#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ww4 n THR 3 N 0.00 -0.01 -0.87 4.28 5.66 -1.26 -5.16 114.28 116.92 1ww4 n THR 3 Ca 0.00 -1.56 -0.29 0.00 -3.05 0.00 0.00 64.05 59.15 1ww4 n THR 3 Cb 0.00 1.46 0.20 0.00 -1.55 0.00 0.00 70.33 70.44 1ww4 n THR 3 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 1ww4 s SER 4 N -1.36 2.16 0.01 1.09 0.01 -1.26 -4.90 113.70 109.44 1ww4 s SER 4 Ca 0.24 1.50 0.01 0.00 1.31 0.00 0.00 55.95 59.01 1ww4 s SER 4 Cb 0.28 -2.19 -0.01 0.00 0.21 0.00 0.00 66.02 64.31 1ww4 s SER 4 CO -0.09 -3.47 -0.04 0.00 0.41 0.00 0.00 173.24 170.06 1ww4 s ALA 5 N -2.72 0.28 -0.21 1.44 0.00 0.37 -5.00 121.76 115.93 1ww4 s ALA 5 Ca 0.66 -0.28 -0.04 0.00 0.00 0.00 0.00 51.96 52.30 1ww4 s ALA 5 Cb -0.21 -0.02 -0.02 0.00 0.00 0.00 0.00 23.12 22.87 1ww4 s ALA 5 CO 0.60 0.02 -0.03 0.08 0.00 0.00 0.00 175.76 176.44 1ww4 s VAL 6 N -0.44 3.61 -0.06 0.00 1.01 -1.26 -2.20 120.40 121.06 1ww4 s VAL 6 Ca -0.03 -0.42 0.05 0.00 0.00 0.00 0.00 61.98 61.59 1ww4 s VAL 6 Cb -0.04 -2.64 -0.01 0.00 0.00 0.00 0.00 36.38 33.70 1ww4 s VAL 6 CO -0.00 0.42 -0.22 0.20 0.00 0.00 0.00 175.10 175.50 1ww4 s ASN 7 N 1.27 2.78 -0.12 3.32 0.01 -0.85 -4.99 114.94 116.36 1ww4 s ASN 7 Ca 0.03 -0.46 0.02 0.00 -0.71 0.00 0.00 52.86 51.74 1ww4 s ASN 7 Cb -0.14 -0.81 -0.01 0.00 0.41 0.00 0.00 41.25 40.70 1ww4 s ASN 7 CO -0.01 0.21 -0.18 -0.63 -1.51 0.00 0.00 177.10 174.98 1ww4 s ILE 8 N -0.06 2.53 0.02 0.60 1.01 -1.26 -1.15 121.20 122.89 1ww4 s ILE 8 Ca -0.05 -0.84 0.05 0.00 0.00 0.00 0.00 60.65 59.81 1ww4 s ILE 8 Cb -0.13 -2.03 -0.02 0.00 0.01 0.00 0.00 42.46 40.29 1ww4 s ILE 8 CO 0.04 0.54 -0.14 -0.31 0.00 0.00 0.00 174.94 175.07 1ww4 s TYR 9 N 0.44 1.21 -0.28 3.97 2.02 0.50 -4.98 117.35 120.23 1ww4 s TYR 9 Ca -0.13 -0.30 -0.09 0.00 -0.37 0.00 0.00 57.07 56.17 1ww4 s TYR 9 Cb -0.17 -0.74 -0.03 0.00 -0.40 0.00 0.00 41.96 40.62 1ww4 s TYR 9 CO 0.06 0.01 0.13 -0.80 -1.57 0.00 0.00 175.55 173.38 1ww4 s ASN 10 N -0.81 5.52 -0.33 2.29 0.01 -1.26 -0.28 114.94 120.08 1ww4 s ASN 10 Ca 0.03 -0.26 -0.05 0.00 -0.71 0.00 0.00 52.86 51.87 1ww4 s ASN 10 Cb -0.07 -2.01 0.04 0.00 0.41 0.00 0.00 41.25 39.63 1ww4 s ASN 10 CO 0.01 -0.09 0.08 -0.63 -1.51 0.00 0.00 177.10 174.96 1ww4 s ILE 11 N 1.66 3.59 0.33 0.60 1.01 0.09 -4.97 121.20 123.51 1ww4 s ILE 11 Ca 0.06 -1.22 -0.26 0.00 0.00 0.00 0.00 60.65 59.23 1ww4 s ILE 11 Cb -0.16 -3.05 -0.10 0.00 0.01 0.00 0.00 42.46 39.16 1ww4 s ILE 11 CO 0.07 -0.18 0.98 -0.44 0.00 0.00 0.00 174.94 175.37 1ww4 s SER 12 N 1.39 7.20 0.23 3.58 0.01 -1.26 -1.25 113.70 123.61 1ww4 s SER 12 Ca -0.02 1.93 -0.31 0.00 1.31 0.00 0.00 55.95 58.85 1ww4 s SER 12 Cb -0.20 -2.59 -0.14 0.00 0.21 0.00 0.00 66.02 63.31 1ww4 s SER 12 CO 0.02 -0.17 1.30 0.00 0.41 0.00 0.00 173.24 174.80 1ww4 n ALA 13 N 0.49 0.53 -0.28 1.44 0.00 -0.34 -0.64 120.51 121.71 1ww4 n ALA 13 Ca 0.02 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.88 1ww4 n ALA 13 Cb 0.49 -2.19 0.00 0.00 0.00 0.00 0.00 19.45 17.76 1ww4 n ALA 13 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ww4 n GLY 14 N 1.94 1.26 4.01 0.00 0.00 0.33 -4.95 105.19 107.77 1ww4 n GLY 14 Ca 0.12 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.96 1ww4 n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ww4 s ALA 15 N -2.86 4.54 -0.08 4.61 0.00 0.19 -4.94 121.76 123.22 1ww4 s ALA 15 Ca 0.00 -1.74 -0.04 0.00 0.00 0.00 0.00 51.96 50.18 1ww4 s ALA 15 Cb 0.00 -1.62 0.05 0.00 0.00 0.00 0.00 23.12 21.55 1ww4 s ALA 15 CO 0.00 -0.41 0.18 0.45 0.00 0.00 0.00 175.76 175.98 1ww4 s SER 16 N -4.41 0.22 0.02 0.00 0.15 -1.26 -2.12 113.70 106.31 1ww4 s SER 16 Ca 0.56 0.37 0.04 0.00 0.70 0.00 0.00 55.95 57.63 1ww4 s SER 16 Cb -0.09 0.30 -0.03 0.00 -1.71 0.00 0.00 66.02 64.49 1ww4 s SER 16 CO 0.34 -0.19 -0.09 0.68 1.20 0.00 0.00 173.24 175.18 1ww4 s VAL 17 N 1.71 3.47 -0.22 4.45 -7.23 -0.05 -4.96 120.40 117.57 1ww4 s VAL 17 Ca -0.04 -0.91 -0.19 0.00 -1.81 0.00 0.00 61.98 59.04 1ww4 s VAL 17 Cb -0.12 -2.52 -0.03 0.00 0.56 0.00 0.00 36.38 34.28 1ww4 s VAL 17 CO -0.06 0.35 0.55 -1.81 -0.31 0.00 0.00 175.10 173.81 1ww4 s ASP 18 N -1.53 6.54 0.27 4.85 1.01 -1.26 -2.06 116.67 124.50 1ww4 s ASP 18 Ca 0.17 0.66 -0.29 0.00 0.71 0.00 0.00 52.55 53.80 1ww4 s ASP 18 Cb -0.11 -2.30 -0.10 0.00 1.01 0.00 0.00 42.92 41.42 1ww4 s ASP 18 CO 0.08 -0.25 1.35 -0.76 0.21 0.00 0.00 175.17 175.80 1ww4 s LEU 19 N 1.97 4.41 0.21 1.23 1.43 -0.28 -4.89 118.68 122.76 1ww4 s LEU 19 Ca 0.24 2.61 0.25 0.00 -1.03 0.00 0.00 54.13 56.20 1ww4 s LEU 19 Cb -0.16 -3.63 0.89 0.00 0.03 0.00 0.00 46.19 43.33 1ww4 s LEU 19 CO 0.09 -0.58 1.75 0.00 0.23 0.00 0.00 176.35 177.85 1ww4 n ALA 20 N 1.76 2.05 -3.69 4.21 0.00 -1.26 -4.56 120.51 119.01 1ww4 n ALA 20 Ca 0.04 0.01 -0.14 0.00 0.00 0.00 0.00 53.44 53.34 1ww4 n ALA 20 Cb 0.42 -1.43 -0.14 0.00 0.00 0.00 0.00 19.45 18.29 1ww4 n ALA 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ww4 s ALA 21 N -3.17 -0.38 0.45 0.00 0.00 -1.26 -5.14 121.76 112.26 1ww4 s ALA 21 Ca 0.09 0.78 -0.23 0.00 0.00 0.00 0.00 51.96 52.59 1ww4 s ALA 21 Cb 0.12 -0.80 -0.08 0.00 0.00 0.00 0.00 23.12 22.36 1ww4 s ALA 21 CO 0.51 -0.47 1.18 -1.25 0.00 0.00 0.00 175.76 175.74 1ww4 s PRO 22 N 2.00 3.80 -0.35 0.00 0.04 -1.26 -4.98 135.00 134.25 1ww4 s PRO 22 Ca -0.01 1.83 -0.20 0.00 0.04 0.00 0.00 61.00 62.66 1ww4 s PRO 22 Cb -0.12 -2.47 -0.00 0.00 0.04 0.00 0.00 34.50 31.95 1ww4 s PRO 22 CO -0.07 -0.53 0.61 0.08 0.04 0.00 0.00 177.00 177.12 1ww4 s VAL 23 N -1.49 4.93 0.18 -0.36 1.01 -0.03 -4.90 120.40 119.73 1ww4 s VAL 23 Ca 0.62 0.57 0.00 0.00 0.00 0.00 0.00 61.98 63.18 1ww4 s VAL 23 Cb -0.30 -4.04 0.00 0.00 0.00 0.00 0.00 36.38 32.04 1ww4 s VAL 23 CO 0.37 -0.26 0.01 1.07 0.00 0.00 0.00 175.10 176.28 1ww4 n THR 24 N 5.52 0.00 -1.65 3.92 5.66 -1.26 -1.18 114.28 125.29 1ww4 n THR 24 Ca -0.02 -0.84 -0.50 0.00 -3.05 0.00 0.00 64.05 59.64 1ww4 n THR 24 Cb 0.49 0.14 -0.05 0.00 -1.55 0.00 0.00 70.33 69.36 1ww4 n THR 24 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 1ww4 n THR 25 N -0.47 0.13 0.00 1.09 -1.04 -1.26 -0.86 114.28 111.86 1ww4 n THR 25 Ca -0.07 -0.02 0.00 0.00 -2.04 0.00 0.00 64.05 61.92 1ww4 n THR 25 Cb 0.23 -1.31 0.00 0.00 -1.82 0.00 0.00 70.33 67.42 1ww4 n THR 25 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ww4 n GLY 26 N 3.36 2.87 3.91 3.41 0.00 0.40 -4.64 105.19 114.50 1ww4 n GLY 26 Ca 0.19 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.93 1ww4 n GLY 26 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ww4 s ASP 27 N -1.27 5.01 0.15 1.61 1.01 -0.04 -4.56 116.67 118.58 1ww4 s ASP 27 Ca 0.00 0.79 0.07 0.00 0.71 0.00 0.00 52.55 54.11 1ww4 s ASP 27 Cb 0.00 -1.48 -0.04 0.00 1.01 0.00 0.00 42.92 42.41 1ww4 s ASP 27 CO 0.00 -1.54 -0.15 -0.63 0.21 0.00 0.00 175.17 173.06 1ww4 s ILE 28 N -3.34 1.51 -0.08 0.77 1.01 0.07 -2.21 121.20 118.93 1ww4 s ILE 28 Ca 0.59 -1.88 -0.03 0.00 0.00 0.00 0.00 60.65 59.33 1ww4 s ILE 28 Cb -0.11 -1.72 0.04 0.00 0.01 0.00 0.00 42.46 40.69 1ww4 s ILE 28 CO 0.48 -0.44 0.17 -0.69 0.00 0.00 0.00 174.94 174.46 1ww4 s VAL 29 N -2.34 -0.16 -0.01 2.92 1.01 -0.62 -1.06 120.40 120.14 1ww4 s VAL 29 Ca 0.13 0.25 0.07 0.00 0.00 0.00 0.00 61.98 62.43 1ww4 s VAL 29 Cb -0.04 -0.29 -0.02 0.00 0.00 0.00 0.00 36.38 36.03 1ww4 s VAL 29 CO 0.04 0.10 -0.22 -0.89 0.00 0.00 0.00 175.10 174.14 1ww4 s THR 30 N 1.71 1.71 -0.17 3.92 2.01 -0.19 0.03 115.64 124.67 1ww4 s THR 30 Ca -0.04 -0.94 -0.03 0.00 0.31 0.00 0.00 61.69 60.99 1ww4 s THR 30 Cb -0.12 -1.42 -0.02 0.00 0.01 0.00 0.00 72.50 70.95 1ww4 s THR 30 CO -0.06 0.47 -0.04 -0.36 -0.69 0.00 0.00 174.62 173.94 1ww4 s PHE 31 N -0.52 2.99 -0.16 4.92 0.08 0.22 -1.67 117.98 123.84 1ww4 s PHE 31 Ca 0.08 -0.45 -0.03 0.00 0.12 0.00 0.00 56.93 56.65 1ww4 s PHE 31 Cb -0.08 -1.99 -0.02 0.00 -0.57 0.00 0.00 43.02 40.36 1ww4 s PHE 31 CO -0.01 -0.16 -0.05 -0.06 -0.10 0.00 0.00 175.22 174.84 1ww4 s PHE 32 N 0.62 2.98 -0.11 0.36 0.08 0.16 -0.80 117.98 121.26 1ww4 s PHE 32 Ca -0.03 -0.42 0.03 0.00 0.12 0.00 0.00 56.93 56.63 1ww4 s PHE 32 Cb -0.14 -1.96 -0.00 0.00 -0.57 0.00 0.00 43.02 40.34 1ww4 s PHE 32 CO 0.02 -0.12 -0.21 0.45 -0.10 0.00 0.00 175.22 175.27 1ww4 s SER 33 N 0.49 3.34 -0.08 1.36 0.15 0.10 -1.06 113.70 118.01 1ww4 s SER 33 Ca -0.04 -0.51 0.10 0.00 0.70 0.00 0.00 55.95 56.21 1ww4 s SER 33 Cb -0.15 -1.47 0.44 0.00 -1.71 0.00 0.00 66.02 63.13 1ww4 s SER 33 CO 0.03 0.15 1.27 -1.54 1.20 0.00 0.00 173.24 174.35 1ww4 n SER 34 N 3.62 3.16 -3.59 5.45 3.41 -1.26 -1.47 113.62 122.94 1ww4 n SER 34 Ca -0.19 -2.31 -0.12 0.00 -0.26 0.00 0.00 58.87 55.99 1ww4 n SER 34 Cb 0.53 -0.47 -0.05 0.00 -0.26 0.00 0.00 64.21 63.96 1ww4 n SER 34 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ww4 s ALA 35 N -1.77 -1.17 -0.13 7.33 0.00 -1.16 -4.65 121.76 120.20 1ww4 s ALA 35 Ca 0.31 0.29 -0.05 0.00 0.00 0.00 0.00 51.96 52.51 1ww4 s ALA 35 Cb 0.20 0.58 0.07 0.00 0.00 0.00 0.00 23.12 23.97 1ww4 s ALA 35 CO 0.14 -0.59 0.26 -1.17 0.00 0.00 0.00 175.76 174.39 1ww4 s LEU 36 N -2.42 -0.30 -0.41 0.00 2.96 -1.25 -4.12 118.68 113.14 1ww4 s LEU 36 Ca -0.01 0.56 0.02 0.00 -0.22 0.00 0.00 54.13 54.49 1ww4 s LEU 36 Cb 0.00 0.69 0.12 0.00 0.50 0.00 0.00 46.19 47.50 1ww4 s LEU 36 CO -0.08 -0.24 0.18 0.20 -1.32 0.00 0.00 176.35 175.09 1ww4 s ASN 37 N 2.42 4.12 0.00 3.68 0.02 -0.83 -4.83 114.94 119.51 1ww4 s ASN 37 Ca 0.02 -2.43 0.28 0.00 -1.02 0.00 0.00 52.86 49.71 1ww4 s ASN 37 Cb -0.12 -1.27 1.16 0.00 0.02 0.00 0.00 41.25 41.04 1ww4 s ASN 37 CO -0.09 -0.31 1.84 0.18 0.02 0.00 0.00 177.10 178.75 1ww4 n LEU 38 N 3.84 0.23 -2.43 0.60 7.99 -1.26 -3.57 117.00 122.39 1ww4 n LEU 38 Ca 0.05 0.23 -0.21 0.00 -0.01 0.00 0.00 56.01 56.06 1ww4 n LEU 38 Cb 0.37 -0.32 0.01 0.00 -0.11 0.00 0.00 43.42 43.37 1ww4 n LEU 38 CO 0.24 0.05 0.12 -1.54 -1.51 0.00 0.00 177.39 174.75 1ww4 n SER 39 N -1.30 3.98 -0.07 -1.43 3.41 -1.26 -4.85 113.62 112.11 1ww4 n SER 39 Ca 0.10 -3.43 -0.10 0.00 -0.26 0.00 0.00 58.87 55.18 1ww4 n SER 39 Cb 0.30 -0.45 -0.09 0.00 -0.26 0.00 0.00 64.21 63.72 1ww4 n SER 39 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ww4 h ALA 40 N 2.56 0.01 0.00 7.33 0.00 -1.91 -3.51 119.26 123.74 1ww4 h ALA 40 Ca 0.22 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1ww4 h ALA 40 Cb 1.13 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1ww4 h ALA 40 CO 0.72 0.03 0.00 0.41 0.00 0.00 0.00 179.25 180.41 1ww4 n GLY 41 N 1.65 -0.35 3.90 0.00 0.00 -1.26 -4.87 105.19 104.27 1ww4 n GLY 41 Ca -0.08 -1.11 -0.33 0.00 0.00 0.00 0.00 46.02 44.51 1ww4 n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ww4 s ALA 42 N -1.00 3.90 0.05 4.61 0.00 -1.26 -4.27 121.76 123.79 1ww4 s ALA 42 Ca 0.00 -0.68 0.00 0.00 0.00 0.00 0.00 51.96 51.28 1ww4 s ALA 42 Cb 0.00 -1.98 -0.04 0.00 0.00 0.00 0.00 23.12 21.10 1ww4 s ALA 42 CO 0.00 0.72 0.18 0.20 0.00 0.00 0.00 175.76 176.86 1ww4 s GLY 43 N -2.10 2.15 -0.88 0.00 0.00 -1.26 -4.84 107.32 100.39 1ww4 s GLY 43 Ca 0.32 -0.86 0.01 0.00 0.00 0.00 0.00 44.72 44.18 1ww4 s GLY 43 CO 0.21 -0.83 1.60 1.44 0.00 0.00 0.00 173.10 175.52 1ww4 n SER 44 N 0.45 6.56 0.00 1.64 7.64 -1.26 -4.03 113.62 124.62 1ww4 n SER 44 Ca -0.07 -3.70 0.11 0.00 1.01 0.00 0.00 58.87 56.22 1ww4 n SER 44 Cb 0.51 -0.98 0.05 0.00 -1.01 0.00 0.00 64.21 62.79 1ww4 n SER 44 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1ww4 n PRO 45 N -0.17 0.03 -3.12 1.43 -0.04 -1.26 -5.05 135.00 126.82 1ww4 n PRO 45 Ca 0.43 -0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 63.49 1ww4 n PRO 45 Cb 0.31 -1.51 -0.06 0.00 -0.04 0.00 0.00 33.50 32.20 1ww4 n PRO 45 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1ww4 s ASN 46 N -3.09 6.69 0.14 3.54 0.02 -1.26 -4.67 114.94 116.31 1ww4 s ASN 46 Ca 0.09 0.83 -0.05 0.00 -1.02 0.00 0.00 52.86 52.71 1ww4 s ASN 46 Cb 0.16 -2.35 -0.04 0.00 0.02 0.00 0.00 41.25 39.05 1ww4 s ASN 46 CO 0.79 -0.27 1.37 0.78 0.02 0.00 0.00 177.10 179.79 1ww4 h ASN 47 N 7.47 0.62 -3.52 -1.22 4.21 -1.18 -3.26 115.58 118.70 1ww4 h ASN 47 Ca -0.32 -0.43 -0.10 0.00 1.21 0.00 0.00 56.30 56.67 1ww4 h ASN 47 Cb 1.14 -0.18 -0.24 0.00 -1.12 0.00 0.00 38.32 37.91 1ww4 h ASN 47 CO 0.77 1.20 -0.20 -0.89 -1.29 0.00 0.00 177.43 177.02 1ww4 s THR 48 N -3.56 -0.01 -0.04 2.81 2.01 -1.17 -2.73 115.64 112.95 1ww4 s THR 48 Ca -0.07 0.04 0.02 0.00 0.31 0.00 0.00 61.69 61.99 1ww4 s THR 48 Cb 0.10 -0.67 0.02 0.00 0.01 0.00 0.00 72.50 71.95 1ww4 s THR 48 CO 0.86 0.02 -0.06 0.00 -0.69 0.00 0.00 174.62 174.75 1ww4 s ALA 49 N 0.88 0.75 -0.14 7.40 0.00 0.40 -0.54 121.76 130.51 1ww4 s ALA 49 Ca -0.05 -0.15 0.01 0.00 0.00 0.00 0.00 51.96 51.77 1ww4 s ALA 49 Cb -0.06 -0.39 -0.00 0.00 0.00 0.00 0.00 23.12 22.67 1ww4 s ALA 49 CO -0.07 0.04 -0.17 -0.51 0.00 0.00 0.00 175.76 175.05 1ww4 s LEU 50 N 0.67 2.44 -0.01 0.00 2.01 0.11 -1.14 118.68 122.75 1ww4 s LEU 50 Ca -0.10 -0.46 0.05 0.00 0.01 0.00 0.00 54.13 53.63 1ww4 s LEU 50 Cb -0.13 -1.54 -0.01 0.00 0.01 0.00 0.00 46.19 44.52 1ww4 s LEU 50 CO 0.01 0.12 -0.16 0.20 1.01 0.00 0.00 176.35 177.52 1ww4 s ASN 51 N 0.60 1.91 -0.27 2.29 -0.87 -0.24 -0.81 114.94 117.54 1ww4 s ASN 51 Ca -0.10 -0.30 -0.06 0.00 -1.57 0.00 0.00 52.86 50.83 1ww4 s ASN 51 Cb -0.16 -0.21 -0.00 0.00 -0.02 0.00 0.00 41.25 40.86 1ww4 s ASN 51 CO 0.03 0.20 0.05 -0.76 -2.57 0.00 0.00 177.10 174.05 1ww4 s LEU 52 N -0.41 3.56 0.02 0.60 1.02 0.08 -1.76 118.68 121.78 1ww4 s LEU 52 Ca 0.06 -0.55 0.06 0.00 0.02 0.00 0.00 54.13 53.72 1ww4 s LEU 52 Cb -0.06 -1.85 -0.03 0.00 0.02 0.00 0.00 46.19 44.26 1ww4 s LEU 52 CO -0.01 -0.12 -0.15 -0.76 0.02 0.00 0.00 176.35 175.34 1ww4 s LEU 53 N 1.51 2.77 0.85 1.79 1.43 0.30 -0.15 118.68 127.18 1ww4 s LEU 53 Ca 0.04 -0.31 -0.13 0.00 -1.03 0.00 0.00 54.13 52.69 1ww4 s LEU 53 Cb -0.16 -1.60 0.11 0.00 0.03 0.00 0.00 46.19 44.57 1ww4 s LEU 53 CO 0.01 0.28 1.21 -0.94 0.23 0.00 0.00 176.35 177.14 1ww4 s SER 54 N -1.31 4.11 0.00 2.29 1.04 -0.01 -1.47 113.70 118.35 1ww4 s SER 54 Ca 0.15 0.68 0.13 0.00 0.48 0.00 0.00 55.95 57.39 1ww4 s SER 54 Cb -0.11 -1.08 0.60 0.00 0.10 0.00 0.00 66.02 65.53 1ww4 s SER 54 CO 0.05 -2.15 1.39 1.21 0.98 0.00 0.00 173.24 174.72 1ww4 n GLU 55 N -3.46 0.08 -0.15 4.02 2.13 -1.26 -1.33 120.64 120.67 1ww4 n GLU 55 Ca 0.09 0.23 0.12 0.00 0.66 0.00 0.00 57.16 58.27 1ww4 n GLU 55 Cb 0.61 -1.50 0.20 0.00 0.27 0.00 0.00 31.44 31.02 1ww4 n GLU 55 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1ww4 n ASN 56 N -1.41 3.31 0.00 4.31 3.02 -1.26 -4.93 115.26 118.30 1ww4 n ASN 56 Ca 0.04 -1.98 0.00 0.00 -0.03 0.00 0.00 54.58 52.61 1ww4 n ASN 56 Cb 0.13 -0.19 0.00 0.00 -0.61 0.00 0.00 39.78 39.11 1ww4 n ASN 56 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ww4 n GLY 57 N 1.47 1.09 3.76 7.41 0.00 -0.44 -4.61 105.19 113.87 1ww4 n GLY 57 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 1ww4 n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ww4 s ALA 58 N -3.22 3.00 -1.07 4.61 0.00 -1.26 -4.40 121.76 119.42 1ww4 s ALA 58 Ca 0.00 1.19 -0.16 0.00 0.00 0.00 0.00 51.96 52.99 1ww4 s ALA 58 Cb 0.00 -3.49 0.15 0.00 0.00 0.00 0.00 23.12 19.77 1ww4 s ALA 58 CO 0.00 -1.01 1.29 0.71 0.00 0.00 0.00 175.76 176.75 1ww4 s TYR 59 N -1.36 3.28 0.16 0.00 2.02 0.62 -0.83 117.35 121.24 1ww4 s TYR 59 Ca 0.65 -1.73 -0.24 0.00 -0.37 0.00 0.00 57.07 55.38 1ww4 s TYR 59 Cb -0.36 -4.31 0.04 0.00 -0.40 0.00 0.00 41.96 36.92 1ww4 s TYR 59 CO 0.45 -1.46 1.59 -0.07 -1.57 0.00 0.00 175.55 174.49 1ww4 h LEU 60 N 10.17 -1.15 -7.46 -1.29 -0.00 -0.83 -2.99 115.31 111.77 1ww4 h LEU 60 Ca 0.24 0.19 -0.30 0.00 -0.00 0.00 0.00 57.88 58.01 1ww4 h LEU 60 Cb 0.95 0.52 -0.34 0.00 -0.00 0.00 0.00 40.66 41.79 1ww4 h LEU 60 CO 1.18 -0.34 -0.70 -0.22 -0.00 0.00 0.00 178.44 178.36 1ww4 s LEU 61 N -10.54 0.82 -0.18 1.67 2.96 -0.81 -4.63 118.68 107.96 1ww4 s LEU 61 Ca -0.15 0.11 -0.01 0.00 -0.22 0.00 0.00 54.13 53.86 1ww4 s LEU 61 Cb 0.13 0.02 -0.00 0.00 0.50 0.00 0.00 46.19 46.84 1ww4 s LEU 61 CO 0.67 -0.16 -0.11 -2.28 -1.32 0.00 0.00 176.35 173.16 1ww4 s HIS 62 N 1.30 2.86 -0.20 5.38 5.65 -0.16 -0.74 115.29 129.38 1ww4 s HIS 62 Ca -0.07 -1.00 0.00 0.00 0.25 0.00 0.00 55.06 54.25 1ww4 s HIS 62 Cb -0.13 -1.98 0.02 0.00 -1.18 0.00 0.00 32.58 29.32 1ww4 s HIS 62 CO -0.04 -0.50 -0.15 0.42 -0.65 0.00 0.00 174.74 173.82 1ww4 s ILE 63 N 1.06 2.33 -0.09 0.89 1.01 0.01 -2.10 121.20 124.31 1ww4 s ILE 63 Ca -0.00 -0.99 0.02 0.00 0.00 0.00 0.00 60.65 59.67 1ww4 s ILE 63 Cb -0.15 -2.07 0.01 0.00 0.01 0.00 0.00 42.46 40.27 1ww4 s ILE 63 CO -0.02 0.41 -0.14 0.00 0.00 0.00 0.00 174.94 175.18 1ww4 s ALA 64 N 1.29 1.53 -0.25 9.38 0.00 -0.24 -0.71 121.76 132.76 1ww4 s ALA 64 Ca 0.03 -0.61 -0.10 0.00 0.00 0.00 0.00 51.96 51.28 1ww4 s ALA 64 Cb -0.15 -0.72 -0.05 0.00 0.00 0.00 0.00 23.12 22.20 1ww4 s ALA 64 CO -0.10 0.02 0.16 -0.06 0.00 0.00 0.00 175.76 175.77 1ww4 s PHE 65 N 0.84 3.26 -0.37 0.00 0.40 0.30 -0.37 117.98 122.04 1ww4 s PHE 65 Ca -0.10 0.12 0.03 0.00 -0.60 0.00 0.00 56.93 56.38 1ww4 s PHE 65 Cb -0.15 -2.29 0.10 0.00 0.51 0.00 0.00 43.02 41.19 1ww4 s PHE 65 CO 0.01 -0.04 0.09 1.03 0.70 0.00 0.00 175.22 177.01 1ww4 s ARG 66 N 1.30 1.58 0.06 0.44 3.00 0.11 -0.69 118.95 124.76 1ww4 s ARG 66 Ca 0.07 -1.96 -0.33 0.00 0.00 0.00 0.00 55.73 53.51 1ww4 s ARG 66 Cb -0.14 -3.26 -0.19 0.00 0.00 0.00 0.00 34.95 31.36 1ww4 s ARG 66 CO 0.06 -0.97 1.56 -0.07 0.00 0.00 0.00 175.30 175.88 1ww4 h LEU 67 N 7.52 -0.79 -1.35 2.53 4.07 -1.81 0.36 115.31 125.83 1ww4 h LEU 67 Ca -0.05 0.02 0.15 0.00 0.08 0.00 0.00 57.88 58.08 1ww4 h LEU 67 Cb 1.01 0.21 -0.07 0.00 1.08 0.00 0.00 40.66 42.88 1ww4 h LEU 67 CO 0.55 -0.54 0.57 0.06 -1.08 0.00 0.00 178.44 178.00 1ww4 h GLN 68 N -0.98 0.60 -0.19 1.13 -0.00 -1.92 0.83 115.11 114.59 1ww4 h GLN 68 Ca -0.10 -0.04 0.00 0.00 -0.00 0.00 0.00 58.65 58.52 1ww4 h GLN 68 Cb 0.73 -0.13 0.00 0.00 -0.00 0.00 0.00 27.48 28.08 1ww4 h GLN 68 CO 0.16 0.40 0.00 0.39 -0.00 0.00 0.00 178.83 179.77 1ww4 n GLU 69 N -4.55 1.98 -4.08 0.06 1.02 -1.16 -4.96 120.64 108.95 1ww4 n GLU 69 Ca 0.17 -1.46 -0.38 0.00 -0.02 0.00 0.00 57.16 55.47 1ww4 n GLU 69 Cb 0.51 -1.44 -0.02 0.00 -0.02 0.00 0.00 31.44 30.47 1ww4 n GLU 69 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1ww4 n ASN 70 N 0.70 -2.25 -3.91 1.62 2.85 0.29 -4.92 115.26 109.63 1ww4 n ASN 70 Ca 0.17 -1.16 -0.09 0.00 -0.11 0.00 0.00 54.58 53.39 1ww4 n ASN 70 Cb 0.43 -1.41 -0.05 0.00 1.24 0.00 0.00 39.78 39.99 1ww4 n ASN 70 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1ww4 s VAL 71 N -3.86 0.01 -0.08 3.44 1.01 -0.29 -2.49 120.40 118.15 1ww4 s VAL 71 Ca 0.31 -1.20 0.02 0.00 0.00 0.00 0.00 61.98 61.11 1ww4 s VAL 71 Cb -0.17 -1.98 0.01 0.00 0.00 0.00 0.00 36.38 34.24 1ww4 s VAL 71 CO 0.88 -0.07 -0.15 -0.63 0.00 0.00 0.00 175.10 175.14 1ww4 s ILE 72 N -3.96 1.33 -0.05 2.22 1.01 -0.46 -0.71 121.20 120.58 1ww4 s ILE 72 Ca 0.17 -0.59 0.02 0.00 0.00 0.00 0.00 60.65 60.26 1ww4 s ILE 72 Cb -0.01 -1.20 -0.03 0.00 0.01 0.00 0.00 42.46 41.23 1ww4 s ILE 72 CO 0.05 0.40 -0.10 -0.69 0.00 0.00 0.00 174.94 174.60 1ww4 s VAL 73 N 0.64 3.46 -0.11 2.92 1.01 0.50 -0.96 120.40 127.86 1ww4 s VAL 73 Ca -0.15 -0.62 0.02 0.00 0.00 0.00 0.00 61.98 61.24 1ww4 s VAL 73 Cb -0.16 -2.41 0.01 0.00 0.00 0.00 0.00 36.38 33.82 1ww4 s VAL 73 CO 0.04 0.56 -0.19 -0.36 0.00 0.00 0.00 175.10 175.16 1ww4 s PHE 74 N -0.81 2.23 0.30 5.22 0.40 -0.85 -1.08 117.98 123.39 1ww4 s PHE 74 Ca 0.13 -1.02 -0.08 0.00 -0.60 0.00 0.00 56.93 55.36 1ww4 s PHE 74 Cb -0.11 -1.55 0.03 0.00 0.51 0.00 0.00 43.02 41.90 1ww4 s PHE 74 CO 0.02 -0.48 0.54 -1.71 0.70 0.00 0.00 175.22 174.29 1ww4 n ASN 75 N 3.98 -1.54 -3.72 1.36 2.85 -0.89 -1.05 115.26 116.25 1ww4 n ASN 75 Ca -0.20 -2.38 -0.10 0.00 -0.11 0.00 0.00 54.58 51.78 1ww4 n ASN 75 Cb 0.52 2.65 -0.04 0.00 1.24 0.00 0.00 39.78 44.15 1ww4 n ASN 75 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 1ww4 s SER 76 N -2.70 0.16 0.00 1.20 0.01 -1.26 -0.99 113.70 110.12 1ww4 s SER 76 Ca 0.17 -1.09 0.00 0.00 1.31 0.00 0.00 55.95 56.35 1ww4 s SER 76 Cb -0.03 0.63 0.00 0.00 0.21 0.00 0.00 66.02 66.83 1ww4 s SER 76 CO 0.13 -1.23 0.00 -2.11 0.41 0.00 0.00 173.24 170.44 1ww4 n ARG 77 N -0.44 0.00 -1.59 12.44 1.85 -1.13 -2.21 116.66 125.58 1ww4 n ARG 77 Ca -0.02 0.00 -0.31 0.00 -1.00 0.00 0.00 57.85 56.52 1ww4 n ARG 77 Cb 0.62 0.00 0.05 0.00 -1.05 0.00 0.00 32.46 32.08 1ww4 n ARG 77 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 1ww4 s GLN 78 N -0.87 2.92 0.49 2.89 -1.52 -1.26 -0.27 119.66 122.04 1ww4 s GLN 78 Ca 0.00 0.99 -0.24 0.00 -1.95 0.00 0.00 55.36 54.16 1ww4 s GLN 78 Cb 0.00 -1.99 -0.07 0.00 -0.22 0.00 0.00 33.01 30.73 1ww4 s GLN 78 CO 0.00 -1.11 1.40 -1.25 -0.25 0.00 0.00 175.29 174.07 1ww4 s PRO 79 N -4.96 3.48 -1.36 2.91 0.04 -1.26 -2.81 135.00 131.05 1ww4 s PRO 79 Ca 0.59 2.34 -0.09 0.00 0.04 0.00 0.00 61.00 63.88 1ww4 s PRO 79 Cb -0.14 -2.50 0.00 0.00 0.04 0.00 0.00 34.50 31.90 1ww4 s PRO 79 CO 0.54 -0.95 0.44 0.09 0.04 0.00 0.00 177.00 177.16 1ww4 n ASN 80 N -0.51 -1.51 -3.81 6.66 3.02 -1.26 -4.96 115.26 112.89 1ww4 n ASN 80 Ca 0.07 -1.10 -0.09 0.00 -0.03 0.00 0.00 54.58 53.43 1ww4 n ASN 80 Cb 0.43 -2.65 -0.07 0.00 -0.61 0.00 0.00 39.78 36.88 1ww4 n ASN 80 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ww4 s ALA 81 N -3.89 -0.37 0.74 5.41 0.00 -1.12 -5.17 121.76 117.35 1ww4 s ALA 81 Ca 0.16 -0.48 -0.11 0.00 0.00 0.00 0.00 51.96 51.52 1ww4 s ALA 81 Cb -0.07 0.51 0.04 0.00 0.00 0.00 0.00 23.12 23.60 1ww4 s ALA 81 CO 0.92 -0.52 1.09 -1.25 0.00 0.00 0.00 175.76 175.99 1ww4 s PRO 82 N -3.74 2.47 0.57 0.00 0.04 -1.26 -4.76 135.00 128.31 1ww4 s PRO 82 Ca 0.04 1.17 -0.20 0.00 0.04 0.00 0.00 61.00 62.05 1ww4 s PRO 82 Cb 0.04 -1.92 -0.04 0.00 0.04 0.00 0.00 34.50 32.61 1ww4 s PRO 82 CO -0.11 -1.48 1.23 -1.58 0.04 0.00 0.00 177.00 175.11 1ww4 s TRP 83 N -2.83 2.42 0.00 0.56 0.23 -1.26 -4.65 118.94 113.42 1ww4 s TRP 83 Ca 0.62 1.49 0.00 0.00 -2.03 0.00 0.00 56.10 56.18 1ww4 s TRP 83 Cb -0.17 -3.54 0.00 0.00 0.03 0.00 0.00 33.47 29.79 1ww4 s TRP 83 CO 0.53 -2.28 0.00 1.28 0.96 0.00 0.00 176.95 177.44 1ww4 n LEU 84 N -1.34 0.00 -4.64 2.99 4.77 -0.94 -5.01 117.00 112.83 1ww4 n LEU 84 Ca 0.12 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.68 1ww4 n LEU 84 Cb 0.48 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.55 1ww4 n LEU 84 CO 0.47 0.00 1.53 -0.69 -1.33 0.00 0.00 177.39 177.36 1ww4 s VAL 85 N 2.21 3.35 -0.28 4.08 1.01 -1.26 -4.86 120.40 124.66 1ww4 s VAL 85 Ca 0.00 0.40 -0.09 0.00 0.00 0.00 0.00 61.98 62.30 1ww4 s VAL 85 Cb 0.00 -3.33 -0.03 0.00 0.00 0.00 0.00 36.38 33.02 1ww4 s VAL 85 CO 0.00 -0.12 0.12 -1.83 0.00 0.00 0.00 175.10 173.28 1ww4 s GLU 86 N 4.84 3.62 0.80 2.72 -1.05 -1.26 -4.66 118.70 123.69 1ww4 s GLU 86 Ca 0.82 -0.52 -0.12 0.00 -0.15 0.00 0.00 54.97 55.00 1ww4 s GLU 86 Cb -0.33 -3.48 0.07 0.00 -0.44 0.00 0.00 34.13 29.96 1ww4 s GLU 86 CO 0.34 -0.26 1.17 -0.65 0.95 0.00 0.00 175.26 176.80 1ww4 s GLN 87 N 1.65 2.08 -0.17 -4.83 -1.52 -0.22 -4.90 119.66 111.75 1ww4 s GLN 87 Ca 0.06 0.17 -0.28 0.00 -1.95 0.00 0.00 55.36 53.36 1ww4 s GLN 87 Cb -0.16 -1.96 0.08 0.00 -0.22 0.00 0.00 33.01 30.76 1ww4 s GLN 87 CO 0.06 -1.53 0.78 -0.98 -0.25 0.00 0.00 175.29 173.37 1ww4 s ARG 88 N -5.54 0.86 -0.10 2.91 1.70 -1.26 -2.01 118.95 115.51 1ww4 s ARG 88 Ca 0.61 0.54 0.02 0.00 -0.47 0.00 0.00 55.73 56.43 1ww4 s ARG 88 Cb -0.11 0.41 -0.01 0.00 -0.57 0.00 0.00 34.95 34.67 1ww4 s ARG 88 CO 0.50 -0.20 -0.18 0.08 -1.08 0.00 0.00 175.30 174.41 1ww4 s VAL 89 N -0.48 2.63 0.26 4.99 1.01 -0.14 -4.97 120.40 123.71 1ww4 s VAL 89 Ca -0.04 -0.83 -0.19 0.00 0.00 0.00 0.00 61.98 60.92 1ww4 s VAL 89 Cb -0.02 -2.05 -0.09 0.00 0.00 0.00 0.00 36.38 34.22 1ww4 s VAL 89 CO 0.04 0.55 0.75 -0.44 0.00 0.00 0.00 175.10 175.99 1ww4 s SER 90 N 0.14 6.98 -0.15 3.32 0.01 -1.26 -1.35 113.70 121.39 1ww4 s SER 90 Ca -0.09 1.41 -0.10 0.00 1.31 0.00 0.00 55.95 58.47 1ww4 s SER 90 Cb -0.16 -2.42 0.04 0.00 0.21 0.00 0.00 66.02 63.70 1ww4 s SER 90 CO 0.06 -0.06 0.21 -3.20 0.41 0.00 0.00 173.24 170.66 1ww4 n ASN 91 N 0.34 -0.63 0.07 2.44 5.15 -1.04 -4.90 115.26 116.68 1ww4 n ASN 91 Ca -0.00 1.11 -0.03 0.00 -0.60 0.00 0.00 54.58 55.06 1ww4 n ASN 91 Cb 0.52 -4.50 -0.01 0.00 -0.53 0.00 0.00 39.78 35.25 1ww4 n ASN 91 CO 0.00 0.00 0.00 0.58 1.40 0.00 0.00 177.26 179.24 1ww4 h VAL 92 N 3.36 0.00 -1.37 3.44 2.07 -1.86 -3.20 116.25 118.68 1ww4 h VAL 92 Ca -0.47 0.00 0.46 0.00 0.82 0.00 0.00 66.70 67.51 1ww4 h VAL 92 Cb 1.06 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.70 1ww4 h VAL 92 CO 0.01 0.00 0.88 0.00 0.02 0.00 0.00 177.57 178.48 1ww4 h ALA 93 N -1.91 2.81 0.00 1.67 0.00 -1.96 0.37 119.26 120.24 1ww4 h ALA 93 Ca -0.02 0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1ww4 h ALA 93 Cb 0.14 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 1ww4 h ALA 93 CO 0.03 -1.48 -0.09 -0.91 0.00 0.00 0.00 179.25 176.80 1ww4 h ASN 94 N 0.04 0.00 1.47 0.00 -0.26 -1.90 -2.04 115.58 112.89 1ww4 h ASN 94 Ca 0.86 0.00 -0.11 0.00 -0.56 0.00 0.00 56.30 56.49 1ww4 h ASN 94 Cb 2.75 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 39.99 1ww4 h ASN 94 CO -0.44 0.09 -0.54 1.56 -1.06 0.00 0.00 177.43 177.04 1ww4 h GLN 95 N 0.00 0.00 -0.62 0.81 1.08 -0.37 -3.25 115.11 112.76 1ww4 h GLN 95 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1ww4 h GLN 95 Cb 0.19 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.62 1ww4 h GLN 95 CO 0.01 0.48 0.00 1.19 -0.95 0.00 0.00 178.83 179.56 1ww4 n PHE 96 N -3.20 1.04 -2.11 2.96 3.72 -0.79 -4.82 117.46 114.26 1ww4 n PHE 96 Ca 0.01 -0.45 -0.42 0.00 -0.05 0.00 0.00 57.45 56.54 1ww4 n PHE 96 Cb 0.73 -0.12 -0.03 0.00 -0.94 0.00 0.00 39.48 39.13 1ww4 n PHE 96 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1ww4 s ILE 97 N -1.53 3.58 0.00 4.37 1.01 -1.08 -2.17 121.20 125.37 1ww4 s ILE 97 Ca 0.41 0.88 0.00 0.00 0.00 0.00 0.00 60.65 61.94 1ww4 s ILE 97 Cb 0.24 -3.57 0.00 0.00 0.01 0.00 0.00 42.46 39.15 1ww4 s ILE 97 CO 0.23 -0.03 0.00 0.61 0.00 0.00 0.00 174.94 175.75 1ww4 n GLY 98 N 3.87 1.83 0.00 6.18 0.00 -1.26 -5.03 105.19 110.78 1ww4 n GLY 98 Ca 0.15 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1ww4 n GLY 98 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ww4 n SER 99 N 0.04 0.00 -0.83 1.61 7.64 -0.92 -5.02 113.62 116.13 1ww4 n SER 99 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1ww4 n SER 99 Cb 0.01 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.21 1ww4 n SER 99 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ww4 n GLY 100 N 2.77 0.66 2.27 0.23 0.00 -1.26 -4.55 105.19 105.31 1ww4 n GLY 100 Ca 0.00 -0.49 -0.02 0.00 0.00 0.00 0.00 46.02 45.51 1ww4 n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ww4 n GLY 101 N -0.74 0.49 3.57 -0.02 0.00 -1.26 -4.99 105.19 102.25 1ww4 n GLY 101 Ca 0.00 -0.21 -0.12 0.00 0.00 0.00 0.00 46.02 45.69 1ww4 n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ww4 s LYS 102 N -1.12 0.69 0.05 1.61 -2.85 -1.26 -2.97 119.74 113.90 1ww4 s LYS 102 Ca 0.00 0.24 -0.03 0.00 -1.00 0.00 0.00 55.97 55.18 1ww4 s LYS 102 Cb 0.00 0.33 -0.02 0.00 -2.06 0.00 0.00 37.83 36.07 1ww4 s LYS 102 CO 0.00 -0.20 0.04 0.00 0.10 0.00 0.00 175.35 175.29 1ww4 s ALA 103 N -0.94 0.21 -0.01 0.59 0.00 -0.54 -4.72 121.76 116.34 1ww4 s ALA 103 Ca -0.03 -0.90 0.01 0.00 0.00 0.00 0.00 51.96 51.04 1ww4 s ALA 103 Cb -0.01 0.30 0.01 0.00 0.00 0.00 0.00 23.12 23.42 1ww4 s ALA 103 CO 0.03 -0.37 -0.01 0.00 0.00 0.00 0.00 175.76 175.41 1ww4 s MET 104 N -3.41 0.21 -0.09 0.00 0.23 -1.26 0.02 119.30 115.00 1ww4 s MET 104 Ca 0.02 -0.01 0.03 0.00 -1.03 0.00 0.00 55.69 54.70 1ww4 s MET 104 Cb 0.04 -0.29 -0.02 0.00 -1.53 0.00 0.00 34.83 33.03 1ww4 s MET 104 CO -0.08 -0.03 -0.16 0.08 -2.03 0.00 0.00 175.02 172.79 1ww4 s VAL 105 N 0.41 2.82 -0.05 5.16 1.01 0.02 -0.56 120.40 129.21 1ww4 s VAL 105 Ca -0.04 -0.78 0.05 0.00 0.00 0.00 0.00 61.98 61.21 1ww4 s VAL 105 Cb -0.06 -2.12 -0.01 0.00 0.00 0.00 0.00 36.38 34.19 1ww4 s VAL 105 CO -0.01 0.56 -0.20 -0.89 0.00 0.00 0.00 175.10 174.56 1ww4 s THR 106 N -0.12 1.63 -0.18 3.92 2.01 0.14 0.69 115.64 123.74 1ww4 s THR 106 Ca -0.02 -0.83 0.01 0.00 0.31 0.00 0.00 61.69 61.15 1ww4 s THR 106 Cb -0.14 -1.39 0.02 0.00 0.01 0.00 0.00 72.50 71.00 1ww4 s THR 106 CO 0.04 0.46 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.55 1ww4 s VAL 107 N -0.06 2.18 -0.19 3.82 1.01 0.10 0.33 120.40 127.60 1ww4 s VAL 107 Ca -0.03 -0.91 -0.09 0.00 0.00 0.00 0.00 61.98 60.96 1ww4 s VAL 107 Cb -0.12 -1.91 -0.05 0.00 0.00 0.00 0.00 36.38 34.30 1ww4 s VAL 107 CO 0.02 0.53 0.11 -0.36 0.00 0.00 0.00 175.10 175.40 1ww4 s PHE 108 N 1.23 3.37 -0.74 5.22 0.40 -0.11 -1.58 117.98 125.76 1ww4 s PHE 108 Ca 0.03 0.26 -0.16 0.00 -0.60 0.00 0.00 56.93 56.47 1ww4 s PHE 108 Cb -0.13 -2.11 0.17 0.00 0.51 0.00 0.00 43.02 41.45 1ww4 s PHE 108 CO -0.10 0.28 0.74 0.34 0.70 0.00 0.00 175.22 177.18 1ww4 s ASP 109 N 0.25 6.53 -0.13 1.36 3.68 -0.94 -1.19 116.67 126.23 1ww4 s ASP 109 Ca 0.07 -2.23 0.00 0.00 2.13 0.00 0.00 52.55 52.53 1ww4 s ASP 109 Cb -0.11 -2.24 0.13 0.00 -1.45 0.00 0.00 42.92 39.24 1ww4 s ASP 109 CO -0.01 -0.77 1.62 1.41 0.13 0.00 0.00 175.17 177.55 1ww4 n HIS 110 N 4.91 0.72 0.00 -5.34 8.25 0.59 0.15 115.22 124.50 1ww4 n HIS 110 Ca 0.05 -1.15 0.00 0.00 -0.26 0.00 0.00 57.72 56.36 1ww4 n HIS 110 Cb 0.45 -0.57 0.00 0.00 1.12 0.00 0.00 29.99 30.99 1ww4 n HIS 110 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ww4 n GLY 111 N 0.55 0.55 1.16 -1.41 0.00 -1.26 -3.38 105.19 101.40 1ww4 n GLY 111 Ca 0.14 -0.01 0.11 0.00 0.00 0.00 0.00 46.02 46.26 1ww4 n GLY 111 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1ww4 n ASP 112 N 1.51 3.56 -3.61 1.61 5.75 -1.26 -4.91 116.55 119.20 1ww4 n ASP 112 Ca 0.00 -1.98 -0.10 0.00 -0.01 0.00 0.00 54.79 52.70 1ww4 n ASP 112 Cb 0.00 -0.33 -0.03 0.00 -1.03 0.00 0.00 41.12 39.73 1ww4 n ASP 112 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1ww4 s LYS 113 N -1.24 1.28 -0.14 0.11 1.02 -1.22 -3.20 119.74 116.35 1ww4 s LYS 113 Ca 0.40 -0.70 0.01 0.00 0.02 0.00 0.00 55.97 55.71 1ww4 s LYS 113 Cb 0.22 0.53 0.02 0.00 -0.52 0.00 0.00 37.83 38.08 1ww4 s LYS 113 CO 0.30 -0.54 -0.17 0.71 -0.92 0.00 0.00 175.35 174.74 1ww4 s TYR 114 N -3.82 2.27 -0.26 3.18 2.02 0.69 -0.30 117.35 121.13 1ww4 s TYR 114 Ca 0.05 -1.21 -0.10 0.00 -0.37 0.00 0.00 57.07 55.44 1ww4 s TYR 114 Cb -0.00 -1.62 -0.05 0.00 -0.40 0.00 0.00 41.96 39.89 1ww4 s TYR 114 CO -0.08 -0.62 0.16 -1.14 -1.57 0.00 0.00 175.55 172.29 1ww4 s GLN 115 N 1.20 3.92 -0.16 -0.62 0.74 -0.33 -1.76 119.66 122.64 1ww4 s GLN 115 Ca -0.00 -0.34 -0.06 0.00 0.05 0.00 0.00 55.36 55.00 1ww4 s GLN 115 Cb -0.14 -3.56 -0.04 0.00 1.10 0.00 0.00 33.01 30.37 1ww4 s GLN 115 CO -0.07 -0.12 0.05 0.08 -0.55 0.00 0.00 175.29 174.68 1ww4 s VAL 116 N 1.56 4.68 -0.06 1.34 1.01 -0.85 -0.94 120.40 127.14 1ww4 s VAL 116 Ca 0.07 -0.08 0.04 0.00 0.00 0.00 0.00 61.98 62.00 1ww4 s VAL 116 Cb -0.15 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 33.15 1ww4 s VAL 116 CO 0.08 0.50 -0.17 -0.69 0.00 0.00 0.00 175.10 174.82 1ww4 s VAL 117 N 0.06 1.48 -0.46 2.92 1.01 0.15 -1.58 120.40 123.98 1ww4 s VAL 117 Ca 0.05 -0.71 -0.09 0.00 0.00 0.00 0.00 61.98 61.22 1ww4 s VAL 117 Cb -0.12 -1.30 0.11 0.00 0.00 0.00 0.00 36.38 35.07 1ww4 s VAL 117 CO 0.01 0.43 0.32 -0.63 0.00 0.00 0.00 175.10 175.23 1ww4 s ILE 118 N 0.32 4.25 0.00 2.22 -1.09 0.10 0.28 121.20 127.29 1ww4 s ILE 118 Ca -0.11 -1.64 0.00 0.00 -2.23 0.00 0.00 60.65 56.67 1ww4 s ILE 118 Cb -0.14 -3.73 0.00 0.00 -1.58 0.00 0.00 42.46 37.00 1ww4 s ILE 118 CO 0.04 -0.69 0.00 0.59 -1.23 0.00 0.00 174.94 173.65 1ww4 n ASN 119 N 4.92 0.00 -0.00 3.58 5.03 0.28 -2.08 115.26 126.99 1ww4 n ASN 119 Ca -0.09 0.00 0.02 0.00 0.87 0.00 0.00 54.58 55.38 1ww4 n ASN 119 Cb 0.41 0.00 -0.02 0.00 -1.02 0.00 0.00 39.78 39.15 1ww4 n ASN 119 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1ww4 n GLU 120 N 0.00 4.97 -3.19 3.52 1.02 -1.26 -4.93 120.64 120.77 1ww4 n GLU 120 Ca 0.00 -0.00 -0.39 0.00 -0.02 0.00 0.00 57.16 56.75 1ww4 n GLU 120 Cb 0.00 -0.74 -0.05 0.00 -0.02 0.00 0.00 31.44 30.63 1ww4 n GLU 120 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1ww4 s LYS 121 N -1.48 4.37 -0.01 3.49 2.20 -0.88 -5.05 119.74 122.37 1ww4 s LYS 121 Ca 0.01 0.68 -0.26 0.00 -0.36 0.00 0.00 55.97 56.03 1ww4 s LYS 121 Cb 0.03 -3.42 -0.04 0.00 -1.51 0.00 0.00 37.83 32.89 1ww4 s LYS 121 CO 0.16 0.17 0.82 0.99 -0.36 0.00 0.00 175.35 177.13 1ww4 s THR 122 N 0.50 4.90 -0.16 3.43 2.01 -1.26 0.03 115.64 125.09 1ww4 s THR 122 Ca 0.31 1.71 0.15 0.00 0.31 0.00 0.00 61.69 64.18 1ww4 s THR 122 Cb -0.17 -4.16 -0.21 0.00 0.01 0.00 0.00 72.50 67.97 1ww4 s THR 122 CO 0.15 0.25 0.08 1.33 -0.69 0.00 0.00 174.62 175.73 1ww4 n VAL 123 N 3.58 1.11 -3.52 3.82 0.24 -0.62 -4.93 118.33 118.01 1ww4 n VAL 123 Ca 0.01 -0.71 -0.13 0.00 -2.04 0.00 0.00 64.34 61.47 1ww4 n VAL 123 Cb 0.51 -0.51 -0.04 0.00 -1.47 0.00 0.00 33.84 32.32 1ww4 n VAL 123 CO 0.00 0.00 0.00 -0.51 -2.14 0.00 0.00 176.83 174.18 1ww4 s ILE 124 N -2.46 0.00 -0.52 1.34 2.07 -1.24 -4.98 121.20 115.41 1ww4 s ILE 124 Ca -0.08 0.00 0.02 0.00 -1.41 0.00 0.00 60.65 59.18 1ww4 s ILE 124 Cb 0.05 -1.00 0.44 0.00 0.13 0.00 0.00 42.46 42.09 1ww4 s ILE 124 CO 0.70 0.00 1.65 0.00 -1.91 0.00 0.00 174.94 175.38 1ww4 n GLN 125 N 0.47 3.10 -0.33 3.50 1.13 -1.26 -2.00 117.38 121.99 1ww4 n GLN 125 Ca -0.14 -3.73 -0.13 0.00 -1.94 0.00 0.00 57.00 51.06 1ww4 n GLN 125 Cb 0.59 -2.28 -0.02 0.00 0.11 0.00 0.00 30.24 28.64 1ww4 n GLN 125 CO 0.00 0.00 0.00 0.98 -1.44 0.00 0.00 177.06 176.60 1ww4 n TYR 126 N -0.78 0.20 -3.35 1.08 9.36 -0.72 -4.48 117.16 118.47 1ww4 n TYR 126 Ca 0.53 0.23 -0.39 0.00 3.32 0.00 0.00 57.90 61.59 1ww4 n TYR 126 Cb 0.74 -0.44 -0.08 0.00 -0.63 0.00 0.00 39.34 38.93 1ww4 n TYR 126 CO 0.00 0.00 0.00 0.99 0.22 0.00 0.00 176.86 178.07 1ww4 s THR 127 N 0.17 5.16 -0.13 2.97 2.01 -1.26 -0.23 115.64 124.34 1ww4 s THR 127 Ca 0.20 0.73 -0.33 0.00 0.31 0.00 0.00 61.69 62.60 1ww4 s THR 127 Cb -0.28 -3.75 -0.10 0.00 0.01 0.00 0.00 72.50 68.38 1ww4 s THR 127 CO 0.13 0.19 2.00 0.29 -0.69 0.00 0.00 174.62 176.55 1ww4 n LYS 128 N 4.88 2.10 0.08 4.92 5.02 -1.19 -4.83 118.16 129.13 1ww4 n LYS 128 Ca -0.07 0.72 -0.02 0.00 -2.02 0.00 0.00 58.31 56.92 1ww4 n LYS 128 Cb 0.51 -2.79 -0.06 0.00 -0.02 0.00 0.00 35.03 32.67 1ww4 n LYS 128 CO 0.00 0.00 0.00 1.96 -0.52 0.00 0.00 177.40 178.84 1ww4 h GLN 129 N 10.96 0.00 -5.20 1.97 4.20 -1.94 -3.45 115.11 121.66 1ww4 h GLN 129 Ca -0.45 0.00 -0.47 0.00 0.06 0.00 0.00 58.65 57.79 1ww4 h GLN 129 Cb 1.27 0.00 -0.29 0.00 0.30 0.00 0.00 27.48 28.76 1ww4 h GLN 129 CO 0.96 0.56 -0.81 0.42 -0.67 0.00 0.00 178.83 179.29 1ww4 s ILE 130 N -2.85 1.05 0.31 2.54 1.01 -1.26 -5.08 121.20 116.91 1ww4 s ILE 130 Ca 0.01 -0.57 0.08 0.00 0.00 0.00 0.00 60.65 60.17 1ww4 s ILE 130 Cb 0.08 -0.87 -0.04 0.00 0.01 0.00 0.00 42.46 41.64 1ww4 s ILE 130 CO 0.79 0.30 0.17 -0.44 0.00 0.00 0.00 174.94 175.75 1ww4 s SER 131 N -0.30 5.00 0.00 3.58 0.01 -1.26 -4.93 113.70 115.80 1ww4 s SER 131 Ca 0.05 -0.56 0.00 0.00 1.31 0.00 0.00 55.95 56.74 1ww4 s SER 131 Cb -0.05 -0.96 0.00 0.00 0.21 0.00 0.00 66.02 65.22 1ww4 s SER 131 CO -0.00 -0.21 0.00 0.61 0.41 0.00 0.00 173.24 174.05 1ww4 n GLY 132 N -1.17 0.29 3.87 3.44 0.00 -1.26 -5.08 105.19 105.27 1ww4 n GLY 132 Ca -0.04 -1.83 -0.37 0.00 0.00 0.00 0.00 46.02 43.78 1ww4 n GLY 132 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ww4 s THR 133 N -1.26 5.40 -0.16 2.61 -4.23 -1.26 -4.89 115.64 111.85 1ww4 s THR 133 Ca 0.00 0.14 -0.29 0.00 -1.18 0.00 0.00 61.69 60.36 1ww4 s THR 133 Cb 0.00 -3.36 -0.00 0.00 1.34 0.00 0.00 72.50 70.47 1ww4 s THR 133 CO 0.00 0.59 1.01 -0.89 -0.54 0.00 0.00 174.62 174.79 1ww4 s THR 134 N -1.04 4.75 -0.39 3.99 2.01 -0.32 -4.23 115.64 120.40 1ww4 s THR 134 Ca 0.16 2.01 0.06 0.00 0.31 0.00 0.00 61.69 64.22 1ww4 s THR 134 Cb -0.12 -4.30 -0.03 0.00 0.01 0.00 0.00 72.50 68.06 1ww4 s THR 134 CO 0.05 -0.07 0.35 -1.54 -0.69 0.00 0.00 174.62 172.72 1ww4 n SER 135 N 5.55 0.56 -3.48 3.53 3.41 -0.54 -0.85 113.62 121.80 1ww4 n SER 135 Ca 0.10 -0.78 -0.14 0.00 -0.26 0.00 0.00 58.87 57.78 1ww4 n SER 135 Cb 0.48 0.77 -0.04 0.00 -0.26 0.00 0.00 64.21 65.15 1ww4 n SER 135 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1ww4 s SER 136 N -1.30 -0.58 0.04 4.04 1.04 -1.09 -1.13 113.70 114.73 1ww4 s SER 136 Ca 0.03 0.35 0.04 0.00 0.48 0.00 0.00 55.95 56.85 1ww4 s SER 136 Cb 0.04 0.54 -0.02 0.00 0.10 0.00 0.00 66.02 66.68 1ww4 s SER 136 CO 0.20 -0.74 -0.12 -0.76 0.98 0.00 0.00 173.24 172.79 1ww4 s LEU 137 N -1.93 2.20 0.02 2.42 1.43 -0.87 -0.54 118.68 121.41 1ww4 s LEU 137 Ca -0.04 -0.48 0.04 0.00 -1.03 0.00 0.00 54.13 52.61 1ww4 s LEU 137 Cb -0.01 -0.47 -0.02 0.00 0.03 0.00 0.00 46.19 45.73 1ww4 s LEU 137 CO -0.01 -0.03 -0.12 -0.94 0.23 0.00 0.00 176.35 175.47 1ww4 s SER 138 N -1.28 1.44 -0.34 2.29 1.04 -0.72 -0.87 113.70 115.25 1ww4 s SER 138 Ca -0.01 -0.34 0.03 0.00 0.48 0.00 0.00 55.95 56.11 1ww4 s SER 138 Cb -0.08 -0.11 0.10 0.00 0.10 0.00 0.00 66.02 66.02 1ww4 s SER 138 CO 0.01 0.07 0.05 -0.47 0.98 0.00 0.00 173.24 173.88 1ww4 s TYR 139 N -0.61 3.50 -0.01 5.02 5.04 -0.90 -1.08 117.35 128.31 1ww4 s TYR 139 Ca 0.02 -2.84 -0.01 0.00 -2.44 0.00 0.00 57.07 51.80 1ww4 s TYR 139 Cb -0.06 -2.77 -0.04 0.00 0.35 0.00 0.00 41.96 39.44 1ww4 s TYR 139 CO 0.00 -0.94 0.09 -0.80 -1.34 0.00 0.00 175.55 172.56 1ww4 s ASN 140 N 0.99 5.74 0.21 4.32 0.02 -0.29 0.12 114.94 126.05 1ww4 s ASN 140 Ca 0.11 0.17 0.01 0.00 -1.02 0.00 0.00 52.86 52.12 1ww4 s ASN 140 Cb -0.19 -1.67 -0.05 0.00 0.02 0.00 0.00 41.25 39.37 1ww4 s ASN 140 CO -0.10 0.28 0.08 -0.44 0.02 0.00 0.00 177.10 176.94 1ww4 s SER 141 N -1.70 0.86 -0.22 -1.22 0.01 -1.26 -0.46 113.70 109.71 1ww4 s SER 141 Ca 0.23 -1.32 -0.10 0.00 1.31 0.00 0.00 55.95 56.07 1ww4 s SER 141 Cb -0.12 0.22 -0.05 0.00 0.21 0.00 0.00 66.02 66.28 1ww4 s SER 141 CO 0.14 -0.72 0.13 -0.89 0.41 0.00 0.00 173.24 172.31 1ww4 s THR 142 N -3.86 5.26 -0.21 1.44 2.01 -1.10 -4.94 115.64 114.23 1ww4 s THR 142 Ca 0.34 0.14 -0.19 0.00 0.31 0.00 0.00 61.69 62.29 1ww4 s THR 142 Cb 0.07 -3.43 -0.08 0.00 0.01 0.00 0.00 72.50 69.07 1ww4 s THR 142 CO 0.10 0.39 0.84 1.21 -0.69 0.00 0.00 174.62 176.47 1ww4 n GLU 143 N 3.98 0.00 -0.93 4.92 2.13 -1.26 -0.97 120.64 128.51 1ww4 n GLU 143 Ca -0.16 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.66 1ww4 n GLU 143 Cb 0.52 -0.63 0.00 0.00 0.27 0.00 0.00 31.44 31.60 1ww4 n GLU 143 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1ww4 n GLY 144 N 2.75 0.00 1.59 8.31 0.00 -1.26 -4.82 105.19 111.76 1ww4 n GLY 144 Ca 0.20 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.15 1ww4 n GLY 144 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ww4 n THR 145 N -1.99 1.99 -2.98 2.61 -2.24 -0.14 -4.92 114.28 106.61 1ww4 n THR 145 Ca 0.00 -3.38 -0.36 0.00 -2.27 0.00 0.00 64.05 58.04 1ww4 n THR 145 Cb 0.43 -0.29 -0.06 0.00 -2.10 0.00 0.00 70.33 68.31 1ww4 n THR 145 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1ww4 s SER 146 N -3.34 7.12 0.00 3.42 0.15 -1.25 -4.60 113.70 115.20 1ww4 s SER 146 Ca 0.42 1.57 0.28 0.00 0.70 0.00 0.00 55.95 58.91 1ww4 s SER 146 Cb 0.38 -2.48 1.08 0.00 -1.71 0.00 0.00 66.02 63.29 1ww4 s SER 146 CO -0.03 -0.05 1.79 2.30 1.20 0.00 0.00 173.24 178.45 1ww4 n ILE 147 N 0.49 0.00 -4.36 6.45 -5.35 -1.26 -4.68 119.36 110.64 1ww4 n ILE 147 Ca 0.00 -0.03 -0.25 0.00 -0.27 0.00 0.00 62.75 62.21 1ww4 n ILE 147 Cb 0.51 -0.14 -0.09 0.00 -1.74 0.00 0.00 39.64 38.18 1ww4 n ILE 147 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 1ww4 s PHE 148 N -2.74 2.53 0.99 4.28 0.08 -1.26 -1.97 117.98 119.88 1ww4 s PHE 148 Ca 0.21 -0.43 -0.11 0.00 0.12 0.00 0.00 56.93 56.71 1ww4 s PHE 148 Cb 0.19 -1.44 0.17 0.00 -0.57 0.00 0.00 43.02 41.37 1ww4 s PHE 148 CO 0.54 0.51 1.00 -1.13 -0.10 0.00 0.00 175.22 176.04 1ww4 n SER 149 N -0.92 -0.48 0.23 1.36 3.41 -1.26 -4.89 113.62 111.08 1ww4 n SER 149 Ca -0.04 0.26 0.07 0.00 -0.26 0.00 0.00 58.87 58.90 1ww4 n SER 149 Cb 0.62 -1.38 0.56 0.00 -0.26 0.00 0.00 64.21 63.74 1ww4 n SER 149 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 1ww4 h THR 150 N -2.06 0.99 -3.23 6.66 1.35 -1.98 -3.39 112.91 111.26 1ww4 h THR 150 Ca -0.48 -0.63 -0.67 0.00 -0.55 0.00 0.00 66.41 64.08 1ww4 h THR 150 Cb 1.29 1.35 -0.32 0.00 -1.73 0.00 0.00 68.15 68.74 1ww4 h THR 150 CO 0.42 0.17 -0.83 -0.69 -0.25 0.00 0.00 175.52 174.34 1ww4 s VAL 151 N -4.51 2.41 -0.16 6.82 1.01 -1.26 -1.20 120.40 123.51 1ww4 s VAL 151 Ca -0.04 -0.85 -0.05 0.00 0.00 0.00 0.00 61.98 61.04 1ww4 s VAL 151 Cb 0.15 -2.00 -0.03 0.00 0.00 0.00 0.00 36.38 34.50 1ww4 s VAL 151 CO 0.67 0.53 -0.01 -0.69 0.00 0.00 0.00 175.10 175.60 1ww4 s VAL 152 N 0.91 4.16 0.24 2.92 1.01 -0.38 -4.63 120.40 124.63 1ww4 s VAL 152 Ca -0.04 -0.26 -0.20 0.00 0.00 0.00 0.00 61.98 61.48 1ww4 s VAL 152 Cb -0.15 -2.84 -0.08 0.00 0.00 0.00 0.00 36.38 33.31 1ww4 s VAL 152 CO -0.03 0.49 0.75 -1.61 0.00 0.00 0.00 175.10 174.70 1ww4 s GLU 153 N 0.33 4.27 -0.07 2.72 2.02 -0.22 -0.74 118.70 127.01 1ww4 s GLU 153 Ca -0.02 0.91 -0.00 0.00 0.02 0.00 0.00 54.97 55.88 1ww4 s GLU 153 Cb -0.14 -2.83 0.02 0.00 0.10 0.00 0.00 34.13 31.29 1ww4 s GLU 153 CO 0.02 0.36 -0.04 0.00 0.02 0.00 0.00 175.26 175.63 1ww4 s ALA 154 N -1.57 0.83 -0.13 5.21 0.00 0.62 0.37 121.76 127.09 1ww4 s ALA 154 Ca 0.45 -0.19 0.00 0.00 0.00 0.00 0.00 51.96 52.22 1ww4 s ALA 154 Cb -0.16 -0.65 -0.01 0.00 0.00 0.00 0.00 23.12 22.30 1ww4 s ALA 154 CO 0.21 -0.26 -0.15 0.08 0.00 0.00 0.00 175.76 175.64 1ww4 s VAL 155 N 1.46 2.83 -0.02 0.00 1.01 -0.67 -0.37 120.40 124.65 1ww4 s VAL 155 Ca -0.02 -0.73 0.05 0.00 0.00 0.00 0.00 61.98 61.27 1ww4 s VAL 155 Cb -0.13 -2.18 -0.03 0.00 0.00 0.00 0.00 36.38 34.04 1ww4 s VAL 155 CO -0.03 0.53 -0.15 0.42 0.00 0.00 0.00 175.10 175.86 1ww4 s THR 156 N 0.46 2.97 -0.29 3.92 -4.23 -0.30 -1.02 115.64 117.15 1ww4 s THR 156 Ca -0.11 -0.88 0.03 0.00 -1.18 0.00 0.00 61.69 59.56 1ww4 s THR 156 Cb -0.16 -2.19 0.07 0.00 1.34 0.00 0.00 72.50 71.56 1ww4 s THR 156 CO 0.05 0.51 -0.05 -0.31 -0.54 0.00 0.00 174.62 174.28 1ww4 s TYR 157 N -0.80 3.44 0.24 3.99 2.02 -0.22 -2.01 117.35 124.01 1ww4 s TYR 157 Ca 0.13 -2.54 0.10 0.00 -0.37 0.00 0.00 57.07 54.39 1ww4 s TYR 157 Cb -0.11 -2.28 -0.05 0.00 -0.40 0.00 0.00 41.96 39.12 1ww4 s TYR 157 CO 0.02 -0.90 -0.17 0.95 -1.57 0.00 0.00 175.55 173.88 1ww4 s THR 158 N 1.04 2.13 0.00 -0.71 -4.23 -0.93 -0.75 115.64 112.18 1ww4 s THR 158 Ca -0.02 -2.31 0.00 0.00 -1.18 0.00 0.00 61.69 58.18 1ww4 s THR 158 Cb -0.20 -2.17 0.00 0.00 1.34 0.00 0.00 72.50 71.47 1ww4 s THR 158 CO -0.06 -0.49 0.00 0.61 -0.54 0.00 0.00 174.62 174.14 1ww4 n GLY 159 N -0.49 0.73 0.00 3.99 0.00 -1.26 -0.48 105.19 107.69 1ww4 n GLY 159 Ca -0.07 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.76 1ww4 n GLY 159 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ww4 n LEU 160 N 0.00 0.12 0.00 0.99 4.77 -1.26 -4.07 117.00 117.55 1ww4 n LEU 160 Ca 0.00 0.09 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 1ww4 n LEU 160 Cb 0.00 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.11 1ww4 n LEU 160 CO 0.00 0.00 0.27 0.00 -1.33 0.00 0.00 177.39 176.33