#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 -4.66 120.51 116.68 1wmj n ALA 2 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 1wmj n ALA 2 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 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 5.64 -0.07 -2.65 0.00 0.00 -1.26 -4.54 120.51 117.63 1wmj n ALA 3 Ca 0.00 0.07 -0.02 0.00 0.00 0.00 0.00 53.44 53.49 1wmj n ALA 3 Cb 0.00 -1.26 0.08 0.00 0.00 0.00 0.00 19.45 18.27 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 -0.03 0.01 0.00 0.00 2.13 -1.26 -4.71 120.64 116.78 1wmj n GLU 4 Ca -0.04 -0.51 0.00 0.00 0.66 0.00 0.00 57.16 57.26 1wmj n GLU 4 Cb 0.41 -0.01 0.00 0.00 0.27 0.00 0.00 31.44 32.11 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 0.24 3.63 0.00 5.31 -0.58 -1.26 -4.92 120.64 123.06 1wmj n GLU 5 Ca -0.14 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.60 1wmj n GLU 5 Cb 0.73 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.60 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 0.75 3.99 0.62 0.00 -1.26 -4.77 105.19 109.52 1wmj n GLY 6 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 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 -1.29 2.32 -0.82 1.61 -7.23 -1.26 -3.64 120.40 110.08 1wmj s VAL 7 Ca 0.00 -1.12 -0.23 0.00 -1.81 0.00 0.00 61.98 58.82 1wmj s VAL 7 Cb 0.00 -2.44 -0.19 0.00 0.56 0.00 0.00 36.38 34.31 1wmj s VAL 7 CO 0.00 0.00 2.41 1.33 -0.31 0.00 0.00 175.10 178.53 1wmj n VAL 8 N -2.00 -0.02 -0.94 1.32 0.24 -1.25 -4.82 118.33 110.86 1wmj n VAL 8 Ca 0.10 -0.46 -0.37 0.00 -2.04 0.00 0.00 64.34 61.57 1wmj n VAL 8 Cb 0.61 -1.33 0.06 0.00 -1.47 0.00 0.00 33.84 31.71 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 7.46 0.00 -3.37 1.34 2.08 -1.26 -4.42 119.36 121.19 1wmj n ILE 9 Ca 0.54 -0.18 -0.26 0.00 0.56 0.00 0.00 62.75 63.42 1wmj n ILE 9 Cb 0.29 -0.12 -0.09 0.00 -0.75 0.00 0.00 39.64 38.97 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 -3.39 2.89 -0.91 -1.39 0.00 -1.25 0.14 120.51 116.59 1wmj n ALA 10 Ca -0.01 -3.58 -0.31 0.00 0.00 0.00 0.00 53.44 49.54 1wmj n ALA 10 Cb 0.68 -0.82 0.15 0.00 0.00 0.00 0.00 19.45 19.45 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 -4.04 -0.58 -1.33 0.00 8.25 -1.26 -4.01 115.22 112.24 1wmj n HIS 12 Ca 0.10 -0.66 -0.00 0.00 -0.26 0.00 0.00 57.72 56.89 1wmj n HIS 12 Cb 0.53 0.75 -0.00 0.00 1.12 0.00 0.00 29.99 32.39 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 -0.43 -0.05 0.00 0.41 2.04 -1.26 -4.89 115.26 111.08 1wmj n ASN 13 Ca -0.15 -0.14 0.00 0.00 -0.44 0.00 0.00 54.58 53.84 1wmj n ASN 13 Cb 0.63 0.01 0.00 0.00 -2.53 0.00 0.00 39.78 37.89 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 -0.14 -3.83 4.81 -1.26 -4.36 118.16 113.37 1wmj n LYS 14 Ca -0.01 0.00 0.13 0.00 -0.87 0.00 0.00 58.31 57.55 1wmj n LYS 14 Cb 0.17 0.00 0.23 0.00 0.02 0.00 0.00 35.03 35.46 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 1.07 0.11 0.07 3.14 2.03 -1.26 0.33 116.55 122.04 1wmj n ASP 15 Ca 0.00 0.73 -0.21 0.00 0.52 0.00 0.00 54.79 55.83 1wmj n ASP 15 Cb 0.00 -0.34 -0.15 0.00 -0.72 0.00 0.00 41.12 39.91 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 0.35 -0.89 -0.67 5.08 -1.98 -3.22 114.58 113.25 1wmj h GLU 16 Ca 0.35 -0.59 0.17 0.00 -1.00 0.00 0.00 59.36 58.29 1wmj h GLU 16 Cb 0.90 0.22 -0.10 0.00 0.50 0.00 0.00 28.75 30.27 1wmj h GLU 16 CO -0.35 1.28 0.46 0.35 -1.00 0.00 0.00 179.01 179.75 1wmj h PHE 17 N -0.26 0.81 -0.24 4.33 3.04 0.52 -1.12 116.94 124.02 1wmj h PHE 17 Ca -0.18 0.04 -0.02 0.00 3.98 0.00 0.00 57.97 61.78 1wmj h PHE 17 Cb 1.76 -0.22 -0.01 0.00 2.56 0.00 0.00 35.95 40.04 1wmj h PHE 17 CO 0.18 0.16 0.06 -0.44 -2.02 0.00 0.00 178.31 176.24 1wmj h ASP 18 N 0.62 0.37 -1.02 0.41 5.19 -1.23 -2.22 116.42 118.52 1wmj h ASP 18 Ca 0.50 -0.23 0.30 0.00 -0.62 0.00 0.00 57.03 56.98 1wmj h ASP 18 Cb 0.76 -0.10 -0.04 0.00 0.18 0.00 0.00 39.33 40.14 1wmj h ASP 18 CO -0.39 0.50 1.20 0.00 -3.12 0.00 0.00 179.24 177.43 1wmj n ALA 19 N -2.29 0.98 -0.12 3.45 0.00 -0.43 -0.72 120.51 121.39 1wmj n ALA 19 Ca -0.03 0.34 -0.23 0.00 0.00 0.00 0.00 53.44 53.52 1wmj n ALA 19 Cb 0.18 -0.59 -0.08 0.00 0.00 0.00 0.00 19.45 18.96 1wmj n ALA 19 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1wmj n GLN 20 N -3.21 0.56 0.30 0.00 3.00 -1.02 -3.59 117.38 113.43 1wmj n GLN 20 Ca 0.23 0.24 0.09 0.00 -0.01 0.00 0.00 57.00 57.54 1wmj n GLN 20 Cb 1.51 -1.45 0.46 0.00 0.00 0.00 0.00 30.24 30.76 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 -0.98 0.00 0.00 -1.09 4.05 -0.32 1.21 114.93 117.80 1wmj h MET 21 Ca -0.47 0.00 -0.06 0.00 -0.28 0.00 0.00 59.70 58.89 1wmj h MET 21 Cb 1.40 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 32.19 1wmj h MET 21 CO -0.28 0.00 -1.99 2.41 0.23 0.00 0.00 176.91 177.27 1wmj n THR 22 N -2.59 0.24 0.55 -0.77 -1.04 -0.07 -4.31 114.28 106.29 1wmj n THR 22 Ca -0.01 -0.53 -0.03 0.00 -2.04 0.00 0.00 64.05 61.44 1wmj n THR 22 Cb 0.59 -0.06 0.05 0.00 -1.82 0.00 0.00 70.33 69.09 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 -2.30 1.44 0.00 -2.82 5.02 0.41 -3.60 118.16 116.32 1wmj n LYS 23 Ca -0.09 -0.65 0.00 0.00 -2.02 0.00 0.00 58.31 55.56 1wmj n LYS 23 Cb 0.64 -1.37 0.00 0.00 -0.02 0.00 0.00 35.03 34.27 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 2.23 -0.19 7.82 0.00 -1.19 -4.50 120.51 124.83 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 0.66 0.19 0.03 0.00 0.00 0.00 0.00 19.45 20.33 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 1.04 0.22 0.00 2.10 -1.75 0.24 116.57 118.41 1wmj h LYS 25 Ca 0.00 -0.37 -0.32 0.00 -2.00 0.00 0.00 60.65 57.96 1wmj h LYS 25 Cb 0.38 -0.07 0.03 0.00 -0.90 0.00 0.00 32.23 31.66 1wmj h LYS 25 CO 0.00 1.06 -1.46 1.05 -2.00 0.00 0.00 179.45 178.10 1wmj h GLU 26 N 0.93 0.46 0.00 0.07 4.11 -1.88 -3.30 114.58 114.97 1wmj h GLU 26 Ca 0.15 -0.79 -0.06 0.00 0.07 0.00 0.00 59.36 58.73 1wmj h GLU 26 Cb 0.64 0.29 -0.01 0.00 0.50 0.00 0.00 28.75 30.18 1wmj h GLU 26 CO 0.04 1.38 -0.30 0.00 0.07 0.00 0.00 179.01 180.21 1wmj h ALA 27 N 0.12 1.15 -0.32 1.06 0.00 -1.78 -3.47 119.26 116.01 1wmj h ALA 27 Ca -0.27 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1wmj h ALA 27 Cb 2.07 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.81 1wmj h ALA 27 CO 0.23 0.37 0.00 0.41 0.00 0.00 0.00 179.25 180.26 1wmj n GLY 28 N -0.15 0.96 3.50 0.00 0.00 0.58 -5.03 105.19 105.05 1wmj n GLY 28 Ca -0.01 -0.51 -0.23 0.00 0.00 0.00 0.00 46.02 45.27 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 -3.09 1.73 0.62 1.61 -2.85 0.28 -5.03 119.74 113.02 1wmj s LYS 29 Ca 0.00 -1.96 -0.10 0.00 -1.00 0.00 0.00 55.97 52.91 1wmj s LYS 29 Cb 0.00 -1.09 -0.02 0.00 -2.06 0.00 0.00 37.83 34.66 1wmj s LYS 29 CO 0.00 -0.14 1.00 0.08 0.10 0.00 0.00 175.35 176.39 1wmj s VAL 30 N -3.13 4.25 0.06 1.79 1.01 -0.43 -4.36 120.40 119.58 1wmj s VAL 30 Ca 0.36 0.56 0.07 0.00 0.00 0.00 0.00 61.98 62.97 1wmj s VAL 30 Cb 0.09 -3.70 -0.03 0.00 0.00 0.00 0.00 36.38 32.73 1wmj s VAL 30 CO 0.16 -0.87 -0.18 -0.69 0.00 0.00 0.00 175.10 173.52 1wmj s VAL 31 N -3.15 2.79 -0.31 2.92 1.01 -1.24 -2.14 120.40 120.29 1wmj s VAL 31 Ca 0.55 -1.25 -0.02 0.00 0.00 0.00 0.00 61.98 61.26 1wmj s VAL 31 Cb -0.11 -2.19 0.12 0.00 0.00 0.00 0.00 36.38 34.20 1wmj s VAL 31 CO 0.51 0.29 0.20 -0.63 0.00 0.00 0.00 175.10 175.47 1wmj s ILE 32 N -0.97 -0.13 -0.14 2.22 1.09 -1.26 -2.62 121.20 119.39 1wmj s ILE 32 Ca 0.15 -0.86 -0.12 0.00 -1.10 0.00 0.00 60.65 58.72 1wmj s ILE 32 Cb -0.10 -0.98 -0.05 0.00 -1.06 0.00 0.00 42.46 40.27 1wmj s ILE 32 CO 0.06 -0.70 0.25 -0.63 -0.10 0.00 0.00 174.94 173.82 1wmj s ILE 33 N 1.95 5.33 -0.51 2.92 1.09 0.43 -1.21 121.20 131.20 1wmj s ILE 33 Ca 0.11 0.45 -0.07 0.00 -1.10 0.00 0.00 60.65 60.05 1wmj s ILE 33 Cb -0.17 -3.57 0.13 0.00 -1.06 0.00 0.00 42.46 37.80 1wmj s ILE 33 CO -0.28 0.46 0.36 -1.81 -0.10 0.00 0.00 174.94 173.57 1wmj s ASP 34 N -0.01 5.56 0.14 3.58 1.01 0.25 -1.60 116.67 125.60 1wmj s ASP 34 Ca 0.15 -2.19 0.00 0.00 0.71 0.00 0.00 52.55 51.23 1wmj s ASP 34 Cb -0.13 -1.94 0.00 0.00 1.01 0.00 0.00 42.92 41.86 1wmj s ASP 34 CO 0.04 -0.58 0.00 0.49 0.21 0.00 0.00 175.17 175.33 1wmj n PHE 35 N 4.47 -0.88 0.00 4.23 3.72 -0.74 -1.00 117.46 127.26 1wmj n PHE 35 Ca -0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 1wmj n PHE 35 Cb 0.41 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.95 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 -0.83 0.00 0.17 4.37 5.66 -1.06 -4.08 114.28 118.51 1wmj n THR 36 Ca 0.00 0.00 -0.14 0.00 -3.05 0.00 0.00 64.05 60.86 1wmj n THR 36 Cb 0.00 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 68.71 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 -0.42 0.00 1.79 0.00 -1.84 -2.15 119.26 116.64 1wmj h ALA 37 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1wmj h ALA 37 Cb 0.00 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1wmj h ALA 37 CO 0.00 -0.75 0.00 0.45 0.00 0.00 0.00 179.25 178.95 1wmj n SER 38 N -5.30 0.00 -0.05 0.00 2.88 -1.26 -4.48 113.62 105.42 1wmj n SER 38 Ca -0.09 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.31 1wmj n SER 38 Cb 0.21 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.59 1wmj n SER 38 CO 0.00 0.00 0.00 4.11 -1.23 0.00 0.00 175.04 177.92 1wmj h TRP 39 N 0.00 0.48 -2.89 0.66 0.09 -2.03 -3.50 115.95 108.77 1wmj h TRP 39 Ca 0.00 -0.18 0.00 0.00 0.09 0.00 0.00 58.89 58.80 1wmj h TRP 39 Cb 0.00 -0.09 0.00 0.00 0.08 0.00 0.00 29.16 29.15 1wmj h TRP 39 CO 0.00 0.86 -0.73 0.00 0.09 0.00 0.00 178.44 178.66 1wmj n GLY 41 N -1.65 -0.59 0.00 0.00 0.00 -1.26 -4.89 105.19 96.80 1wmj n GLY 41 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1wmj n GLY 41 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1wmj n PRO 42 N 0.00 0.00 -0.51 1.61 -0.04 -1.26 -4.89 135.00 129.91 1wmj n PRO 42 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1wmj n PRO 42 Cb 0.00 -0.24 0.00 0.00 -0.04 0.00 0.00 33.50 33.22 1wmj n PRO 42 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1wmj n ARG 44 N -2.00 1.04 0.12 0.00 5.12 -1.26 -4.40 116.66 115.27 1wmj n ARG 44 Ca 0.00 0.00 -0.24 0.00 -1.93 0.00 0.00 57.85 55.68 1wmj n ARG 44 Cb 0.00 -0.74 -0.15 0.00 -1.16 0.00 0.00 32.46 30.41 1wmj n ARG 44 CO 0.00 0.00 0.00 0.35 -1.93 0.00 0.00 177.63 176.05 1wmj h PHE 45 N 0.00 0.91 -0.59 -1.55 3.04 -1.98 -3.31 116.94 113.47 1wmj h PHE 45 Ca 0.00 -0.65 0.00 0.00 3.98 0.00 0.00 57.97 61.30 1wmj h PHE 45 Cb 0.47 -0.04 0.00 0.00 2.56 0.00 0.00 35.95 38.94 1wmj h PHE 45 CO 0.00 1.50 0.00 1.51 -2.02 0.00 0.00 178.31 179.30 1wmj n ILE 46 N -3.81 0.94 0.18 1.41 3.06 -1.26 -4.57 119.36 115.31 1wmj n ILE 46 Ca -0.16 -0.97 -0.14 0.00 -2.50 0.00 0.00 62.75 58.98 1wmj n ILE 46 Cb 1.03 0.55 -0.07 0.00 0.54 0.00 0.00 39.64 41.70 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 3.64 -0.59 0.00 1.51 0.00 -1.77 -1.11 119.26 120.95 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 0.91 0.41 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1wmj h ALA 47 CO 0.00 -0.86 0.00 -0.35 0.00 0.00 0.00 179.25 178.04 1wmj n PRO 48 N -5.40 0.49 -0.14 0.00 -0.04 -1.26 -2.96 135.00 125.69 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 0.31 -1.22 -0.10 0.00 -0.04 0.00 0.00 33.50 32.45 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 -0.72 1.49 0.00 0.52 0.31 -0.47 -4.04 118.33 115.42 1wmj n VAL 49 Ca 0.05 -0.40 0.00 0.00 -0.01 0.00 0.00 64.34 63.98 1wmj n VAL 49 Cb 0.02 -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 -0.22 3.52 3.72 -0.90 -0.15 117.46 119.31 1wmj n PHE 50 Ca -0.53 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 56.86 1wmj n PHE 50 Cb 0.89 -0.40 0.06 0.00 -0.94 0.00 0.00 39.48 39.08 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 0.33 -0.38 4.37 0.00 -1.85 0.45 119.26 120.18 1wmj h ALA 51 Ca 0.00 0.24 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 1wmj h ALA 51 Cb 0.00 0.57 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 1wmj h ALA 51 CO 0.00 -0.48 0.23 1.05 0.00 0.00 0.00 179.25 180.06 1wmj h GLU 52 N -0.04 0.51 -0.23 0.00 4.11 -1.70 -2.47 114.58 114.77 1wmj h GLU 52 Ca 0.30 -0.04 -0.11 0.00 0.07 0.00 0.00 59.36 59.58 1wmj h GLU 52 Cb 0.51 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.64 1wmj h GLU 52 CO -0.68 0.36 -0.29 1.88 0.07 0.00 0.00 179.01 180.34 1wmj h TYR 53 N 0.52 0.72 -0.93 2.06 -1.99 0.32 -2.29 116.97 115.39 1wmj h TYR 53 Ca 0.14 -0.23 0.27 0.00 2.00 0.00 0.00 58.73 60.90 1wmj h TYR 53 Cb -0.03 -0.15 -0.15 0.00 2.00 0.00 0.00 36.73 38.41 1wmj h TYR 53 CO 0.00 0.95 0.34 0.00 -0.00 0.00 0.00 178.16 179.46 1wmj h ALA 54 N 0.65 1.51 0.14 3.88 0.00 -0.25 0.14 119.26 125.32 1wmj h ALA 54 Ca 0.03 0.22 -0.23 0.00 0.00 0.00 0.00 54.91 54.92 1wmj h ALA 54 Cb 0.86 0.28 0.03 0.00 0.00 0.00 0.00 17.79 18.95 1wmj h ALA 54 CO 0.07 -0.51 -0.99 0.87 0.00 0.00 0.00 179.25 178.69 1wmj h LYS 55 N 0.24 0.43 -0.42 0.00 1.57 -1.54 -3.25 116.57 113.59 1wmj h LYS 55 Ca 0.62 -0.64 0.12 0.00 -1.87 0.00 0.00 60.65 58.88 1wmj h LYS 55 Cb 1.32 0.23 -0.02 0.00 0.08 0.00 0.00 32.23 33.84 1wmj h LYS 55 CO -0.65 1.29 0.35 0.87 -0.57 0.00 0.00 179.45 180.73 1wmj h LYS 56 N -0.10 0.00 -3.50 3.15 1.57 -0.34 -3.25 116.57 114.10 1wmj h LYS 56 Ca -0.16 0.00 -0.69 0.00 -1.87 0.00 0.00 60.65 57.93 1wmj h LYS 56 Cb 1.74 0.00 -0.36 0.00 0.08 0.00 0.00 32.23 33.69 1wmj h LYS 56 CO 0.19 0.00 -0.36 -0.06 -0.57 0.00 0.00 179.45 178.65 1wmj s PHE 57 N -4.86 3.44 -1.56 -1.35 0.08 0.25 -4.91 117.98 109.07 1wmj s PHE 57 Ca -0.05 -2.82 0.15 0.00 0.12 0.00 0.00 56.93 54.33 1wmj s PHE 57 Cb 0.18 -3.16 0.79 0.00 -0.57 0.00 0.00 43.02 40.26 1wmj s PHE 57 CO 0.66 -0.81 1.39 -0.35 -0.10 0.00 0.00 175.22 176.01 1wmj n PRO 58 N 3.24 0.27 -0.54 0.24 -0.04 -1.23 -2.76 135.00 134.18 1wmj n PRO 58 Ca 0.10 0.11 0.03 0.00 -0.04 0.00 0.00 63.50 63.71 1wmj n PRO 58 Cb 0.37 -1.50 0.23 0.00 -0.04 0.00 0.00 33.50 32.57 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 -0.03 2.42 3.49 0.55 0.00 -1.26 -4.90 105.19 105.45 1wmj n GLY 59 Ca 0.08 -0.55 -0.10 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.04 -0.00 -0.20 4.61 0.00 -1.11 -1.32 121.76 121.70 1wmj s ALA 60 Ca 0.32 -0.99 0.10 0.00 0.00 0.00 0.00 51.96 51.39 1wmj s ALA 60 Cb 0.25 1.08 -0.19 0.00 0.00 0.00 0.00 23.12 24.26 1wmj s ALA 60 CO 0.09 -0.78 -0.05 1.33 0.00 0.00 0.00 175.76 176.35 1wmj n VAL 61 N -0.34 1.24 -1.30 0.00 0.24 -0.91 -4.92 118.33 112.35 1wmj n VAL 61 Ca -0.02 -0.64 0.15 0.00 -2.04 0.00 0.00 64.34 61.79 1wmj n VAL 61 Cb 0.63 -0.86 -0.08 0.00 -1.47 0.00 0.00 33.84 32.06 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 -2.87 -3.22 0.00 6.34 3.01 -1.26 -4.64 117.46 114.83 1wmj n PHE 62 Ca -0.33 1.77 0.00 0.00 1.01 0.00 0.00 57.45 59.89 1wmj n PHE 62 Cb 1.01 -2.93 0.00 0.00 -0.01 0.00 0.00 39.48 37.55 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 -4.11 0.00 -4.21 4.37 7.94 -0.35 -4.12 117.00 116.52 1wmj n LEU 63 Ca -0.07 0.00 -0.30 0.00 -1.11 0.00 0.00 56.01 54.53 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 -0.54 -0.75 -1.11 0.00 0.00 177.39 175.02 1wmj s LYS 64 N -1.79 2.38 0.30 1.96 2.20 0.36 0.84 119.74 125.99 1wmj s LYS 64 Ca 0.00 -0.79 0.04 0.00 -0.36 0.00 0.00 55.97 54.87 1wmj s LYS 64 Cb 0.00 -1.97 -0.06 0.00 -1.51 0.00 0.00 37.83 34.29 1wmj s LYS 64 CO 0.00 0.28 0.03 0.14 -0.36 0.00 0.00 175.35 175.44 1wmj s VAL 65 N 0.04 1.26 -0.21 4.02 -7.23 -0.17 0.24 120.40 118.36 1wmj s VAL 65 Ca -0.07 -2.03 -0.02 0.00 -1.81 0.00 0.00 61.98 58.05 1wmj s VAL 65 Cb -0.14 -2.67 -0.00 0.00 0.56 0.00 0.00 36.38 34.12 1wmj s VAL 65 CO 0.04 -0.10 -0.09 -0.62 -0.31 0.00 0.00 175.10 174.03 1wmj s ASP 66 N -3.46 4.00 0.00 4.85 -1.08 -1.26 -3.45 116.67 116.27 1wmj s ASP 66 Ca 0.34 -0.45 0.00 0.00 -0.52 0.00 0.00 52.55 51.92 1wmj s ASP 66 Cb 0.07 -1.67 0.00 0.00 -1.46 0.00 0.00 42.92 39.87 1wmj s ASP 66 CO 0.14 -0.00 1.75 1.33 0.52 0.00 0.00 175.17 178.91 1wmj n VAL 67 N 4.68 1.75 0.00 1.11 0.24 -0.81 -2.95 118.33 122.35 1wmj n VAL 67 Ca -0.19 -0.40 0.00 0.00 -2.04 0.00 0.00 64.34 61.72 1wmj n VAL 67 Cb 0.51 -1.39 0.00 0.00 -1.47 0.00 0.00 33.84 31.48 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 1.35 2.21 0.00 -1.34 2.03 -1.26 -4.45 116.55 115.09 1wmj n ASP 68 Ca 0.00 -0.06 0.00 0.00 0.52 0.00 0.00 54.79 55.25 1wmj n ASP 68 Cb 0.48 0.56 0.00 0.00 -0.72 0.00 0.00 41.12 41.44 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 -0.79 3.09 -0.54 -0.67 0.28 -1.15 -4.76 120.64 116.10 1wmj n GLU 69 Ca 0.00 0.00 0.06 0.00 -0.16 0.00 0.00 57.16 57.06 1wmj n GLU 69 Cb 0.00 -1.00 0.12 0.00 1.43 0.00 0.00 31.44 32.00 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 -2.10 1.90 -0.46 -1.84 -0.00 -1.15 -4.84 117.00 108.51 1wmj n LEU 70 Ca 0.00 -2.89 0.36 0.00 -0.00 0.00 0.00 56.01 53.48 1wmj n LEU 70 Cb 0.50 -0.33 0.55 0.00 -0.00 0.00 0.00 43.42 44.14 1wmj n LEU 70 CO 0.00 0.85 1.05 2.29 -0.00 0.00 0.00 177.39 181.59 1wmj n LYS 71 N -0.80 0.00 0.11 1.47 2.85 -1.26 0.39 118.16 120.92 1wmj n LYS 71 Ca 0.13 0.78 0.14 0.00 -1.05 0.00 0.00 58.31 58.31 1wmj n LYS 71 Cb 0.75 -1.82 0.34 0.00 -0.65 0.00 0.00 35.03 33.64 1wmj n LYS 71 CO 0.00 0.00 0.00 1.05 -0.05 0.00 0.00 177.40 178.40 1wmj h GLU 72 N 0.00 0.00 0.00 -1.58 4.11 -1.94 2.20 114.58 117.37 1wmj h GLU 72 Ca 0.63 0.00 -0.29 0.00 0.07 0.00 0.00 59.36 59.78 1wmj h GLU 72 Cb 2.66 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 31.85 1wmj h GLU 72 CO -0.01 0.00 -1.88 0.28 0.07 0.00 0.00 179.01 177.47 1wmj n VAL 73 N -2.95 1.43 1.18 -1.06 0.31 0.16 -3.36 118.33 114.04 1wmj n VAL 73 Ca 0.09 -0.79 0.14 0.00 -0.01 0.00 0.00 64.34 63.77 1wmj n VAL 73 Cb 1.08 -0.78 0.57 0.00 -0.91 0.00 0.00 33.84 33.80 1wmj n VAL 73 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1wmj n ALA 74 N -2.58 2.70 -0.02 3.52 0.00 0.72 -3.29 120.51 121.57 1wmj n ALA 74 Ca -0.20 -0.20 0.07 0.00 0.00 0.00 0.00 53.44 53.11 1wmj n ALA 74 Cb 1.04 -1.37 -0.13 0.00 0.00 0.00 0.00 19.45 18.98 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 -1.31 0.61 0.13 0.00 -0.58 0.06 -1.74 120.64 117.80 1wmj n GLU 75 Ca 0.10 -0.14 0.04 0.00 -0.42 0.00 0.00 57.16 56.74 1wmj n GLU 75 Cb 0.31 -1.41 0.02 0.00 -0.57 0.00 0.00 31.44 29.79 1wmj n GLU 75 CO 0.00 0.00 0.00 1.57 -0.48 0.00 0.00 177.13 178.22 1wmj h LYS 76 N 0.00 0.00 0.00 3.49 5.09 -1.58 -3.32 116.57 120.25 1wmj h LYS 76 Ca -0.04 0.00 -0.11 0.00 0.09 0.00 0.00 60.65 60.59 1wmj h LYS 76 Cb 0.91 0.00 -0.02 0.00 0.10 0.00 0.00 32.23 33.22 1wmj h LYS 76 CO 0.00 0.34 -2.04 0.66 -2.09 0.00 0.00 179.45 176.32 1wmj n TYR 77 N -3.09 0.00 -1.32 0.07 4.01 -1.21 -5.05 117.16 110.57 1wmj n TYR 77 Ca -0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1wmj n TYR 77 Cb 0.71 -0.61 0.00 0.00 -0.31 0.00 0.00 39.34 39.13 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 -2.36 -1.75 -0.09 7.72 4.05 -1.21 -5.03 115.26 116.58 1wmj n ASN 78 Ca -0.12 0.00 -0.11 0.00 0.45 0.00 0.00 54.58 54.80 1wmj n ASN 78 Cb 0.71 -0.88 -0.13 0.00 1.23 0.00 0.00 39.78 40.71 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 -0.73 1.25 0.00 3.44 0.24 -0.71 -5.03 118.33 116.78 1wmj n VAL 79 Ca 0.00 -0.69 0.00 0.00 -2.04 0.00 0.00 64.34 61.61 1wmj n VAL 79 Cb 0.29 -0.73 0.00 0.00 -1.47 0.00 0.00 33.84 31.93 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 -2.79 0.00 0.00 7.34 -0.58 -1.26 -4.50 120.64 118.85 1wmj n GLU 80 Ca -0.32 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.42 1wmj n GLU 80 Cb 1.04 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.91 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 0.00 0.62 0.00 -1.26 -5.07 120.51 114.80 1wmj n ALA 81 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1wmj n ALA 81 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1wmj n ALA 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wmj n MET 82 N 0.00 0.00 -0.24 0.00 0.00 -1.26 -4.71 117.12 110.90 1wmj n MET 82 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 57.70 57.70 1wmj n MET 82 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 33.22 33.22 1wmj n MET 82 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 175.97 175.62 1wmj n PRO 83 N -0.15 0.49 -1.67 3.17 -0.04 -1.26 -2.57 135.00 132.97 1wmj n PRO 83 Ca 0.00 -0.00 -0.47 0.00 -0.04 0.00 0.00 63.50 62.98 1wmj n PRO 83 Cb 0.00 -1.26 -0.05 0.00 -0.04 0.00 0.00 33.50 32.16 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 1.76 0.18 -0.57 0.52 -1.04 -1.26 0.22 114.28 114.08 1wmj n THR 84 Ca 0.00 -0.03 -0.05 0.00 -2.04 0.00 0.00 64.05 61.92 1wmj n THR 84 Cb 0.24 -1.57 0.01 0.00 -1.82 0.00 0.00 70.33 67.19 1wmj n THR 84 CO 0.00 0.00 0.00 0.33 -0.64 0.00 0.00 175.07 174.76 1wmj n PHE 85 N 4.34 0.52 -0.83 -1.42 7.35 -1.25 -1.79 117.46 124.38 1wmj n PHE 85 Ca 0.19 -1.29 -0.28 0.00 -0.76 0.00 0.00 57.45 55.31 1wmj n PHE 85 Cb 0.28 -0.64 -0.01 0.00 0.35 0.00 0.00 39.48 39.46 1wmj n PHE 85 CO 0.00 0.00 0.00 -0.11 -0.76 0.00 0.00 176.76 175.89 1wmj n LEU 86 N 1.07 -1.30 -4.34 -2.13 -0.00 -0.63 -4.07 117.00 105.60 1wmj n LEU 86 Ca 0.10 0.59 -0.28 0.00 -0.00 0.00 0.00 56.01 56.43 1wmj n LEU 86 Cb 0.53 -0.56 -0.13 0.00 -0.00 0.00 0.00 43.42 43.26 1wmj n LEU 86 CO 0.13 -2.24 -0.55 -0.36 -0.00 0.00 0.00 177.39 174.36 1wmj s PHE 87 N -0.84 2.12 -0.50 1.96 0.40 0.56 -0.43 117.98 121.25 1wmj s PHE 87 Ca 0.38 -0.39 0.06 0.00 -0.60 0.00 0.00 56.93 56.38 1wmj s PHE 87 Cb -0.48 -1.19 0.23 0.00 0.51 0.00 0.00 43.02 42.09 1wmj s PHE 87 CO 0.37 0.24 0.56 -0.89 0.70 0.00 0.00 175.22 176.19 1wmj n ILE 88 N 1.23 0.40 -2.43 0.64 2.08 -1.08 -1.96 119.36 118.25 1wmj n ILE 88 Ca -0.18 -4.38 -0.43 0.00 0.56 0.00 0.00 62.75 58.32 1wmj n ILE 88 Cb 0.53 -1.98 -0.02 0.00 -0.75 0.00 0.00 39.64 37.42 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 -1.41 4.30 0.00 0.38 2.20 -1.26 -2.68 119.74 121.26 1wmj s LYS 89 Ca 0.35 1.68 0.00 0.00 -0.36 0.00 0.00 55.97 57.64 1wmj s LYS 89 Cb 0.12 -3.65 0.00 0.00 -1.51 0.00 0.00 37.83 32.79 1wmj s LYS 89 CO -0.10 -0.56 0.00 -3.47 -0.36 0.00 0.00 175.35 170.85 1wmj n ASP 90 N 5.82 0.00 0.00 1.43 -0.08 -1.26 -3.67 116.55 118.79 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 0.45 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.91 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 0.92 0.00 0.27 0.00 -1.09 -4.81 105.19 98.48 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 0.93 -3.17 4.61 0.00 -1.24 -5.10 120.51 116.54 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 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 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 0.11 -0.14 0.00 2.12 -1.26 -4.69 118.70 114.85 1wmj s GLU 93 Ca 0.00 0.21 0.16 0.00 0.36 0.00 0.00 54.97 55.70 1wmj s GLU 93 Cb 0.00 0.12 -0.24 0.00 0.26 0.00 0.00 34.13 34.27 1wmj s GLU 93 CO 0.00 -0.11 0.31 0.00 -0.54 0.00 0.00 175.26 174.92 1wmj n ALA 94 N 5.36 1.50 0.00 6.30 0.00 -0.83 -4.75 120.51 128.09 1wmj n ALA 94 Ca -0.08 -1.11 0.00 0.00 0.00 0.00 0.00 53.44 52.25 1wmj n ALA 94 Cb 0.54 -0.45 0.00 0.00 0.00 0.00 0.00 19.45 19.54 1wmj n ALA 94 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1wmj n ASP 95 N -2.87 0.00 -4.30 0.00 8.00 -1.25 -5.00 116.55 111.14 1wmj n ASP 95 Ca -0.27 0.00 -0.16 0.00 0.71 0.00 0.00 54.79 55.07 1wmj n ASP 95 Cb 1.12 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 42.11 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 -1.94 1.41 0.00 -1.24 0.00 -1.26 0.21 119.74 116.92 1wmj s LYS 96 Ca 0.00 -1.77 0.00 0.00 0.00 0.00 0.00 55.97 54.20 1wmj s LYS 96 Cb 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 37.83 37.59 1wmj s LYS 96 CO 0.00 -0.30 0.00 0.28 0.00 0.00 0.00 175.35 175.33 1wmj n VAL 97 N -0.46 0.00 0.00 1.79 0.31 -1.26 -4.89 118.33 113.82 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 0.66 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 -1.13 2.52 0.31 -1.26 -4.33 118.33 114.44 1wmj n VAL 98 Ca 0.00 0.00 -0.17 0.00 -0.01 0.00 0.00 64.34 64.16 1wmj n VAL 98 Cb 0.00 0.00 -0.10 0.00 -0.91 0.00 0.00 33.84 32.83 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 -0.61 3.53 0.39 2.92 0.00 0.58 -3.42 105.19 108.58 1wmj n GLY 99 Ca 0.00 -1.36 0.00 0.00 0.00 0.00 0.00 46.02 44.66 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 1.69 1.77 -3.82 4.61 0.00 -1.26 -4.62 120.51 118.88 1wmj n ALA 100 Ca 0.41 -0.05 -0.30 0.00 0.00 0.00 0.00 53.44 53.50 1wmj n ALA 100 Cb 0.73 -0.02 -0.15 0.00 0.00 0.00 0.00 19.45 20.01 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 0.95 0.00 0.00 3.00 -1.22 -4.96 118.95 116.72 1wmj s ARG 101 Ca 0.00 -1.29 0.14 0.00 0.00 0.00 0.00 55.73 54.58 1wmj s ARG 101 Cb 0.00 -2.34 0.83 0.00 0.00 0.00 0.00 34.95 33.44 1wmj s ARG 101 CO 0.00 -0.96 1.38 1.17 0.00 0.00 0.00 175.30 176.89 1wmj n LYS 102 N 4.68 0.79 0.00 3.54 0.00 -1.26 -1.65 118.16 124.26 1wmj n LYS 102 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.30 1wmj n LYS 102 Cb 0.42 -1.28 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 -0.40 0.00 0.00 0.00 177.40 177.00 1wmj n ASP 103 N -0.78 0.25 -0.00 3.14 5.68 -1.26 -4.67 116.55 118.91 1wmj n ASP 103 Ca 0.10 -0.60 0.04 0.00 -0.50 0.00 0.00 54.79 53.83 1wmj n ASP 103 Cb 0.05 0.66 -0.05 0.00 -1.14 0.00 0.00 41.12 40.64 1wmj n ASP 103 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 1wmj n ASP 104 N -0.66 2.06 0.00 -1.12 -0.08 -1.01 -4.44 116.55 111.29 1wmj n ASP 104 Ca 0.00 -0.28 0.00 0.00 -1.51 0.00 0.00 54.79 53.00 1wmj n ASP 104 Cb 0.01 1.20 0.00 0.00 2.34 0.00 0.00 41.12 44.66 1wmj n ASP 104 CO 0.00 0.00 0.00 -0.11 0.12 0.00 0.00 177.20 177.21 1wmj n LEU 105 N -1.51 1.46 -0.26 -2.67 7.94 -0.66 -2.84 117.00 118.47 1wmj n LEU 105 Ca -0.00 0.30 0.33 0.00 -1.11 0.00 0.00 56.01 55.52 1wmj n LEU 105 Cb 0.16 -0.20 0.74 0.00 0.53 0.00 0.00 43.42 44.65 1wmj n LEU 105 CO 0.15 -0.20 1.30 0.06 -1.11 0.00 0.00 177.39 177.59 1wmj h GLN 106 N 0.00 0.00 -0.14 1.96 -0.00 -1.84 0.73 115.11 115.82 1wmj h GLN 106 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 58.65 58.56 1wmj h GLN 106 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 27.47 1wmj h GLN 106 CO 0.00 0.00 -0.30 -0.97 -0.00 0.00 0.00 178.83 177.56 1wmj h ASN 107 N 0.00 0.27 0.14 0.06 -1.24 -1.78 -2.27 115.58 110.77 1wmj h ASN 107 Ca 0.51 -0.09 -0.27 0.00 0.71 0.00 0.00 56.30 57.16 1wmj h ASN 107 Cb 2.06 -0.07 0.01 0.00 0.73 0.00 0.00 38.32 41.04 1wmj h ASN 107 CO -0.01 0.56 -1.30 0.74 -1.29 0.00 0.00 177.43 176.14 1wmj h THR 108 N 0.24 1.18 -0.01 -3.57 2.02 0.57 -3.23 112.91 110.10 1wmj h THR 108 Ca 0.03 -2.48 0.00 0.00 0.77 0.00 0.00 66.41 64.74 1wmj h THR 108 Cb 0.65 2.89 -0.00 0.00 -1.74 0.00 0.00 68.15 69.95 1wmj h THR 108 CO 0.05 0.74 0.01 0.40 0.37 0.00 0.00 175.52 177.08 1wmj h ILE 109 N -0.23 0.69 0.02 3.11 5.03 -1.18 -0.74 117.51 124.21 1wmj h ILE 109 Ca -0.26 0.00 -0.21 0.00 -0.12 0.00 0.00 64.86 64.27 1wmj h ILE 109 Cb 1.81 0.99 -0.02 0.00 -3.03 0.00 0.00 36.82 36.57 1wmj h ILE 109 CO 0.12 0.00 -0.95 -0.37 -0.68 0.00 0.00 178.15 176.26 1wmj h VAL 110 N 0.00 1.61 0.00 1.67 -1.51 -1.50 1.20 116.25 117.71 1wmj h VAL 110 Ca 0.01 -3.03 -0.19 0.00 -1.23 0.00 0.00 66.70 62.25 1wmj h VAL 110 Cb 0.03 2.69 -0.03 0.00 -2.13 0.00 0.00 31.29 31.85 1wmj h VAL 110 CO -0.00 0.87 -0.90 0.07 -1.23 0.00 0.00 177.57 176.38 1wmj h LYS 111 N 0.03 0.00 0.00 5.19 2.10 -1.21 0.15 116.57 122.84 1wmj h LYS 111 Ca -0.03 0.00 -0.44 0.00 -2.00 0.00 0.00 60.65 58.17 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 0.13 0.90 -2.50 0.72 -2.00 0.00 0.00 179.45 176.71 1wmj n HIS 112 N -3.41 0.04 -0.05 0.07 8.25 -0.43 -4.06 115.22 115.63 1wmj n HIS 112 Ca -0.00 0.02 -0.09 0.00 -0.26 0.00 0.00 57.72 57.38 1wmj n HIS 112 Cb 0.87 -1.00 -0.15 0.00 1.12 0.00 0.00 29.99 30.83 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 -4.04 1.52 0.81 1.59 0.31 0.37 -4.12 118.33 114.78 1wmj n VAL 113 Ca -0.52 -0.82 0.13 0.00 -0.01 0.00 0.00 64.34 63.12 1wmj n VAL 113 Cb 0.91 -0.82 0.51 0.00 -0.91 0.00 0.00 33.84 33.53 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 -1.59 1.91 2.92 0.00 0.98 -4.77 105.19 106.28 1wmj n GLY 114 Ca -0.24 -0.06 -0.01 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.64 -0.58 0.00 4.61 0.00 0.24 -4.33 120.51 118.82 1wmj n ALA 115 Ca 0.06 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.52 1wmj n ALA 115 Cb 0.38 -0.49 0.00 0.00 0.00 0.00 0.00 19.45 19.34 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 -1.96 0.00 -2.62 0.00 -1.04 -1.01 -5.04 114.28 102.60 1wmj n THR 116 Ca -0.01 0.00 0.10 0.00 -2.04 0.00 0.00 64.05 62.09 1wmj n THR 116 Cb 0.31 0.00 -0.02 0.00 -1.82 0.00 0.00 70.33 68.80 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 -1.05 -1.96 -3.63 2.41 0.00 -0.66 -4.67 120.51 110.95 1wmj n ALA 117 Ca 0.00 0.22 -0.28 0.00 0.00 0.00 0.00 53.44 53.38 1wmj n ALA 117 Cb 0.00 -0.66 -0.11 0.00 0.00 0.00 0.00 19.45 18.67 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 -1.98 2.42 -1.50 0.00 0.00 -1.26 -4.88 121.76 114.56 1wmj s ALA 118 Ca 0.00 -2.99 -0.10 0.00 0.00 0.00 0.00 51.96 48.87 1wmj s ALA 118 Cb 0.00 -1.85 0.07 0.00 0.00 0.00 0.00 23.12 21.34 1wmj s ALA 118 CO 0.00 -2.04 0.80 0.43 0.00 0.00 0.00 175.76 174.96 1wmj n SER 119 N 2.62 -3.06 -4.84 0.00 7.64 -1.26 -4.94 113.62 109.78 1wmj n SER 119 Ca 0.23 -0.87 -0.35 0.00 1.01 0.00 0.00 58.87 58.90 1wmj n SER 119 Cb 0.41 -3.58 -0.06 0.00 -1.01 0.00 0.00 64.21 59.97 1wmj n SER 119 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1wmj s ALA 120 N -3.48 3.47 -0.40 -0.43 0.00 -1.26 -5.06 121.76 114.60 1wmj s ALA 120 Ca 0.44 -0.01 0.01 0.00 0.00 0.00 0.00 51.96 52.40 1wmj s ALA 120 Cb -0.22 -2.66 0.14 0.00 0.00 0.00 0.00 23.12 20.37 1wmj s ALA 120 CO 0.85 0.39 0.24 -1.12 0.00 0.00 0.00 175.76 176.12 1wmj s SER 121 N -1.86 3.20 0.00 0.00 0.01 -1.26 -5.14 113.70 108.66 1wmj s SER 121 Ca 0.43 -2.47 0.22 0.00 1.31 0.00 0.00 55.95 55.44 1wmj s SER 121 Cb -0.14 -0.71 0.17 0.00 0.21 0.00 0.00 66.02 65.55 1wmj s SER 121 CO 0.20 -0.28 1.19 0.00 0.41 0.00 0.00 173.24 174.76