#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wmj n ALA 2 N 0.00 0.00 -1.77 3.17 0.00 -1.26 -5.02 120.51 115.63 1wmj n ALA 2 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1wmj n ALA 2 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1wmj n ALA 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wmj n ALA 3 N -3.00 -0.07 -2.77 0.00 0.00 -1.26 -4.65 120.51 108.76 1wmj n ALA 3 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.44 1wmj n ALA 3 Cb 0.00 -0.46 -0.00 0.00 0.00 0.00 0.00 19.45 18.99 1wmj n ALA 3 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1wmj n GLU 4 N -0.99 -3.19 0.00 0.00 2.13 -1.26 -5.05 120.64 112.27 1wmj n GLU 4 Ca 0.00 2.60 0.00 0.00 0.66 0.00 0.00 57.16 60.42 1wmj n GLU 4 Cb 0.46 -4.90 0.00 0.00 0.27 0.00 0.00 31.44 27.27 1wmj n GLU 4 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1wmj n GLU 5 N 0.81 3.69 -0.42 5.31 -0.58 -1.26 -4.93 120.64 123.25 1wmj n GLU 5 Ca -0.01 0.00 -0.08 0.00 -0.42 0.00 0.00 57.16 56.65 1wmj n GLU 5 Cb 0.07 0.00 0.06 0.00 -0.57 0.00 0.00 31.44 31.00 1wmj n GLU 5 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1wmj n GLY 6 N 5.00 2.86 3.55 0.62 0.00 -1.26 -4.85 105.19 111.11 1wmj n GLY 6 Ca 0.00 -0.38 -0.24 0.00 0.00 0.00 0.00 46.02 45.40 1wmj n GLY 6 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1wmj n VAL 7 N -0.00 0.00 -1.53 1.61 0.24 -1.26 -3.89 118.33 113.50 1wmj n VAL 7 Ca 0.20 -2.04 -0.28 0.00 -2.04 0.00 0.00 64.34 60.18 1wmj n VAL 7 Cb 0.87 -0.05 -0.11 0.00 -1.47 0.00 0.00 33.84 33.09 1wmj n VAL 7 CO 0.00 0.00 0.00 1.33 -2.14 0.00 0.00 176.83 176.02 1wmj n VAL 8 N -1.69 -0.03 -0.95 3.34 0.24 -1.24 -4.83 118.33 113.17 1wmj n VAL 8 Ca -0.02 -0.49 -0.37 0.00 -2.04 0.00 0.00 64.34 61.42 1wmj n VAL 8 Cb 0.58 -1.54 0.05 0.00 -1.47 0.00 0.00 33.84 31.46 1wmj n VAL 8 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 1wmj n ILE 9 N 7.64 0.00 -3.14 1.34 2.08 -1.25 -4.40 119.36 121.63 1wmj n ILE 9 Ca 0.52 -0.22 -0.20 0.00 0.56 0.00 0.00 62.75 63.41 1wmj n ILE 9 Cb 0.32 -0.10 -0.03 0.00 -0.75 0.00 0.00 39.64 39.08 1wmj n ILE 9 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1wmj n ALA 10 N -3.25 2.55 -0.91 -1.39 0.00 -1.24 0.22 120.51 116.49 1wmj n ALA 10 Ca -0.01 -3.67 -0.35 0.00 0.00 0.00 0.00 53.44 49.41 1wmj n ALA 10 Cb 0.66 -0.89 0.07 0.00 0.00 0.00 0.00 19.45 19.30 1wmj n ALA 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wmj n HIS 12 N -3.02 -0.72 0.00 0.00 -0.00 -1.26 -4.11 115.22 106.10 1wmj n HIS 12 Ca 0.01 -0.75 0.00 0.00 0.46 0.00 0.00 57.72 57.45 1wmj n HIS 12 Cb 0.56 0.84 0.00 0.00 -0.12 0.00 0.00 29.99 31.27 1wmj n HIS 12 CO 0.00 0.00 0.00 0.27 0.46 0.00 0.00 176.34 177.07 1wmj n ASN 13 N -0.54 0.00 0.00 0.26 2.04 -1.26 -4.96 115.26 110.80 1wmj n ASN 13 Ca -0.15 0.00 0.00 0.00 -0.44 0.00 0.00 54.58 53.99 1wmj n ASN 13 Cb 0.65 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.90 1wmj n ASN 13 CO 0.00 0.00 0.00 1.17 -0.44 0.00 0.00 177.26 177.99 1wmj n LYS 14 N 0.00 0.00 -0.21 -3.83 4.81 -1.26 -4.31 118.16 113.35 1wmj n LYS 14 Ca 0.00 0.00 0.20 0.00 -0.87 0.00 0.00 58.31 57.64 1wmj n LYS 14 Cb 0.00 0.00 0.35 0.00 0.02 0.00 0.00 35.03 35.40 1wmj n LYS 14 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1wmj n ASP 15 N 1.12 0.17 0.08 3.14 -0.08 -1.26 0.31 116.55 120.03 1wmj n ASP 15 Ca 0.00 0.89 -0.22 0.00 -1.51 0.00 0.00 54.79 53.95 1wmj n ASP 15 Cb 0.00 -0.43 -0.15 0.00 2.34 0.00 0.00 41.12 42.88 1wmj n ASP 15 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 1wmj h GLU 16 N 0.00 0.38 -0.99 -0.67 5.08 -1.97 -3.19 114.58 113.22 1wmj h GLU 16 Ca 0.49 -0.65 0.15 0.00 -1.00 0.00 0.00 59.36 58.35 1wmj h GLU 16 Cb 1.40 0.24 -0.09 0.00 0.50 0.00 0.00 28.75 30.81 1wmj h GLU 16 CO -0.37 1.31 0.62 0.35 -1.00 0.00 0.00 179.01 179.92 1wmj h PHE 17 N -0.16 1.06 -0.42 4.33 3.04 0.44 -0.57 116.94 124.65 1wmj h PHE 17 Ca -0.22 0.03 -0.14 0.00 3.98 0.00 0.00 57.97 61.63 1wmj h PHE 17 Cb 1.87 -0.33 -0.01 0.00 2.56 0.00 0.00 35.95 40.04 1wmj h PHE 17 CO 0.16 0.35 -0.29 -0.44 -2.02 0.00 0.00 178.31 176.08 1wmj h ASP 18 N 0.86 0.95 -0.35 0.41 3.32 -1.25 -2.39 116.42 117.98 1wmj h ASP 18 Ca 0.52 -0.39 0.10 0.00 0.02 0.00 0.00 57.03 57.28 1wmj h ASP 18 Cb 0.68 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 1wmj h ASP 18 CO -0.29 1.17 0.89 0.00 -1.72 0.00 0.00 179.24 179.29 1wmj h ALA 19 N 0.89 2.18 0.00 3.45 0.00 -1.08 0.39 119.26 125.09 1wmj h ALA 19 Ca 0.09 -0.01 -0.24 0.00 0.00 0.00 0.00 54.91 54.75 1wmj h ALA 19 Cb 0.86 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.64 1wmj h ALA 19 CO 0.08 -1.07 -1.70 1.04 0.00 0.00 0.00 179.25 177.59 1wmj n GLN 20 N -2.91 0.37 -0.06 0.00 3.00 -1.10 -4.01 117.38 112.66 1wmj n GLN 20 Ca 0.07 0.16 0.25 0.00 -0.01 0.00 0.00 57.00 57.47 1wmj n GLN 20 Cb 1.01 -1.12 0.65 0.00 0.00 0.00 0.00 30.24 30.77 1wmj n GLN 20 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.06 179.04 1wmj h MET 21 N -0.64 0.00 0.00 -1.09 4.05 -0.75 1.16 114.93 117.66 1wmj h MET 21 Ca -0.36 0.00 -0.09 0.00 -0.28 0.00 0.00 59.70 58.97 1wmj h MET 21 Cb 1.23 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 32.02 1wmj h MET 21 CO -0.22 0.00 -1.37 2.41 0.23 0.00 0.00 176.91 177.97 1wmj n THR 22 N -3.59 0.85 0.55 -0.77 -1.04 0.02 -4.01 114.28 106.30 1wmj n THR 22 Ca 0.15 -0.62 -0.03 0.00 -2.04 0.00 0.00 64.05 61.50 1wmj n THR 22 Cb 1.01 -0.49 0.05 0.00 -1.82 0.00 0.00 70.33 69.07 1wmj n THR 22 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1wmj n LYS 23 N -2.73 1.41 0.00 -2.82 5.02 0.40 -3.62 118.16 115.81 1wmj n LYS 23 Ca -0.06 -0.64 0.00 0.00 -2.02 0.00 0.00 58.31 55.59 1wmj n LYS 23 Cb 0.71 -1.36 0.00 0.00 -0.02 0.00 0.00 35.03 34.37 1wmj n LYS 23 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1wmj n ALA 24 N 0.15 2.55 -0.19 7.82 0.00 -1.19 -4.30 120.51 125.35 1wmj n ALA 24 Ca 0.11 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.45 1wmj n ALA 24 Cb 0.67 0.33 0.01 0.00 0.00 0.00 0.00 19.45 20.46 1wmj n ALA 24 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1wmj h LYS 25 N 0.00 1.03 0.17 0.00 2.10 -1.74 0.55 116.57 118.68 1wmj h LYS 25 Ca 0.00 -0.37 -0.36 0.00 -2.00 0.00 0.00 60.65 57.92 1wmj h LYS 25 Cb 0.66 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 31.92 1wmj h LYS 25 CO 0.00 1.06 -1.84 1.05 -2.00 0.00 0.00 179.45 177.73 1wmj h GLU 26 N 0.91 0.35 -0.02 0.07 4.11 -1.87 -3.34 114.58 114.79 1wmj h GLU 26 Ca 0.15 -0.60 -0.06 0.00 0.07 0.00 0.00 59.36 58.92 1wmj h GLU 26 Cb 0.66 0.22 -0.01 0.00 0.50 0.00 0.00 28.75 30.12 1wmj h GLU 26 CO 0.05 1.28 -0.27 0.00 0.07 0.00 0.00 179.01 180.14 1wmj h ALA 27 N 0.11 1.52 -0.32 1.06 0.00 -1.74 -3.47 119.26 116.42 1wmj h ALA 27 Ca -0.37 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.28 1wmj h ALA 27 Cb 2.08 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.82 1wmj h ALA 27 CO 0.15 0.36 0.00 0.41 0.00 0.00 0.00 179.25 180.16 1wmj n GLY 28 N -0.73 1.01 3.21 0.00 0.00 0.06 -5.00 105.19 103.74 1wmj n GLY 28 Ca -0.02 -0.45 -0.13 0.00 0.00 0.00 0.00 46.02 45.42 1wmj n GLY 28 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wmj s LYS 29 N -2.82 0.94 0.77 1.61 -2.85 -0.46 -5.01 119.74 111.92 1wmj s LYS 29 Ca 0.00 -1.35 -0.11 0.00 -1.00 0.00 0.00 55.97 53.51 1wmj s LYS 29 Cb 0.00 -0.47 0.05 0.00 -2.06 0.00 0.00 37.83 35.35 1wmj s LYS 29 CO 0.00 0.05 1.08 0.08 0.10 0.00 0.00 175.35 176.66 1wmj s VAL 30 N -3.23 3.41 0.05 1.79 1.01 -0.37 -4.39 120.40 118.67 1wmj s VAL 30 Ca 0.13 0.46 0.06 0.00 0.00 0.00 0.00 61.98 62.62 1wmj s VAL 30 Cb 0.02 -3.02 -0.04 0.00 0.00 0.00 0.00 36.38 33.35 1wmj s VAL 30 CO -0.01 -0.60 -0.11 -0.69 0.00 0.00 0.00 175.10 173.69 1wmj s VAL 31 N -2.96 3.32 -0.31 2.92 1.01 -1.23 -2.00 120.40 121.16 1wmj s VAL 31 Ca 0.61 -1.06 -0.01 0.00 0.00 0.00 0.00 61.98 61.52 1wmj s VAL 31 Cb -0.16 -2.47 0.12 0.00 0.00 0.00 0.00 36.38 33.87 1wmj s VAL 31 CO 0.56 0.28 0.22 -0.63 0.00 0.00 0.00 175.10 175.53 1wmj s ILE 32 N -1.05 -0.15 -0.19 2.22 1.09 -1.26 -2.48 121.20 119.38 1wmj s ILE 32 Ca 0.18 -0.91 -0.14 0.00 -1.10 0.00 0.00 60.65 58.68 1wmj s ILE 32 Cb -0.11 -0.97 -0.04 0.00 -1.06 0.00 0.00 42.46 40.27 1wmj s ILE 32 CO 0.09 -0.70 0.31 -0.63 -0.10 0.00 0.00 174.94 173.91 1wmj s ILE 33 N 1.87 5.28 -0.94 2.92 1.09 0.14 -0.95 121.20 130.61 1wmj s ILE 33 Ca 0.12 0.54 -0.09 0.00 -1.10 0.00 0.00 60.65 60.12 1wmj s ILE 33 Cb -0.17 -3.64 0.24 0.00 -1.06 0.00 0.00 42.46 37.83 1wmj s ILE 33 CO -0.24 0.33 0.89 -0.62 -0.10 0.00 0.00 174.94 175.20 1wmj s ASP 34 N 0.77 6.77 0.63 3.58 2.15 0.18 -1.15 116.67 129.60 1wmj s ASP 34 Ca 0.16 -3.22 0.00 0.00 0.43 0.00 0.00 52.55 49.91 1wmj s ASP 34 Cb -0.14 -2.14 0.00 0.00 -0.30 0.00 0.00 42.92 40.34 1wmj s ASP 34 CO 0.05 -0.38 0.00 0.49 -0.17 0.00 0.00 175.17 175.16 1wmj n PHE 35 N 3.18 -1.44 0.00 -5.34 3.72 0.03 -2.93 117.46 114.67 1wmj n PHE 35 Ca 0.19 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.59 1wmj n PHE 35 Cb 0.42 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.96 1wmj n PHE 35 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 176.76 174.34 1wmj n THR 36 N -2.37 0.00 0.00 4.37 5.66 -0.56 -4.03 114.28 117.34 1wmj n THR 36 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1wmj n THR 36 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 1wmj n THR 36 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1wmj n ALA 37 N 0.00 -0.01 0.00 1.79 0.00 -1.25 -1.35 120.51 119.70 1wmj n ALA 37 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1wmj n ALA 37 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1wmj n ALA 37 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1wmj n SER 38 N -0.53 0.00 0.02 0.00 2.88 -1.26 -4.25 113.62 110.47 1wmj n SER 38 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1wmj n SER 38 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1wmj n SER 38 CO 0.00 0.00 0.00 0.79 -1.23 0.00 0.00 175.04 174.60 1wmj n TRP 39 N -1.50 -0.15 -1.16 0.66 8.01 -1.26 -5.02 117.44 117.01 1wmj n TRP 39 Ca 0.00 0.03 -0.53 0.00 -1.31 0.00 0.00 57.50 55.69 1wmj n TRP 39 Cb 0.00 0.12 -0.11 0.00 -2.01 0.00 0.00 31.31 29.31 1wmj n TRP 39 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1wmj n GLY 41 N 6.71 4.84 0.06 0.00 0.00 -1.26 -4.47 105.19 111.06 1wmj n GLY 41 Ca 0.51 -1.07 -0.13 0.00 0.00 0.00 0.00 46.02 45.33 1wmj n GLY 41 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wmj h PRO 42 N 0.00 -0.00 -4.43 1.61 0.13 -1.83 -3.47 132.00 124.01 1wmj h PRO 42 Ca 0.00 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.90 1wmj h PRO 42 Cb 0.00 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.10 1wmj h PRO 42 CO 0.00 0.49 -0.31 0.00 -0.23 0.00 0.00 178.00 177.95 1wmj n ARG 44 N -2.94 0.00 -0.29 0.00 0.63 -1.26 -4.71 116.66 108.09 1wmj n ARG 44 Ca -0.09 0.00 0.01 0.00 -0.92 0.00 0.00 57.85 56.85 1wmj n ARG 44 Cb 0.57 0.00 0.14 0.00 0.45 0.00 0.00 32.46 33.63 1wmj n ARG 44 CO 0.00 0.00 0.00 0.35 -2.51 0.00 0.00 177.63 175.47 1wmj h PHE 45 N 0.00 0.88 -0.54 -0.14 3.57 -2.00 -1.73 116.94 116.99 1wmj h PHE 45 Ca 0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1wmj h PHE 45 Cb 0.00 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 38.46 1wmj h PHE 45 CO 0.00 0.41 0.00 1.51 -2.23 0.00 0.00 178.31 178.00 1wmj n ILE 46 N -4.70 1.15 0.19 1.41 3.06 -1.26 -4.60 119.36 114.61 1wmj n ILE 46 Ca 0.12 -1.06 -0.14 0.00 -2.50 0.00 0.00 62.75 59.17 1wmj n ILE 46 Cb 0.22 0.43 -0.07 0.00 0.54 0.00 0.00 39.64 40.75 1wmj n ILE 46 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1wmj h ALA 47 N 3.19 -0.55 0.00 1.51 0.00 -1.59 -1.26 119.26 120.56 1wmj h ALA 47 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1wmj h ALA 47 Cb 0.95 0.37 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1wmj h ALA 47 CO 0.04 -0.84 0.00 -0.35 0.00 0.00 0.00 179.25 178.09 1wmj n PRO 48 N -5.38 0.49 -0.14 0.00 -0.04 -1.26 -2.95 135.00 125.72 1wmj n PRO 48 Ca -0.09 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.09 1wmj n PRO 48 Cb 0.29 -1.26 -0.10 0.00 -0.04 0.00 0.00 33.50 32.39 1wmj n PRO 48 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1wmj n VAL 49 N -0.76 1.53 0.00 0.52 0.31 -0.52 -4.03 118.33 115.37 1wmj n VAL 49 Ca 0.06 -0.40 0.00 0.00 -0.01 0.00 0.00 64.34 63.99 1wmj n VAL 49 Cb 0.03 -1.82 0.00 0.00 -0.91 0.00 0.00 33.84 31.14 1wmj n VAL 49 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1wmj n PHE 50 N -4.11 0.00 -0.26 3.52 3.72 -0.92 -0.50 117.46 118.92 1wmj n PHE 50 Ca -0.53 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 56.90 1wmj n PHE 50 Cb 0.90 -0.43 0.11 0.00 -0.94 0.00 0.00 39.48 39.12 1wmj n PHE 50 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1wmj h ALA 51 N -2.00 0.59 -0.23 4.37 0.00 -1.85 0.66 119.26 120.80 1wmj h ALA 51 Ca 0.00 0.28 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 1wmj h ALA 51 Cb 0.00 0.52 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1wmj h ALA 51 CO 0.00 -0.42 0.04 1.05 0.00 0.00 0.00 179.25 179.92 1wmj h GLU 52 N 0.03 0.33 -0.16 0.00 4.11 -1.70 -2.73 114.58 114.47 1wmj h GLU 52 Ca 0.38 -0.05 -0.07 0.00 0.07 0.00 0.00 59.36 59.69 1wmj h GLU 52 Cb 0.61 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.80 1wmj h GLU 52 CO -0.74 0.33 -0.16 1.88 0.07 0.00 0.00 179.01 180.39 1wmj h TYR 53 N 0.33 0.46 -0.96 2.06 -1.99 0.29 -2.40 116.97 114.75 1wmj h TYR 53 Ca 0.08 -0.14 0.31 0.00 2.00 0.00 0.00 58.73 60.97 1wmj h TYR 53 Cb 0.16 -0.10 -0.17 0.00 2.00 0.00 0.00 36.73 38.63 1wmj h TYR 53 CO 0.00 0.78 0.26 0.00 -0.00 0.00 0.00 178.16 179.20 1wmj h ALA 54 N 0.61 1.52 0.12 3.88 0.00 -0.58 0.33 119.26 125.14 1wmj h ALA 54 Ca 0.02 0.28 -0.24 0.00 0.00 0.00 0.00 54.91 54.97 1wmj h ALA 54 Cb 0.70 0.42 0.03 0.00 0.00 0.00 0.00 17.79 18.94 1wmj h ALA 54 CO 0.04 -0.65 -1.02 0.87 0.00 0.00 0.00 179.25 178.50 1wmj h LYS 55 N 0.08 0.48 -0.52 0.00 1.57 -1.59 -3.25 116.57 113.34 1wmj h LYS 55 Ca 0.66 -0.67 0.14 0.00 -1.87 0.00 0.00 60.65 58.91 1wmj h LYS 55 Cb 1.51 0.23 -0.02 0.00 0.08 0.00 0.00 32.23 34.02 1wmj h LYS 55 CO -0.79 1.29 0.37 0.87 -0.57 0.00 0.00 179.45 180.62 1wmj h LYS 56 N -0.01 0.04 -3.57 3.15 1.57 0.04 -3.26 116.57 114.52 1wmj h LYS 56 Ca -0.16 -0.00 -0.71 0.00 -1.87 0.00 0.00 60.65 57.91 1wmj h LYS 56 Cb 1.74 -0.01 -0.34 0.00 0.08 0.00 0.00 32.23 33.71 1wmj h LYS 56 CO 0.19 0.03 -0.26 -0.06 -0.57 0.00 0.00 179.45 178.78 1wmj s PHE 57 N -5.05 3.50 -1.72 -1.35 0.08 0.43 -4.90 117.98 108.97 1wmj s PHE 57 Ca -0.05 -2.66 0.15 0.00 0.12 0.00 0.00 56.93 54.49 1wmj s PHE 57 Cb 0.20 -3.29 0.84 0.00 -0.57 0.00 0.00 43.02 40.20 1wmj s PHE 57 CO 0.73 -0.85 1.38 -0.35 -0.10 0.00 0.00 175.22 176.03 1wmj n PRO 58 N 3.40 0.35 -0.60 0.24 -0.04 -1.23 -2.68 135.00 134.43 1wmj n PRO 58 Ca 0.10 0.07 0.05 0.00 -0.04 0.00 0.00 63.50 63.69 1wmj n PRO 58 Cb 0.39 -1.50 0.28 0.00 -0.04 0.00 0.00 33.50 32.63 1wmj n PRO 58 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1wmj n GLY 59 N -0.02 2.45 3.37 0.55 0.00 -1.26 -4.91 105.19 105.36 1wmj n GLY 59 Ca 0.09 -0.64 -0.10 0.00 0.00 0.00 0.00 46.02 45.38 1wmj n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wmj s ALA 60 N -2.16 -0.39 -0.18 4.61 0.00 -1.09 -1.24 121.76 121.31 1wmj s ALA 60 Ca 0.38 -0.57 0.03 0.00 0.00 0.00 0.00 51.96 51.79 1wmj s ALA 60 Cb 0.28 0.79 -0.22 0.00 0.00 0.00 0.00 23.12 23.97 1wmj s ALA 60 CO 0.12 -0.67 0.12 1.33 0.00 0.00 0.00 175.76 176.66 1wmj n VAL 61 N -0.23 1.59 -1.58 0.00 0.24 -0.85 -4.92 118.33 112.58 1wmj n VAL 61 Ca -0.10 -0.67 0.00 0.00 -2.04 0.00 0.00 64.34 61.53 1wmj n VAL 61 Cb 0.63 -1.34 -0.00 0.00 -1.47 0.00 0.00 33.84 31.65 1wmj n VAL 61 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 1wmj n PHE 62 N -3.24 -4.19 0.00 6.34 3.01 -1.26 -4.67 117.46 113.46 1wmj n PHE 62 Ca -0.36 2.27 0.00 0.00 1.01 0.00 0.00 57.45 60.37 1wmj n PHE 62 Cb 1.04 -3.51 0.00 0.00 -0.01 0.00 0.00 39.48 37.00 1wmj n PHE 62 CO 0.00 0.00 0.00 -0.11 1.01 0.00 0.00 176.76 177.66 1wmj n LEU 63 N -2.64 0.00 -4.05 4.37 7.94 -0.12 -3.82 117.00 118.67 1wmj n LEU 63 Ca -0.00 0.00 -0.27 0.00 -1.11 0.00 0.00 56.01 54.63 1wmj n LEU 63 Cb 0.48 0.00 -0.17 0.00 0.53 0.00 0.00 43.42 44.26 1wmj n LEU 63 CO 0.00 0.00 -0.49 -0.75 -1.11 0.00 0.00 177.39 175.04 1wmj s LYS 64 N -2.00 2.04 0.32 1.96 2.20 0.60 0.49 119.74 125.36 1wmj s LYS 64 Ca 0.00 -0.51 0.07 0.00 -0.36 0.00 0.00 55.97 55.17 1wmj s LYS 64 Cb 0.00 -1.70 -0.06 0.00 -1.51 0.00 0.00 37.83 34.56 1wmj s LYS 64 CO 0.00 -0.01 -0.04 0.14 -0.36 0.00 0.00 175.35 175.09 1wmj s VAL 65 N 0.81 1.77 -0.22 4.02 -7.23 -1.15 0.24 120.40 118.63 1wmj s VAL 65 Ca -0.11 -2.10 -0.05 0.00 -1.81 0.00 0.00 61.98 57.91 1wmj s VAL 65 Cb -0.16 -2.65 -0.01 0.00 0.56 0.00 0.00 36.38 34.13 1wmj s VAL 65 CO 0.02 -0.18 -0.02 -0.62 -0.31 0.00 0.00 175.10 173.99 1wmj s ASP 66 N -3.53 4.51 -0.07 4.85 2.15 -1.26 -3.47 116.67 119.85 1wmj s ASP 66 Ca 0.32 -0.33 0.00 0.00 0.43 0.00 0.00 52.55 52.97 1wmj s ASP 66 Cb 0.05 -1.78 0.07 0.00 -0.30 0.00 0.00 42.92 40.96 1wmj s ASP 66 CO 0.15 -0.01 1.55 1.33 -0.17 0.00 0.00 175.17 178.02 1wmj n VAL 67 N 4.75 1.74 0.00 1.11 0.24 -0.45 -2.92 118.33 122.79 1wmj n VAL 67 Ca -0.18 -0.52 0.00 0.00 -2.04 0.00 0.00 64.34 61.60 1wmj n VAL 67 Cb 0.51 -1.19 0.00 0.00 -1.47 0.00 0.00 33.84 31.69 1wmj n VAL 67 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1wmj n ASP 68 N 0.73 3.27 -0.02 -1.34 2.03 -1.26 -4.35 116.55 115.61 1wmj n ASP 68 Ca 0.08 -0.03 -0.02 0.00 0.52 0.00 0.00 54.79 55.34 1wmj n ASP 68 Cb 0.59 0.71 -0.02 0.00 -0.72 0.00 0.00 41.12 41.67 1wmj n ASP 68 CO 0.00 0.00 0.00 -1.84 -1.92 0.00 0.00 177.20 173.44 1wmj n GLU 69 N -1.03 2.46 -0.60 -0.67 0.28 -1.19 -4.75 120.64 115.13 1wmj n GLU 69 Ca 0.00 0.01 0.06 0.00 -0.16 0.00 0.00 57.16 57.06 1wmj n GLU 69 Cb 0.00 -1.08 0.11 0.00 1.43 0.00 0.00 31.44 31.90 1wmj n GLU 69 CO 0.00 0.00 0.00 1.47 -0.16 0.00 0.00 177.13 178.44 1wmj n LEU 70 N -2.27 1.69 -0.34 -1.84 -0.00 -1.15 -4.86 117.00 108.24 1wmj n LEU 70 Ca -0.05 -2.67 0.27 0.00 -0.00 0.00 0.00 56.01 53.56 1wmj n LEU 70 Cb 0.59 -0.28 0.45 0.00 -0.00 0.00 0.00 43.42 44.17 1wmj n LEU 70 CO 0.06 0.77 0.80 2.29 -0.00 0.00 0.00 177.39 181.31 1wmj n LYS 71 N -0.65 -0.02 -0.47 1.47 2.85 -1.25 0.15 118.16 120.24 1wmj n LYS 71 Ca 0.11 0.75 0.37 0.00 -1.05 0.00 0.00 58.31 58.50 1wmj n LYS 71 Cb 0.77 -1.54 0.58 0.00 -0.65 0.00 0.00 35.03 34.19 1wmj n LYS 71 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 177.40 176.50 1wmj n GLU 72 N -3.71 0.00 0.04 -1.58 0.00 -1.26 0.25 120.64 114.38 1wmj n GLU 72 Ca 0.26 0.85 -0.19 0.00 0.00 0.00 0.00 57.16 58.08 1wmj n GLU 72 Cb 1.05 -2.01 -0.14 0.00 0.00 0.00 0.00 31.44 30.34 1wmj n GLU 72 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 1wmj h VAL 73 N 0.00 1.53 -0.23 3.84 2.07 -0.70 -3.23 116.25 119.54 1wmj h VAL 73 Ca 0.66 -2.50 -0.12 0.00 0.82 0.00 0.00 66.70 65.56 1wmj h VAL 73 Cb 2.85 3.19 -0.01 0.00 -1.52 0.00 0.00 31.29 35.80 1wmj h VAL 73 CO -0.01 0.70 -0.38 0.00 0.02 0.00 0.00 177.57 177.90 1wmj h ALA 74 N 0.09 0.91 0.00 1.67 0.00 0.31 -2.76 119.26 119.49 1wmj h ALA 74 Ca -0.13 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 54.34 1wmj h ALA 74 Cb 1.57 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.25 1wmj h ALA 74 CO 0.14 0.63 -0.09 0.93 0.00 0.00 0.00 179.25 180.86 1wmj h GLU 75 N 0.43 0.00 0.04 0.00 5.08 -0.83 0.73 114.58 120.04 1wmj h GLU 75 Ca 0.04 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.17 1wmj h GLU 75 Cb 0.86 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.11 1wmj h GLU 75 CO 0.07 0.09 -1.03 1.57 -1.00 0.00 0.00 179.01 178.72 1wmj h LYS 76 N 0.00 0.26 0.00 2.33 2.10 -1.50 -3.25 116.57 116.51 1wmj h LYS 76 Ca -0.00 -0.34 0.00 0.00 -2.00 0.00 0.00 60.65 58.31 1wmj h LYS 76 Cb 0.20 0.11 0.00 0.00 -0.90 0.00 0.00 32.23 31.65 1wmj h LYS 76 CO 0.01 1.08 -0.89 0.66 -2.00 0.00 0.00 179.45 178.32 1wmj n TYR 77 N -3.61 0.20 -2.65 0.07 4.01 -0.76 -5.01 117.16 109.41 1wmj n TYR 77 Ca -0.06 0.06 -0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1wmj n TYR 77 Cb 0.90 -0.36 0.00 0.00 -0.31 0.00 0.00 39.34 39.57 1wmj n TYR 77 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1wmj n ASN 78 N -1.82 -6.25 -0.03 7.72 4.05 0.25 -4.98 115.26 114.19 1wmj n ASN 78 Ca 0.03 -0.06 0.04 0.00 0.45 0.00 0.00 54.58 55.04 1wmj n ASN 78 Cb 0.40 -4.17 -0.14 0.00 1.23 0.00 0.00 39.78 37.10 1wmj n ASN 78 CO 0.00 0.00 0.00 1.33 -3.05 0.00 0.00 177.26 175.54 1wmj n VAL 79 N -1.59 0.35 0.00 3.44 0.24 -1.04 -5.03 118.33 114.71 1wmj n VAL 79 Ca -0.00 -0.51 0.00 0.00 -2.04 0.00 0.00 64.34 61.79 1wmj n VAL 79 Cb 0.50 -0.11 0.00 0.00 -1.47 0.00 0.00 33.84 32.76 1wmj n VAL 79 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1wmj n GLU 80 N -2.29 0.00 0.00 7.34 -0.58 -1.26 -4.17 120.64 119.68 1wmj n GLU 80 Ca -0.11 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.63 1wmj n GLU 80 Cb 0.65 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.52 1wmj n GLU 80 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1wmj n ALA 81 N 0.00 0.00 -2.30 0.62 0.00 -1.26 -5.03 120.51 112.54 1wmj n ALA 81 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 1wmj n ALA 81 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 1wmj n ALA 81 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1wmj s MET 82 N 0.00 1.27 0.00 0.00 -1.94 -1.26 -3.79 119.30 113.59 1wmj s MET 82 Ca 0.00 -1.62 0.00 0.00 -1.71 0.00 0.00 55.69 52.36 1wmj s MET 82 Cb 0.00 0.29 0.00 0.00 2.01 0.00 0.00 34.83 37.13 1wmj s MET 82 CO 0.00 -0.43 0.29 -0.35 -0.01 0.00 0.00 175.02 174.52 1wmj n PRO 83 N -0.31 0.49 -1.57 2.03 -0.04 -1.26 -1.50 135.00 132.84 1wmj n PRO 83 Ca 0.02 0.00 -0.56 0.00 -0.04 0.00 0.00 63.50 62.92 1wmj n PRO 83 Cb 0.65 -1.25 -0.07 0.00 -0.04 0.00 0.00 33.50 32.80 1wmj n PRO 83 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1wmj n THR 84 N 0.35 0.02 -0.63 0.52 -1.04 -1.26 0.65 114.28 112.89 1wmj n THR 84 Ca 0.00 -0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 61.90 1wmj n THR 84 Cb 0.14 -0.53 0.03 0.00 -1.82 0.00 0.00 70.33 68.15 1wmj n THR 84 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1wmj n PHE 85 N 2.44 1.02 -0.71 -1.42 3.72 -1.25 -0.79 117.46 120.46 1wmj n PHE 85 Ca 0.20 -1.56 -0.24 0.00 -0.05 0.00 0.00 57.45 55.81 1wmj n PHE 85 Cb 0.13 -0.76 -0.01 0.00 -0.94 0.00 0.00 39.48 37.90 1wmj n PHE 85 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 176.76 176.60 1wmj n LEU 86 N 0.64 -1.11 -4.43 4.37 -0.00 -0.30 -4.13 117.00 112.04 1wmj n LEU 86 Ca 0.20 0.51 -0.25 0.00 -0.00 0.00 0.00 56.01 56.47 1wmj n LEU 86 Cb 0.59 -0.48 -0.11 0.00 -0.00 0.00 0.00 43.42 43.42 1wmj n LEU 86 CO 0.25 -1.91 -0.50 -0.36 -0.00 0.00 0.00 177.39 174.87 1wmj s PHE 87 N -0.71 2.23 -0.41 1.96 0.40 0.54 0.27 117.98 122.25 1wmj s PHE 87 Ca 0.32 -0.37 0.06 0.00 -0.60 0.00 0.00 56.93 56.35 1wmj s PHE 87 Cb -0.41 -1.04 0.21 0.00 0.51 0.00 0.00 43.02 42.29 1wmj s PHE 87 CO 0.31 0.58 0.47 -0.89 0.70 0.00 0.00 175.22 176.39 1wmj n ILE 88 N -0.17 -0.87 -2.54 0.64 2.08 -1.04 -2.64 119.36 114.83 1wmj n ILE 88 Ca -0.09 -3.46 -0.43 0.00 0.56 0.00 0.00 62.75 59.33 1wmj n ILE 88 Cb 0.58 -1.49 -0.02 0.00 -0.75 0.00 0.00 39.64 37.95 1wmj n ILE 88 CO 0.00 0.00 0.00 -0.75 0.56 0.00 0.00 176.55 176.36 1wmj s LYS 89 N -0.42 4.30 0.00 0.38 2.20 -1.26 -2.93 119.74 122.00 1wmj s LYS 89 Ca 0.34 1.54 0.00 0.00 -0.36 0.00 0.00 55.97 57.49 1wmj s LYS 89 Cb 0.11 -3.65 0.00 0.00 -1.51 0.00 0.00 37.83 32.78 1wmj s LYS 89 CO -0.15 -0.57 0.00 -3.47 -0.36 0.00 0.00 175.35 170.80 1wmj n ASP 90 N 5.97 0.00 0.00 1.43 2.03 -1.26 -3.74 116.55 120.98 1wmj n ASP 90 Ca 0.12 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.43 1wmj n ASP 90 Cb 0.46 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.86 1wmj n ASP 90 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1wmj n GLY 91 N -2.00 0.88 0.00 0.27 0.00 -1.15 -4.74 105.19 98.45 1wmj n GLY 91 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1wmj n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wmj n ALA 92 N 0.00 0.80 -3.15 4.61 0.00 -1.24 -5.11 120.51 116.42 1wmj n ALA 92 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 1wmj n ALA 92 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 1wmj n ALA 92 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1wmj s GLU 93 N 0.00 0.16 -0.02 0.00 2.12 -1.26 -4.70 118.70 115.00 1wmj s GLU 93 Ca 0.00 0.21 0.04 0.00 0.36 0.00 0.00 54.97 55.58 1wmj s GLU 93 Cb 0.00 0.11 -0.25 0.00 0.26 0.00 0.00 34.13 34.25 1wmj s GLU 93 CO 0.00 -0.24 0.76 0.00 -0.54 0.00 0.00 175.26 175.24 1wmj h ALA 94 N 7.61 0.50 0.00 6.30 0.00 -1.78 -3.45 119.26 128.44 1wmj h ALA 94 Ca -0.11 -1.27 0.00 0.00 0.00 0.00 0.00 54.91 53.54 1wmj h ALA 94 Cb 1.18 0.37 0.00 0.00 0.00 0.00 0.00 17.79 19.34 1wmj h ALA 94 CO -0.10 1.35 0.00 -0.25 0.00 0.00 0.00 179.25 180.25 1wmj n ASP 95 N -3.29 0.00 -4.24 0.00 8.00 -1.26 -5.00 116.55 110.77 1wmj n ASP 95 Ca -0.17 0.00 -0.19 0.00 0.71 0.00 0.00 54.79 55.15 1wmj n ASP 95 Cb 1.03 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 42.04 1wmj n ASP 95 CO 0.00 0.00 0.00 -1.59 -0.39 0.00 0.00 177.20 175.22 1wmj s LYS 96 N -1.90 1.54 0.00 -1.24 0.00 -1.26 0.20 119.74 117.07 1wmj s LYS 96 Ca 0.00 -1.86 0.00 0.00 0.00 0.00 0.00 55.97 54.11 1wmj s LYS 96 Cb 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 37.83 37.49 1wmj s LYS 96 CO 0.00 -0.33 0.00 0.28 0.00 0.00 0.00 175.35 175.30 1wmj n VAL 97 N -0.56 0.00 0.00 1.79 0.31 -1.26 -4.89 118.33 113.71 1wmj n VAL 97 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 1wmj n VAL 97 Cb 0.66 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.59 1wmj n VAL 97 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 1wmj n VAL 98 N 0.00 0.00 -0.73 2.52 0.31 -1.26 -4.43 118.33 114.74 1wmj n VAL 98 Ca 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 64.34 64.27 1wmj n VAL 98 Cb 0.00 0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 32.87 1wmj n VAL 98 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1wmj n GLY 99 N -0.14 2.85 0.20 2.92 0.00 0.21 -3.14 105.19 108.09 1wmj n GLY 99 Ca 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.47 1wmj n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wmj n ALA 100 N 1.72 1.41 -3.98 4.61 0.00 -1.26 -4.54 120.51 118.46 1wmj n ALA 100 Ca 0.18 -0.34 -0.30 0.00 0.00 0.00 0.00 53.44 52.98 1wmj n ALA 100 Cb 0.65 -0.10 -0.16 0.00 0.00 0.00 0.00 19.45 19.84 1wmj n ALA 100 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1wmj s ARG 101 N 0.00 1.94 -0.02 0.00 3.00 -1.19 -4.98 118.95 117.71 1wmj s ARG 101 Ca 0.00 -0.86 0.09 0.00 0.00 0.00 0.00 55.73 54.96 1wmj s ARG 101 Cb 0.00 -2.43 0.31 0.00 0.00 0.00 0.00 34.95 32.83 1wmj s ARG 101 CO 0.00 -0.46 1.21 1.17 0.00 0.00 0.00 175.30 177.22 1wmj n LYS 102 N 4.69 1.95 0.00 3.54 0.00 -1.26 -2.75 118.16 124.33 1wmj n LYS 102 Ca -0.14 -1.23 0.00 0.00 0.00 0.00 0.00 58.31 56.94 1wmj n LYS 102 Cb 0.46 -1.37 0.00 0.00 0.00 0.00 0.00 35.03 34.12 1wmj n LYS 102 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 1wmj n ASP 103 N 0.43 0.24 -0.04 3.14 5.75 -1.26 -4.80 116.55 120.00 1wmj n ASP 103 Ca 0.11 -0.66 -0.05 0.00 -0.01 0.00 0.00 54.79 54.18 1wmj n ASP 103 Cb 0.36 0.17 -0.05 0.00 -1.03 0.00 0.00 41.12 40.56 1wmj n ASP 103 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 1wmj n ASP 104 N -0.17 3.21 0.00 -1.12 2.03 -1.23 -4.44 116.55 114.83 1wmj n ASP 104 Ca 0.00 -0.03 0.00 0.00 0.52 0.00 0.00 54.79 55.28 1wmj n ASP 104 Cb 0.09 0.27 0.00 0.00 -0.72 0.00 0.00 41.12 40.76 1wmj n ASP 104 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 1wmj n LEU 105 N -2.52 0.00 0.20 -2.67 7.94 -1.11 -1.43 117.00 117.42 1wmj n LEU 105 Ca -0.15 0.96 0.17 0.00 -1.11 0.00 0.00 56.01 55.89 1wmj n LEU 105 Cb 0.71 -0.48 0.72 0.00 0.53 0.00 0.00 43.42 44.91 1wmj n LEU 105 CO 0.13 -0.48 1.15 0.06 -1.11 0.00 0.00 177.39 177.14 1wmj h GLN 106 N 0.00 0.00 0.00 1.96 -0.00 -1.87 0.62 115.11 115.83 1wmj h GLN 106 Ca 0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 58.65 58.48 1wmj h GLN 106 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 27.46 1wmj h GLN 106 CO 0.00 0.00 -0.81 -0.91 -0.00 0.00 0.00 178.83 177.11 1wmj h ASN 107 N 0.00 0.04 0.19 0.06 -0.26 -1.71 -3.03 115.58 110.88 1wmj h ASN 107 Ca 0.11 -0.03 -0.33 0.00 -0.56 0.00 0.00 56.30 55.48 1wmj h ASN 107 Cb 1.03 -0.01 0.01 0.00 -1.06 0.00 0.00 38.32 38.29 1wmj h ASN 107 CO -0.00 0.83 -1.63 0.74 -1.06 0.00 0.00 177.43 176.31 1wmj h THR 108 N 0.02 1.03 0.00 2.81 2.02 0.14 -3.28 112.91 115.65 1wmj h THR 108 Ca -0.01 -2.53 -0.01 0.00 0.77 0.00 0.00 66.41 64.63 1wmj h THR 108 Cb 1.42 2.82 -0.00 0.00 -1.74 0.00 0.00 68.15 70.65 1wmj h THR 108 CO 0.11 0.82 -0.04 0.40 0.37 0.00 0.00 175.52 177.19 1wmj h ILE 109 N 0.04 0.44 0.00 3.11 5.03 -1.31 -1.01 117.51 123.80 1wmj h ILE 109 Ca -0.32 -0.17 -0.18 0.00 -0.12 0.00 0.00 64.86 64.07 1wmj h ILE 109 Cb 2.05 1.12 -0.03 0.00 -3.03 0.00 0.00 36.82 36.93 1wmj h ILE 109 CO 0.18 0.03 -0.87 -0.37 -0.68 0.00 0.00 178.15 176.44 1wmj h VAL 110 N 0.00 1.51 0.00 1.67 -1.51 -1.62 0.89 116.25 117.19 1wmj h VAL 110 Ca -0.00 -3.09 -0.18 0.00 -1.23 0.00 0.00 66.70 62.20 1wmj h VAL 110 Cb 0.11 2.72 -0.03 0.00 -2.13 0.00 0.00 31.29 31.96 1wmj h VAL 110 CO 0.00 0.85 -0.95 0.07 -1.23 0.00 0.00 177.57 176.32 1wmj h LYS 111 N 0.00 0.00 0.00 5.19 2.10 -1.28 -0.41 116.57 122.17 1wmj h LYS 111 Ca -0.01 0.00 -0.45 0.00 -2.00 0.00 0.00 60.65 58.19 1wmj h LYS 111 Cb 1.65 0.00 -0.07 0.00 -0.90 0.00 0.00 32.23 32.91 1wmj h LYS 111 CO 0.11 0.75 -2.52 0.72 -2.00 0.00 0.00 179.45 176.51 1wmj n HIS 112 N -3.25 0.00 -0.05 0.07 8.25 -0.63 -4.17 115.22 115.43 1wmj n HIS 112 Ca -0.02 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.34 1wmj n HIS 112 Cb 0.88 -0.98 -0.15 0.00 1.12 0.00 0.00 29.99 30.86 1wmj n HIS 112 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1wmj n VAL 113 N -4.08 1.53 0.96 1.59 0.31 0.27 -4.09 118.33 114.82 1wmj n VAL 113 Ca -0.53 -0.81 0.13 0.00 -0.01 0.00 0.00 64.34 63.12 1wmj n VAL 113 Cb 0.90 -0.87 0.58 0.00 -0.91 0.00 0.00 33.84 33.54 1wmj n VAL 113 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1wmj n GLY 114 N 1.67 -1.36 4.05 2.92 0.00 0.11 -4.78 105.19 107.81 1wmj n GLY 114 Ca -0.25 -0.10 -0.35 0.00 0.00 0.00 0.00 46.02 45.33 1wmj n GLY 114 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wmj n ALA 115 N -1.46 -1.11 0.00 4.61 0.00 -0.41 -4.32 120.51 117.81 1wmj n ALA 115 Ca 0.07 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1wmj n ALA 115 Cb 0.29 -1.93 0.00 0.00 0.00 0.00 0.00 19.45 17.81 1wmj n ALA 115 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1wmj n THR 116 N -3.54 0.00 -1.01 0.00 -1.04 -1.06 -5.06 114.28 102.57 1wmj n THR 116 Ca 0.05 0.00 0.12 0.00 -2.04 0.00 0.00 64.05 62.19 1wmj n THR 116 Cb 0.40 0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 68.88 1wmj n THR 116 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1wmj n ALA 117 N -0.84 -3.15 -2.61 2.41 0.00 -0.46 -4.92 120.51 110.94 1wmj n ALA 117 Ca 0.00 0.36 -0.16 0.00 0.00 0.00 0.00 53.44 53.63 1wmj n ALA 117 Cb 0.00 -1.06 -0.11 0.00 0.00 0.00 0.00 19.45 18.28 1wmj n ALA 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wmj s ALA 118 N -2.34 1.15 -0.18 0.00 0.00 -1.26 -4.93 121.76 114.20 1wmj s ALA 118 Ca 0.00 -1.09 -0.29 0.00 0.00 0.00 0.00 51.96 50.57 1wmj s ALA 118 Cb 0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 23.12 23.07 1wmj s ALA 118 CO 0.00 0.07 1.26 0.45 0.00 0.00 0.00 175.76 177.53 1wmj s SER 119 N -2.10 6.92 0.22 0.00 0.15 -1.26 -4.99 113.70 112.64 1wmj s SER 119 Ca 0.02 1.62 -0.10 0.00 0.70 0.00 0.00 55.95 58.19 1wmj s SER 119 Cb -0.07 -2.54 -0.01 0.00 -1.71 0.00 0.00 66.02 61.69 1wmj s SER 119 CO 0.01 -0.80 0.38 0.00 1.20 0.00 0.00 173.24 174.04 1wmj s ALA 120 N 3.59 0.07 0.17 5.45 0.00 -1.26 -5.09 121.76 124.70 1wmj s ALA 120 Ca 0.54 -1.03 0.00 0.00 0.00 0.00 0.00 51.96 51.47 1wmj s ALA 120 Cb -0.21 1.10 0.00 0.00 0.00 0.00 0.00 23.12 24.01 1wmj s ALA 120 CO 0.15 -0.77 0.00 0.43 0.00 0.00 0.00 175.76 175.57 1wmj n SER 121 N -0.33 -0.13 0.00 0.00 7.64 -1.26 -5.32 113.62 114.22 1wmj n SER 121 Ca -0.02 0.30 0.00 0.00 1.01 0.00 0.00 58.87 60.16 1wmj n SER 121 Cb 0.63 0.27 0.00 0.00 -1.01 0.00 0.00 64.21 64.10 1wmj n SER 121 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03