#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 -0.94 3.04 0.00 -1.26 -4.86 120.51 116.49 1wmj n ALA 2 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 1wmj n ALA 2 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 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 -0.04 -2.65 0.00 0.00 -1.26 -4.54 120.51 109.02 1wmj n ALA 3 Ca 0.00 0.04 -0.03 0.00 0.00 0.00 0.00 53.44 53.46 1wmj n ALA 3 Cb 0.00 -1.33 0.05 0.00 0.00 0.00 0.00 19.45 18.17 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 0.37 0.06 0.00 0.00 2.13 -1.26 -4.77 120.64 117.17 1wmj n GLU 4 Ca -0.03 -0.57 0.00 0.00 0.66 0.00 0.00 57.16 57.22 1wmj n GLU 4 Cb 0.44 -0.03 0.00 0.00 0.27 0.00 0.00 31.44 32.12 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 0.02 3.58 0.00 5.31 -0.58 -1.26 -4.90 120.64 122.80 1wmj n GLU 5 Ca -0.18 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.56 1wmj n GLU 5 Cb 0.70 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.57 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 1.40 3.98 0.62 0.00 -1.26 -4.79 105.19 110.15 1wmj n GLY 6 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 1wmj n GLY 6 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1wmj s VAL 7 N -1.03 2.14 -0.76 1.61 -7.23 -1.26 -3.44 120.40 110.42 1wmj s VAL 7 Ca 0.00 -1.16 -0.24 0.00 -1.81 0.00 0.00 61.98 58.77 1wmj s VAL 7 Cb 0.00 -2.30 -0.16 0.00 0.56 0.00 0.00 36.38 34.48 1wmj s VAL 7 CO 0.00 0.00 2.43 1.33 -0.31 0.00 0.00 175.10 178.55 1wmj n VAL 8 N -2.02 -0.03 -0.89 1.32 0.24 -1.24 -4.81 118.33 110.90 1wmj n VAL 8 Ca 0.09 -0.52 -0.36 0.00 -2.04 0.00 0.00 64.34 61.51 1wmj n VAL 8 Cb 0.62 -1.68 0.08 0.00 -1.47 0.00 0.00 33.84 31.39 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 7.75 0.00 -3.30 1.34 2.08 -1.26 -4.43 119.36 121.56 1wmj n ILE 9 Ca 0.50 -0.14 -0.23 0.00 0.56 0.00 0.00 62.75 63.44 1wmj n ILE 9 Cb 0.35 -0.21 -0.08 0.00 -0.75 0.00 0.00 39.64 38.94 1wmj n ILE 9 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1wmj s ALA 10 N -2.09 0.71 1.01 -1.39 0.00 -1.26 0.14 121.76 118.89 1wmj s ALA 10 Ca 0.43 -2.01 -0.13 0.00 0.00 0.00 0.00 51.96 50.26 1wmj s ALA 10 Cb 0.00 -1.79 0.20 0.00 0.00 0.00 0.00 23.12 21.53 1wmj s ALA 10 CO 0.68 -2.03 0.45 0.00 0.00 0.00 0.00 175.76 174.85 1wmj n HIS 12 N -4.45 0.00 0.00 0.00 8.25 -1.26 -4.69 115.22 113.07 1wmj n HIS 12 Ca 0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.53 1wmj n HIS 12 Cb 0.31 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.42 1wmj n HIS 12 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1wmj n ASN 13 N 0.00 0.00 0.00 0.41 6.94 -1.26 -4.97 115.26 116.38 1wmj n ASN 13 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.56 1wmj n ASN 13 Cb 0.00 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.42 1wmj n ASN 13 CO 0.00 0.00 0.00 1.17 -1.03 0.00 0.00 177.26 177.40 1wmj n LYS 14 N 0.00 0.00 -0.16 -3.83 4.81 -1.26 -4.29 118.16 113.43 1wmj n LYS 14 Ca 0.00 0.00 0.15 0.00 -0.87 0.00 0.00 58.31 57.59 1wmj n LYS 14 Cb 0.00 0.00 0.27 0.00 0.02 0.00 0.00 35.03 35.32 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 0.80 0.14 0.09 3.14 2.03 -1.26 0.34 116.55 121.84 1wmj n ASP 15 Ca 0.00 0.82 -0.22 0.00 0.52 0.00 0.00 54.79 55.91 1wmj n ASP 15 Cb 0.00 -0.38 -0.15 0.00 -0.72 0.00 0.00 41.12 39.87 1wmj n ASP 15 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 1wmj h GLU 16 N 0.00 0.44 -0.96 -0.67 5.08 -1.97 -3.17 114.58 113.33 1wmj h GLU 16 Ca 0.40 -0.71 0.11 0.00 -1.00 0.00 0.00 59.36 58.16 1wmj h GLU 16 Cb 1.03 0.26 -0.08 0.00 0.50 0.00 0.00 28.75 30.47 1wmj h GLU 16 CO -0.39 1.33 0.61 0.35 -1.00 0.00 0.00 179.01 179.92 1wmj h PHE 17 N -0.07 1.07 -0.11 4.33 3.04 0.55 -0.22 116.94 125.53 1wmj h PHE 17 Ca -0.19 0.03 -0.11 0.00 3.98 0.00 0.00 57.97 61.68 1wmj h PHE 17 Cb 1.86 -0.34 -0.01 0.00 2.56 0.00 0.00 35.95 40.02 1wmj h PHE 17 CO 0.16 0.46 -0.42 -0.44 -2.02 0.00 0.00 178.31 176.05 1wmj h ASP 18 N 0.96 0.26 0.00 0.41 3.32 -1.11 -2.76 116.42 117.50 1wmj h ASP 18 Ca 0.46 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.40 1wmj h ASP 18 Cb 0.45 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.93 1wmj h ASP 18 CO -0.22 0.65 0.37 0.00 -1.72 0.00 0.00 179.24 178.32 1wmj h ALA 19 N 1.36 1.30 0.00 3.45 0.00 -1.00 -1.63 119.26 122.75 1wmj h ALA 19 Ca 0.02 0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.69 1wmj h ALA 19 Cb 0.83 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.58 1wmj h ALA 19 CO 0.07 -0.30 -1.71 1.04 0.00 0.00 0.00 179.25 178.35 1wmj n GLN 20 N -2.33 0.40 0.05 0.00 3.00 -1.06 -4.03 117.38 113.42 1wmj n GLN 20 Ca -0.01 0.17 0.20 0.00 -0.01 0.00 0.00 57.00 57.35 1wmj n GLN 20 Cb 0.40 -1.17 0.58 0.00 0.00 0.00 0.00 30.24 30.04 1wmj n GLN 20 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.06 177.58 1wmj h MET 21 N -0.69 0.00 0.00 -1.09 2.86 -1.24 1.28 114.93 116.05 1wmj h MET 21 Ca -0.36 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.13 1wmj h MET 21 Cb 1.23 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.87 1wmj h MET 21 CO -0.22 0.00 -1.49 2.41 1.06 0.00 0.00 176.91 178.67 1wmj n THR 22 N -3.30 1.06 0.62 2.22 -1.04 -0.67 -4.01 114.28 109.16 1wmj n THR 22 Ca 0.10 -0.68 -0.03 0.00 -2.04 0.00 0.00 64.05 61.41 1wmj n THR 22 Cb 0.92 -0.62 0.04 0.00 -1.82 0.00 0.00 70.33 68.85 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 -2.81 1.32 0.00 -2.82 5.02 0.44 -3.57 118.16 115.75 1wmj n LYS 23 Ca -0.10 -0.54 0.00 0.00 -2.02 0.00 0.00 58.31 55.65 1wmj n LYS 23 Cb 0.81 -1.30 0.00 0.00 -0.02 0.00 0.00 35.03 34.52 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 0.19 2.46 -0.15 7.82 0.00 -1.19 -4.33 120.51 125.31 1wmj n ALA 24 Ca 0.09 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.41 1wmj n ALA 24 Cb 0.65 0.32 -0.01 0.00 0.00 0.00 0.00 19.45 20.41 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 0.99 0.12 0.00 2.10 -1.73 -0.37 116.57 117.68 1wmj h LYS 25 Ca 0.00 -0.45 -0.29 0.00 -2.00 0.00 0.00 60.65 57.91 1wmj h LYS 25 Cb 0.63 -0.02 -0.00 0.00 -0.90 0.00 0.00 32.23 31.94 1wmj h LYS 25 CO 0.00 1.12 -1.46 1.05 -2.00 0.00 0.00 179.45 178.16 1wmj h GLU 26 N 0.83 0.26 -0.09 0.07 4.11 -1.88 -3.34 114.58 114.54 1wmj h GLU 26 Ca 0.10 -0.44 -0.03 0.00 0.07 0.00 0.00 59.36 59.06 1wmj h GLU 26 Cb 0.85 0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.26 1wmj h GLU 26 CO 0.08 1.21 -0.07 0.00 0.07 0.00 0.00 179.01 180.30 1wmj h ALA 27 N -0.03 1.72 -0.31 1.06 0.00 -1.75 -3.47 119.26 116.49 1wmj h ALA 27 Ca -0.31 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1wmj h ALA 27 Cb 1.80 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.53 1wmj h ALA 27 CO 0.07 0.21 0.00 0.41 0.00 0.00 0.00 179.25 179.94 1wmj n GLY 28 N -1.16 1.05 3.15 0.00 0.00 -0.28 -5.01 105.19 102.94 1wmj n GLY 28 Ca -0.01 -0.40 -0.13 0.00 0.00 0.00 0.00 46.02 45.47 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 -2.61 0.79 0.89 1.61 -2.85 -0.40 -5.02 119.74 112.15 1wmj s LYS 29 Ca 0.00 -1.13 -0.11 0.00 -1.00 0.00 0.00 55.97 53.73 1wmj s LYS 29 Cb 0.00 -0.42 0.13 0.00 -2.06 0.00 0.00 37.83 35.48 1wmj s LYS 29 CO 0.00 0.05 1.09 0.08 0.10 0.00 0.00 175.35 176.68 1wmj s VAL 30 N -2.52 2.67 0.03 1.79 1.01 -0.81 -4.37 120.40 118.20 1wmj s VAL 30 Ca 0.04 0.22 0.06 0.00 0.00 0.00 0.00 61.98 62.30 1wmj s VAL 30 Cb -0.02 -2.59 -0.03 0.00 0.00 0.00 0.00 36.38 33.73 1wmj s VAL 30 CO -0.01 -0.28 -0.14 -0.69 0.00 0.00 0.00 175.10 173.97 1wmj s VAL 31 N -2.84 3.06 -0.31 2.92 1.01 -1.23 -2.35 120.40 120.66 1wmj s VAL 31 Ca 0.64 -1.05 -0.02 0.00 0.00 0.00 0.00 61.98 61.55 1wmj s VAL 31 Cb -0.19 -2.31 0.12 0.00 0.00 0.00 0.00 36.38 34.00 1wmj s VAL 31 CO 0.58 0.36 0.20 -0.63 0.00 0.00 0.00 175.10 175.60 1wmj s ILE 32 N -0.95 -0.11 -0.23 2.22 1.09 -1.26 -2.58 121.20 119.38 1wmj s ILE 32 Ca 0.15 -0.94 -0.11 0.00 -1.10 0.00 0.00 60.65 58.66 1wmj s ILE 32 Cb -0.11 -0.99 -0.05 0.00 -1.06 0.00 0.00 42.46 40.26 1wmj s ILE 32 CO 0.06 -0.73 0.19 -0.63 -0.10 0.00 0.00 174.94 173.73 1wmj s ILE 33 N 1.87 5.34 -0.60 2.92 1.09 0.65 -1.23 121.20 131.24 1wmj s ILE 33 Ca 0.12 0.25 -0.12 0.00 -1.10 0.00 0.00 60.65 59.79 1wmj s ILE 33 Cb -0.17 -3.53 0.15 0.00 -1.06 0.00 0.00 42.46 37.85 1wmj s ILE 33 CO -0.25 0.34 0.52 -0.62 -0.10 0.00 0.00 174.94 174.83 1wmj s ASP 34 N 1.01 6.12 0.40 3.58 2.15 0.17 -0.34 116.67 129.74 1wmj s ASP 34 Ca 0.09 -2.14 0.00 0.00 0.43 0.00 0.00 52.55 50.93 1wmj s ASP 34 Cb -0.13 -2.12 0.00 0.00 -0.30 0.00 0.00 42.92 40.36 1wmj s ASP 34 CO 0.04 -0.70 0.00 0.49 -0.17 0.00 0.00 175.17 174.84 1wmj n PHE 35 N 4.68 -1.41 0.00 -5.34 3.72 -0.44 -1.14 117.46 117.53 1wmj n PHE 35 Ca -0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.37 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 -1.73 0.00 0.03 4.37 5.66 -0.76 -4.03 114.28 117.81 1wmj n THR 36 Ca 0.00 0.00 -0.08 0.00 -3.05 0.00 0.00 64.05 60.92 1wmj n THR 36 Cb 0.00 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 68.72 1wmj n THR 36 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1wmj h ALA 37 N 0.00 -0.17 0.00 1.79 0.00 -1.78 -0.53 119.26 118.57 1wmj h ALA 37 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1wmj h ALA 37 Cb 0.00 0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1wmj h ALA 37 CO 0.00 -0.20 0.00 0.45 0.00 0.00 0.00 179.25 179.50 1wmj n SER 38 N -4.87 0.00 0.10 0.00 2.88 -1.26 -4.43 113.62 106.04 1wmj n SER 38 Ca -0.06 0.00 -0.19 0.00 -1.33 0.00 0.00 58.87 57.29 1wmj n SER 38 Cb 0.23 0.00 -0.15 0.00 -0.75 0.00 0.00 64.21 63.54 1wmj n SER 38 CO 0.00 0.00 0.00 -0.50 -1.23 0.00 0.00 175.04 173.31 1wmj h TRP 39 N 0.00 0.62 -4.67 0.66 6.55 -1.95 -3.48 115.95 113.69 1wmj h TRP 39 Ca 0.00 -0.46 -0.36 0.00 0.95 0.00 0.00 58.89 59.02 1wmj h TRP 39 Cb 0.00 -0.02 -0.02 0.00 -0.86 0.00 0.00 29.16 28.26 1wmj h TRP 39 CO 0.00 1.42 -0.52 0.00 -1.05 0.00 0.00 178.44 178.29 1wmj n GLY 41 N -1.19 3.95 0.16 0.00 0.00 -1.26 -2.28 105.19 104.57 1wmj n GLY 41 Ca -0.09 0.10 -0.13 0.00 0.00 0.00 0.00 46.02 45.91 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 0.47 -3.35 1.61 0.13 -1.81 -3.46 132.00 125.59 1wmj h PRO 42 Ca 0.00 -0.25 -0.04 0.00 -0.87 0.00 0.00 66.00 64.84 1wmj h PRO 42 Cb 0.00 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.13 1wmj h PRO 42 CO 0.00 0.82 -0.05 0.00 -0.23 0.00 0.00 178.00 178.54 1wmj n ARG 44 N -1.85 0.00 0.12 0.00 1.74 -1.26 -4.75 116.66 110.66 1wmj n ARG 44 Ca -0.02 0.00 -0.24 0.00 -0.77 0.00 0.00 57.85 56.82 1wmj n ARG 44 Cb 0.30 -0.08 -0.15 0.00 -1.02 0.00 0.00 32.46 31.50 1wmj n ARG 44 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 1wmj h PHE 45 N 0.00 0.92 -0.55 -1.55 3.57 -1.98 -3.32 116.94 114.04 1wmj h PHE 45 Ca 0.00 -0.65 0.00 0.00 3.53 0.00 0.00 57.97 60.85 1wmj h PHE 45 Cb 0.00 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 38.69 1wmj h PHE 45 CO 0.00 1.50 0.00 1.51 -2.23 0.00 0.00 178.31 179.09 1wmj n ILE 46 N -3.81 0.97 0.17 1.41 3.06 -1.26 -4.60 119.36 115.31 1wmj n ILE 46 Ca -0.16 -0.99 -0.14 0.00 -2.50 0.00 0.00 62.75 58.96 1wmj n ILE 46 Cb 1.03 0.52 -0.07 0.00 0.54 0.00 0.00 39.64 41.67 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 3.28 -0.55 0.00 1.51 0.00 -1.86 -1.11 119.26 120.53 1wmj h ALA 47 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1wmj h ALA 47 Cb 0.87 0.39 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1wmj h ALA 47 CO 0.00 -0.84 0.00 -0.35 0.00 0.00 0.00 179.25 178.06 1wmj n PRO 48 N -5.39 0.49 -0.13 0.00 -0.04 -1.26 -2.96 135.00 125.71 1wmj n PRO 48 Ca -0.08 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.10 1wmj n PRO 48 Cb 0.30 -1.29 -0.10 0.00 -0.04 0.00 0.00 33.50 32.36 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 -0.79 1.53 0.00 0.52 0.31 -0.47 -4.01 118.33 115.43 1wmj n VAL 49 Ca 0.07 -0.38 0.00 0.00 -0.01 0.00 0.00 64.34 64.02 1wmj n VAL 49 Cb 0.03 -1.84 0.00 0.00 -0.91 0.00 0.00 33.84 31.12 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 -4.14 0.00 -0.27 3.52 3.72 -0.91 -0.11 117.46 119.27 1wmj n PHE 50 Ca -0.51 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 56.94 1wmj n PHE 50 Cb 0.88 -0.39 0.16 0.00 -0.94 0.00 0.00 39.48 39.19 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 0.76 -0.11 4.37 0.00 -1.85 0.80 119.26 121.23 1wmj h ALA 51 Ca 0.00 0.28 -0.05 0.00 0.00 0.00 0.00 54.91 55.14 1wmj h ALA 51 Cb 0.00 0.50 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1wmj h ALA 51 CO 0.00 -0.44 -0.15 1.05 0.00 0.00 0.00 179.25 179.71 1wmj h GLU 52 N 0.06 0.17 -0.12 0.00 4.11 -1.69 -2.91 114.58 114.20 1wmj h GLU 52 Ca 0.43 -0.04 -0.06 0.00 0.07 0.00 0.00 59.36 59.75 1wmj h GLU 52 Cb 0.75 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.97 1wmj h GLU 52 CO -0.75 0.33 -0.18 1.88 0.07 0.00 0.00 179.01 180.37 1wmj h TYR 53 N 0.16 0.41 -0.97 2.06 -1.99 0.40 -2.61 116.97 114.44 1wmj h TYR 53 Ca 0.03 -0.14 0.30 0.00 2.00 0.00 0.00 58.73 60.93 1wmj h TYR 53 Cb 0.37 -0.08 -0.17 0.00 2.00 0.00 0.00 36.73 38.85 1wmj h TYR 53 CO 0.00 0.78 0.21 0.00 -0.00 0.00 0.00 178.16 179.15 1wmj h ALA 54 N 0.56 1.46 0.05 3.88 0.00 -0.65 0.45 119.26 125.01 1wmj h ALA 54 Ca 0.01 0.30 -0.25 0.00 0.00 0.00 0.00 54.91 54.98 1wmj h ALA 54 Cb 0.74 0.47 0.02 0.00 0.00 0.00 0.00 17.79 19.02 1wmj h ALA 54 CO 0.04 -0.65 -1.00 0.87 0.00 0.00 0.00 179.25 178.51 1wmj h LYS 55 N 0.05 0.59 -0.36 0.00 1.57 -1.58 -3.21 116.57 113.63 1wmj h LYS 55 Ca 0.66 -0.70 0.10 0.00 -1.87 0.00 0.00 60.65 58.85 1wmj h LYS 55 Cb 1.48 0.21 -0.01 0.00 0.08 0.00 0.00 32.23 33.99 1wmj h LYS 55 CO -0.83 1.29 0.30 0.87 -0.57 0.00 0.00 179.45 180.51 1wmj h LYS 56 N 0.19 0.00 -3.48 3.15 1.57 0.17 -3.27 116.57 114.91 1wmj h LYS 56 Ca -0.14 0.00 -0.68 0.00 -1.87 0.00 0.00 60.65 57.96 1wmj h LYS 56 Cb 1.68 0.00 -0.37 0.00 0.08 0.00 0.00 32.23 33.62 1wmj h LYS 56 CO 0.19 0.00 -0.42 -0.06 -0.57 0.00 0.00 179.45 178.60 1wmj s PHE 57 N -4.87 3.38 -1.38 -1.35 0.08 0.14 -4.91 117.98 109.06 1wmj s PHE 57 Ca -0.05 -2.88 0.15 0.00 0.12 0.00 0.00 56.93 54.27 1wmj s PHE 57 Cb 0.18 -3.09 0.74 0.00 -0.57 0.00 0.00 43.02 40.27 1wmj s PHE 57 CO 0.65 -0.80 1.42 -0.35 -0.10 0.00 0.00 175.22 176.04 1wmj n PRO 58 N 3.24 0.19 -0.45 0.24 -0.04 -1.23 -2.74 135.00 134.21 1wmj n PRO 58 Ca 0.09 0.16 0.04 0.00 -0.04 0.00 0.00 63.50 63.74 1wmj n PRO 58 Cb 0.36 -1.50 0.20 0.00 -0.04 0.00 0.00 33.50 32.53 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 2.20 3.33 0.55 0.00 -1.26 -4.88 105.19 105.10 1wmj n GLY 59 Ca 0.07 -0.46 -0.09 0.00 0.00 0.00 0.00 46.02 45.53 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 -1.88 -0.39 -0.14 4.61 0.00 -1.11 -1.92 121.76 120.93 1wmj s ALA 60 Ca 0.27 -0.54 0.09 0.00 0.00 0.00 0.00 51.96 51.78 1wmj s ALA 60 Cb 0.21 0.72 -0.23 0.00 0.00 0.00 0.00 23.12 23.82 1wmj s ALA 60 CO 0.08 -0.63 0.28 1.33 0.00 0.00 0.00 175.76 176.82 1wmj n VAL 61 N -0.19 1.56 -1.30 0.00 0.24 -0.99 -4.94 118.33 112.69 1wmj n VAL 61 Ca -0.12 -0.75 0.15 0.00 -2.04 0.00 0.00 64.34 61.58 1wmj n VAL 61 Cb 0.63 -1.06 -0.08 0.00 -1.47 0.00 0.00 33.84 31.86 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 -3.07 -3.25 0.00 6.34 3.01 -1.26 -4.64 117.46 114.58 1wmj n PHE 62 Ca -0.29 1.80 0.00 0.00 1.01 0.00 0.00 57.45 59.96 1wmj n PHE 62 Cb 1.07 -2.96 0.00 0.00 -0.01 0.00 0.00 39.48 37.58 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 -4.14 0.00 -4.28 4.37 7.94 -0.37 -4.10 117.00 116.42 1wmj n LEU 63 Ca -0.08 0.00 -0.32 0.00 -1.11 0.00 0.00 56.01 54.50 1wmj n LEU 63 Cb 0.58 0.00 -0.16 0.00 0.53 0.00 0.00 43.42 44.37 1wmj n LEU 63 CO 0.03 0.00 -0.53 -1.59 -1.11 0.00 0.00 177.39 174.19 1wmj s LYS 64 N -2.00 2.97 0.12 1.96 -2.85 0.37 0.44 119.74 120.75 1wmj s LYS 64 Ca 0.00 -0.83 0.10 0.00 -1.00 0.00 0.00 55.97 54.24 1wmj s LYS 64 Cb 0.00 -2.34 -0.04 0.00 -2.06 0.00 0.00 37.83 33.39 1wmj s LYS 64 CO 0.00 0.26 -0.25 0.54 0.10 0.00 0.00 175.35 176.00 1wmj s VAL 65 N 0.16 2.38 -0.27 1.79 0.11 -0.30 -0.38 120.40 123.90 1wmj s VAL 65 Ca -0.12 -1.69 -0.10 0.00 -2.93 0.00 0.00 61.98 57.15 1wmj s VAL 65 Cb -0.16 -2.06 -0.04 0.00 -1.53 0.00 0.00 36.38 32.59 1wmj s VAL 65 CO 0.06 0.10 0.15 -0.62 -3.33 0.00 0.00 175.10 171.47 1wmj s ASP 66 N -2.04 5.76 -0.25 3.54 2.15 -1.26 -2.68 116.67 121.87 1wmj s ASP 66 Ca 0.15 -0.06 -0.00 0.00 0.43 0.00 0.00 52.55 53.06 1wmj s ASP 66 Cb -0.10 -2.06 0.20 0.00 -0.30 0.00 0.00 42.92 40.66 1wmj s ASP 66 CO 0.07 -0.03 1.89 1.33 -0.17 0.00 0.00 175.17 178.25 1wmj n VAL 67 N 4.95 2.51 0.00 1.11 0.24 -0.21 -2.93 118.33 124.00 1wmj n VAL 67 Ca -0.15 -1.34 0.00 0.00 -2.04 0.00 0.00 64.34 60.81 1wmj n VAL 67 Cb 0.52 -1.24 0.00 0.00 -1.47 0.00 0.00 33.84 31.64 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 0.38 2.25 -0.03 -1.34 2.03 -1.26 -4.50 116.55 114.07 1wmj n ASP 68 Ca 0.25 0.00 -0.04 0.00 0.52 0.00 0.00 54.79 55.52 1wmj n ASP 68 Cb 0.65 0.36 -0.04 0.00 -0.72 0.00 0.00 41.12 41.36 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 -0.88 1.60 -0.63 -0.67 -0.00 -1.23 -4.72 120.64 114.10 1wmj n GLU 69 Ca 0.00 0.02 0.06 0.00 -0.00 0.00 0.00 57.16 57.24 1wmj n GLU 69 Cb 0.09 -1.15 0.14 0.00 -0.00 0.00 0.00 31.44 30.52 1wmj n GLU 69 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.13 178.60 1wmj n LEU 70 N -2.47 2.04 -0.41 -1.84 -0.00 -1.15 -4.85 117.00 108.33 1wmj n LEU 70 Ca -0.12 -3.07 0.31 0.00 -0.00 0.00 0.00 56.01 53.13 1wmj n LEU 70 Cb 0.67 -0.36 0.48 0.00 -0.00 0.00 0.00 43.42 44.21 1wmj n LEU 70 CO 0.10 0.96 0.86 2.29 -0.00 0.00 0.00 177.39 181.60 1wmj n LYS 71 N -0.79 -0.00 -0.21 1.47 2.85 -1.23 0.06 118.16 120.30 1wmj n LYS 71 Ca 0.14 0.64 0.27 0.00 -1.05 0.00 0.00 58.31 58.31 1wmj n LYS 71 Cb 0.76 -1.47 0.41 0.00 -0.65 0.00 0.00 35.03 34.08 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 -3.19 0.01 0.04 -1.58 0.28 -1.26 0.30 120.64 115.24 1wmj n GLU 72 Ca 0.26 0.95 -0.18 0.00 -0.16 0.00 0.00 57.16 58.03 1wmj n GLU 72 Cb 1.17 -2.36 -0.14 0.00 1.43 0.00 0.00 31.44 31.53 1wmj n GLU 72 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 1wmj h VAL 73 N 0.00 0.93 0.00 3.84 2.07 -0.75 -3.29 116.25 119.05 1wmj h VAL 73 Ca 0.47 -2.61 0.00 0.00 0.82 0.00 0.00 66.70 65.37 1wmj h VAL 73 Cb 2.75 2.64 0.00 0.00 -1.52 0.00 0.00 31.29 35.17 1wmj h VAL 73 CO -0.00 0.80 0.00 0.00 0.02 0.00 0.00 177.57 178.38 1wmj n ALA 74 N -2.77 1.93 0.08 1.67 0.00 0.86 -2.55 120.51 119.73 1wmj n ALA 74 Ca -0.22 -0.04 0.11 0.00 0.00 0.00 0.00 53.44 53.29 1wmj n ALA 74 Cb 1.05 -1.36 -0.03 0.00 0.00 0.00 0.00 19.45 19.11 1wmj n ALA 74 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1wmj n GLU 75 N -1.72 0.61 0.08 0.00 1.02 -0.32 -2.04 120.64 118.28 1wmj n GLU 75 Ca 0.05 0.08 -0.03 0.00 -0.02 0.00 0.00 57.16 57.24 1wmj n GLU 75 Cb 0.26 -1.78 -0.06 0.00 -0.02 0.00 0.00 31.44 29.84 1wmj n GLU 75 CO 0.00 0.00 0.00 1.57 1.18 0.00 0.00 177.13 179.88 1wmj h LYS 76 N 0.00 0.00 0.00 3.49 2.10 -1.56 -3.29 116.57 117.31 1wmj h LYS 76 Ca -0.01 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 1wmj h LYS 76 Cb 1.04 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.37 1wmj h LYS 76 CO 0.00 0.74 -1.44 0.66 -2.00 0.00 0.00 179.45 177.42 1wmj n TYR 77 N -3.26 0.03 -2.56 0.07 4.01 -1.21 -5.03 117.16 109.21 1wmj n TYR 77 Ca -0.01 0.01 -0.01 0.00 -0.16 0.00 0.00 57.90 57.73 1wmj n TYR 77 Cb 0.86 -0.26 0.01 0.00 -0.31 0.00 0.00 39.34 39.64 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 -1.88 -5.77 0.00 7.72 4.05 -1.04 -5.04 115.26 113.30 1wmj n ASN 78 Ca 0.00 -0.11 0.00 0.00 0.45 0.00 0.00 54.58 54.93 1wmj n ASN 78 Cb 0.44 -3.85 0.00 0.00 1.23 0.00 0.00 39.78 37.61 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 -1.67 0.00 0.00 3.44 0.24 -0.87 -5.06 118.33 114.42 1wmj n VAL 79 Ca -0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.29 1wmj n VAL 79 Cb 0.51 -0.41 0.00 0.00 -1.47 0.00 0.00 33.84 32.47 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 -0.50 0.00 0.00 7.34 -0.58 -1.26 -4.95 120.64 120.69 1wmj n GLU 80 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1wmj n GLU 80 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 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 -2.23 0.62 0.00 -1.26 -5.09 120.51 112.55 1wmj n ALA 81 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.29 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 1.40 0.00 0.00 1.00 -1.26 -3.99 119.30 116.45 1wmj s MET 82 Ca 0.00 -1.77 0.00 0.00 0.00 0.00 0.00 55.69 53.92 1wmj s MET 82 Cb 0.00 0.28 0.00 0.00 0.00 0.00 0.00 34.83 35.11 1wmj s MET 82 CO 0.00 -0.48 0.26 -0.35 0.00 0.00 0.00 175.02 174.45 1wmj n PRO 83 N -0.40 0.49 -1.43 2.03 -0.04 -1.26 -1.83 135.00 132.56 1wmj n PRO 83 Ca 0.04 0.00 -0.56 0.00 -0.04 0.00 0.00 63.50 62.94 1wmj n PRO 83 Cb 0.65 -1.23 -0.08 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 0.21 0.00 -1.93 0.52 -1.04 -1.26 -0.93 114.28 109.85 1wmj n THR 84 Ca 0.00 0.00 -0.41 0.00 -2.04 0.00 0.00 64.05 61.60 1wmj n THR 84 Cb 0.11 -0.28 -0.01 0.00 -1.82 0.00 0.00 70.33 68.34 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 2.69 2.77 -1.57 -1.42 3.72 -1.25 -1.33 117.46 121.07 1wmj n PHE 85 Ca 0.23 -2.88 -0.41 0.00 -0.05 0.00 0.00 57.45 54.34 1wmj n PHE 85 Cb -0.01 -2.08 0.02 0.00 -0.94 0.00 0.00 39.48 36.47 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 3.25 2.15 -4.19 4.37 -0.00 0.53 -3.52 117.00 119.59 1wmj n LEU 86 Ca 0.58 0.95 -0.28 0.00 -0.00 0.00 0.00 56.01 57.25 1wmj n LEU 86 Cb 0.29 -1.30 -0.16 0.00 -0.00 0.00 0.00 43.42 42.25 1wmj n LEU 86 CO 0.79 -1.93 -0.53 -0.36 -0.00 0.00 0.00 177.39 175.35 1wmj s PHE 87 N -1.39 2.01 -0.66 1.96 0.40 0.57 -0.26 117.98 120.62 1wmj s PHE 87 Ca 0.66 -0.58 0.05 0.00 -0.60 0.00 0.00 56.93 56.46 1wmj s PHE 87 Cb -0.53 -1.33 0.20 0.00 0.51 0.00 0.00 43.02 41.86 1wmj s PHE 87 CO 0.55 -0.18 0.58 -0.89 0.70 0.00 0.00 175.22 175.98 1wmj n ILE 88 N 3.04 1.68 -2.56 0.64 2.08 -1.06 0.13 119.36 123.31 1wmj n ILE 88 Ca -0.18 -4.90 -0.43 0.00 0.56 0.00 0.00 62.75 57.81 1wmj n ILE 88 Cb 0.53 -2.12 -0.02 0.00 -0.75 0.00 0.00 39.64 37.27 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 -1.76 4.29 0.00 0.38 2.20 -1.26 -3.04 119.74 120.54 1wmj s LYS 89 Ca 0.31 1.50 0.00 0.00 -0.36 0.00 0.00 55.97 57.42 1wmj s LYS 89 Cb 0.04 -3.66 0.00 0.00 -1.51 0.00 0.00 37.83 32.70 1wmj s LYS 89 CO -0.11 -0.59 0.00 -3.47 -0.36 0.00 0.00 175.35 170.82 1wmj n ASP 90 N 6.09 0.00 0.00 1.43 -0.08 -1.26 -3.81 116.55 118.92 1wmj n ASP 90 Ca 0.12 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.40 1wmj n ASP 90 Cb 0.46 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.92 1wmj n ASP 90 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1wmj n GLY 91 N -2.00 0.87 0.00 0.27 0.00 -1.17 -4.80 105.19 98.36 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 0.67 -3.15 4.61 0.00 -1.25 -5.11 120.51 116.28 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 -0.03 0.00 2.12 -1.26 -4.69 118.70 115.00 1wmj s GLU 93 Ca 0.00 0.25 0.11 0.00 0.36 0.00 0.00 54.97 55.69 1wmj s GLU 93 Cb 0.00 0.13 -0.23 0.00 0.26 0.00 0.00 34.13 34.29 1wmj s GLU 93 CO 0.00 -0.22 0.70 0.00 -0.54 0.00 0.00 175.26 175.21 1wmj h ALA 94 N 7.78 0.72 0.00 6.30 0.00 -0.57 -3.45 119.26 130.04 1wmj h ALA 94 Ca -0.12 -1.42 0.00 0.00 0.00 0.00 0.00 54.91 53.38 1wmj h ALA 94 Cb 1.17 0.44 0.00 0.00 0.00 0.00 0.00 17.79 19.41 1wmj h ALA 94 CO -0.11 1.54 0.00 -0.25 0.00 0.00 0.00 179.25 180.44 1wmj n ASP 95 N -3.09 0.00 -1.66 0.00 8.00 -1.21 -4.98 116.55 113.61 1wmj n ASP 95 Ca -0.16 0.00 -0.01 0.00 0.71 0.00 0.00 54.79 55.33 1wmj n ASP 95 Cb 1.04 0.00 -0.00 0.00 -0.02 0.00 0.00 41.12 42.14 1wmj n ASP 95 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1wmj n LYS 96 N -0.97 1.07 0.00 -1.24 4.01 -1.26 0.21 118.16 119.98 1wmj n LYS 96 Ca 0.00 -0.16 0.00 0.00 -0.51 0.00 0.00 58.31 57.64 1wmj n LYS 96 Cb 0.00 0.08 0.00 0.00 -0.51 0.00 0.00 35.03 34.60 1wmj n LYS 96 CO 0.00 0.00 0.00 0.28 -1.11 0.00 0.00 177.40 176.57 1wmj n VAL 97 N -0.04 0.00 0.00 -0.18 0.31 -1.23 -4.87 118.33 112.31 1wmj n VAL 97 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1wmj n VAL 97 Cb 0.03 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.96 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 -4.46 118.33 114.71 1wmj n VAL 98 Ca 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.25 1wmj n VAL 98 Cb 0.00 0.00 -0.11 0.00 -0.91 0.00 0.00 33.84 32.82 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 0.00 2.53 0.20 2.92 0.00 -0.11 -2.91 105.19 107.82 1wmj n GLY 99 Ca 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.22 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 2.40 1.40 -3.92 4.61 0.00 -1.26 -4.61 120.51 119.13 1wmj n ALA 100 Ca 0.28 -0.27 -0.29 0.00 0.00 0.00 0.00 53.44 53.16 1wmj n ALA 100 Cb 0.68 -0.08 -0.16 0.00 0.00 0.00 0.00 19.45 19.89 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 1.59 0.00 0.00 3.00 -1.14 -4.98 118.95 117.41 1wmj s ARG 101 Ca 0.00 -0.68 0.19 0.00 0.00 0.00 0.00 55.73 55.24 1wmj s ARG 101 Cb 0.00 -2.22 0.91 0.00 0.00 0.00 0.00 34.95 33.64 1wmj s ARG 101 CO 0.00 -0.47 1.61 1.17 0.00 0.00 0.00 175.30 177.62 1wmj n LYS 102 N 4.80 1.32 0.00 3.54 0.00 -1.26 -2.53 118.16 124.02 1wmj n LYS 102 Ca -0.13 -0.48 0.00 0.00 0.00 0.00 0.00 58.31 57.71 1wmj n LYS 102 Cb 0.47 -1.32 0.00 0.00 0.00 0.00 0.00 35.03 34.17 1wmj n LYS 102 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1wmj n ASP 103 N -0.30 0.21 -0.03 3.14 2.03 -1.26 -4.67 116.55 115.67 1wmj n ASP 103 Ca 0.14 -0.57 0.02 0.00 0.52 0.00 0.00 54.79 54.91 1wmj n ASP 103 Cb 0.18 0.64 -0.10 0.00 -0.72 0.00 0.00 41.12 41.11 1wmj n ASP 103 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1wmj n ASP 104 N -0.64 1.94 0.00 1.67 2.03 -1.20 -4.36 116.55 116.00 1wmj n ASP 104 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1wmj n ASP 104 Cb 0.01 1.33 0.00 0.00 -0.72 0.00 0.00 41.12 41.74 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 -2.14 1.54 0.00 -2.67 7.94 -1.05 -2.31 117.00 118.32 1wmj n LEU 105 Ca -0.09 0.28 0.21 0.00 -1.11 0.00 0.00 56.01 55.31 1wmj n LEU 105 Cb 0.54 -0.14 0.55 0.00 0.53 0.00 0.00 43.42 44.90 1wmj n LEU 105 CO 0.27 -0.14 1.19 0.06 -1.11 0.00 0.00 177.39 177.67 1wmj h GLN 106 N 0.00 0.00 -0.03 1.96 -0.00 -1.83 1.11 115.11 116.32 1wmj h GLN 106 Ca 0.00 0.00 -0.22 0.00 -0.00 0.00 0.00 58.65 58.43 1wmj h GLN 106 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.48 1wmj h GLN 106 CO 0.00 0.00 -0.89 -0.91 -0.00 0.00 0.00 178.83 177.03 1wmj h ASN 107 N 0.00 0.59 0.39 0.06 2.35 -1.76 -2.89 115.58 114.33 1wmj h ASN 107 Ca 0.29 -0.45 -0.29 0.00 -0.55 0.00 0.00 56.30 55.30 1wmj h ASN 107 Cb 1.93 -0.18 0.02 0.00 0.05 0.00 0.00 38.32 40.14 1wmj h ASN 107 CO -0.00 1.23 -1.29 0.74 -1.65 0.00 0.00 177.43 176.47 1wmj h THR 108 N 0.28 1.38 0.00 2.81 2.02 0.16 -3.16 112.91 116.40 1wmj h THR 108 Ca -0.07 -2.77 -0.03 0.00 0.77 0.00 0.00 66.41 64.31 1wmj h THR 108 Cb 1.52 2.87 -0.00 0.00 -1.74 0.00 0.00 68.15 70.79 1wmj h THR 108 CO 0.16 0.82 -0.16 0.40 0.37 0.00 0.00 175.52 177.11 1wmj h ILE 109 N 0.15 0.72 0.00 3.11 5.03 -1.23 -1.69 117.51 123.60 1wmj h ILE 109 Ca -0.18 -0.64 -0.17 0.00 -0.12 0.00 0.00 64.86 63.75 1wmj h ILE 109 Cb 1.98 1.39 -0.02 0.00 -3.03 0.00 0.00 36.82 37.14 1wmj h ILE 109 CO 0.23 0.15 -0.82 -0.37 -0.68 0.00 0.00 178.15 176.66 1wmj h VAL 110 N 0.00 1.45 0.00 1.67 -1.51 -1.54 1.12 116.25 117.45 1wmj h VAL 110 Ca -0.00 -2.95 -0.14 0.00 -1.23 0.00 0.00 66.70 62.38 1wmj h VAL 110 Cb 0.38 2.65 -0.02 0.00 -2.13 0.00 0.00 31.29 32.17 1wmj h VAL 110 CO 0.02 0.80 -0.75 0.07 -1.23 0.00 0.00 177.57 176.49 1wmj h LYS 111 N 0.00 0.00 0.00 5.19 2.10 -1.36 -0.58 116.57 121.92 1wmj h LYS 111 Ca -0.01 0.00 -0.37 0.00 -2.00 0.00 0.00 60.65 58.27 1wmj h LYS 111 Cb 1.58 0.00 -0.06 0.00 -0.90 0.00 0.00 32.23 32.86 1wmj h LYS 111 CO 0.11 0.57 -2.27 0.72 -2.00 0.00 0.00 179.45 176.58 1wmj n HIS 112 N -3.20 0.00 -0.05 0.07 8.25 -0.70 -4.25 115.22 115.34 1wmj n HIS 112 Ca -0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.36 1wmj n HIS 112 Cb 0.79 -0.82 -0.15 0.00 1.12 0.00 0.00 29.99 30.94 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 -3.83 1.52 0.85 1.59 0.31 0.35 -4.09 118.33 115.03 1wmj n VAL 113 Ca -0.43 -0.82 0.13 0.00 -0.01 0.00 0.00 64.34 63.20 1wmj n VAL 113 Cb 0.84 -0.81 0.54 0.00 -0.91 0.00 0.00 33.84 33.49 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 1.64 -1.47 3.22 2.92 0.00 0.10 -4.77 105.19 106.83 1wmj n GLY 114 Ca -0.23 -0.07 -0.17 0.00 0.00 0.00 0.00 46.02 45.54 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 -1.56 -1.01 0.00 4.61 0.00 -0.49 -4.27 120.51 117.79 1wmj n ALA 115 Ca 0.06 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1wmj n ALA 115 Cb 0.33 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.50 1wmj n ALA 115 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1wmj n THR 116 N -2.97 0.00 0.00 0.00 -2.24 -1.08 -5.06 114.28 102.93 1wmj n THR 116 Ca 0.05 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 1wmj n THR 116 Cb 0.44 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.67 1wmj n THR 116 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wmj n ALA 117 N -1.10 0.00 -1.91 6.98 0.00 -0.41 -4.72 120.51 119.35 1wmj n ALA 117 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 1wmj n ALA 117 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1wmj n ALA 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wmj n ALA 118 N 0.44 -3.04 -3.65 0.00 0.00 -1.26 -4.81 120.51 108.19 1wmj n ALA 118 Ca 0.00 0.33 -0.01 0.00 0.00 0.00 0.00 53.44 53.75 1wmj n ALA 118 Cb 0.00 -1.01 -0.05 0.00 0.00 0.00 0.00 19.45 18.39 1wmj n ALA 118 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1wmj s SER 119 N -1.30 -0.00 -0.50 0.00 1.04 -1.26 -5.08 113.70 106.59 1wmj s SER 119 Ca 0.06 0.01 0.07 0.00 0.48 0.00 0.00 55.95 56.57 1wmj s SER 119 Cb -0.02 0.01 0.35 0.00 0.10 0.00 0.00 66.02 66.46 1wmj s SER 119 CO 0.24 -0.00 0.90 0.00 0.98 0.00 0.00 173.24 175.35 1wmj n ALA 120 N 0.85 3.90 -0.60 5.32 0.00 -1.26 -5.04 120.51 123.67 1wmj n ALA 120 Ca -0.03 -4.25 0.00 0.00 0.00 0.00 0.00 53.44 49.16 1wmj n ALA 120 Cb 0.58 -0.78 0.00 0.00 0.00 0.00 0.00 19.45 19.25 1wmj n ALA 120 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1wmj n SER 121 N -0.11 0.00 -0.16 0.00 7.64 -1.26 -5.37 113.62 114.36 1wmj n SER 121 Ca 0.29 0.00 0.02 0.00 1.01 0.00 0.00 58.87 60.19 1wmj n SER 121 Cb 0.50 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.72 1wmj n SER 121 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03