61.69 59.20 1wmy s THR 95 Cb -0.13 -1.26 0.33 0.00 1.34 0.00 0.00 72.50 72.79 1wmy s THR 95 CO 0.05 -0.60 0.79 1.17 -0.54 0.00 0.00 174.62 175.50 1wmy n LYS 96 N 0.63 0.95 -2.27 3.99 4.81 -1.26 -5.07 118.16 119.94 1wmy n LYS 96 Ca -0.17 -3.04 -0.41 0.00 -0.87 0.00 0.00 58.31 53.82 1wmy n LYS 96 Cb 0.58 -1.53 -0.03 0.00 0.02 0.00 0.00 35.03 34.07 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 -1.71 3.31 0.75 5.64 0.52 -1.26 0.09 118.94 126.28 1wmy s TRP 97 Ca 0.36 1.27 -0.14 0.00 0.02 0.00 0.00 56.10 57.61 1wmy s TRP 97 Cb 0.32 -3.55 0.05 0.00 -1.15 0.00 0.00 33.47 29.14 1wmy s TRP 97 CO -0.08 -1.68 1.18 0.00 0.02 0.00 0.00 176.95 176.38 1wmy s ALA 98 N 0.14 2.07 0.24 0.98 0.00 -0.27 -4.68 121.76 120.24 1wmy s ALA 98 Ca 0.56 0.75 -0.31 0.00 0.00 0.00 0.00 51.96 52.96 1wmy s ALA 98 Cb -0.35 -3.43 -0.12 0.00 0.00 0.00 0.00 23.12 19.21 1wmy s ALA 98 CO 0.37 -1.93 1.59 0.41 0.00 0.00 0.00 175.76 176.21 1wmy n GLY 99 N 0.14 1.25 2.03 0.00 0.00 -1.26 -1.77 105.19 105.57 1wmy n GLY 99 Ca 0.12 0.55 0.00 0.00 0.00 0.00 0.00 46.02 46.69 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 2.87 0.84 3.44 -0.02 0.00 -1.26 -5.04 105.19 106.03 1wmy n GLY 100 Ca 0.13 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.32 1.59 0.24 1.61 -1.52 -0.73 -4.03 119.66 116.50 1wmy s GLN 101 Ca 0.00 -1.37 -0.27 0.00 -1.95 0.00 0.00 55.36 51.77 1wmy s GLN 101 Cb 0.00 -1.95 -0.09 0.00 -0.22 0.00 0.00 33.01 30.75 1wmy s GLN 101 CO 0.00 0.44 0.88 -1.25 -0.25 0.00 0.00 175.29 175.10 1wmy s PRO 102 N -2.39 4.65 0.00 2.91 0.04 -1.26 -4.61 135.00 134.34 1wmy s PRO 102 Ca 0.18 1.30 0.02 0.00 0.04 0.00 0.00 61.00 62.54 1wmy s PRO 102 Cb -0.09 -3.11 0.02 0.00 0.04 0.00 0.00 34.50 31.36 1wmy s PRO 102 CO 0.09 0.46 0.71 -0.40 0.04 0.00 0.00 177.00 177.90 1wmy n ASP 103 N 1.20 1.46 -4.17 6.66 3.85 -1.26 -5.01 116.55 119.28 1wmy n ASP 103 Ca -0.02 -1.36 -0.30 0.00 -0.71 0.00 0.00 54.79 52.40 1wmy n ASP 103 Cb 0.49 -0.01 -0.06 0.00 -1.35 0.00 0.00 41.12 40.19 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 -0.05 -0.14 -4.72 -1.12 5.15 -1.26 -4.76 115.26 108.36 1wmy n ASN 104 Ca 0.01 -1.14 -0.43 0.00 -0.60 0.00 0.00 54.58 52.43 1wmy n ASN 104 Cb 0.12 -2.33 -0.02 0.00 -0.53 0.00 0.00 39.78 37.02 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 -4.46 2.62 -2.49 1.20 -0.00 -1.26 -0.96 117.44 112.09 1wmy n TRP 105 Ca -0.26 0.35 -0.13 0.00 -0.00 0.00 0.00 57.50 57.45 1wmy n TRP 105 Cb 0.66 -2.54 -0.01 0.00 -0.00 0.00 0.00 31.31 29.43 1wmy n TRP 105 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 177.69 177.78 1wmy n ASN 106 N 1.91 -4.00 -3.54 5.87 5.03 -1.26 -2.20 115.26 117.07 1wmy n ASN 106 Ca 0.08 0.15 -0.26 0.00 0.87 0.00 0.00 54.58 55.43 1wmy n ASN 106 Cb 0.35 -3.39 0.00 0.00 -1.02 0.00 0.00 39.78 35.72 1wmy n ASN 106 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 1wmy n ASN 107 N -1.85 -4.16 -0.78 6.41 5.15 -0.13 -4.85 115.26 115.05 1wmy n ASN 107 Ca -0.14 -0.53 0.01 0.00 -0.60 0.00 0.00 54.58 53.32 1wmy n ASN 107 Cb 0.61 -3.40 0.00 0.00 -0.53 0.00 0.00 39.78 36.46 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 -3.86 2.17 -3.97 5.20 0.00 -0.93 -5.04 120.51 114.08 1wmy n ALA 108 Ca -0.00 -1.24 -0.32 0.00 0.00 0.00 0.00 53.44 51.87 1wmy n ALA 108 Cb 0.54 -0.51 -0.14 0.00 0.00 0.00 0.00 19.45 19.34 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 1.83 -0.01 0.00 2.02 -1.25 -4.24 118.70 117.05 1wmy s GLU 109 Ca 0.09 -1.68 0.01 0.00 0.02 0.00 0.00 54.97 53.41 1wmy s GLU 109 Cb 0.10 -3.17 0.02 0.00 0.10 0.00 0.00 34.13 31.18 1wmy s GLU 109 CO -0.04 -0.83 0.95 -0.25 0.02 0.00 0.00 175.26 175.11 1wmy n ASP 110 N 4.37 1.79 -4.06 -0.19 8.00 -0.88 -4.52 116.55 121.06 1wmy n ASP 110 Ca -0.03 -1.95 -0.27 0.00 0.71 0.00 0.00 54.79 53.25 1wmy n ASP 110 Cb 0.42 -0.03 -0.17 0.00 -0.02 0.00 0.00 41.12 41.33 1wmy n ASP 110 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1wmy s TYR 111 N -0.99 1.73 0.36 1.24 1.51 -0.82 -1.28 117.35 119.11 1wmy s TYR 111 Ca 0.02 -0.69 -0.15 0.00 -1.01 0.00 0.00 57.07 55.24 1wmy s TYR 111 Cb 0.02 -1.24 -0.09 0.00 -0.11 0.00 0.00 41.96 40.54 1wmy s TYR 111 CO 0.00 -0.34 0.78 0.20 -1.11 0.00 0.00 175.55 175.09 1wmy s GLY 112 N 0.68 2.25 -0.14 0.71 0.00 0.93 -0.47 107.32 111.28 1wmy s GLY 112 Ca -0.14 0.04 -0.24 0.00 0.00 0.00 0.00 44.72 44.38 1wmy s GLY 112 CO 0.04 0.26 0.60 -0.86 0.00 0.00 0.00 173.10 173.14 1wmy s GLN 113 N -3.25 0.84 0.30 2.90 -2.07 -0.18 -2.10 119.66 116.10 1wmy s GLN 113 Ca 0.55 0.50 -0.29 0.00 -1.82 0.00 0.00 55.36 54.29 1wmy s GLN 113 Cb -0.10 0.40 -0.10 0.00 -1.09 0.00 0.00 33.01 32.12 1wmy s GLN 113 CO 0.20 -0.19 1.21 -0.06 -1.32 0.00 0.00 175.29 175.13 1wmy s PHE 114 N -0.46 3.31 0.62 9.60 2.99 0.40 -0.68 117.98 133.76 1wmy s PHE 114 Ca -0.06 1.54 -0.09 0.00 0.00 0.00 0.00 56.93 58.31 1wmy s PHE 114 Cb -0.03 -3.49 -0.01 0.00 0.00 0.00 0.00 43.02 39.50 1wmy s PHE 114 CO 0.05 -1.24 0.99 1.03 -0.00 0.00 0.00 175.22 176.04 1wmy s ARG 115 N -1.50 3.16 0.00 0.44 0.52 0.08 -1.47 118.95 120.19 1wmy s ARG 115 Ca 0.47 0.39 0.30 0.00 -0.52 0.00 0.00 55.73 56.37 1wmy s ARG 115 Cb -0.36 -2.15 1.62 0.00 0.52 0.00 0.00 34.95 34.58 1wmy s ARG 115 CO 0.46 -0.71 2.08 -2.39 0.02 0.00 0.00 175.30 174.76 1wmy n HIS 116 N -2.73 0.00 -4.01 -0.53 1.44 -0.92 -3.99 115.22 104.49 1wmy n HIS 116 Ca 0.05 0.00 -0.24 0.00 -2.01 0.00 0.00 57.72 55.52 1wmy n HIS 116 Cb 0.56 -0.18 -0.06 0.00 0.12 0.00 0.00 29.99 30.43 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 -2.36 2.41 -1.39 0.61 -4.23 -1.26 -4.75 115.64 104.67 1wmy s THR 117 Ca 0.35 -1.62 -0.04 0.00 -1.18 0.00 0.00 61.69 59.19 1wmy s THR 117 Cb 0.20 -3.00 0.03 0.00 1.34 0.00 0.00 72.50 71.07 1wmy s THR 117 CO 0.41 -0.01 0.74 -0.62 -0.54 0.00 0.00 174.62 174.60 1wmy n GLU 118 N -1.30 -4.80 -1.49 3.99 1.02 -1.26 -1.27 120.64 115.54 1wmy n GLU 118 Ca -0.00 0.58 -0.17 0.00 -0.02 0.00 0.00 57.16 57.55 1wmy n GLU 118 Cb 0.64 -5.17 -0.07 0.00 -0.02 0.00 0.00 31.44 26.82 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 -1.66 1.65 0.96 0.62 0.00 -1.26 -2.52 105.19 102.98 1wmy n GLY 119 Ca -0.20 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.73 1.00 3.56 -0.02 0.00 -0.39 -4.80 105.19 103.81 1wmy n GLY 120 Ca -0.17 -0.47 -0.44 0.00 0.00 0.00 0.00 46.02 44.94 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 -0.81 -0.60 -2.33 4.61 0.00 -1.05 -3.97 120.51 116.36 1wmy n ALA 121 Ca 0.00 0.36 -0.35 0.00 0.00 0.00 0.00 53.44 53.45 1wmy n ALA 121 Cb 0.14 -1.96 -0.06 0.00 0.00 0.00 0.00 19.45 17.57 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 -1.11 3.61 0.10 0.00 0.51 0.11 -0.74 118.94 121.43 1wmy s TRP 122 Ca 0.60 1.10 0.08 0.00 -2.12 0.00 0.00 56.10 55.76 1wmy s TRP 122 Cb -0.71 -2.40 -0.03 0.00 -0.81 0.00 0.00 33.47 29.52 1wmy s TRP 122 CO 0.59 0.42 -0.20 1.21 -0.51 0.00 0.00 176.95 178.47 1wmy s ASN 123 N -1.70 2.39 -0.10 2.95 2.47 0.14 -1.11 114.94 119.98 1wmy s ASN 123 Ca 0.38 -0.68 -0.15 0.00 0.42 0.00 0.00 52.86 52.84 1wmy s ASN 123 Cb -0.15 -0.12 -0.05 0.00 -1.45 0.00 0.00 41.25 39.48 1wmy s ASN 123 CO 0.19 0.03 0.36 1.51 -3.72 0.00 0.00 177.10 175.48 1wmy s ASP 124 N -1.90 6.60 0.24 -4.21 -4.77 -1.26 -1.01 116.67 110.37 1wmy s ASP 124 Ca 0.05 0.71 0.04 0.00 -3.30 0.00 0.00 52.55 50.05 1wmy s ASP 124 Cb -0.10 -2.22 -0.01 0.00 -1.09 0.00 0.00 42.92 39.50 1wmy s ASP 124 CO 0.04 0.16 0.13 -3.20 0.70 0.00 0.00 175.17 173.00 1wmy n ASN 125 N 2.98 0.39 -4.97 2.11 2.85 0.38 -4.88 115.26 114.13 1wmy n ASN 125 Ca -0.12 -2.39 -0.19 0.00 -0.11 0.00 0.00 54.58 51.77 1wmy n ASN 125 Cb 0.52 0.85 0.00 0.00 1.24 0.00 0.00 39.78 42.39 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 -2.54 5.36 0.25 1.20 1.04 -1.26 -1.94 113.70 115.80 1wmy s SER 126 Ca 0.19 -0.61 0.22 0.00 0.48 0.00 0.00 55.95 56.23 1wmy s SER 126 Cb 0.01 -0.46 0.99 0.00 0.10 0.00 0.00 66.02 66.66 1wmy s SER 126 CO 0.13 -0.82 1.68 0.00 0.98 0.00 0.00 173.24 175.21 1wmy n ALA 127 N -1.81 1.52 0.06 5.32 0.00 -1.26 -2.83 120.51 121.51 1wmy n ALA 127 Ca 0.07 0.10 0.11 0.00 0.00 0.00 0.00 53.44 53.73 1wmy n ALA 127 Cb 0.60 -1.36 -0.06 0.00 0.00 0.00 0.00 19.45 18.64 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 -1.76 2.62 -1.19 0.00 0.00 -1.26 -4.68 120.51 114.24 1wmy n ALA 128 Ca 0.01 -0.33 -0.31 0.00 0.00 0.00 0.00 53.44 52.81 1wmy n ALA 128 Cb 0.18 -0.98 0.10 0.00 0.00 0.00 0.00 19.45 18.75 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 -3.42 2.16 0.07 0.00 0.00 -1.13 -4.94 121.76 114.49 1wmy s ALA 129 Ca -0.03 0.30 0.09 0.00 0.00 0.00 0.00 51.96 52.31 1wmy s ALA 129 Cb 0.11 -3.29 -0.03 0.00 0.00 0.00 0.00 23.12 19.91 1wmy s ALA 129 CO 0.83 -1.89 -0.23 -0.65 0.00 0.00 0.00 175.76 173.82 1wmy s GLN 130 N -4.88 1.47 0.19 0.00 -0.21 -1.26 -4.19 119.66 110.78 1wmy s GLN 130 Ca 0.62 -1.08 -0.21 0.00 0.02 0.00 0.00 55.36 54.71 1wmy s GLN 130 Cb -0.18 -1.68 0.05 0.00 1.00 0.00 0.00 33.01 32.19 1wmy s GLN 130 CO 0.56 0.42 0.59 0.00 -2.12 0.00 0.00 175.29 174.74 1wmy s ALA 131 N -0.89 -1.31 1.04 6.09 0.00 -0.55 -4.80 121.76 121.34 1wmy s ALA 131 Ca 0.10 0.11 -0.16 0.00 0.00 0.00 0.00 51.96 52.01 1wmy s ALA 131 Cb -0.10 0.86 0.21 0.00 0.00 0.00 0.00 23.12 24.10 1wmy s ALA 131 CO 0.03 -0.82 1.18 0.15 0.00 0.00 0.00 175.76 176.30 1wmy s LYS 132 N -3.82 0.08 0.07 0.00 -0.14 -0.77 -1.15 119.74 114.01 1wmy s LYS 132 Ca 0.05 -0.05 -0.13 0.00 -1.36 0.00 0.00 55.97 54.48 1wmy s LYS 132 Cb -0.02 -1.75 0.02 0.00 -1.68 0.00 0.00 37.83 34.41 1wmy s LYS 132 CO -0.07 -2.85 0.30 1.52 -0.76 0.00 0.00 175.35 173.50 1wmy s TYR 133 N -3.35 -0.07 -0.07 3.18 1.13 -1.18 -0.80 117.35 116.19 1wmy s TYR 133 Ca 0.70 -0.18 0.01 0.00 -1.41 0.00 0.00 57.07 56.18 1wmy s TYR 133 Cb -0.10 0.10 0.02 0.00 -1.10 0.00 0.00 41.96 40.88 1wmy s TYR 133 CO 0.54 -0.56 -0.08 1.41 -2.51 0.00 0.00 175.55 174.35 1wmy s MET 134 N -3.17 1.32 0.21 -3.49 1.75 -1.23 -0.87 119.30 113.82 1wmy s MET 134 Ca -0.01 -0.24 0.05 0.00 -1.25 0.00 0.00 55.69 54.24 1wmy s MET 134 Cb 0.01 -1.25 -0.03 0.00 2.84 0.00 0.00 34.83 36.40 1wmy s MET 134 CO -0.07 -0.11 0.30 0.00 -0.65 0.00 0.00 175.02 174.49 1wmy s LYS 136 N -3.71 0.01 -0.08 0.00 2.20 0.22 -1.36 119.74 117.01 1wmy s LYS 136 Ca 0.34 0.08 -0.15 0.00 -0.36 0.00 0.00 55.97 55.88 1wmy s LYS 136 Cb -0.09 -0.06 -0.05 0.00 -1.51 0.00 0.00 37.83 36.11 1wmy s LYS 136 CO 0.28 -0.05 0.37 -0.51 -0.36 0.00 0.00 175.35 175.08 1wmy s LEU 137 N 0.32 4.35 -0.15 5.43 1.43 0.75 -1.69 118.68 129.13 1wmy s LEU 137 Ca -0.03 0.76 0.01 0.00 -1.03 0.00 0.00 54.13 53.84 1wmy s LEU 137 Cb -0.04 -2.51 0.02 0.00 0.03 0.00 0.00 46.19 43.69 1wmy s LEU 137 CO -0.01 0.19 -0.17 -0.89 0.23 0.00 0.00 176.35 175.70 1wmy s THR 138 N -0.21 1.73 -0.83 5.49 2.01 0.34 -3.59 115.64 120.58 1wmy s THR 138 Ca 0.22 -0.75 -0.20 0.00 0.31 0.00 0.00 61.69 61.27 1wmy s THR 138 Cb -0.15 -1.58 0.12 0.00 0.01 0.00 0.00 72.50 70.89 1wmy s THR 138 CO 0.09 0.49 1.04 -0.36 -0.69 0.00 0.00 174.62 175.18 1wmy s PHE 139 N 1.25 3.01 -2.00 4.92 0.40 -1.26 -1.06 117.98 123.25 1wmy s PHE 139 Ca 0.01 -1.16 0.26 0.00 -0.60 0.00 0.00 56.93 55.44 1wmy s PHE 139 Cb -0.14 -4.25 1.57 0.00 0.51 0.00 0.00 43.02 40.71 1wmy s PHE 139 CO -0.08 -1.50 1.92 -1.91 0.70 0.00 0.00 175.22 174.35