#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wp1 s SER 2 N 0.00 3.37 -0.18 0.00 0.15 -1.26 -3.92 113.70 111.86 1wp1 s SER 2 Ca 0.00 -0.50 0.16 0.00 0.70 0.00 0.00 55.95 56.31 1wp1 s SER 2 Cb 0.00 -1.48 0.75 0.00 -1.71 0.00 0.00 66.02 63.58 1wp1 s SER 2 CO 0.00 0.14 1.67 0.18 1.20 0.00 0.00 173.24 176.43 1wp1 n LEU 3 N 3.66 5.17 -4.73 3.45 4.77 -1.26 -4.96 117.00 123.10 1wp1 n LEU 3 Ca -0.19 -2.74 -0.42 0.00 -0.03 0.00 0.00 56.01 52.63 1wp1 n LEU 3 Cb 0.53 -0.63 -0.03 0.00 -2.33 0.00 0.00 43.42 40.96 1wp1 n LEU 3 CO 0.29 0.71 0.95 -0.63 -1.33 0.00 0.00 177.39 177.37 1wp1 s ILE 4 N -2.40 3.49 0.81 -0.08 1.01 -1.26 -4.02 121.20 118.74 1wp1 s ILE 4 Ca 0.52 1.17 -0.12 0.00 0.00 0.00 0.00 60.65 62.22 1wp1 s ILE 4 Cb 0.37 -3.75 0.08 0.00 0.01 0.00 0.00 42.46 39.18 1wp1 s ILE 4 CO 0.19 0.15 1.13 -2.84 0.00 0.00 0.00 174.94 173.57 1wp1 s PRO 5 N 0.30 1.83 0.49 2.79 0.02 -1.26 -4.96 135.00 134.20 1wp1 s PRO 5 Ca 0.57 1.44 -0.23 0.00 0.02 0.00 0.00 61.00 62.81 1wp1 s PRO 5 Cb -0.34 -1.83 -0.07 0.00 0.02 0.00 0.00 34.50 32.29 1wp1 s PRO 5 CO 0.34 -2.01 1.25 -0.51 -0.33 0.00 0.00 177.00 175.75 1wp1 s ASP 6 N -2.80 5.85 -0.25 2.53 1.01 -1.26 -4.96 116.67 116.79 1wp1 s ASP 6 Ca 0.66 2.51 -0.08 0.00 0.71 0.00 0.00 52.55 56.36 1wp1 s ASP 6 Cb -0.22 -2.62 -0.03 0.00 1.01 0.00 0.00 42.92 41.06 1wp1 s ASP 6 CO 0.53 -1.15 0.09 -0.47 0.21 0.00 0.00 175.17 174.38 1wp1 s TYR 7 N -1.42 3.12 -0.38 4.23 5.04 -1.26 -5.05 117.35 121.63 1wp1 s TYR 7 Ca 0.66 -0.30 -0.04 0.00 -2.44 0.00 0.00 57.07 54.95 1wp1 s TYR 7 Cb -0.34 -2.26 0.08 0.00 0.35 0.00 0.00 41.96 39.80 1wp1 s TYR 7 CO 0.41 -0.30 0.16 -1.14 -1.34 0.00 0.00 175.55 173.34 1wp1 s GLN 8 N 1.58 2.26 -0.25 4.97 2.00 -1.26 -5.09 119.66 123.87 1wp1 s GLN 8 Ca 0.06 -1.58 -0.43 0.00 -2.00 0.00 0.00 55.36 51.42 1wp1 s GLN 8 Cb -0.15 -3.51 -0.19 0.00 0.80 0.00 0.00 33.01 29.95 1wp1 s GLN 8 CO 0.05 -0.91 1.40 -2.13 -0.50 0.00 0.00 175.29 173.19 1wp1 n ARG 9 N 4.67 0.20 -1.40 1.67 0.63 -1.26 -4.91 116.66 116.27 1wp1 n ARG 9 Ca -0.07 0.07 -0.31 0.00 -0.92 0.00 0.00 57.85 56.63 1wp1 n ARG 9 Cb 0.42 -1.60 0.08 0.00 0.45 0.00 0.00 32.46 31.81 1wp1 n ARG 9 CO 0.00 0.00 0.00 -2.14 -2.51 0.00 0.00 177.63 172.98 1wp1 s PRO 10 N 1.75 2.31 -0.13 -0.14 0.02 -1.26 -4.95 135.00 132.60 1wp1 s PRO 10 Ca 0.98 0.97 -0.29 0.00 0.02 0.00 0.00 61.00 62.67 1wp1 s PRO 10 Cb -1.33 -1.92 -0.04 0.00 0.02 0.00 0.00 34.50 31.23 1wp1 s PRO 10 CO 0.68 -1.55 1.58 -1.21 -0.33 0.00 0.00 177.00 176.17 1wp1 s GLU 11 N -4.99 4.06 -0.75 5.54 0.41 -1.26 -4.94 118.70 116.77 1wp1 s GLU 11 Ca 0.60 1.92 -0.36 0.00 -0.41 0.00 0.00 54.97 56.73 1wp1 s GLU 11 Cb -0.16 -3.97 -0.20 0.00 -1.78 0.00 0.00 34.13 28.03 1wp1 s GLU 11 CO 0.56 -0.98 2.37 0.00 -0.49 0.00 0.00 175.26 176.71 1wp1 n ALA 12 N 7.50 0.25 -0.29 5.21 0.00 -1.26 -4.83 120.51 127.10 1wp1 n ALA 12 Ca 0.17 -0.06 -0.07 0.00 0.00 0.00 0.00 53.44 53.48 1wp1 n ALA 12 Cb 0.44 -2.11 0.03 0.00 0.00 0.00 0.00 19.45 17.80 1wp1 n ALA 12 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1wp1 n PRO 13 N 7.78 1.35 -4.39 0.00 -0.05 -1.26 -4.83 135.00 133.60 1wp1 n PRO 13 Ca 0.59 -0.73 -0.24 0.00 -0.05 0.00 0.00 63.50 63.08 1wp1 n PRO 13 Cb -0.00 -1.28 -0.09 0.00 -0.05 0.00 0.00 33.50 32.08 1wp1 n PRO 13 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 175.50 175.59 1wp1 s VAL 14 N -0.98 2.87 0.47 0.52 -7.23 -1.26 -4.96 120.40 109.83 1wp1 s VAL 14 Ca 0.14 -2.17 -0.23 0.00 -1.81 0.00 0.00 61.98 57.92 1wp1 s VAL 14 Cb 0.11 -2.57 -0.09 0.00 0.56 0.00 0.00 36.38 34.39 1wp1 s VAL 14 CO 0.01 -0.36 1.03 0.00 -0.31 0.00 0.00 175.10 175.46 1wp1 n ALA 15 N -0.77 0.33 -0.20 1.32 0.00 -1.26 -4.91 120.51 115.02 1wp1 n ALA 15 Ca -0.05 0.17 -0.02 0.00 0.00 0.00 0.00 53.44 53.54 1wp1 n ALA 15 Cb 0.60 -2.11 0.19 0.00 0.00 0.00 0.00 19.45 18.13 1wp1 n ALA 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wp1 h ALA 16 N 1.33 1.30 -3.00 0.00 0.00 -2.00 -3.42 119.26 113.46 1wp1 h ALA 16 Ca -0.46 -0.13 -0.66 0.00 0.00 0.00 0.00 54.91 53.66 1wp1 h ALA 16 Cb 1.34 -0.28 -0.09 0.00 0.00 0.00 0.00 17.79 18.76 1wp1 h ALA 16 CO 0.55 0.55 -0.55 0.00 0.00 0.00 0.00 179.25 179.80 1wp1 s ALA 17 N -5.58 3.67 0.57 0.00 0.00 -1.26 -4.32 121.76 114.84 1wp1 s ALA 17 Ca -0.11 -0.81 -0.19 0.00 0.00 0.00 0.00 51.96 50.85 1wp1 s ALA 17 Cb 0.17 -1.68 -0.06 0.00 0.00 0.00 0.00 23.12 21.55 1wp1 s ALA 17 CO 0.80 0.68 0.93 0.66 0.00 0.00 0.00 175.76 178.83 1wp1 n TYR 18 N 1.33 0.74 -1.06 0.00 0.53 -1.26 -4.98 117.16 112.46 1wp1 n TYR 18 Ca -0.14 0.45 -0.32 0.00 -1.02 0.00 0.00 57.90 56.87 1wp1 n TYR 18 Cb 0.53 -2.14 0.13 0.00 -1.03 0.00 0.00 39.34 36.83 1wp1 n TYR 18 CO 0.00 0.00 0.00 -2.14 -1.02 0.00 0.00 176.86 173.70 1wp1 s PRO 19 N -2.59 1.63 0.46 -0.72 0.02 -1.26 -4.98 135.00 127.56 1wp1 s PRO 19 Ca 0.73 1.57 0.03 0.00 0.02 0.00 0.00 61.00 63.34 1wp1 s PRO 19 Cb -0.44 -1.79 -0.02 0.00 0.02 0.00 0.00 34.50 32.27 1wp1 s PRO 19 CO 0.49 -2.18 0.07 -0.65 -0.33 0.00 0.00 177.00 174.40 1wp1 s GLN 20 N -4.42 2.05 0.00 5.54 -1.52 -1.26 -4.90 119.66 115.16 1wp1 s GLN 20 Ca 0.69 -2.28 0.00 0.00 -1.95 0.00 0.00 55.36 51.82 1wp1 s GLN 20 Cb -0.24 -1.07 0.00 0.00 -0.22 0.00 0.00 33.01 31.48 1wp1 s GLN 20 CO 0.53 -0.41 0.00 0.41 -0.25 0.00 0.00 175.29 175.57 1wp1 n GLY 21 N -1.08 0.93 0.31 3.09 0.00 -1.26 -4.89 105.19 102.29 1wp1 n GLY 21 Ca -0.12 -2.04 0.19 0.00 0.00 0.00 0.00 46.02 44.05 1wp1 n GLY 21 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1wp1 h GLN 22 N 7.26 0.00 -0.00 1.61 5.75 -2.02 -2.92 115.11 124.79 1wp1 h GLN 22 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1wp1 h GLN 22 Cb 0.00 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.55 1wp1 h GLN 22 CO 0.00 0.02 -0.33 0.00 -2.65 0.00 0.00 178.83 175.87 1wp1 n ALA 23 N -2.14 3.18 -2.56 3.38 0.00 -1.26 -4.90 120.51 116.21 1wp1 n ALA 23 Ca -0.02 -0.30 -0.27 0.00 0.00 0.00 0.00 53.44 52.85 1wp1 n ALA 23 Cb 0.15 -1.21 -0.16 0.00 0.00 0.00 0.00 19.45 18.24 1wp1 n ALA 23 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1wp1 s TYR 24 N -2.88 1.82 0.93 0.00 1.51 -1.10 -3.66 117.35 113.97 1wp1 s TYR 24 Ca 0.15 -0.40 -0.11 0.00 -1.01 0.00 0.00 57.07 55.71 1wp1 s TYR 24 Cb 0.18 -1.18 0.12 0.00 -0.11 0.00 0.00 41.96 40.97 1wp1 s TYR 24 CO 0.62 -0.07 0.95 0.41 -1.11 0.00 0.00 175.55 176.34 1wp1 n GLY 25 N 2.73 -0.85 3.77 0.71 0.00 -1.26 -4.70 105.19 105.59 1wp1 n GLY 25 Ca -0.16 -0.74 -0.40 0.00 0.00 0.00 0.00 46.02 44.72 1wp1 n GLY 25 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1wp1 s GLN 26 N -4.37 3.77 0.09 1.61 -1.52 -1.26 -4.90 119.66 113.10 1wp1 s GLN 26 Ca 0.64 2.49 -0.31 0.00 -1.95 0.00 0.00 55.36 56.23 1wp1 s GLN 26 Cb -0.22 -2.73 -0.11 0.00 -0.22 0.00 0.00 33.01 29.73 1wp1 s GLN 26 CO 0.61 -0.77 1.85 0.09 -0.25 0.00 0.00 175.29 176.82 1wp1 n ASN 27 N -0.05 3.97 -0.21 5.90 3.02 -1.26 -4.87 115.26 121.76 1wp1 n ASN 27 Ca 0.04 0.98 0.14 0.00 -0.03 0.00 0.00 54.58 55.71 1wp1 n ASN 27 Cb 0.41 -1.52 0.69 0.00 -0.61 0.00 0.00 39.78 38.75 1wp1 n ASN 27 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1wp1 n THR 28 N 4.81 0.02 -4.93 3.41 -2.24 -1.26 -5.02 114.28 109.07 1wp1 n THR 28 Ca 0.19 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 1wp1 n THR 28 Cb 0.37 -0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.54 1wp1 n THR 28 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wp1 n GLY 29 N 1.04 0.85 3.76 3.38 0.00 -1.26 -4.78 105.19 108.19 1wp1 n GLY 29 Ca 0.20 -0.76 -0.39 0.00 0.00 0.00 0.00 46.02 45.08 1wp1 n GLY 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wp1 s ALA 30 N -1.93 3.11 -0.18 4.61 0.00 -1.26 -3.75 121.76 122.37 1wp1 s ALA 30 Ca 0.00 1.29 -0.04 0.00 0.00 0.00 0.00 51.96 53.22 1wp1 s ALA 30 Cb 0.00 -3.52 -0.02 0.00 0.00 0.00 0.00 23.12 19.57 1wp1 s ALA 30 CO 0.00 -1.05 -0.04 0.00 0.00 0.00 0.00 175.76 174.67 1wp1 s ALA 31 N -1.29 2.92 0.11 0.00 0.00 -1.26 -4.89 121.76 117.34 1wp1 s ALA 31 Ca 0.62 -0.94 -0.24 0.00 0.00 0.00 0.00 51.96 51.41 1wp1 s ALA 31 Cb -0.39 -1.60 -0.10 0.00 0.00 0.00 0.00 23.12 21.03 1wp1 s ALA 31 CO 0.49 -0.00 1.70 0.00 0.00 0.00 0.00 175.76 177.95 1wp1 h ALA 32 N 7.19 -0.12 -3.31 0.00 0.00 -1.98 -3.33 119.26 117.72 1wp1 h ALA 32 Ca -0.33 0.00 -0.68 0.00 0.00 0.00 0.00 54.91 53.89 1wp1 h ALA 32 Cb 1.19 0.16 -0.36 0.00 0.00 0.00 0.00 17.79 18.77 1wp1 h ALA 32 CO 0.61 -0.59 -0.58 0.08 0.00 0.00 0.00 179.25 178.76 1wp1 s VAL 33 N -6.16 3.01 0.47 0.00 1.01 -1.26 -5.09 120.40 112.38 1wp1 s VAL 33 Ca -0.14 -2.30 -0.22 0.00 0.00 0.00 0.00 61.98 59.32 1wp1 s VAL 33 Cb 0.08 -3.09 -0.10 0.00 0.00 0.00 0.00 36.38 33.26 1wp1 s VAL 33 CO 0.66 -0.69 0.76 -2.65 0.00 0.00 0.00 175.10 173.18 1wp1 n PRO 34 N 4.30 0.88 -0.16 2.72 -0.02 -1.25 -4.76 135.00 136.70 1wp1 n PRO 34 Ca 0.01 0.32 0.10 0.00 -2.02 0.00 0.00 63.50 61.92 1wp1 n PRO 34 Cb 0.41 -1.81 0.43 0.00 -0.02 0.00 0.00 33.50 32.51 1wp1 n PRO 34 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1wp1 h ALA 35 N 0.93 1.89 -0.16 3.55 0.00 -1.92 0.20 119.26 123.75 1wp1 h ALA 35 Ca -0.44 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.51 1wp1 h ALA 35 Cb 1.37 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 1wp1 h ALA 35 CO 0.53 -0.04 0.25 0.00 0.00 0.00 0.00 179.25 179.98 1wp1 h ALA 36 N 1.64 1.67 0.00 0.00 0.00 -1.82 -2.50 119.26 118.24 1wp1 h ALA 36 Ca 0.33 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1wp1 h ALA 36 Cb 0.51 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1wp1 h ALA 36 CO -0.11 -0.33 -0.60 -0.25 0.00 0.00 0.00 179.25 177.96 1wp1 n ASP 37 N -3.51 0.56 -4.67 0.00 8.00 0.06 -4.61 116.55 112.38 1wp1 n ASP 37 Ca 0.01 -0.19 -0.42 0.00 0.71 0.00 0.00 54.79 54.90 1wp1 n ASP 37 Cb 0.36 0.31 -0.03 0.00 -0.02 0.00 0.00 41.12 41.74 1wp1 n ASP 37 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1wp1 s ILE 38 N -3.06 4.77 0.54 0.53 1.01 -0.94 -1.49 121.20 122.56 1wp1 s ILE 38 Ca 0.09 1.87 -0.21 0.00 0.00 0.00 0.00 60.65 62.41 1wp1 s ILE 38 Cb 0.16 -4.24 -0.05 0.00 0.01 0.00 0.00 42.46 38.34 1wp1 s ILE 38 CO 0.72 -0.07 1.22 -0.83 0.00 0.00 0.00 174.94 175.97 1wp1 s GLY 39 N 1.19 2.78 0.36 6.18 0.00 -1.25 -4.79 107.32 111.78 1wp1 s GLY 39 Ca 0.42 1.04 0.10 0.00 0.00 0.00 0.00 44.72 46.29 1wp1 s GLY 39 CO 0.10 1.48 1.83 0.11 0.00 0.00 0.00 173.10 176.61 1wp1 h TRP 40 N 1.39 0.14 -0.16 1.90 5.08 -1.33 0.24 115.95 123.20 1wp1 h TRP 40 Ca -0.50 -0.03 0.05 0.00 1.08 0.00 0.00 58.89 59.49 1wp1 h TRP 40 Cb 1.28 -0.03 -0.01 0.00 -3.00 0.00 0.00 29.16 27.40 1wp1 h TRP 40 CO 0.49 0.42 0.13 -0.09 -1.28 0.00 0.00 178.44 178.11 1wp1 h ARG 41 N 0.11 0.00 0.06 0.12 9.65 -1.75 0.10 114.38 122.67 1wp1 h ARG 41 Ca 0.01 0.00 -0.28 0.00 -1.10 0.00 0.00 59.98 58.61 1wp1 h ARG 41 Cb 0.61 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.17 1wp1 h ARG 41 CO 0.04 0.00 -1.52 1.49 2.80 0.00 0.00 179.97 182.79 1wp1 h GLU 42 N 0.00 0.13 -0.92 0.20 4.81 -1.51 -3.39 114.58 113.91 1wp1 h GLU 42 Ca 0.08 -0.22 0.00 0.00 -0.13 0.00 0.00 59.36 59.08 1wp1 h GLU 42 Cb 0.33 0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.75 1wp1 h GLU 42 CO -0.00 1.11 0.58 0.35 -0.73 0.00 0.00 179.01 180.31 1wp1 h PHE 43 N -0.52 1.18 -2.98 0.92 3.57 -0.59 -3.37 116.94 115.15 1wp1 h PHE 43 Ca -0.36 0.01 -0.72 0.00 3.53 0.00 0.00 57.97 60.43 1wp1 h PHE 43 Cb 1.62 -0.39 -0.21 0.00 2.79 0.00 0.00 35.95 39.76 1wp1 h PHE 43 CO 0.10 0.77 0.07 -0.06 -2.23 0.00 0.00 178.31 176.96 1wp1 s PHE 44 N -5.97 3.10 0.41 0.41 0.40 0.32 -1.58 117.98 115.08 1wp1 s PHE 44 Ca -0.12 -1.11 0.16 0.00 -0.60 0.00 0.00 56.93 55.25 1wp1 s PHE 44 Cb 0.18 -3.97 0.96 0.00 0.51 0.00 0.00 43.02 40.70 1wp1 s PHE 44 CO 0.81 -1.23 1.94 0.00 0.70 0.00 0.00 175.22 177.45 1wp1 h ARG 45 N 9.02 0.00 -6.27 0.44 3.08 -1.33 -3.43 114.38 115.90 1wp1 h ARG 45 Ca -0.25 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.23 1wp1 h ARG 45 Cb 1.08 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.11 1wp1 h ARG 45 CO 1.07 0.24 1.10 0.34 -1.07 0.00 0.00 179.97 181.65 1wp1 s ASP 46 N -6.86 6.46 0.50 7.04 -1.08 -1.26 -4.89 116.67 116.59 1wp1 s ASP 46 Ca -0.03 1.69 0.27 0.00 -0.52 0.00 0.00 52.55 53.96 1wp1 s ASP 46 Cb 0.15 -2.53 1.33 0.00 -1.46 0.00 0.00 42.92 40.41 1wp1 s ASP 46 CO 0.69 -1.18 2.01 -0.65 0.52 0.00 0.00 175.17 176.57 1wp1 h PRO 47 N 10.38 0.00 -0.02 4.34 0.11 -1.82 -1.90 132.00 143.08 1wp1 h PRO 47 Ca -0.34 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.72 1wp1 h PRO 47 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1wp1 h PRO 47 CO 0.99 0.14 -0.21 0.37 -0.21 0.00 0.00 178.00 179.09 1wp1 h GLN 48 N 0.00 0.17 -0.91 1.05 4.15 -1.82 -2.94 115.11 114.81 1wp1 h GLN 48 Ca -0.00 -0.16 0.17 0.00 0.77 0.00 0.00 58.65 59.43 1wp1 h GLN 48 Cb 0.44 0.04 -0.10 0.00 0.21 0.00 0.00 27.48 28.06 1wp1 h GLN 48 CO 0.02 0.86 0.49 1.25 -1.93 0.00 0.00 178.83 179.52 1wp1 h LEU 49 N -0.46 0.58 -0.31 -2.39 5.85 -1.89 -2.26 115.31 114.42 1wp1 h LEU 49 Ca -0.02 0.10 0.02 0.00 0.84 0.00 0.00 57.88 58.82 1wp1 h LEU 49 Cb 0.92 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.94 1wp1 h LEU 49 CO 0.04 0.20 0.17 1.56 -0.34 0.00 0.00 178.44 180.07 1wp1 h GLN 50 N 0.63 0.33 -0.69 1.25 4.20 -1.19 0.30 115.11 119.94 1wp1 h GLN 50 Ca 0.52 -0.02 -0.04 0.00 0.06 0.00 0.00 58.65 59.17 1wp1 h GLN 50 Cb 0.81 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.48 1wp1 h GLN 50 CO -0.40 0.22 0.27 0.37 -0.67 0.00 0.00 178.83 178.62 1wp1 h GLN 51 N 0.34 1.04 -0.25 1.46 4.15 -1.32 -1.40 115.11 119.13 1wp1 h GLN 51 Ca 0.13 -0.19 0.00 0.00 0.77 0.00 0.00 58.65 59.35 1wp1 h GLN 51 Cb 0.03 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 27.54 1wp1 h GLN 51 CO -0.08 0.87 0.16 -0.07 -1.93 0.00 0.00 178.83 177.78 1wp1 h LEU 52 N 0.99 0.29 -0.53 -2.39 3.38 -0.80 0.13 115.31 116.38 1wp1 h LEU 52 Ca 0.23 -0.02 0.07 0.00 0.09 0.00 0.00 57.88 58.25 1wp1 h LEU 52 Cb 0.22 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 40.84 1wp1 h LEU 52 CO -0.02 0.22 0.19 0.40 0.09 0.00 0.00 178.44 179.32 1wp1 h ILE 53 N 0.33 0.82 -0.33 1.22 2.04 -0.67 -0.61 117.51 120.31 1wp1 h ILE 53 Ca 0.09 -0.13 0.05 0.00 1.00 0.00 0.00 64.86 65.87 1wp1 h ILE 53 Cb -0.02 0.41 -0.05 0.00 -0.74 0.00 0.00 36.82 36.42 1wp1 h ILE 53 CO -0.02 0.07 0.04 1.23 0.00 0.00 0.00 178.15 179.47 1wp1 h GLY 54 N 0.37 0.36 0.55 5.37 0.00 -0.19 0.04 103.07 109.57 1wp1 h GLY 54 Ca 0.26 0.00 0.06 0.00 0.00 0.00 0.00 47.33 47.65 1wp1 h GLY 54 CO -0.26 -0.04 0.12 -2.08 0.00 0.00 0.00 176.54 174.28 1wp1 h VAL 55 N 0.15 0.83 -0.60 4.60 2.07 -0.34 -2.34 116.25 120.61 1wp1 h VAL 55 Ca 0.15 -0.09 0.01 0.00 0.82 0.00 0.00 66.70 67.59 1wp1 h VAL 55 Cb 0.19 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 30.47 1wp1 h VAL 55 CO -0.22 0.05 0.40 0.00 0.02 0.00 0.00 177.57 177.81 1wp1 h ALA 56 N 1.29 0.76 -0.55 1.67 0.00 -0.04 -1.44 119.26 120.96 1wp1 h ALA 56 Ca 0.20 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 1wp1 h ALA 56 Cb 0.22 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1wp1 h ALA 56 CO -0.23 0.19 0.21 -0.07 0.00 0.00 0.00 179.25 179.35 1wp1 h LEU 57 N 0.81 0.72 -0.88 0.00 3.38 -0.60 -0.11 115.31 118.62 1wp1 h LEU 57 Ca 0.22 -0.09 -0.10 0.00 0.09 0.00 0.00 57.88 58.00 1wp1 h LEU 57 Cb -0.09 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.46 1wp1 h LEU 57 CO -0.05 0.65 -0.24 -0.33 0.09 0.00 0.00 178.44 178.56 1wp1 h GLU 58 N 0.78 0.54 0.00 1.13 5.08 -0.97 -3.41 114.58 117.74 1wp1 h GLU 58 Ca 0.19 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1wp1 h GLU 58 Cb 0.16 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.38 1wp1 h GLU 58 CO -0.02 0.75 -0.92 0.09 -1.00 0.00 0.00 179.01 177.91 1wp1 n ASN 59 N -4.12 4.59 -4.64 1.42 3.02 -0.59 -5.02 115.26 109.92 1wp1 n ASN 59 Ca -0.00 -0.02 -0.43 0.00 -0.03 0.00 0.00 54.58 54.10 1wp1 n ASN 59 Cb 0.41 0.95 -0.03 0.00 -0.61 0.00 0.00 39.78 40.51 1wp1 n ASN 59 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1wp1 s ASN 60 N -1.87 6.50 0.44 6.41 3.84 -0.11 -4.52 114.94 125.64 1wp1 s ASN 60 Ca 0.00 1.83 0.12 0.00 0.21 0.00 0.00 52.86 55.02 1wp1 s ASN 60 Cb 0.00 -2.53 0.96 0.00 -0.55 0.00 0.00 41.25 39.13 1wp1 s ASN 60 CO 0.00 -1.12 2.00 0.03 -2.79 0.00 0.00 177.10 175.22 1wp1 h ARG 61 N 10.21 0.14 -0.43 0.43 2.47 -1.90 -1.57 114.38 123.71 1wp1 h ARG 61 Ca -0.35 -0.02 -0.09 0.00 -1.26 0.00 0.00 59.98 58.25 1wp1 h ARG 61 Cb 1.16 -0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 29.44 1wp1 h ARG 61 CO 0.98 0.23 -0.09 -0.44 0.56 0.00 0.00 179.97 181.21 1wp1 h ASP 62 N 0.13 0.83 -0.13 7.04 3.32 -1.98 -0.60 116.42 125.04 1wp1 h ASP 62 Ca 0.03 -0.36 -0.13 0.00 0.02 0.00 0.00 57.03 56.60 1wp1 h ASP 62 Cb 0.24 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 1wp1 h ASP 62 CO 0.01 1.00 -0.34 0.25 -1.72 0.00 0.00 179.24 178.44 1wp1 h LEU 63 N 0.66 0.66 -0.89 1.55 5.85 -1.87 -1.91 115.31 119.35 1wp1 h LEU 63 Ca 0.11 -0.27 -0.01 0.00 0.84 0.00 0.00 57.88 58.55 1wp1 h LEU 63 Cb 0.62 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.43 1wp1 h LEU 63 CO 0.04 0.95 0.52 -0.09 -0.34 0.00 0.00 178.44 179.52 1wp1 h ARG 64 N 0.53 1.23 -0.44 1.25 2.43 -1.06 -1.09 114.38 117.23 1wp1 h ARG 64 Ca 0.06 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 1wp1 h ARG 64 Cb 0.84 -0.25 -0.02 0.00 -0.42 0.00 0.00 29.97 30.12 1wp1 h ARG 64 CO 0.07 0.87 0.28 0.28 -1.51 0.00 0.00 179.97 179.96 1wp1 h VAL 65 N 1.24 1.13 -0.92 0.20 2.07 -0.96 -1.20 116.25 117.80 1wp1 h VAL 65 Ca 0.32 -0.27 0.04 0.00 0.82 0.00 0.00 66.70 67.60 1wp1 h VAL 65 Cb -0.02 0.52 -0.06 0.00 -1.52 0.00 0.00 31.29 30.21 1wp1 h VAL 65 CO -0.06 0.13 0.60 0.00 0.02 0.00 0.00 177.57 178.26 1wp1 h ALA 66 N 1.14 1.22 -0.26 1.67 0.00 -0.45 -0.65 119.26 121.93 1wp1 h ALA 66 Ca 0.16 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 1wp1 h ALA 66 Cb -0.03 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.44 1wp1 h ALA 66 CO -0.03 0.45 -0.12 0.00 0.00 0.00 0.00 179.25 179.55 1wp1 h ALA 67 N 1.38 0.36 -0.88 0.00 0.00 -1.03 -2.73 119.26 116.37 1wp1 h ALA 67 Ca 0.37 -0.31 0.10 0.00 0.00 0.00 0.00 54.91 55.07 1wp1 h ALA 67 Cb 0.02 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.66 1wp1 h ALA 67 CO -0.12 0.23 0.57 -0.07 0.00 0.00 0.00 179.25 179.85 1wp1 h LEU 68 N 0.27 0.77 -1.02 0.00 3.38 -0.82 -1.88 115.31 116.00 1wp1 h LEU 68 Ca 0.06 0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.98 1wp1 h LEU 68 Cb 0.62 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 1wp1 h LEU 68 CO 0.04 0.45 -0.11 -1.13 0.09 0.00 0.00 178.44 177.77 1wp1 h ASN 69 N 0.85 0.55 -0.53 -0.43 -1.24 -0.96 0.19 115.58 114.01 1wp1 h ASN 69 Ca 0.41 -0.15 0.06 0.00 0.71 0.00 0.00 56.30 57.33 1wp1 h ASN 69 Cb 0.44 -0.15 -0.05 0.00 0.73 0.00 0.00 38.32 39.29 1wp1 h ASN 69 CO -0.17 0.70 0.24 0.58 -1.29 0.00 0.00 177.43 177.49 1wp1 h VAL 70 N 0.53 0.90 -0.41 2.57 2.07 -1.04 -1.04 116.25 119.82 1wp1 h VAL 70 Ca 0.10 -0.16 -0.02 0.00 0.82 0.00 0.00 66.70 67.43 1wp1 h VAL 70 Cb 0.51 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 1wp1 h VAL 70 CO 0.03 0.08 0.16 -0.33 0.02 0.00 0.00 177.57 177.53 1wp1 h GLU 71 N 0.46 0.61 -0.53 1.57 4.39 -0.96 -0.63 114.58 119.50 1wp1 h GLU 71 Ca 0.24 -0.11 0.10 0.00 0.34 0.00 0.00 59.36 59.93 1wp1 h GLU 71 Cb 0.20 -0.10 -0.09 0.00 -0.10 0.00 0.00 28.75 28.67 1wp1 h GLU 71 CO -0.20 0.58 0.01 0.00 -1.16 0.00 0.00 179.01 178.24 1wp1 h ALA 72 N 1.00 0.52 0.00 3.43 0.00 -0.26 -0.51 119.26 123.44 1wp1 h ALA 72 Ca 0.14 0.16 -0.12 0.00 0.00 0.00 0.00 54.91 55.08 1wp1 h ALA 72 Cb 0.20 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1wp1 h ALA 72 CO -0.01 -0.38 -0.56 0.74 0.00 0.00 0.00 179.25 179.04 1wp1 h PHE 73 N 0.13 0.00 -0.53 0.00 -1.00 -1.02 -1.92 116.94 112.59 1wp1 h PHE 73 Ca 0.27 0.00 -0.08 0.00 2.81 0.00 0.00 57.97 60.97 1wp1 h PHE 73 Cb 0.41 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.95 1wp1 h PHE 73 CO -0.32 0.56 0.01 -0.09 -1.61 0.00 0.00 178.31 176.86 1wp1 h ARG 74 N 0.00 0.93 -0.75 1.51 2.43 -0.36 -1.34 114.38 116.81 1wp1 h ARG 74 Ca -0.01 -0.29 0.02 0.00 -0.81 0.00 0.00 59.98 58.89 1wp1 h ARG 74 Cb 1.01 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 30.43 1wp1 h ARG 74 CO 0.07 0.95 0.50 0.00 -1.51 0.00 0.00 179.97 179.98 1wp1 h ALA 75 N 0.95 1.50 -0.48 2.80 0.00 -0.81 0.32 119.26 123.55 1wp1 h ALA 75 Ca 0.15 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 1wp1 h ALA 75 Cb 0.52 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1wp1 h ALA 75 CO 0.03 0.44 -0.11 0.37 0.00 0.00 0.00 179.25 179.98 1wp1 h GLN 76 N 0.98 0.92 -0.28 0.00 5.75 -1.12 -0.24 115.11 121.12 1wp1 h GLN 76 Ca 0.28 -0.35 0.00 0.00 -0.15 0.00 0.00 58.65 58.43 1wp1 h GLN 76 Cb -0.05 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.43 1wp1 h GLN 76 CO -0.07 1.01 0.18 -0.92 -2.65 0.00 0.00 178.83 176.37 1wp1 h TYR 77 N 0.77 0.36 -0.25 3.99 3.20 -0.48 -2.25 116.97 122.31 1wp1 h TYR 77 Ca 0.12 0.00 0.03 0.00 3.14 0.00 0.00 58.73 62.02 1wp1 h TYR 77 Cb 0.66 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.80 1wp1 h TYR 77 CO 0.05 0.25 0.17 0.00 -1.64 0.00 0.00 178.16 176.98 1wp1 h ARG 78 N 0.36 0.22 0.53 1.82 3.08 -0.59 0.27 114.38 120.07 1wp1 h ARG 78 Ca 0.10 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.11 1wp1 h ARG 78 Cb -0.01 -0.05 0.01 0.00 0.08 0.00 0.00 29.97 29.99 1wp1 h ARG 78 CO -0.02 0.15 -0.25 0.82 -1.07 0.00 0.00 179.97 179.59 1wp1 h ILE 79 N 0.23 0.30 -0.84 2.04 2.04 -0.50 -2.43 117.51 118.35 1wp1 h ILE 79 Ca 0.10 -0.43 0.12 0.00 1.00 0.00 0.00 64.86 65.65 1wp1 h ILE 79 Cb 0.12 0.42 -0.06 0.00 -0.74 0.00 0.00 36.82 36.56 1wp1 h ILE 79 CO -0.02 0.05 0.54 1.56 0.00 0.00 0.00 178.15 180.28 1wp1 h GLN 80 N -1.03 0.70 -0.62 2.37 1.08 -0.86 -1.02 115.11 115.72 1wp1 h GLN 80 Ca -0.07 -0.04 0.04 0.00 -1.45 0.00 0.00 58.65 57.12 1wp1 h GLN 80 Cb 0.62 -0.16 -0.04 0.00 -0.05 0.00 0.00 27.48 27.85 1wp1 h GLN 80 CO 0.12 0.46 0.36 -0.09 -0.95 0.00 0.00 178.83 178.73 1wp1 h ARG 81 N 0.72 0.68 0.00 1.46 2.43 -0.44 -1.70 114.38 117.53 1wp1 h ARG 81 Ca 0.40 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.53 1wp1 h ARG 81 Cb 0.56 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 1wp1 h ARG 81 CO -0.17 0.45 0.00 0.00 -1.51 0.00 0.00 179.97 178.75 1wp1 h ALA 82 N 1.29 1.00 0.00 2.80 0.00 -0.68 -3.03 119.26 120.65 1wp1 h ALA 82 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1wp1 h ALA 82 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1wp1 h ALA 82 CO -0.13 0.00 0.00 -3.47 0.00 0.00 0.00 179.25 175.65 1wp1 n ASP 83 N -2.94 0.37 -0.71 0.00 -0.08 -0.64 -1.86 116.55 110.70 1wp1 n ASP 83 Ca 0.01 0.59 0.08 0.00 -1.51 0.00 0.00 54.79 53.96 1wp1 n ASP 83 Cb 0.29 -0.67 0.24 0.00 2.34 0.00 0.00 41.12 43.31 1wp1 n ASP 83 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1wp1 n LEU 84 N -1.91 2.09 -4.22 -2.67 4.77 -1.14 -4.88 117.00 109.04 1wp1 n LEU 84 Ca 0.03 -0.99 -0.20 0.00 -0.03 0.00 0.00 56.01 54.82 1wp1 n LEU 84 Cb 0.20 -0.22 -0.12 0.00 -2.33 0.00 0.00 43.42 40.95 1wp1 n LEU 84 CO 0.17 0.50 -0.47 -0.36 -1.33 0.00 0.00 177.39 175.89 1wp1 s PHE 85 N -1.55 1.41 0.12 -1.77 0.40 -0.78 -4.99 117.98 110.82 1wp1 s PHE 85 Ca 0.29 -0.47 -0.30 0.00 -0.60 0.00 0.00 56.93 55.85 1wp1 s PHE 85 Cb 0.16 -0.77 -0.06 0.00 0.51 0.00 0.00 43.02 42.85 1wp1 s PHE 85 CO 0.21 0.12 1.06 -2.14 0.70 0.00 0.00 175.22 175.17 1wp1 s PRO 86 N -2.00 4.60 -0.23 0.24 0.02 -1.26 -4.99 135.00 131.38 1wp1 s PRO 86 Ca 0.03 1.61 -0.29 0.00 0.02 0.00 0.00 61.00 62.36 1wp1 s PRO 86 Cb -0.09 -3.34 0.00 0.00 0.02 0.00 0.00 34.50 31.10 1wp1 s PRO 86 CO 0.03 0.07 1.15 1.03 -0.33 0.00 0.00 177.00 178.95 1wp1 s ARG 87 N 0.08 4.18 -0.21 5.54 0.52 -1.26 -5.01 118.95 122.79 1wp1 s ARG 87 Ca 0.50 1.40 -0.01 0.00 -0.52 0.00 0.00 55.73 57.10 1wp1 s ARG 87 Cb -0.27 -3.72 0.01 0.00 0.52 0.00 0.00 34.95 31.49 1wp1 s ARG 87 CO 0.32 -0.75 -0.12 0.42 0.02 0.00 0.00 175.30 175.18 1wp1 s ILE 88 N 3.51 2.66 0.00 1.52 1.01 -1.26 -4.16 121.20 124.48 1wp1 s ILE 88 Ca 0.49 -0.80 0.00 0.00 0.00 0.00 0.00 60.65 60.34 1wp1 s ILE 88 Cb -0.17 -2.20 0.00 0.00 0.01 0.00 0.00 42.46 40.10 1wp1 s ILE 88 CO 0.12 0.44 0.00 0.61 0.00 0.00 0.00 174.94 176.11 1wp1 n GLY 89 N 4.69 5.71 2.96 6.18 0.00 -1.10 -4.95 105.19 118.68 1wp1 n GLY 89 Ca -0.19 -2.05 -0.30 0.00 0.00 0.00 0.00 46.02 43.47 1wp1 n GLY 89 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wp1 s VAL 90 N -0.27 2.25 -0.84 1.61 1.01 -1.26 -3.30 120.40 119.59 1wp1 s VAL 90 Ca 0.00 -2.63 -0.17 0.00 0.00 0.00 0.00 61.98 59.17 1wp1 s VAL 90 Cb 0.00 -2.62 0.16 0.00 0.00 0.00 0.00 36.38 33.92 1wp1 s VAL 90 CO 0.00 -0.69 0.94 -1.81 0.00 0.00 0.00 175.10 173.54 1wp1 s ASP 91 N 0.51 6.61 -1.29 3.32 -0.00 -1.01 -4.84 116.67 119.96 1wp1 s ASP 91 Ca 0.13 -2.17 -0.17 0.00 -0.00 0.00 0.00 52.55 50.35 1wp1 s ASP 91 Cb -0.22 -2.32 0.09 0.00 -0.00 0.00 0.00 42.92 40.47 1wp1 s ASP 91 CO -0.06 -0.91 1.72 0.61 -0.00 0.00 0.00 175.17 176.53 1wp1 n GLY 92 N 4.93 2.94 3.59 0.21 0.00 -1.26 -2.86 105.19 112.74 1wp1 n GLY 92 Ca 0.15 -1.60 -0.29 0.00 0.00 0.00 0.00 46.02 44.28 1wp1 n GLY 92 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1wp1 n SER 93 N 7.56 -1.25 0.00 1.61 2.88 -1.05 -4.85 113.62 118.53 1wp1 n SER 93 Ca 0.47 -1.28 0.00 0.00 -1.33 0.00 0.00 58.87 56.72 1wp1 n SER 93 Cb 0.45 -1.00 0.00 0.00 -0.75 0.00 0.00 64.21 62.91 1wp1 n SER 93 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wp1 n GLY 94 N -4.26 -1.43 3.81 0.46 0.00 -1.26 -3.18 105.19 99.33 1wp1 n GLY 94 Ca 0.16 0.85 -0.36 0.00 0.00 0.00 0.00 46.02 46.67 1wp1 n GLY 94 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wp1 s THR 95 N 0.00 4.43 -0.42 2.61 2.01 -0.78 -4.91 115.64 118.59 1wp1 s THR 95 Ca 0.00 1.47 0.05 0.00 0.31 0.00 0.00 61.69 63.52 1wp1 s THR 95 Cb 0.00 -3.86 0.17 0.00 0.01 0.00 0.00 72.50 68.82 1wp1 s THR 95 CO 0.00 0.09 0.50 -0.60 -0.69 0.00 0.00 174.62 173.91 1wp1 s ARG 96 N -2.23 0.81 0.09 4.92 3.52 -1.26 -0.66 118.95 124.13 1wp1 s ARG 96 Ca 0.49 -0.99 0.04 0.00 -0.13 0.00 0.00 55.73 55.13 1wp1 s ARG 96 Cb -0.16 -0.53 -0.04 0.00 -1.56 0.00 0.00 34.95 32.66 1wp1 s ARG 96 CO 0.21 -1.26 0.04 1.14 -0.81 0.00 0.00 175.30 174.62 1wp1 s GLN 97 N 1.16 2.72 -0.24 5.12 -2.07 -0.86 -4.97 119.66 120.52 1wp1 s GLN 97 Ca 0.22 -0.77 -0.10 0.00 -1.82 0.00 0.00 55.36 52.89 1wp1 s GLN 97 Cb -0.07 -2.63 -0.05 0.00 -1.09 0.00 0.00 33.01 29.17 1wp1 s GLN 97 CO -0.06 0.55 0.14 0.50 -1.32 0.00 0.00 175.29 175.09 1wp1 s ARG 98 N -2.39 3.99 0.26 9.60 3.52 -1.26 -1.84 118.95 130.84 1wp1 s ARG 98 Ca 0.28 -0.31 0.08 0.00 -0.13 0.00 0.00 55.73 55.64 1wp1 s ARG 98 Cb -0.12 -3.48 -0.04 0.00 -1.56 0.00 0.00 34.95 29.75 1wp1 s ARG 98 CO 0.20 0.03 0.13 -0.51 -0.81 0.00 0.00 175.30 174.34 1wp1 s LEU 99 N 1.12 3.57 0.78 -0.88 1.43 -0.73 -5.02 118.68 118.95 1wp1 s LEU 99 Ca 0.07 -0.42 -0.09 0.00 -1.03 0.00 0.00 54.13 52.65 1wp1 s LEU 99 Cb -0.14 -2.10 0.09 0.00 0.03 0.00 0.00 46.19 44.08 1wp1 s LEU 99 CO 0.05 -0.05 1.12 -2.16 0.23 0.00 0.00 176.35 175.53 1wp1 s PRO 100 N -3.79 1.85 0.25 1.29 0.04 -1.26 -2.99 135.00 130.38 1wp1 s PRO 100 Ca 0.33 -0.21 -0.04 0.00 0.04 0.00 0.00 61.00 61.12 1wp1 s PRO 100 Cb -0.07 -2.06 0.40 0.00 0.04 0.00 0.00 34.50 32.81 1wp1 s PRO 100 CO 0.23 -1.55 1.83 0.78 0.04 0.00 0.00 177.00 178.33 1wp1 h GLY 101 N -0.91 1.36 1.08 0.56 0.00 -1.79 0.15 103.07 103.52 1wp1 h GLY 101 Ca -0.44 -0.37 0.00 0.00 0.00 0.00 0.00 47.33 46.52 1wp1 h GLY 101 CO 0.57 0.20 0.00 2.09 0.00 0.00 0.00 176.54 179.40 1wp1 n ASP 102 N -4.66 0.00 0.00 0.19 5.75 -1.26 -3.12 116.55 113.45 1wp1 n ASP 102 Ca 0.14 -0.56 0.00 0.00 -0.01 0.00 0.00 54.79 54.36 1wp1 n ASP 102 Cb 0.24 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.30 1wp1 n ASP 102 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1wp1 n LEU 103 N -1.04 0.00 -4.65 -2.12 4.77 -0.44 -5.09 117.00 108.43 1wp1 n LEU 103 Ca 0.15 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.83 1wp1 n LEU 103 Cb 0.08 0.00 0.17 0.00 -2.33 0.00 0.00 43.42 41.35 1wp1 n LEU 103 CO 0.12 0.00 0.63 -0.94 -1.33 0.00 0.00 177.39 175.87 1wp1 s SER 104 N -2.10 2.71 0.29 -1.43 1.04 0.41 -4.96 113.70 109.67 1wp1 s SER 104 Ca 0.00 1.60 0.05 0.00 0.48 0.00 0.00 55.95 58.08 1wp1 s SER 104 Cb 0.00 -2.25 0.43 0.00 0.10 0.00 0.00 66.02 64.30 1wp1 s SER 104 CO 0.00 -3.13 1.70 0.71 0.98 0.00 0.00 173.24 173.49 1wp1 h THR 105 N -1.89 1.30 0.00 2.02 1.35 -1.89 -3.35 112.91 110.45 1wp1 h THR 105 Ca -0.52 -1.46 -0.00 0.00 -0.55 0.00 0.00 66.41 63.88 1wp1 h THR 105 Cb 1.30 1.60 -0.00 0.00 -1.73 0.00 0.00 68.15 69.32 1wp1 h THR 105 CO 0.51 0.44 -0.01 0.71 -0.25 0.00 0.00 175.52 176.92 1wp1 h THR 106 N 0.27 1.33 0.00 6.82 1.35 -1.92 -3.48 112.91 117.27 1wp1 h THR 106 Ca 0.03 -2.00 0.00 0.00 -0.55 0.00 0.00 66.41 63.88 1wp1 h THR 106 Cb 0.79 2.52 0.00 0.00 -1.73 0.00 0.00 68.15 69.73 1wp1 h THR 106 CO 0.06 0.45 0.00 0.61 -0.25 0.00 0.00 175.52 176.39 1wp1 n GLY 107 N 1.65 1.68 3.54 5.82 0.00 -1.25 -5.10 105.19 111.52 1wp1 n GLY 107 Ca -0.08 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.70 1wp1 n GLY 107 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wp1 s SER 108 N -2.00 3.86 -0.42 1.61 1.04 -1.26 -4.46 113.70 112.07 1wp1 s SER 108 Ca 0.00 -1.00 -0.36 0.00 0.48 0.00 0.00 55.95 55.08 1wp1 s SER 108 Cb 0.00 -0.43 -0.13 0.00 0.10 0.00 0.00 66.02 65.56 1wp1 s SER 108 CO 0.00 -0.06 2.23 -2.65 0.98 0.00 0.00 173.24 173.74 1wp1 n PRO 109 N -0.75 0.84 -4.05 4.02 -0.02 -1.26 -4.33 135.00 129.46 1wp1 n PRO 109 Ca -0.05 0.21 -0.23 0.00 -2.02 0.00 0.00 63.50 61.41 1wp1 n PRO 109 Cb 0.61 -2.31 -0.06 0.00 -0.02 0.00 0.00 33.50 31.72 1wp1 n PRO 109 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1wp1 s ALA 110 N 7.52 3.56 -0.38 3.55 0.00 -1.16 -4.94 121.76 129.90 1wp1 s ALA 110 Ca 1.12 -1.79 0.03 0.00 0.00 0.00 0.00 51.96 51.32 1wp1 s ALA 110 Cb -0.94 -0.82 0.11 0.00 0.00 0.00 0.00 23.12 21.47 1wp1 s ALA 110 CO 0.50 0.03 0.13 0.42 0.00 0.00 0.00 175.76 176.84 1wp1 s ILE 111 N -2.40 1.98 0.63 0.00 1.01 -1.26 -1.77 121.20 119.39 1wp1 s ILE 111 Ca 0.38 -2.41 -0.01 0.00 0.00 0.00 0.00 60.65 58.62 1wp1 s ILE 111 Cb -0.03 -2.44 0.06 0.00 0.01 0.00 0.00 42.46 40.06 1wp1 s ILE 111 CO 0.23 -0.69 0.88 -0.94 0.00 0.00 0.00 174.94 174.42 1wp1 s SER 112 N 0.71 4.93 -0.28 3.58 1.04 -0.77 -4.95 113.70 117.96 1wp1 s SER 112 Ca 0.13 -0.01 -0.27 0.00 0.48 0.00 0.00 55.95 56.27 1wp1 s SER 112 Cb -0.21 -0.69 0.19 0.00 0.10 0.00 0.00 66.02 65.41 1wp1 s SER 112 CO -0.09 -1.43 1.36 -0.94 0.98 0.00 0.00 173.24 173.13 1wp1 s SER 113 N -4.53 -0.08 0.17 7.02 1.04 -1.26 -2.02 113.70 114.04 1wp1 s SER 113 Ca 0.60 0.12 -0.04 0.00 0.48 0.00 0.00 55.95 57.11 1wp1 s SER 113 Cb -0.09 0.11 -0.03 0.00 0.10 0.00 0.00 66.02 66.11 1wp1 s SER 113 CO 0.41 -0.05 0.18 0.00 0.98 0.00 0.00 173.24 174.77 1wp1 s GLN 114 N -0.53 1.14 0.04 4.02 -2.07 0.16 -4.61 119.66 117.80 1wp1 s GLN 114 Ca 0.07 -1.41 -0.13 0.00 -1.82 0.00 0.00 55.36 52.07 1wp1 s GLN 114 Cb -0.03 0.31 0.02 0.00 -1.09 0.00 0.00 33.01 32.22 1wp1 s GLN 114 CO -0.11 -0.38 0.29 0.71 -1.32 0.00 0.00 175.29 174.48 1wp1 s TYR 115 N -4.06 -0.09 0.00 9.60 1.51 -0.94 -1.86 117.35 121.51 1wp1 s TYR 115 Ca 0.27 -0.05 0.00 0.00 -1.01 0.00 0.00 57.07 56.28 1wp1 s TYR 115 Cb 0.05 0.08 0.00 0.00 -0.11 0.00 0.00 41.96 41.99 1wp1 s TYR 115 CO 0.05 -0.49 0.00 0.41 -1.11 0.00 0.00 175.55 174.41 1wp1 n GLY 116 N 0.61 -1.59 3.65 0.71 0.00 -1.19 -2.27 105.19 105.10 1wp1 n GLY 116 Ca -0.19 1.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.41 1wp1 n GLY 116 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wp1 s VAL 117 N 0.00 3.32 0.45 1.61 1.01 -1.20 -2.52 120.40 123.07 1wp1 s VAL 117 Ca 0.00 0.38 0.03 0.00 0.00 0.00 0.00 61.98 62.38 1wp1 s VAL 117 Cb 0.00 -3.28 -0.02 0.00 0.00 0.00 0.00 36.38 33.07 1wp1 s VAL 117 CO 0.00 -0.08 0.07 0.28 0.00 0.00 0.00 175.10 175.37 1wp1 s THR 118 N 5.03 0.90 -0.17 3.92 -1.32 -1.14 -1.88 115.64 120.99 1wp1 s THR 118 Ca 0.82 -2.00 -0.04 0.00 -1.21 0.00 0.00 61.69 59.26 1wp1 s THR 118 Cb -0.35 -2.29 0.08 0.00 -1.51 0.00 0.00 72.50 68.43 1wp1 s THR 118 CO 0.35 0.00 0.23 -0.22 -2.21 0.00 0.00 174.62 172.77 1wp1 s LEU 119 N -3.73 -0.18 0.00 9.08 0.20 0.98 -2.40 118.68 122.62 1wp1 s LEU 119 Ca 0.16 0.11 0.00 0.00 0.69 0.00 0.00 54.13 55.09 1wp1 s LEU 119 Cb 0.02 0.49 0.00 0.00 -0.43 0.00 0.00 46.19 46.27 1wp1 s LEU 119 CO 0.09 -0.29 0.00 0.61 -0.29 0.00 0.00 176.35 176.48 1wp1 n GLY 120 N 5.33 -0.92 3.61 7.98 0.00 -1.21 -2.75 105.19 117.24 1wp1 n GLY 120 Ca -0.05 -0.81 -0.26 0.00 0.00 0.00 0.00 46.02 44.89 1wp1 n GLY 120 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wp1 s THR 121 N -3.00 3.37 -0.11 2.61 2.01 -0.95 -2.70 115.64 116.88 1wp1 s THR 121 Ca 0.00 -1.62 0.02 0.00 0.31 0.00 0.00 61.69 60.40 1wp1 s THR 121 Cb 0.00 -2.70 -0.01 0.00 0.01 0.00 0.00 72.50 69.80 1wp1 s THR 121 CO 0.00 -0.14 -0.17 -0.89 -0.69 0.00 0.00 174.62 172.73 1wp1 s THR 122 N -1.79 2.76 -1.05 -0.82 2.01 -1.26 -2.00 115.64 113.49 1wp1 s THR 122 Ca 0.26 -0.78 0.00 0.00 0.31 0.00 0.00 61.69 61.48 1wp1 s THR 122 Cb -0.09 -2.12 0.00 0.00 0.01 0.00 0.00 72.50 70.31 1wp1 s THR 122 CO 0.17 0.55 0.00 0.00 -0.69 0.00 0.00 174.62 174.64 1wp1 n ALA 123 N 3.29 -0.59 -1.61 7.40 0.00 -1.16 -4.86 120.51 122.98 1wp1 n ALA 123 Ca -0.18 0.12 -0.55 0.00 0.00 0.00 0.00 53.44 52.84 1wp1 n ALA 123 Cb 0.53 -1.36 -0.07 0.00 0.00 0.00 0.00 19.45 18.54 1wp1 n ALA 123 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 1wp1 n TRP 124 N -2.80 1.92 -2.96 0.00 -0.00 -0.58 -4.57 117.44 108.46 1wp1 n TRP 124 Ca -0.13 0.40 -0.41 0.00 -0.00 0.00 0.00 57.50 57.36 1wp1 n TRP 124 Cb 0.53 -2.50 -0.05 0.00 -0.00 0.00 0.00 31.31 29.29 1wp1 n TRP 124 CO 0.00 0.00 0.00 -2.00 -0.00 0.00 0.00 177.69 175.69 1wp1 s GLU 125 N 4.52 4.28 -0.25 5.87 2.12 -1.26 -0.97 118.70 133.01 1wp1 s GLU 125 Ca 1.02 0.90 -0.14 0.00 0.36 0.00 0.00 54.97 57.11 1wp1 s GLU 125 Cb -0.98 -3.57 -0.04 0.00 0.26 0.00 0.00 34.13 29.80 1wp1 s GLU 125 CO 0.59 -0.29 0.33 -0.51 -0.54 0.00 0.00 175.26 174.84 1wp1 s LEU 126 N 2.03 4.08 -0.23 2.70 1.43 -1.13 -4.95 118.68 122.62 1wp1 s LEU 126 Ca 0.36 0.29 -0.03 0.00 -1.03 0.00 0.00 54.13 53.72 1wp1 s LEU 126 Cb -0.16 -2.37 0.01 0.00 0.03 0.00 0.00 46.19 43.70 1wp1 s LEU 126 CO 0.12 -0.10 2.66 -0.67 0.23 0.00 0.00 176.35 178.59 1wp1 n ASP 127 N 4.90 5.98 -0.00 2.29 2.03 -1.26 -4.30 116.55 126.19 1wp1 n ASP 127 Ca -0.10 -2.86 -0.09 0.00 0.52 0.00 0.00 54.79 52.26 1wp1 n ASP 127 Cb 0.51 -1.22 -0.03 0.00 -0.72 0.00 0.00 41.12 39.66 1wp1 n ASP 127 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 1wp1 h LEU 128 N 3.66 -0.40 -1.77 -2.67 5.85 -1.93 -2.14 115.31 115.92 1wp1 h LEU 128 Ca 0.25 0.08 0.00 0.00 0.84 0.00 0.00 57.88 59.05 1wp1 h LEU 128 Cb 1.02 0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.24 1wp1 h LEU 128 CO 0.54 -0.17 0.00 0.49 -0.34 0.00 0.00 178.44 178.96 1wp1 n PHE 129 N -5.27 0.34 -0.74 1.25 3.01 -1.26 -2.43 117.46 112.36 1wp1 n PHE 129 Ca -0.03 -0.17 0.00 0.00 1.01 0.00 0.00 57.45 58.26 1wp1 n PHE 129 Cb 0.19 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.66 1wp1 n PHE 129 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1wp1 n GLY 130 N 1.34 0.85 0.18 1.37 0.00 -0.80 -4.34 105.19 103.78 1wp1 n GLY 130 Ca 0.18 -0.54 -0.05 0.00 0.00 0.00 0.00 46.02 45.61 1wp1 n GLY 130 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1wp1 h ARG 131 N 0.00 0.32 -0.08 1.61 2.43 -1.87 -1.78 114.38 115.01 1wp1 h ARG 131 Ca 0.00 -0.02 -0.17 0.00 -0.81 0.00 0.00 59.98 58.98 1wp1 h ARG 131 Cb 0.20 -0.07 0.01 0.00 -0.42 0.00 0.00 29.97 29.69 1wp1 h ARG 131 CO 0.00 0.21 -0.60 -0.07 -1.51 0.00 0.00 179.97 178.00 1wp1 h LEU 132 N 0.33 0.67 -0.89 3.80 3.38 -1.93 -2.15 115.31 118.51 1wp1 h LEU 132 Ca 0.20 -0.67 0.06 0.00 0.09 0.00 0.00 57.88 57.56 1wp1 h LEU 132 Cb 0.18 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 40.67 1wp1 h LEU 132 CO -0.20 1.24 0.56 -0.09 0.09 0.00 0.00 178.44 180.04 1wp1 h ARG 133 N 0.15 1.00 0.55 1.13 2.43 -1.91 0.12 114.38 117.85 1wp1 h ARG 133 Ca -0.05 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.03 1wp1 h ARG 133 Cb 1.26 -0.23 0.01 0.00 -0.42 0.00 0.00 29.97 30.59 1wp1 h ARG 133 CO 0.12 0.66 -0.26 0.77 -1.51 0.00 0.00 179.97 179.76 1wp1 h SER 134 N 1.03 -0.62 -0.95 -3.80 0.02 -1.28 -0.69 113.55 107.27 1wp1 h SER 134 Ca 0.38 0.01 0.22 0.00 -0.84 0.00 0.00 61.79 61.56 1wp1 h SER 134 Cb 0.14 0.16 -0.08 0.00 0.14 0.00 0.00 62.40 62.77 1wp1 h SER 134 CO -0.16 -0.43 0.62 -0.07 -1.14 0.00 0.00 176.83 175.65 1wp1 h LEU 135 N -0.76 0.46 0.48 5.07 3.38 -0.79 -0.28 115.31 122.88 1wp1 h LEU 135 Ca -0.07 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 1wp1 h LEU 135 Cb 0.57 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.30 1wp1 h LEU 135 CO 0.12 0.16 -0.23 -0.09 0.09 0.00 0.00 178.44 178.49 1wp1 h ARG 136 N 0.45 -0.62 -0.07 1.13 1.12 -0.35 -1.60 114.38 114.44 1wp1 h ARG 136 Ca 0.51 0.04 0.02 0.00 -1.11 0.00 0.00 59.98 59.45 1wp1 h ARG 136 Cb 1.22 0.14 -0.00 0.00 -0.01 0.00 0.00 29.97 31.32 1wp1 h ARG 136 CO -0.23 -0.32 0.09 -0.44 -3.11 0.00 0.00 179.97 175.97 1wp1 h ASP 137 N -0.99 0.00 -0.41 -3.80 3.32 -0.66 0.11 116.42 113.99 1wp1 h ASP 137 Ca -0.07 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.87 1wp1 h ASP 137 Cb 0.59 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.13 1wp1 h ASP 137 CO 0.11 0.00 -0.20 -0.61 -1.72 0.00 0.00 179.24 176.82 1wp1 h GLN 138 N 0.00 0.87 -0.03 3.56 4.15 -0.81 -2.06 115.11 120.78 1wp1 h GLN 138 Ca 0.03 -0.38 -0.07 0.00 0.77 0.00 0.00 58.65 59.00 1wp1 h GLN 138 Cb 0.21 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.86 1wp1 h GLN 138 CO -0.00 1.02 -0.32 0.00 -1.93 0.00 0.00 178.83 177.60 1wp1 h ALA 139 N 0.82 1.40 -0.28 3.38 0.00 0.14 -2.50 119.26 122.22 1wp1 h ALA 139 Ca 0.09 -0.31 -0.17 0.00 0.00 0.00 0.00 54.91 54.52 1wp1 h ALA 139 Cb 0.77 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 1wp1 h ALA 139 CO 0.06 0.44 -0.48 1.25 0.00 0.00 0.00 179.25 180.52 1wp1 h LEU 140 N 0.06 0.90 -0.83 0.00 5.85 -0.81 -2.04 115.31 118.43 1wp1 h LEU 140 Ca 0.01 -0.53 -0.10 0.00 0.84 0.00 0.00 57.88 58.10 1wp1 h LEU 140 Cb 0.60 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 1wp1 h LEU 140 CO 0.04 1.26 -0.20 -0.33 -0.34 0.00 0.00 178.44 178.87 1wp1 h GLU 141 N 0.58 0.66 -0.63 1.25 4.39 -1.29 -0.60 114.58 118.92 1wp1 h GLU 141 Ca 0.02 -0.24 -0.07 0.00 0.34 0.00 0.00 59.36 59.41 1wp1 h GLU 141 Cb 1.08 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.66 1wp1 h GLU 141 CO 0.11 0.81 0.11 1.96 -1.16 0.00 0.00 179.01 180.84 1wp1 h GLN 142 N 0.58 1.03 0.23 2.33 4.20 -1.38 0.25 115.11 122.35 1wp1 h GLN 142 Ca 0.09 -0.26 -0.01 0.00 0.06 0.00 0.00 58.65 58.53 1wp1 h GLN 142 Cb 0.66 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.31 1wp1 h GLN 142 CO 0.05 0.94 -0.12 -0.92 -0.67 0.00 0.00 178.83 178.11 1wp1 h TYR 143 N 0.97 -0.30 -0.76 2.96 3.20 -1.01 -0.23 116.97 121.81 1wp1 h TYR 143 Ca 0.20 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.15 1wp1 h TYR 143 Cb 0.40 0.10 -0.07 0.00 1.54 0.00 0.00 36.73 38.70 1wp1 h TYR 143 CO 0.03 -0.19 0.41 -0.07 -1.64 0.00 0.00 178.16 176.70 1wp1 h LEU 144 N -0.32 0.57 -0.34 2.82 3.38 -0.54 0.64 115.31 121.52 1wp1 h LEU 144 Ca -0.03 0.05 0.04 0.00 0.09 0.00 0.00 57.88 58.03 1wp1 h LEU 144 Cb 0.25 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 40.90 1wp1 h LEU 144 CO 0.05 0.33 0.11 0.00 0.09 0.00 0.00 178.44 179.03 1wp1 h ALA 145 N 1.43 0.39 -0.48 1.53 0.00 -0.31 -1.67 119.26 120.15 1wp1 h ALA 145 Ca 0.36 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.27 1wp1 h ALA 145 Cb 0.33 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1wp1 h ALA 145 CO -0.24 -0.28 0.09 1.15 0.00 0.00 0.00 179.25 179.96 1wp1 h THR 146 N 0.26 1.22 -0.71 0.00 2.02 -0.16 -0.13 112.91 115.41 1wp1 h THR 146 Ca 0.16 -0.80 0.05 0.00 0.77 0.00 0.00 66.41 66.59 1wp1 h THR 146 Cb 0.14 0.75 -0.05 0.00 -1.74 0.00 0.00 68.15 67.25 1wp1 h THR 146 CO -0.17 0.29 0.42 -0.08 0.37 0.00 0.00 175.52 176.36 1wp1 h GLU 147 N 0.71 0.77 -0.29 6.66 4.81 -0.34 -1.77 114.58 125.13 1wp1 h GLU 147 Ca 0.16 -0.05 -0.12 0.00 -0.13 0.00 0.00 59.36 59.22 1wp1 h GLU 147 Cb 0.30 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.50 1wp1 h GLU 147 CO 0.00 0.51 -0.33 1.96 -0.73 0.00 0.00 179.01 180.42 1wp1 h GLN 148 N 0.80 0.63 -0.87 1.92 1.08 -0.34 -2.84 115.11 115.49 1wp1 h GLN 148 Ca 0.30 -0.29 0.01 0.00 -1.45 0.00 0.00 58.65 57.23 1wp1 h GLN 148 Cb 0.12 -0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 27.49 1wp1 h GLN 148 CO -0.15 0.87 0.57 0.00 -0.95 0.00 0.00 178.83 179.18 1wp1 h ALA 149 N 1.11 1.40 0.25 3.87 0.00 -0.64 0.13 119.26 125.39 1wp1 h ALA 149 Ca 0.06 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1wp1 h ALA 149 Cb 0.83 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1wp1 h ALA 149 CO 0.07 0.55 -0.12 0.37 0.00 0.00 0.00 179.25 180.12 1wp1 h GLN 150 N 1.16 -0.33 -0.50 0.00 4.15 -1.10 0.21 115.11 118.70 1wp1 h GLN 150 Ca 0.32 0.02 0.07 0.00 0.77 0.00 0.00 58.65 59.83 1wp1 h GLN 150 Cb -0.11 0.07 -0.06 0.00 0.21 0.00 0.00 27.48 27.60 1wp1 h GLN 150 CO -0.08 -0.21 0.19 0.00 -1.93 0.00 0.00 178.83 176.80 1wp1 h ARG 151 N -0.35 0.36 -0.26 1.69 3.08 -1.14 0.28 114.38 118.05 1wp1 h ARG 151 Ca -0.03 -0.02 0.06 0.00 0.07 0.00 0.00 59.98 60.05 1wp1 h ARG 151 Cb 0.27 -0.08 -0.06 0.00 0.08 0.00 0.00 29.97 30.17 1wp1 h ARG 151 CO 0.06 0.24 -0.17 1.03 -1.07 0.00 0.00 179.97 180.06 1wp1 h SER 152 N 0.37 -0.55 -0.77 7.04 0.87 -0.61 0.58 113.55 120.48 1wp1 h SER 152 Ca 0.24 0.12 0.08 0.00 -1.23 0.00 0.00 61.79 61.00 1wp1 h SER 152 Cb 0.24 0.28 -0.07 0.00 -0.44 0.00 0.00 62.40 62.42 1wp1 h SER 152 CO -0.23 -0.21 0.43 0.00 -0.53 0.00 0.00 176.83 176.29 1wp1 h ALA 153 N 1.01 1.07 -0.04 6.23 0.00 0.12 -0.42 119.26 127.25 1wp1 h ALA 153 Ca 0.14 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1wp1 h ALA 153 Cb 0.36 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 1wp1 h ALA 153 CO -0.35 0.07 0.02 0.37 0.00 0.00 0.00 179.25 179.36 1wp1 h GLN 154 N 0.74 0.05 -0.78 0.00 4.15 0.78 0.40 115.11 120.44 1wp1 h GLN 154 Ca 0.37 -0.00 0.04 0.00 0.77 0.00 0.00 58.65 59.82 1wp1 h GLN 154 Cb 0.32 -0.01 -0.05 0.00 0.21 0.00 0.00 27.48 27.95 1wp1 h GLN 154 CO -0.23 0.04 0.51 1.79 -1.93 0.00 0.00 178.83 179.01 1wp1 h THR 155 N 0.04 1.10 -0.38 2.39 1.35 0.04 0.10 112.91 117.56 1wp1 h THR 155 Ca 0.01 -0.32 -0.01 0.00 -0.55 0.00 0.00 66.41 65.54 1wp1 h THR 155 Cb 0.00 0.09 -0.02 0.00 -1.73 0.00 0.00 68.15 66.50 1wp1 h THR 155 CO -0.00 0.17 0.19 0.74 -0.25 0.00 0.00 175.52 176.37 1wp1 h THR 156 N 0.93 1.16 -0.41 6.82 2.02 -0.69 -1.64 112.91 121.10 1wp1 h THR 156 Ca 0.32 -0.44 0.03 0.00 0.77 0.00 0.00 66.41 67.09 1wp1 h THR 156 Cb 0.08 0.76 -0.03 0.00 -1.74 0.00 0.00 68.15 67.22 1wp1 h THR 156 CO -0.10 0.17 0.22 0.25 0.37 0.00 0.00 175.52 176.43 1wp1 h LEU 157 N 0.47 0.34 -0.13 2.58 5.85 0.67 -0.76 115.31 124.34 1wp1 h LEU 157 Ca 0.13 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.88 1wp1 h LEU 157 Cb 0.09 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 1wp1 h LEU 157 CO -0.02 0.25 0.02 0.58 -0.34 0.00 0.00 178.44 178.93 1wp1 h VAL 158 N 0.45 0.94 -0.75 1.05 2.07 -0.70 0.07 116.25 119.38 1wp1 h VAL 158 Ca 0.17 -0.02 0.02 0.00 0.82 0.00 0.00 66.70 67.69 1wp1 h VAL 158 Cb 0.05 0.86 -0.04 0.00 -1.52 0.00 0.00 31.29 30.63 1wp1 h VAL 158 CO -0.10 0.01 0.48 0.00 0.02 0.00 0.00 177.57 177.98 1wp1 h ALA 159 N 1.10 0.98 -0.37 1.67 0.00 -1.01 -1.53 119.26 120.10 1wp1 h ALA 159 Ca 0.06 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 1wp1 h ALA 159 Cb 0.05 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1wp1 h ALA 159 CO -0.08 0.30 -0.18 0.77 0.00 0.00 0.00 179.25 180.06 1wp1 h SER 160 N 0.96 0.80 0.01 0.00 0.02 -0.72 -1.03 113.55 113.59 1wp1 h SER 160 Ca 0.29 -0.40 -0.00 0.00 -0.84 0.00 0.00 61.79 60.84 1wp1 h SER 160 Cb -0.02 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.30 1wp1 h SER 160 CO -0.10 1.03 -0.00 0.58 -1.14 0.00 0.00 176.83 177.20 1wp1 h VAL 161 N 0.57 1.04 -0.97 2.27 2.07 -0.81 0.26 116.25 120.68 1wp1 h VAL 161 Ca 0.08 -0.12 0.03 0.00 0.82 0.00 0.00 66.70 67.51 1wp1 h VAL 161 Cb 0.72 1.12 -0.05 0.00 -1.52 0.00 0.00 31.29 31.56 1wp1 h VAL 161 CO 0.05 0.03 0.63 0.00 0.02 0.00 0.00 177.57 178.31 1wp1 h ALA 162 N 0.94 1.27 -0.34 1.67 0.00 -1.20 -1.00 119.26 120.59 1wp1 h ALA 162 Ca -0.00 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 1wp1 h ALA 162 Cb 0.06 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1wp1 h ALA 162 CO 0.00 0.54 -0.15 1.15 0.00 0.00 0.00 179.25 180.79 1wp1 h THR 163 N 1.24 1.29 -0.69 0.00 2.02 -0.88 0.88 112.91 116.76 1wp1 h THR 163 Ca 0.38 -1.26 -0.04 0.00 0.77 0.00 0.00 66.41 66.26 1wp1 h THR 163 Cb -0.04 1.37 -0.03 0.00 -1.74 0.00 0.00 68.15 67.71 1wp1 h THR 163 CO -0.11 0.41 0.27 0.00 0.37 0.00 0.00 175.52 176.46 1wp1 h ALA 164 N 0.79 0.90 -0.36 6.16 0.00 0.23 0.01 119.26 126.98 1wp1 h ALA 164 Ca 0.08 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1wp1 h ALA 164 Cb 0.68 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1wp1 h ALA 164 CO 0.05 0.52 0.16 -0.92 0.00 0.00 0.00 179.25 179.06 1wp1 h TYR 165 N 0.99 0.54 -0.56 0.00 3.20 -1.06 -1.11 116.97 118.96 1wp1 h TYR 165 Ca 0.23 -0.03 -0.09 0.00 3.14 0.00 0.00 58.73 61.97 1wp1 h TYR 165 Cb 0.21 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.30 1wp1 h TYR 165 CO 0.02 0.47 -0.02 -0.07 -1.64 0.00 0.00 178.16 176.92 1wp1 h LEU 166 N 0.45 0.96 -0.65 2.82 3.38 -0.39 -0.91 115.31 120.97 1wp1 h LEU 166 Ca 0.12 -0.27 -0.03 0.00 0.09 0.00 0.00 57.88 57.80 1wp1 h LEU 166 Cb 0.15 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 1wp1 h LEU 166 CO -0.01 1.02 0.31 0.74 0.09 0.00 0.00 178.44 180.59 1wp1 h THR 167 N 0.90 1.22 -0.29 0.22 2.02 -0.86 0.24 112.91 116.36 1wp1 h THR 167 Ca 0.16 -0.64 0.03 0.00 0.77 0.00 0.00 66.41 66.73 1wp1 h THR 167 Cb 0.55 0.44 -0.03 0.00 -1.74 0.00 0.00 68.15 67.37 1wp1 h THR 167 CO 0.03 0.26 0.10 0.25 0.37 0.00 0.00 175.52 176.54 1wp1 h LEU 168 N 0.90 0.12 -0.72 2.58 5.85 -0.93 -1.26 115.31 121.85 1wp1 h LEU 168 Ca 0.22 0.03 -0.08 0.00 0.84 0.00 0.00 57.88 58.89 1wp1 h LEU 168 Cb 0.13 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 1wp1 h LEU 168 CO -0.03 0.10 0.05 0.50 -0.34 0.00 0.00 178.44 178.72 1wp1 h LYS 169 N 0.24 1.03 0.36 1.25 1.63 -0.23 0.98 116.57 121.83 1wp1 h LYS 169 Ca 0.13 -0.29 -0.02 0.00 -0.85 0.00 0.00 60.65 59.62 1wp1 h LYS 169 Cb 0.10 -0.11 0.00 0.00 -0.60 0.00 0.00 32.23 31.62 1wp1 h LYS 169 CO -0.13 0.98 -0.18 0.00 -3.45 0.00 0.00 179.45 176.67 1wp1 h ALA 170 N 1.09 -0.49 -0.10 5.00 0.00 -0.37 -1.87 119.26 122.51 1wp1 h ALA 170 Ca 0.18 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 1wp1 h ALA 170 Cb 0.49 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1wp1 h ALA 170 CO 0.02 -0.77 -0.22 -0.44 0.00 0.00 0.00 179.25 177.84 1wp1 h ASP 171 N -0.50 0.16 -0.78 0.00 3.32 -0.81 0.77 116.42 118.59 1wp1 h ASP 171 Ca -0.05 -0.04 -0.05 0.00 0.02 0.00 0.00 57.03 56.91 1wp1 h ASP 171 Cb 0.38 -0.04 -0.03 0.00 0.22 0.00 0.00 39.33 39.85 1wp1 h ASP 171 CO 0.08 0.39 0.29 1.56 -1.72 0.00 0.00 179.24 179.84 1wp1 h GLN 172 N 0.16 1.18 -0.15 3.56 4.20 -0.59 -0.45 115.11 123.01 1wp1 h GLN 172 Ca 0.03 -0.23 -0.02 0.00 0.06 0.00 0.00 58.65 58.48 1wp1 h GLN 172 Cb 0.48 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 28.07 1wp1 h GLN 172 CO 0.03 0.97 0.00 0.00 -0.67 0.00 0.00 178.83 179.17 1wp1 h ALA 173 N 1.16 0.20 -0.62 3.87 0.00 -0.40 -0.82 119.26 122.65 1wp1 h ALA 173 Ca 0.26 -0.19 0.12 0.00 0.00 0.00 0.00 54.91 55.10 1wp1 h ALA 173 Cb 0.25 -0.06 -0.10 0.00 0.00 0.00 0.00 17.79 17.89 1wp1 h ALA 173 CO -0.02 -0.10 0.08 1.96 0.00 0.00 0.00 179.25 181.18 1wp1 h GLN 174 N 0.01 0.19 -0.10 0.00 1.08 -0.63 0.49 115.11 116.15 1wp1 h GLN 174 Ca 0.04 -0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 57.23 1wp1 h GLN 174 Cb 0.37 -0.04 -0.00 0.00 -0.05 0.00 0.00 27.48 27.75 1wp1 h GLN 174 CO 0.01 0.13 0.06 1.25 -0.95 0.00 0.00 178.83 179.32 1wp1 h LEU 175 N 0.20 0.13 -0.34 1.46 5.85 -0.95 0.31 115.31 121.96 1wp1 h LEU 175 Ca 0.33 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.95 1wp1 h LEU 175 Cb 0.52 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.50 1wp1 h LEU 175 CO -0.46 0.17 0.15 -0.61 -0.34 0.00 0.00 178.44 177.35 1wp1 h GLN 176 N 0.08 0.50 -0.62 1.25 5.75 -0.56 0.21 115.11 121.71 1wp1 h GLN 176 Ca 0.04 -0.08 0.07 0.00 -0.15 0.00 0.00 58.65 58.53 1wp1 h GLN 176 Cb 0.07 -0.09 -0.06 0.00 1.07 0.00 0.00 27.48 28.47 1wp1 h GLN 176 CO -0.01 0.48 0.30 1.25 -2.65 0.00 0.00 178.83 178.20 1wp1 h LEU 177 N 0.41 0.40 -0.52 -2.39 5.85 0.31 -1.11 115.31 118.26 1wp1 h LEU 177 Ca 0.12 0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.86 1wp1 h LEU 177 Cb 0.15 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 1wp1 h LEU 177 CO -0.01 0.25 0.23 0.74 -0.34 0.00 0.00 178.44 179.30 1wp1 h THR 178 N 0.54 1.21 -0.35 1.05 2.02 0.08 -1.08 112.91 116.38 1wp1 h THR 178 Ca 0.29 -0.62 0.08 0.00 0.77 0.00 0.00 66.41 66.93 1wp1 h THR 178 Cb 0.27 0.65 -0.08 0.00 -1.74 0.00 0.00 68.15 67.25 1wp1 h THR 178 CO -0.23 0.24 -0.18 0.11 0.37 0.00 0.00 175.52 175.83 1wp1 h LYS 179 N 0.70 -0.12 -0.73 6.66 1.57 0.57 0.73 116.57 125.96 1wp1 h LYS 179 Ca 0.18 0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.95 1wp1 h LYS 179 Cb 0.16 0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.47 1wp1 h LYS 179 CO -0.02 -0.08 0.39 -0.44 -0.57 0.00 0.00 179.45 178.74 1wp1 h ASP 180 N -0.12 0.92 -0.38 0.86 3.32 -1.02 -2.08 116.42 117.93 1wp1 h ASP 180 Ca 0.18 -0.10 -0.09 0.00 0.02 0.00 0.00 57.03 57.04 1wp1 h ASP 180 Cb 0.39 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 1wp1 h ASP 180 CO -0.43 0.76 -0.10 0.74 -1.72 0.00 0.00 179.24 178.49 1wp1 h THR 181 N 1.01 1.28 -0.04 0.35 2.02 -0.41 -1.42 112.91 115.69 1wp1 h THR 181 Ca 0.26 -1.18 0.02 0.00 0.77 0.00 0.00 66.41 66.27 1wp1 h THR 181 Cb 0.05 1.26 -0.02 0.00 -1.74 0.00 0.00 68.15 67.70 1wp1 h THR 181 CO -0.04 0.39 -0.05 0.25 0.37 0.00 0.00 175.52 176.44 1wp1 h LEU 182 N 0.54 -0.17 -0.92 2.58 5.85 -0.66 0.20 115.31 122.72 1wp1 h LEU 182 Ca 0.09 0.03 0.26 0.00 0.84 0.00 0.00 57.88 59.10 1wp1 h LEU 182 Cb 0.62 0.08 -0.14 0.00 0.37 0.00 0.00 40.66 41.59 1wp1 h LEU 182 CO 0.04 -0.08 0.38 1.23 -0.34 0.00 0.00 178.44 179.67 1wp1 h GLY 183 N -0.08 1.63 0.82 3.75 0.00 -1.03 0.36 103.07 108.53 1wp1 h GLY 183 Ca 0.04 -0.13 -0.11 0.00 0.00 0.00 0.00 47.33 47.12 1wp1 h GLY 183 CO -0.09 -0.37 -0.34 -0.84 0.00 0.00 0.00 176.54 174.89 1wp1 h THR 184 N 0.30 1.36 -0.70 4.70 2.02 -0.05 -1.46 112.91 119.08 1wp1 h THR 184 Ca 0.61 -1.62 -0.01 0.00 0.77 0.00 0.00 66.41 66.16 1wp1 h THR 184 Cb 1.26 2.04 -0.03 0.00 -1.74 0.00 0.00 68.15 69.68 1wp1 h THR 184 CO -0.60 0.49 0.41 1.88 0.37 0.00 0.00 175.52 178.06 1wp1 h TYR 185 N 0.09 0.94 -0.49 3.16 0.99 0.80 0.13 116.97 122.60 1wp1 h TYR 185 Ca -0.00 -0.01 0.05 0.00 2.00 0.00 0.00 58.73 60.77 1wp1 h TYR 185 Cb 0.95 -0.31 -0.05 0.00 1.00 0.00 0.00 36.73 38.33 1wp1 h TYR 185 CO 0.10 0.65 0.23 1.96 -0.00 0.00 0.00 178.16 181.09 1wp1 h GLN 186 N 0.96 0.43 -0.12 4.88 4.20 -0.33 0.49 115.11 125.62 1wp1 h GLN 186 Ca 0.25 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.94 1wp1 h GLN 186 Cb -0.01 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 1wp1 h GLN 186 CO -0.05 0.28 0.06 -0.22 -0.67 0.00 0.00 178.83 178.24 1wp1 h LYS 187 N 0.44 0.13 -0.50 1.46 3.64 -0.75 0.51 116.57 121.50 1wp1 h LYS 187 Ca 0.22 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.57 1wp1 h LYS 187 Cb 0.17 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 1wp1 h LYS 187 CO -0.18 0.09 0.23 1.03 -2.27 0.00 0.00 179.45 178.34 1wp1 h SER 188 N 0.14 0.67 -0.99 4.20 0.87 -0.27 -1.76 113.55 116.40 1wp1 h SER 188 Ca 0.05 -0.14 0.03 0.00 -1.23 0.00 0.00 61.79 60.49 1wp1 h SER 188 Cb -0.00 -0.17 -0.05 0.00 -0.44 0.00 0.00 62.40 61.73 1wp1 h SER 188 CO -0.03 0.63 0.65 0.15 -0.53 0.00 0.00 176.83 177.70 1wp1 h PHE 189 N 0.66 1.23 -0.46 2.24 3.57 0.39 -0.89 116.94 123.69 1wp1 h PHE 189 Ca 0.17 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.63 1wp1 h PHE 189 Cb 0.15 -0.41 -0.02 0.00 2.79 0.00 0.00 35.95 38.46 1wp1 h PHE 189 CO -0.00 0.74 0.01 -0.44 -2.23 0.00 0.00 178.31 176.39 1wp1 h ASP 190 N 1.29 0.78 -0.72 0.41 3.32 -0.35 0.12 116.42 121.27 1wp1 h ASP 190 Ca 0.38 -0.30 0.02 0.00 0.02 0.00 0.00 57.03 57.15 1wp1 h ASP 190 Cb -0.06 -0.21 -0.04 0.00 0.22 0.00 0.00 39.33 39.24 1wp1 h ASP 190 CO -0.11 0.88 0.47 -0.07 -1.72 0.00 0.00 179.24 178.70 1wp1 h LEU 191 N 0.64 0.79 -0.91 1.55 3.38 -0.99 -0.90 115.31 118.86 1wp1 h LEU 191 Ca 0.13 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.99 1wp1 h LEU 191 Cb 0.48 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1wp1 h LEU 191 CO 0.02 0.56 -0.21 0.74 0.09 0.00 0.00 178.44 179.64 1wp1 h THR 192 N 0.94 1.26 -0.12 0.22 2.02 -0.88 -1.02 112.91 115.32 1wp1 h THR 192 Ca 0.28 -1.23 -0.01 0.00 0.77 0.00 0.00 66.41 66.22 1wp1 h THR 192 Cb -0.05 1.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.62 1wp1 h THR 192 CO -0.08 0.40 0.05 -0.61 0.37 0.00 0.00 175.52 175.64 1wp1 h GLN 193 N 0.49 0.19 -0.86 6.66 5.75 -0.34 0.97 115.11 127.98 1wp1 h GLN 193 Ca 0.08 -0.04 0.05 0.00 -0.15 0.00 0.00 58.65 58.59 1wp1 h GLN 193 Cb 0.64 -0.03 -0.05 0.00 1.07 0.00 0.00 27.48 29.11 1wp1 h GLN 193 CO 0.05 0.30 0.56 0.00 -2.65 0.00 0.00 178.83 177.09 1wp1 h ARG 194 N 0.04 0.99 0.01 1.69 3.08 -0.92 0.18 114.38 119.44 1wp1 h ARG 194 Ca 0.04 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 1wp1 h ARG 194 Cb 0.19 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 30.01 1wp1 h ARG 194 CO -0.00 0.66 -0.00 1.03 -1.07 0.00 0.00 179.97 180.58 1wp1 h SER 195 N 1.02 -0.01 -0.53 7.04 0.87 -0.95 -2.73 113.55 118.27 1wp1 h SER 195 Ca 0.35 -0.21 0.07 0.00 -1.23 0.00 0.00 61.79 60.78 1wp1 h SER 195 Cb 0.10 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 62.01 1wp1 h SER 195 CO -0.12 0.20 0.19 0.22 -0.53 0.00 0.00 176.83 176.80 1wp1 h TYR 196 N -0.22 0.33 -0.43 2.24 3.20 -0.11 -1.49 116.97 120.50 1wp1 h TYR 196 Ca -0.00 0.03 0.13 0.00 3.14 0.00 0.00 58.73 62.02 1wp1 h TYR 196 Cb 0.21 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.40 1wp1 h TYR 196 CO -0.01 0.10 0.32 -0.44 -1.64 0.00 0.00 178.16 176.49 1wp1 h ASP 197 N 0.37 0.00 -0.12 -2.11 3.32 -0.61 -2.15 116.42 115.11 1wp1 h ASP 197 Ca 0.26 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.31 1wp1 h ASP 197 Cb 0.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.84 1wp1 h ASP 197 CO -0.26 0.00 0.00 0.55 -1.72 0.00 0.00 179.24 177.81 1wp1 n VAL 198 N -4.39 0.13 0.00 -1.35 3.14 -0.65 -4.93 118.33 110.28 1wp1 n VAL 198 Ca 0.07 -0.56 0.00 0.00 -2.96 0.00 0.00 64.34 60.90 1wp1 n VAL 198 Cb 0.52 1.35 0.00 0.00 -1.06 0.00 0.00 33.84 34.65 1wp1 n VAL 198 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1wp1 n GLY 199 N 1.39 0.74 0.34 7.55 0.00 -0.81 -5.00 105.19 109.39 1wp1 n GLY 199 Ca 0.15 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.13 1wp1 n GLY 199 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1wp1 n VAL 200 N -1.57 1.00 -1.95 1.61 0.31 -0.67 -4.94 118.33 112.13 1wp1 n VAL 200 Ca 0.00 0.26 -0.37 0.00 -0.01 0.00 0.00 64.34 64.22 1wp1 n VAL 200 Cb 0.00 -1.90 0.04 0.00 -0.91 0.00 0.00 33.84 31.06 1wp1 n VAL 200 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1wp1 s ALA 201 N -2.67 2.64 0.41 3.52 0.00 -1.20 -4.92 121.76 119.53 1wp1 s ALA 201 Ca -0.15 1.11 -0.02 0.00 0.00 0.00 0.00 51.96 52.91 1wp1 s ALA 201 Cb 0.02 -3.49 -0.03 0.00 0.00 0.00 0.00 23.12 19.62 1wp1 s ALA 201 CO 0.22 -1.22 0.66 -1.54 0.00 0.00 0.00 175.76 173.87 1wp1 s SER 202 N -1.38 6.22 0.25 0.00 1.04 -1.26 -4.22 113.70 114.35 1wp1 s SER 202 Ca 0.75 0.61 -0.03 0.00 0.48 0.00 0.00 55.95 57.76 1wp1 s SER 202 Cb -0.34 -2.05 0.45 0.00 0.10 0.00 0.00 66.02 64.18 1wp1 s SER 202 CO 0.38 -0.46 1.77 0.00 0.98 0.00 0.00 173.24 175.91 1wp1 h ALA 203 N 0.50 1.16 -0.07 5.32 0.00 -1.97 -1.42 119.26 122.78 1wp1 h ALA 203 Ca -0.48 0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.53 1wp1 h ALA 203 Cb 1.22 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 1wp1 h ALA 203 CO 0.61 -0.06 -0.10 1.25 0.00 0.00 0.00 179.25 180.95 1wp1 h LEU 204 N 0.63 -0.30 -0.59 0.00 5.85 -1.99 -0.00 115.31 118.90 1wp1 h LEU 204 Ca 0.42 0.06 0.12 0.00 0.84 0.00 0.00 57.88 59.31 1wp1 h LEU 204 Cb 0.52 0.15 -0.11 0.00 0.37 0.00 0.00 40.66 41.59 1wp1 h LEU 204 CO -0.32 -0.14 -0.17 0.44 -0.34 0.00 0.00 178.44 177.91 1wp1 h ASP 205 N -0.14 -0.62 -0.45 1.25 3.32 -1.68 0.53 116.42 118.64 1wp1 h ASP 205 Ca 0.06 0.18 0.01 0.00 0.02 0.00 0.00 57.03 57.30 1wp1 h ASP 205 Cb 0.23 0.39 -0.02 0.00 0.22 0.00 0.00 39.33 40.14 1wp1 h ASP 205 CO -0.16 -0.21 0.30 0.25 -1.72 0.00 0.00 179.24 177.70 1wp1 h LEU 206 N -0.02 0.51 -0.50 1.55 5.85 -0.83 -0.46 115.31 121.41 1wp1 h LEU 206 Ca 0.28 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.97 1wp1 h LEU 206 Cb 0.45 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.34 1wp1 h LEU 206 CO -0.62 0.37 0.23 0.03 -0.34 0.00 0.00 178.44 178.11 1wp1 h ARG 207 N 0.60 0.73 -0.08 1.25 2.47 -0.27 -1.32 114.38 117.75 1wp1 h ARG 207 Ca 0.17 -0.12 0.03 0.00 -1.26 0.00 0.00 59.98 58.80 1wp1 h ARG 207 Cb -0.06 -0.13 -0.03 0.00 -1.65 0.00 0.00 29.97 28.11 1wp1 h ARG 207 CO -0.04 0.62 -0.08 1.96 0.56 0.00 0.00 179.97 183.00 1wp1 h GLN 208 N 0.66 -0.09 -0.55 0.04 4.20 -0.49 -1.11 115.11 117.77 1wp1 h GLN 208 Ca 0.17 0.01 0.09 0.00 0.06 0.00 0.00 58.65 58.97 1wp1 h GLN 208 Cb 0.15 0.02 -0.07 0.00 0.30 0.00 0.00 27.48 27.88 1wp1 h GLN 208 CO -0.02 -0.06 0.17 0.00 -0.67 0.00 0.00 178.83 178.25 1wp1 h ALA 209 N 0.98 0.67 -0.24 3.87 0.00 -0.89 -2.49 119.26 121.15 1wp1 h ALA 209 Ca 0.06 0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.10 1wp1 h ALA 209 Cb 0.18 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 1wp1 h ALA 209 CO -0.14 -0.25 0.02 0.37 0.00 0.00 0.00 179.25 179.25 1wp1 h GLN 210 N 0.32 0.10 -0.93 0.00 4.15 -0.68 -1.17 115.11 116.90 1wp1 h GLN 210 Ca 0.28 -0.01 0.28 0.00 0.77 0.00 0.00 58.65 59.97 1wp1 h GLN 210 Cb 0.36 -0.02 -0.16 0.00 0.21 0.00 0.00 27.48 27.87 1wp1 h GLN 210 CO -0.31 0.06 0.27 1.15 -1.93 0.00 0.00 178.83 178.07 1wp1 h THR 211 N 0.10 0.21 -0.29 2.39 2.02 -0.77 0.31 112.91 116.88 1wp1 h THR 211 Ca 0.11 -0.05 -0.13 0.00 0.77 0.00 0.00 66.41 67.11 1wp1 h THR 211 Cb 0.14 0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 66.58 1wp1 h THR 211 CO -0.18 0.03 -0.35 0.00 0.37 0.00 0.00 175.52 175.39 1wp1 h ALA 212 N 1.86 0.85 0.26 6.16 0.00 -1.01 -2.64 119.26 124.73 1wp1 h ALA 212 Ca 0.62 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1wp1 h ALA 212 Cb 1.35 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1wp1 h ALA 212 CO -0.72 0.64 -0.12 0.28 0.00 0.00 0.00 179.25 179.32 1wp1 h VAL 213 N 0.54 0.79 -0.79 0.00 2.07 -0.70 -2.27 116.25 115.90 1wp1 h VAL 213 Ca 0.06 -0.57 -0.04 0.00 0.82 0.00 0.00 66.70 66.96 1wp1 h VAL 213 Cb 0.86 1.10 -0.04 0.00 -1.52 0.00 0.00 31.29 31.69 1wp1 h VAL 213 CO 0.07 0.12 0.32 -0.33 0.02 0.00 0.00 177.57 177.77 1wp1 h GLU 214 N -0.65 1.18 -0.84 1.57 4.39 -1.13 -0.78 114.58 118.31 1wp1 h GLU 214 Ca -0.04 -0.21 0.02 0.00 0.34 0.00 0.00 59.36 59.48 1wp1 h GLU 214 Cb 0.46 -0.19 -0.05 0.00 -0.10 0.00 0.00 28.75 28.87 1wp1 h GLU 214 CO 0.06 0.95 0.55 0.78 -1.16 0.00 0.00 179.01 180.19 1wp1 h GLY 215 N 1.16 1.20 1.17 -3.84 0.00 -1.47 -1.88 103.07 99.41 1wp1 h GLY 215 Ca 0.27 -0.43 -0.07 0.00 0.00 0.00 0.00 47.33 47.09 1wp1 h GLY 215 CO -0.02 0.40 0.10 0.00 0.00 0.00 0.00 176.54 177.02 1wp1 h ALA 216 N 1.33 1.00 -0.92 3.60 0.00 -0.69 -2.23 119.26 121.34 1wp1 h ALA 216 Ca 0.32 -0.26 0.04 0.00 0.00 0.00 0.00 54.91 55.01 1wp1 h ALA 216 Cb -0.07 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 17.42 1wp1 h ALA 216 CO -0.09 0.64 0.59 0.00 0.00 0.00 0.00 179.25 180.39 1wp1 h ARG 217 N 0.96 1.11 -0.32 0.00 3.08 -0.60 -1.19 114.38 117.40 1wp1 h ARG 217 Ca 0.19 -0.07 -0.11 0.00 0.07 0.00 0.00 59.98 60.07 1wp1 h ARG 217 Cb 0.41 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 1wp1 h ARG 217 CO 0.01 0.73 -0.23 0.00 -1.07 0.00 0.00 179.97 179.42 1wp1 h ALA 218 N 1.39 0.46 -0.80 0.04 0.00 -1.00 -2.43 119.26 116.92 1wp1 h ALA 218 Ca 0.37 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1wp1 h ALA 218 Cb 0.03 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 1wp1 h ALA 218 CO -0.13 0.43 0.46 1.15 0.00 0.00 0.00 179.25 181.16 1wp1 h THR 219 N 0.49 1.23 -0.00 0.00 2.02 -1.24 -1.20 112.91 114.21 1wp1 h THR 219 Ca 0.06 -0.54 0.02 0.00 0.77 0.00 0.00 66.41 66.72 1wp1 h THR 219 Cb 0.78 0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 67.30 1wp1 h THR 219 CO 0.06 0.25 -0.10 0.25 0.37 0.00 0.00 175.52 176.35 1wp1 h LEU 220 N 1.11 -0.28 -0.19 2.58 5.85 -0.94 -0.32 115.31 123.13 1wp1 h LEU 220 Ca 0.28 0.04 0.02 0.00 0.84 0.00 0.00 57.88 59.07 1wp1 h LEU 220 Cb -0.01 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.12 1wp1 h LEU 220 CO -0.05 -0.14 0.06 0.00 -0.34 0.00 0.00 178.44 177.97 1wp1 h ALA 221 N 0.81 0.21 -0.09 1.25 0.00 -1.06 -0.66 119.26 119.72 1wp1 h ALA 221 Ca 0.04 0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.01 1wp1 h ALA 221 Cb 0.21 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.95 1wp1 h ALA 221 CO -0.10 -0.37 -0.38 0.37 0.00 0.00 0.00 179.25 178.77 1wp1 h GLN 222 N 0.15 -0.46 0.00 0.00 4.15 -0.83 -1.02 115.11 117.10 1wp1 h GLN 222 Ca 0.08 0.03 -0.06 0.00 0.77 0.00 0.00 58.65 59.47 1wp1 h GLN 222 Cb 0.05 0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.84 1wp1 h GLN 222 CO -0.08 -0.31 -0.28 1.88 -1.93 0.00 0.00 178.83 178.11 1wp1 h TYR 223 N -0.48 0.00 -0.68 3.99 0.99 -0.80 0.10 116.97 120.10 1wp1 h TYR 223 Ca 0.08 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.80 1wp1 h TYR 223 Cb 0.60 0.00 -0.03 0.00 1.00 0.00 0.00 36.73 38.30 1wp1 h TYR 223 CO -0.44 0.28 0.39 1.15 -0.00 0.00 0.00 178.16 179.54 1wp1 h THR 224 N 0.00 1.21 0.05 -2.88 2.02 -0.78 0.12 112.91 112.65 1wp1 h THR 224 Ca -0.00 -0.49 -0.00 0.00 0.77 0.00 0.00 66.41 66.68 1wp1 h THR 224 Cb 0.56 0.30 0.00 0.00 -1.74 0.00 0.00 68.15 67.27 1wp1 h THR 224 CO 0.04 0.22 -0.02 -0.09 0.37 0.00 0.00 175.52 176.03 1wp1 h ARG 225 N 0.92 -0.07 -0.91 6.66 2.43 0.43 -2.99 114.38 120.86 1wp1 h ARG 225 Ca 0.24 0.00 0.06 0.00 -0.81 0.00 0.00 59.98 59.48 1wp1 h ARG 225 Cb 0.01 0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 29.52 1wp1 h ARG 225 CO -0.04 0.23 0.57 -0.07 -1.51 0.00 0.00 179.97 179.15 1wp1 h LEU 226 N -0.36 0.91 -0.47 3.80 3.38 -0.76 -1.27 115.31 120.53 1wp1 h LEU 226 Ca -0.01 0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.01 1wp1 h LEU 226 Cb 0.32 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 1wp1 h LEU 226 CO 0.01 0.58 0.25 0.58 0.09 0.00 0.00 178.44 179.95 1wp1 h VAL 227 N 1.04 0.98 -0.36 1.22 2.07 -0.72 0.09 116.25 120.57 1wp1 h VAL 227 Ca 0.39 -0.17 -0.05 0.00 0.82 0.00 0.00 66.70 67.70 1wp1 h VAL 227 Cb 0.16 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 1wp1 h VAL 227 CO -0.17 0.09 0.04 0.00 0.02 0.00 0.00 177.57 177.55 1wp1 h ALA 228 N 1.25 0.48 -0.19 1.67 0.00 -1.26 -2.21 119.26 119.00 1wp1 h ALA 228 Ca 0.20 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 1wp1 h ALA 228 Cb 0.10 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1wp1 h ALA 228 CO -0.14 0.21 -0.16 1.96 0.00 0.00 0.00 179.25 181.12 1wp1 h GLN 229 N 0.45 0.31 -0.65 0.00 4.20 -0.89 -0.97 115.11 117.55 1wp1 h GLN 229 Ca 0.11 -0.08 0.01 0.00 0.06 0.00 0.00 58.65 58.74 1wp1 h GLN 229 Cb 0.39 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.11 1wp1 h GLN 229 CO 0.01 0.47 0.43 -0.44 -0.67 0.00 0.00 178.83 178.63 1wp1 h ASP 230 N 0.29 0.74 -0.80 1.46 3.32 -0.70 -0.67 116.42 120.06 1wp1 h ASP 230 Ca 0.05 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.07 1wp1 h ASP 230 Cb 0.46 -0.19 -0.04 0.00 0.22 0.00 0.00 39.33 39.79 1wp1 h ASP 230 CO 0.03 0.54 0.45 1.56 -1.72 0.00 0.00 179.24 180.09 1wp1 h GLN 231 N 0.88 1.12 -0.43 3.56 4.20 -0.59 -0.42 115.11 123.43 1wp1 h GLN 231 Ca 0.24 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.81 1wp1 h GLN 231 Cb -0.10 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 27.44 1wp1 h GLN 231 CO -0.05 0.82 0.23 -0.91 -0.67 0.00 0.00 178.83 178.24 1wp1 h ASN 232 N 1.11 0.54 -0.25 1.46 2.35 -0.94 0.83 115.58 120.69 1wp1 h ASN 232 Ca 0.28 -0.10 0.01 0.00 -0.55 0.00 0.00 56.30 55.95 1wp1 h ASN 232 Cb 0.02 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.24 1wp1 h ASN 232 CO -0.05 0.49 0.13 0.00 -1.65 0.00 0.00 177.43 176.35 1wp1 h ALA 233 N 1.08 0.30 -0.62 -0.83 0.00 -0.76 -2.02 119.26 116.41 1wp1 h ALA 233 Ca 0.15 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.07 1wp1 h ALA 233 Cb 0.07 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1wp1 h ALA 233 CO -0.02 -0.27 0.40 1.25 0.00 0.00 0.00 179.25 180.61 1wp1 h LEU 234 N 0.27 0.69 -1.53 0.00 5.85 -0.55 -2.18 115.31 117.87 1wp1 h LEU 234 Ca 0.10 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.78 1wp1 h LEU 234 Cb 0.02 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 40.87 1wp1 h LEU 234 CO -0.06 0.50 -0.02 0.58 -0.34 0.00 0.00 178.44 179.10 1wp1 h VAL 235 N 0.82 1.13 0.38 1.05 2.07 -0.62 -0.05 116.25 121.03 1wp1 h VAL 235 Ca 0.23 -0.53 -0.02 0.00 0.82 0.00 0.00 66.70 67.20 1wp1 h VAL 235 Cb -0.07 1.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.71 1wp1 h VAL 235 CO -0.06 0.18 -0.18 0.25 0.02 0.00 0.00 177.57 177.77 1wp1 h LEU 236 N 0.28 -0.43 -1.33 2.57 5.85 -0.77 -2.37 115.31 119.11 1wp1 h LEU 236 Ca 0.06 -0.14 0.16 0.00 0.84 0.00 0.00 57.88 58.80 1wp1 h LEU 236 Cb 0.22 0.11 -0.07 0.00 0.37 0.00 0.00 40.66 41.29 1wp1 h LEU 236 CO 0.01 -0.03 0.58 -0.07 -0.34 0.00 0.00 178.44 178.58 1wp1 h LEU 237 N -0.91 0.60 -1.66 2.25 3.38 -1.24 0.01 115.31 117.75 1wp1 h LEU 237 Ca -0.05 0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 1wp1 h LEU 237 Cb 0.54 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1wp1 h LEU 237 CO 0.09 0.29 -0.20 -0.07 0.09 0.00 0.00 178.44 178.64 1wp1 h LEU 238 N 0.63 0.00 0.29 1.67 3.38 -0.92 -3.42 115.31 116.94 1wp1 h LEU 238 Ca 0.45 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.30 1wp1 h LEU 238 Cb 0.82 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.52 1wp1 h LEU 238 CO -0.21 0.20 -0.11 0.61 0.09 0.00 0.00 178.44 179.02 1wp1 n GLY 239 N -0.68 0.70 3.85 0.83 0.00 -0.01 -3.47 105.19 106.42 1wp1 n GLY 239 Ca -0.02 -0.11 -0.06 0.00 0.00 0.00 0.00 46.02 45.83 1wp1 n GLY 239 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wp1 s SER 240 N -2.33 0.01 0.88 1.61 1.04 -1.23 -4.71 113.70 108.97 1wp1 s SER 240 Ca 0.00 -0.90 -0.11 0.00 0.48 0.00 0.00 55.95 55.42 1wp1 s SER 240 Cb 0.00 0.66 0.12 0.00 0.10 0.00 0.00 66.02 66.90 1wp1 s SER 240 CO 0.00 -1.32 1.10 -0.83 0.98 0.00 0.00 173.24 173.17 1wp1 s GLY 241 N -3.26 1.65 -0.01 7.32 0.00 -1.26 -4.76 107.32 107.00 1wp1 s GLY 241 Ca 0.19 0.22 -0.30 0.00 0.00 0.00 0.00 44.72 44.83 1wp1 s GLY 241 CO 0.08 0.66 1.50 -0.42 0.00 0.00 0.00 173.10 174.92 1wp1 s ILE 242 N -2.81 3.56 0.86 0.90 1.01 -1.26 -4.97 121.20 118.49 1wp1 s ILE 242 Ca 0.64 0.90 -0.12 0.00 0.00 0.00 0.00 60.65 62.07 1wp1 s ILE 242 Cb -0.19 -3.58 0.10 0.00 0.01 0.00 0.00 42.46 38.80 1wp1 s ILE 242 CO 0.57 -0.02 1.08 -2.65 0.00 0.00 0.00 174.94 173.92 1wp1 n PRO 243 N 5.86 -0.11 0.00 2.79 -0.02 -1.26 -4.92 135.00 137.34 1wp1 n PRO 243 Ca 0.15 0.04 0.12 0.00 -2.02 0.00 0.00 63.50 61.79 1wp1 n PRO 243 Cb 0.43 -2.33 0.23 0.00 -0.02 0.00 0.00 33.50 31.80 1wp1 n PRO 243 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1wp1 n ALA 244 N -3.67 2.91 -2.74 3.55 0.00 -1.26 -4.41 120.51 114.88 1wp1 n ALA 244 Ca 0.12 -0.56 -0.10 0.00 0.00 0.00 0.00 53.44 52.90 1wp1 n ALA 244 Cb 0.51 -0.95 0.03 0.00 0.00 0.00 0.00 19.45 19.04 1wp1 n ALA 244 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1wp1 n ASN 245 N 0.30 1.05 -4.75 0.00 3.02 -1.26 -5.12 115.26 108.51 1wp1 n ASN 245 Ca 0.13 -2.75 -0.38 0.00 -0.03 0.00 0.00 54.58 51.55 1wp1 n ASN 245 Cb 0.46 -0.40 0.04 0.00 -0.61 0.00 0.00 39.78 39.27 1wp1 n ASN 245 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1wp1 s LEU 246 N -3.01 3.82 1.14 3.41 1.43 -1.26 -5.03 118.68 119.18 1wp1 s LEU 246 Ca 0.29 2.73 -0.13 0.00 -1.03 0.00 0.00 54.13 55.99 1wp1 s LEU 246 Cb 0.44 -4.32 0.27 0.00 0.03 0.00 0.00 46.19 42.60 1wp1 s LEU 246 CO 0.01 -1.61 1.04 -2.84 0.23 0.00 0.00 176.35 173.18 1wp1 s PRO 247 N -2.97 -0.74 0.31 1.29 0.02 -1.26 -4.98 135.00 126.67 1wp1 s PRO 247 Ca 0.73 0.72 -0.28 0.00 0.02 0.00 0.00 61.00 62.19 1wp1 s PRO 247 Cb -0.40 -1.58 -0.09 0.00 0.02 0.00 0.00 34.50 32.45 1wp1 s PRO 247 CO 0.46 -3.57 1.07 -0.65 -0.33 0.00 0.00 177.00 173.98 1wp1 s GLN 248 N -4.57 4.51 0.14 5.54 -0.21 -1.26 -4.64 119.66 119.17 1wp1 s GLN 248 Ca 0.68 1.69 -0.02 0.00 0.02 0.00 0.00 55.36 57.73 1wp1 s GLN 248 Cb -0.24 -3.00 0.03 0.00 1.00 0.00 0.00 33.01 30.81 1wp1 s GLN 248 CO 0.63 0.13 0.16 0.41 -2.12 0.00 0.00 175.29 174.51 1wp1 n GLY 249 N 0.96 -1.59 3.27 3.09 0.00 -1.26 -4.35 105.19 105.30 1wp1 n GLY 249 Ca 0.01 -1.60 -0.28 0.00 0.00 0.00 0.00 46.02 44.14 1wp1 n GLY 249 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wp1 s LEU 250 N 0.00 2.08 0.76 0.99 1.43 -1.26 -4.97 118.68 117.71 1wp1 s LEU 250 Ca 0.10 -0.45 -0.11 0.00 -1.03 0.00 0.00 54.13 52.63 1wp1 s LEU 250 Cb -0.00 -1.16 0.05 0.00 0.03 0.00 0.00 46.19 45.10 1wp1 s LEU 250 CO 0.07 0.26 1.08 -0.83 0.23 0.00 0.00 176.35 177.16 1wp1 s GLY 251 N -0.72 1.65 0.49 -3.19 0.00 -1.26 -4.96 107.32 99.33 1wp1 s GLY 251 Ca 0.09 -0.03 0.33 0.00 0.00 0.00 0.00 44.72 45.11 1wp1 s GLY 251 CO -0.00 0.35 1.99 1.41 0.00 0.00 0.00 173.10 176.84 1wp1 h LEU 252 N -0.98 0.00 -0.89 0.66 3.38 -2.01 -2.60 115.31 112.87 1wp1 h LEU 252 Ca -0.46 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.40 1wp1 h LEU 252 Cb 1.24 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.98 1wp1 h LEU 252 CO 0.57 0.00 -0.43 -2.24 0.09 0.00 0.00 178.44 176.43 1wp1 h ASP 253 N 0.00 0.29 -3.56 -0.43 2.03 -2.04 -3.46 116.42 109.24 1wp1 h ASP 253 Ca 0.00 -0.12 -0.42 0.00 -0.73 0.00 0.00 57.03 55.76 1wp1 h ASP 253 Cb 0.28 -0.08 0.19 0.00 -0.83 0.00 0.00 39.33 38.89 1wp1 h ASP 253 CO 0.00 0.69 0.15 -1.10 -1.03 0.00 0.00 179.24 177.95 1wp1 s GLN 254 N -4.11 -0.98 -0.24 4.15 -0.21 -0.98 -5.00 119.66 112.28 1wp1 s GLN 254 Ca -0.05 -0.02 -0.18 0.00 0.02 0.00 0.00 55.36 55.13 1wp1 s GLN 254 Cb 0.13 -1.62 -0.03 0.00 1.00 0.00 0.00 33.01 32.49 1wp1 s GLN 254 CO 0.78 -3.56 0.51 0.99 -2.12 0.00 0.00 175.29 171.89 1wp1 s THR 255 N -3.04 5.08 -0.09 -0.19 2.01 -1.26 -4.93 115.64 113.22 1wp1 s THR 255 Ca 0.70 0.90 0.14 0.00 0.31 0.00 0.00 61.69 63.74 1wp1 s THR 255 Cb -0.10 -3.83 -0.20 0.00 0.01 0.00 0.00 72.50 68.38 1wp1 s THR 255 CO 0.56 0.12 0.16 0.18 -0.69 0.00 0.00 174.62 174.95 1wp1 n LEU 256 N 5.26 0.00 -4.11 4.42 4.77 -1.26 -4.79 117.00 121.29 1wp1 n LEU 256 Ca -0.04 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 55.71 1wp1 n LEU 256 Cb 0.50 0.21 -0.15 0.00 -2.33 0.00 0.00 43.42 41.65 1wp1 n LEU 256 CO 0.41 0.21 -0.48 -0.76 -1.33 0.00 0.00 177.39 175.45 1wp1 s LEU 257 N -4.66 2.03 0.27 2.23 1.43 -1.26 -1.21 118.68 117.51 1wp1 s LEU 257 Ca -0.06 -0.26 -0.29 0.00 -1.03 0.00 0.00 54.13 52.48 1wp1 s LEU 257 Cb 0.06 -0.73 -0.09 0.00 0.03 0.00 0.00 46.19 45.45 1wp1 s LEU 257 CO 0.60 0.17 1.25 -0.89 0.23 0.00 0.00 176.35 177.70 1wp1 s THR 258 N -0.35 3.13 0.03 5.49 2.01 -0.62 -4.97 115.64 120.37 1wp1 s THR 258 Ca 0.05 1.05 -0.30 0.00 0.31 0.00 0.00 61.69 62.80 1wp1 s THR 258 Cb -0.06 -3.67 -0.08 0.00 0.01 0.00 0.00 72.50 68.71 1wp1 s THR 258 CO -0.01 0.22 1.72 -0.70 -0.69 0.00 0.00 174.62 175.16 1wp1 s GLU 259 N -1.06 4.18 -0.09 4.92 2.56 -1.26 -4.99 118.70 122.96 1wp1 s GLU 259 Ca 0.50 2.35 -0.02 0.00 0.00 0.00 0.00 54.97 57.80 1wp1 s GLU 259 Cb -0.36 -3.83 -0.03 0.00 2.00 0.00 0.00 34.13 31.90 1wp1 s GLU 259 CO 0.44 -0.82 0.00 0.08 -0.56 0.00 0.00 175.26 174.41 1wp1 s VAL 260 N 3.44 4.30 0.27 3.70 1.01 -1.26 -5.10 120.40 126.76 1wp1 s VAL 260 Ca 0.77 -0.25 -0.13 0.00 0.00 0.00 0.00 61.98 62.37 1wp1 s VAL 260 Cb -0.38 -2.81 -0.08 0.00 0.00 0.00 0.00 36.38 33.10 1wp1 s VAL 260 CO 0.33 0.60 0.65 -2.16 0.00 0.00 0.00 175.10 174.52 1wp1 s PRO 261 N -0.84 3.93 0.20 2.72 0.04 -1.26 -4.98 135.00 134.81 1wp1 s PRO 261 Ca 0.13 0.50 -0.11 0.00 0.04 0.00 0.00 61.00 61.56 1wp1 s PRO 261 Cb -0.11 -2.57 0.24 0.00 0.04 0.00 0.00 34.50 32.10 1wp1 s PRO 261 CO 0.02 0.25 1.71 0.00 0.04 0.00 0.00 177.00 179.02 1wp1 h ALA 262 N 2.50 0.63 -0.57 8.56 0.00 -1.95 -3.38 119.26 125.06 1wp1 h ALA 262 Ca -0.47 0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1wp1 h ALA 262 Cb 1.17 0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1wp1 h ALA 262 CO 0.67 -0.31 0.00 0.41 0.00 0.00 0.00 179.25 180.02 1wp1 n GLY 263 N -1.30 -1.25 3.58 0.00 0.00 -1.25 -4.85 105.19 100.12 1wp1 n GLY 263 Ca 0.07 -1.22 -0.31 0.00 0.00 0.00 0.00 46.02 44.56 1wp1 n GLY 263 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wp1 s LEU 264 N 0.00 3.10 0.27 0.99 1.43 -1.26 -4.43 118.68 118.77 1wp1 s LEU 264 Ca 0.00 -0.26 0.03 0.00 -1.03 0.00 0.00 54.13 52.87 1wp1 s LEU 264 Cb 0.00 -1.83 0.69 0.00 0.03 0.00 0.00 46.19 45.08 1wp1 s LEU 264 CO 0.00 0.23 1.35 -2.65 0.23 0.00 0.00 176.35 175.51 1wp1 n PRO 265 N 1.18 -0.07 0.20 1.29 -0.02 -1.26 -0.36 135.00 135.96 1wp1 n PRO 265 Ca -0.14 1.28 0.18 0.00 -2.02 0.00 0.00 63.50 62.80 1wp1 n PRO 265 Cb 0.52 -2.05 0.83 0.00 -0.02 0.00 0.00 33.50 32.78 1wp1 n PRO 265 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1wp1 h SER 266 N 0.00 0.00 0.42 2.55 4.64 -1.91 -1.54 113.55 117.71 1wp1 h SER 266 Ca 0.53 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.83 1wp1 h SER 266 Cb 1.13 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.21 1wp1 h SER 266 CO -0.80 0.00 -0.10 0.44 -0.87 0.00 0.00 176.83 175.50 1wp1 h ASP 267 N 0.00 0.00 -0.42 4.97 3.32 -1.11 -2.90 116.42 120.28 1wp1 h ASP 267 Ca 0.10 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.12 1wp1 h ASP 267 Cb 0.67 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.20 1wp1 h ASP 267 CO -0.00 0.10 0.19 -0.07 -1.72 0.00 0.00 179.24 177.74 1wp1 h LEU 268 N 0.00 0.60 -1.10 1.55 3.38 -1.44 -0.92 115.31 117.38 1wp1 h LEU 268 Ca -0.00 -0.06 -0.07 0.00 0.09 0.00 0.00 57.88 57.84 1wp1 h LEU 268 Cb 0.34 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1wp1 h LEU 268 CO 0.01 0.54 -0.31 -0.07 0.09 0.00 0.00 178.44 178.70 1wp1 h LEU 269 N 0.66 0.00 0.00 1.67 3.38 -1.71 -0.74 115.31 118.57 1wp1 h LEU 269 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1wp1 h LEU 269 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1wp1 h LEU 269 CO -0.02 0.31 -1.08 0.00 0.09 0.00 0.00 178.44 177.75 1wp1 n GLN 270 N -3.55 0.18 0.00 1.13 1.13 -0.97 -4.74 117.38 110.57 1wp1 n GLN 270 Ca -0.00 -0.03 0.00 0.00 -1.94 0.00 0.00 57.00 55.03 1wp1 n GLN 270 Cb 0.46 -1.53 0.00 0.00 0.11 0.00 0.00 30.24 29.27 1wp1 n GLN 270 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1wp1 n ARG 271 N -1.75 1.59 -2.55 -1.09 5.12 -0.39 -5.01 116.66 112.58 1wp1 n ARG 271 Ca 0.02 0.00 -0.43 0.00 -1.93 0.00 0.00 57.85 55.52 1wp1 n ARG 271 Cb 0.40 -0.67 -0.02 0.00 -1.16 0.00 0.00 32.46 31.01 1wp1 n ARG 271 CO 0.00 0.00 0.00 0.50 -1.93 0.00 0.00 177.63 176.20 1wp1 s ARG 272 N -1.27 4.29 0.24 5.56 3.52 -0.31 -4.69 118.95 126.28 1wp1 s ARG 272 Ca 0.00 1.52 -0.07 0.00 -0.13 0.00 0.00 55.73 57.05 1wp1 s ARG 272 Cb 0.00 -3.65 0.28 0.00 -1.56 0.00 0.00 34.95 30.02 1wp1 s ARG 272 CO 0.00 -0.57 1.87 -1.35 -0.81 0.00 0.00 175.30 174.44 1wp1 h PRO 273 N 7.63 1.02 0.00 5.12 0.11 -1.88 -2.44 132.00 141.57 1wp1 h PRO 273 Ca -0.26 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1wp1 h PRO 273 Cb 1.11 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 31.99 1wp1 h PRO 273 CO 0.94 0.68 0.00 -0.40 -0.21 0.00 0.00 178.00 179.01 1wp1 n ASP 274 N -4.56 0.58 0.12 -2.05 5.75 -1.26 0.70 116.55 115.83 1wp1 n ASP 274 Ca 0.11 0.62 -0.24 0.00 -0.01 0.00 0.00 54.79 55.27 1wp1 n ASP 274 Cb 0.11 -0.75 -0.16 0.00 -1.03 0.00 0.00 41.12 39.29 1wp1 n ASP 274 CO 0.00 0.00 0.00 0.40 -0.11 0.00 0.00 177.20 177.49 1wp1 h ILE 275 N 0.00 1.27 -0.46 2.12 2.04 -1.77 -2.32 117.51 118.39 1wp1 h ILE 275 Ca 0.00 -2.65 -0.04 0.00 1.00 0.00 0.00 64.86 63.17 1wp1 h ILE 275 Cb 0.44 3.03 -0.02 0.00 -0.74 0.00 0.00 36.82 39.54 1wp1 h ILE 275 CO 0.00 0.80 0.13 -0.07 0.00 0.00 0.00 178.15 179.01 1wp1 h LEU 276 N 0.06 0.69 -0.37 1.44 3.38 -1.02 -1.17 115.31 118.32 1wp1 h LEU 276 Ca -0.25 -0.22 0.06 0.00 0.09 0.00 0.00 57.88 57.55 1wp1 h LEU 276 Cb 2.08 -0.18 -0.08 0.00 0.09 0.00 0.00 40.66 42.56 1wp1 h LEU 276 CO 0.24 0.73 -0.49 -0.08 0.09 0.00 0.00 178.44 178.94 1wp1 h GLU 277 N 0.62 -0.37 -0.96 1.13 4.81 0.21 0.34 114.58 120.35 1wp1 h GLU 277 Ca 0.15 0.03 0.06 0.00 -0.13 0.00 0.00 59.36 59.46 1wp1 h GLU 277 Cb 0.30 0.08 -0.06 0.00 0.63 0.00 0.00 28.75 29.70 1wp1 h GLU 277 CO -0.00 -0.25 0.63 0.00 -0.73 0.00 0.00 179.01 178.66 1wp1 h ALA 278 N 0.17 1.42 -0.45 2.92 0.00 -1.16 -1.88 119.26 120.27 1wp1 h ALA 278 Ca 0.10 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.99 1wp1 h ALA 278 Cb 0.60 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1wp1 h ALA 278 CO -0.57 0.45 0.29 1.49 0.00 0.00 0.00 179.25 180.91 1wp1 h GLU 279 N 1.15 0.57 -0.34 0.00 4.81 -0.25 -0.86 114.58 119.65 1wp1 h GLU 279 Ca 0.41 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.61 1wp1 h GLU 279 Cb 0.12 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 1wp1 h GLU 279 CO -0.15 0.37 0.22 0.45 -0.73 0.00 0.00 179.01 179.18 1wp1 h HIS 280 N 0.58 0.42 -0.97 0.92 3.86 -0.21 0.10 115.15 119.85 1wp1 h HIS 280 Ca 0.17 0.01 0.11 0.00 -1.16 0.00 0.00 60.37 59.50 1wp1 h HIS 280 Cb -0.03 -0.14 -0.08 0.00 1.06 0.00 0.00 27.41 28.22 1wp1 h HIS 280 CO -0.06 0.26 0.60 1.96 0.86 0.00 0.00 177.93 181.55 1wp1 h GLN 281 N 0.45 0.94 -0.27 2.45 1.08 -1.13 0.29 115.11 118.92 1wp1 h GLN 281 Ca 0.13 -0.06 0.00 0.00 -1.45 0.00 0.00 58.65 57.27 1wp1 h GLN 281 Cb -0.04 -0.21 -0.01 0.00 -0.05 0.00 0.00 27.48 27.16 1wp1 h GLN 281 CO -0.03 0.63 0.17 1.25 -0.95 0.00 0.00 178.83 179.89 1wp1 h LEU 282 N 0.97 0.31 -1.77 1.46 5.85 -0.52 0.26 115.31 121.87 1wp1 h LEU 282 Ca 0.47 -0.02 -0.03 0.00 0.84 0.00 0.00 57.88 59.13 1wp1 h LEU 282 Cb 0.42 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.37 1wp1 h LEU 282 CO -0.25 0.24 -0.16 0.24 -0.34 0.00 0.00 178.44 178.17 1wp1 h MET 283 N 0.36 0.00 -0.01 1.25 2.86 0.00 0.12 114.93 119.51 1wp1 h MET 283 Ca 0.10 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.68 1wp1 h MET 283 Cb -0.03 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.64 1wp1 h MET 283 CO -0.02 0.16 -0.22 0.00 1.06 0.00 0.00 176.91 177.89 1wp1 h ALA 284 N 1.84 0.04 -0.82 6.32 0.00 -0.05 -1.47 119.26 125.11 1wp1 h ALA 284 Ca -0.00 -0.45 0.16 0.00 0.00 0.00 0.00 54.91 54.62 1wp1 h ALA 284 Cb 0.36 0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.06 1wp1 h ALA 284 CO 0.02 0.07 0.37 0.00 0.00 0.00 0.00 179.25 179.71 1wp1 h ALA 285 N 0.29 1.22 -0.44 0.00 0.00 0.08 -1.01 119.26 119.40 1wp1 h ALA 285 Ca -0.03 0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 1wp1 h ALA 285 Cb 0.96 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 1wp1 h ALA 285 CO 0.04 -0.19 0.00 -0.97 0.00 0.00 0.00 179.25 178.13 1wp1 h ASN 286 N 0.50 0.76 -0.32 0.00 -1.24 -0.74 -2.07 115.58 112.47 1wp1 h ASN 286 Ca 0.46 -0.31 -0.02 0.00 0.71 0.00 0.00 56.30 57.15 1wp1 h ASN 286 Cb 0.73 -0.20 -0.02 0.00 0.73 0.00 0.00 38.32 39.56 1wp1 h ASN 286 CO -0.42 0.88 0.16 0.00 -1.29 0.00 0.00 177.43 176.76 1wp1 h ALA 287 N 0.91 1.59 0.00 1.57 0.00 -0.30 -2.20 119.26 120.83 1wp1 h ALA 287 Ca 0.12 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1wp1 h ALA 287 Cb 0.49 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1wp1 h ALA 287 CO 0.02 0.33 0.00 0.66 0.00 0.00 0.00 179.25 180.26 1wp1 h SER 288 N 0.51 0.00 -0.16 0.00 4.64 -0.49 -2.54 113.55 115.52 1wp1 h SER 288 Ca 0.13 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.44 1wp1 h SER 288 Cb 0.09 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.18 1wp1 h SER 288 CO -0.01 0.00 0.05 0.40 -0.87 0.00 0.00 176.83 176.40 1wp1 h ILE 289 N 0.00 1.18 -0.87 0.95 2.04 -1.30 -2.77 117.51 116.74 1wp1 h ILE 289 Ca 0.00 -0.55 0.10 0.00 1.00 0.00 0.00 64.86 65.41 1wp1 h ILE 289 Cb 0.33 1.25 -0.12 0.00 -0.74 0.00 0.00 36.82 37.54 1wp1 h ILE 289 CO 0.00 0.17 -0.44 0.61 0.00 0.00 0.00 178.15 178.49 1wp1 n GLY 290 N -0.60 -2.07 0.30 5.37 0.00 -0.96 -1.00 105.19 106.23 1wp1 n GLY 290 Ca -0.05 1.01 -0.08 0.00 0.00 0.00 0.00 46.02 46.91 1wp1 n GLY 290 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wp1 h ALA 291 N 0.74 -0.15 -0.11 4.61 0.00 -1.55 -0.69 119.26 122.12 1wp1 h ALA 291 Ca 0.21 0.09 -0.08 0.00 0.00 0.00 0.00 54.91 55.13 1wp1 h ALA 291 Cb 0.42 0.60 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 1wp1 h ALA 291 CO -0.84 -0.69 -0.28 0.00 0.00 0.00 0.00 179.25 177.44 1wp1 h ALA 292 N 0.79 1.33 -0.50 0.00 0.00 -1.01 -2.69 119.26 117.18 1wp1 h ALA 292 Ca 0.16 -0.31 -0.09 0.00 0.00 0.00 0.00 54.91 54.67 1wp1 h ALA 292 Cb 0.50 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1wp1 h ALA 292 CO -0.46 0.46 -0.05 0.00 0.00 0.00 0.00 179.25 179.20 1wp1 h ARG 293 N 0.17 0.91 0.00 0.00 3.08 -0.23 -3.09 114.38 115.22 1wp1 h ARG 293 Ca 0.03 -0.32 -0.01 0.00 0.07 0.00 0.00 59.98 59.75 1wp1 h ARG 293 Cb 0.59 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.57 1wp1 h ARG 293 CO 0.04 0.96 -0.06 0.00 -1.07 0.00 0.00 179.97 179.84 1wp1 h ALA 294 N 0.92 1.47 0.00 0.04 0.00 -0.81 -2.77 119.26 118.10 1wp1 h ALA 294 Ca 0.13 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1wp1 h ALA 294 Cb 0.59 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1wp1 h ALA 294 CO 0.04 0.08 0.00 0.00 0.00 0.00 0.00 179.25 179.36 1wp1 h ALA 295 N 1.94 1.00 0.01 0.00 0.00 -1.49 -2.25 119.26 118.46 1wp1 h ALA 295 Ca -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1wp1 h ALA 295 Cb 0.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1wp1 h ALA 295 CO 0.01 0.00 -0.00 0.74 0.00 0.00 0.00 179.25 180.00 1wp1 h PHE 296 N 0.00 -0.01 -4.24 0.00 -1.00 -1.68 -3.44 116.94 106.57 1wp1 h PHE 296 Ca 0.00 -0.00 -0.52 0.00 2.81 0.00 0.00 57.97 60.26 1wp1 h PHE 296 Cb 0.10 0.00 0.17 0.00 3.61 0.00 0.00 35.95 39.82 1wp1 h PHE 296 CO 0.00 0.84 0.32 -0.06 -1.61 0.00 0.00 178.31 177.79 1wp1 s PHE 297 N -2.63 1.99 0.89 -0.55 0.40 -0.85 -4.22 117.98 113.02 1wp1 s PHE 297 Ca -0.17 1.67 -0.11 0.00 -0.60 0.00 0.00 56.93 57.71 1wp1 s PHE 297 Cb -0.02 -3.34 0.11 0.00 0.51 0.00 0.00 43.02 40.28 1wp1 s PHE 297 CO 0.65 -2.52 1.05 -2.30 0.70 0.00 0.00 175.22 172.80 1wp1 n PRO 298 N -3.41 -0.26 -3.54 0.24 -0.02 -1.26 -4.76 135.00 121.99 1wp1 n PRO 298 Ca 0.12 -0.01 -0.29 0.00 -2.02 0.00 0.00 63.50 61.30 1wp1 n PRO 298 Cb 0.51 -2.31 -0.13 0.00 -0.02 0.00 0.00 33.50 31.56 1wp1 n PRO 298 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1wp1 s SER 299 N -2.39 3.28 0.50 2.55 0.15 0.01 -4.71 113.70 113.10 1wp1 s SER 299 Ca 0.67 -2.05 -0.23 0.00 0.70 0.00 0.00 55.95 55.04 1wp1 s SER 299 Cb -0.25 -0.53 -0.06 0.00 -1.71 0.00 0.00 66.02 63.47 1wp1 s SER 299 CO 0.57 -0.34 1.37 -0.63 1.20 0.00 0.00 173.24 175.42 1wp1 s ILE 300 N 1.19 2.13 0.05 6.45 1.01 -1.26 -2.34 121.20 128.43 1wp1 s ILE 300 Ca 0.16 0.11 -0.11 0.00 0.00 0.00 0.00 60.65 60.80 1wp1 s ILE 300 Cb -0.21 -3.06 0.01 0.00 0.01 0.00 0.00 42.46 39.21 1wp1 s ILE 300 CO -0.08 0.01 0.25 -0.55 0.00 0.00 0.00 174.94 174.56 1wp1 s SER 301 N -0.80 -0.04 -0.21 3.58 0.15 -1.25 -2.84 113.70 112.29 1wp1 s SER 301 Ca 0.67 -0.31 -0.09 0.00 0.70 0.00 0.00 55.95 56.92 1wp1 s SER 301 Cb -0.41 0.33 0.09 0.00 -1.71 0.00 0.00 66.02 64.31 1wp1 s SER 301 CO 0.50 -0.60 0.48 -0.22 1.20 0.00 0.00 173.24 174.60 1wp1 s LEU 302 N -2.15 -0.59 -0.12 3.45 2.96 -0.14 -0.99 118.68 121.10 1wp1 s LEU 302 Ca -0.04 1.10 -0.01 0.00 -0.22 0.00 0.00 54.13 54.96 1wp1 s LEU 302 Cb -0.00 1.60 -0.03 0.00 0.50 0.00 0.00 46.19 48.26 1wp1 s LEU 302 CO -0.04 -0.22 -0.07 -0.89 -1.32 0.00 0.00 176.35 173.81 1wp1 s THR 303 N 2.19 3.64 0.01 3.68 2.01 -1.06 -1.52 115.64 124.58 1wp1 s THR 303 Ca -0.06 -0.47 0.01 0.00 0.31 0.00 0.00 61.69 61.48 1wp1 s THR 303 Cb -0.10 -2.54 -0.01 0.00 0.01 0.00 0.00 72.50 69.86 1wp1 s THR 303 CO -0.14 0.54 -0.02 0.00 -0.69 0.00 0.00 174.62 174.30 1wp1 s ALA 304 N -0.09 0.16 0.15 7.40 0.00 -0.85 -1.57 121.76 126.98 1wp1 s ALA 304 Ca 0.01 -0.25 -0.01 0.00 0.00 0.00 0.00 51.96 51.71 1wp1 s ALA 304 Cb -0.13 0.02 -0.04 0.00 0.00 0.00 0.00 23.12 22.96 1wp1 s ALA 304 CO 0.03 -0.02 0.07 -0.80 0.00 0.00 0.00 175.76 175.04 1wp1 s ASN 305 N -0.52 0.41 -0.29 0.00 -0.87 0.93 -2.25 114.94 112.35 1wp1 s ASN 305 Ca -0.04 -1.25 -0.21 0.00 -1.57 0.00 0.00 52.86 49.79 1wp1 s ASN 305 Cb -0.04 0.29 0.15 0.00 -0.02 0.00 0.00 41.25 41.63 1wp1 s ASN 305 CO -0.00 -0.73 1.08 0.00 -2.57 0.00 0.00 177.10 174.88 1wp1 s ALA 306 N -4.02 -2.16 0.00 0.60 0.00 -1.11 -3.82 121.76 111.25 1wp1 s ALA 306 Ca 0.28 1.97 0.00 0.00 0.00 0.00 0.00 51.96 54.21 1wp1 s ALA 306 Cb 0.07 -1.62 0.00 0.00 0.00 0.00 0.00 23.12 21.57 1wp1 s ALA 306 CO 0.05 -0.26 0.00 0.41 0.00 0.00 0.00 175.76 175.95 1wp1 n GLY 307 N 2.71 -0.66 2.81 0.00 0.00 0.20 -0.02 105.19 110.23 1wp1 n GLY 307 Ca -0.15 -0.52 -0.25 0.00 0.00 0.00 0.00 46.02 45.11 1wp1 n GLY 307 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1wp1 s THR 308 N -3.70 0.60 0.27 2.61 -4.23 -0.79 -1.03 115.64 109.37 1wp1 s THR 308 Ca 0.00 -0.10 0.08 0.00 -1.18 0.00 0.00 61.69 60.49 1wp1 s THR 308 Cb 0.00 -0.76 -0.04 0.00 1.34 0.00 0.00 72.50 73.04 1wp1 s THR 308 CO 0.00 0.23 0.16 -0.04 -0.54 0.00 0.00 174.62 174.43 1wp1 s MET 309 N 1.87 2.75 0.20 3.99 -1.94 -0.84 -3.25 119.30 122.07 1wp1 s MET 309 Ca 0.04 -1.18 -0.23 0.00 -1.71 0.00 0.00 55.69 52.61 1wp1 s MET 309 Cb -0.13 -2.45 0.05 0.00 2.01 0.00 0.00 34.83 34.30 1wp1 s MET 309 CO -0.06 0.35 0.77 0.45 -0.01 0.00 0.00 175.02 176.51 1wp1 s SER 310 N -3.82 -0.31 0.11 3.03 0.15 -0.96 -4.74 113.70 107.14 1wp1 s SER 310 Ca 0.34 -0.38 0.09 0.00 0.70 0.00 0.00 55.95 56.70 1wp1 s SER 310 Cb -0.07 0.61 -0.18 0.00 -1.71 0.00 0.00 66.02 64.67 1wp1 s SER 310 CO 0.24 -1.10 1.17 -0.09 1.20 0.00 0.00 173.24 174.66 1wp1 h ARG 311 N 2.00 0.00 -5.37 5.44 9.65 -1.88 -2.49 114.38 121.73 1wp1 h ARG 311 Ca -0.24 0.00 -0.41 0.00 -1.10 0.00 0.00 59.98 58.24 1wp1 h ARG 311 Cb 1.26 0.00 -0.18 0.00 -1.39 0.00 0.00 29.97 29.65 1wp1 h ARG 311 CO 0.27 0.83 -0.76 -0.65 2.80 0.00 0.00 179.97 182.47 1wp1 s GLN 312 N -2.73 0.99 0.31 0.20 -0.21 -1.26 -4.28 119.66 112.69 1wp1 s GLN 312 Ca 0.00 -1.21 0.05 0.00 0.02 0.00 0.00 55.36 54.22 1wp1 s GLN 312 Cb 0.09 -0.86 0.68 0.00 1.00 0.00 0.00 33.01 33.92 1wp1 s GLN 312 CO 0.81 0.16 1.83 1.25 -2.12 0.00 0.00 175.29 177.23 1wp1 h LEU 313 N 3.57 0.81 -1.69 2.90 5.85 -1.95 -2.50 115.31 122.30 1wp1 h LEU 313 Ca -0.40 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.38 1wp1 h LEU 313 Cb 1.19 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.12 1wp1 h LEU 313 CO 0.50 0.39 0.00 0.77 -0.34 0.00 0.00 178.44 179.76 1wp1 h SER 314 N 0.85 0.00 -0.27 1.25 4.64 -1.99 -2.54 113.55 115.49 1wp1 h SER 314 Ca 0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.83 1wp1 h SER 314 Cb 0.67 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.76 1wp1 h SER 314 CO -0.28 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.29 1wp1 n GLY 315 N -1.22 1.40 0.36 -0.77 0.00 -0.94 -4.73 105.19 99.28 1wp1 n GLY 315 Ca -0.02 -0.60 -0.13 0.00 0.00 0.00 0.00 46.02 45.27 1wp1 n GLY 315 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1wp1 h LEU 316 N 3.67 -0.88 -5.13 0.99 3.38 -1.60 -3.12 115.31 112.61 1wp1 h LEU 316 Ca 0.00 0.05 -0.76 0.00 0.09 0.00 0.00 57.88 57.27 1wp1 h LEU 316 Cb 0.85 0.26 -0.26 0.00 0.09 0.00 0.00 40.66 41.60 1wp1 h LEU 316 CO 0.00 -0.51 1.04 0.49 0.09 0.00 0.00 178.44 179.55 1wp1 n PHE 317 N -4.50 2.87 -4.30 1.13 0.99 -1.26 -4.69 117.46 107.69 1wp1 n PHE 317 Ca -0.10 -2.33 -0.30 0.00 -0.00 0.00 0.00 57.45 54.72 1wp1 n PHE 317 Cb 0.34 -1.21 -0.10 0.00 -1.00 0.00 0.00 39.48 37.51 1wp1 n PHE 317 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.76 177.10 1wp1 s ASP 318 N -1.01 4.45 0.44 4.37 -1.08 -1.18 -5.09 116.67 117.56 1wp1 s ASP 318 Ca 0.51 -0.32 -0.22 0.00 -0.52 0.00 0.00 52.55 52.00 1wp1 s ASP 318 Cb 0.40 -0.90 -0.12 0.00 -1.46 0.00 0.00 42.92 40.85 1wp1 s ASP 318 CO -0.37 0.21 0.63 0.00 0.52 0.00 0.00 175.17 176.16 1wp1 n ALA 319 N 0.93 -1.13 -2.01 3.66 0.00 -1.26 -2.62 120.51 118.09 1wp1 n ALA 319 Ca -0.14 0.15 -0.16 0.00 0.00 0.00 0.00 53.44 53.29 1wp1 n ALA 319 Cb 0.52 -1.84 -0.03 0.00 0.00 0.00 0.00 19.45 18.10 1wp1 n ALA 319 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wp1 n GLY 320 N 1.67 0.39 0.97 0.00 0.00 -1.26 -4.77 105.19 102.19 1wp1 n GLY 320 Ca 0.11 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.24 1wp1 n GLY 320 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1wp1 n SER 321 N -1.44 2.91 -4.47 1.61 3.41 -1.08 -5.00 113.62 109.56 1wp1 n SER 321 Ca -0.18 -1.92 -0.45 0.00 -0.26 0.00 0.00 58.87 56.06 1wp1 n SER 321 Cb 0.60 -0.21 -0.02 0.00 -0.26 0.00 0.00 64.21 64.32 1wp1 n SER 321 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wp1 n GLY 322 N 1.39 -1.21 3.09 5.00 0.00 -1.26 -2.00 105.19 110.20 1wp1 n GLY 322 Ca 0.18 0.26 -0.10 0.00 0.00 0.00 0.00 46.02 46.37 1wp1 n GLY 322 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wp1 s SER 323 N -0.83 0.16 0.25 1.61 1.04 -0.19 -4.70 113.70 111.04 1wp1 s SER 323 Ca 0.62 -0.46 -0.20 0.00 0.48 0.00 0.00 55.95 56.39 1wp1 s SER 323 Cb -0.77 0.20 0.02 0.00 0.10 0.00 0.00 66.02 65.57 1wp1 s SER 323 CO 0.58 -0.44 0.65 -1.66 0.98 0.00 0.00 173.24 173.35 1wp1 s TRP 324 N -2.15 -0.16 -0.07 5.02 1.48 -1.26 -0.63 118.94 121.17 1wp1 s TRP 324 Ca -0.09 -0.24 -0.09 0.00 -1.06 0.00 0.00 56.10 54.63 1wp1 s TRP 324 Cb -0.04 0.58 0.02 0.00 -1.16 0.00 0.00 33.47 32.87 1wp1 s TRP 324 CO -0.03 -1.11 0.23 -1.17 -4.06 0.00 0.00 176.95 170.81 1wp1 s LEU 325 N -2.90 1.14 -0.10 -4.66 2.96 -1.25 -4.94 118.68 108.94 1wp1 s LEU 325 Ca 0.11 0.34 -0.04 0.00 -0.22 0.00 0.00 54.13 54.32 1wp1 s LEU 325 Cb -0.04 0.83 0.05 0.00 0.50 0.00 0.00 46.19 47.53 1wp1 s LEU 325 CO 0.03 -0.16 0.20 0.12 -1.32 0.00 0.00 176.35 175.22 1wp1 s PHE 326 N -0.23 -0.26 -0.41 5.38 5.36 -1.26 -0.05 117.98 126.51 1wp1 s PHE 326 Ca -0.03 0.71 0.05 0.00 -0.96 0.00 0.00 56.93 56.70 1wp1 s PHE 326 Cb -0.03 -0.14 0.17 0.00 -0.34 0.00 0.00 43.02 42.68 1wp1 s PHE 326 CO 0.01 -0.28 0.49 -1.14 -1.46 0.00 0.00 175.22 172.84 1wp1 s GLN 327 N 2.06 0.79 0.82 10.12 0.74 -0.61 -5.04 119.66 128.55 1wp1 s GLN 327 Ca -0.00 -0.91 -0.11 0.00 0.05 0.00 0.00 55.36 54.38 1wp1 s GLN 327 Cb -0.12 -0.50 0.09 0.00 1.10 0.00 0.00 33.01 33.57 1wp1 s GLN 327 CO -0.07 -1.24 1.09 -1.25 -0.55 0.00 0.00 175.29 173.27 1wp1 s PRO 328 N 1.26 1.86 -0.44 1.67 0.04 -1.26 -2.57 135.00 135.57 1wp1 s PRO 328 Ca 0.21 0.96 0.07 0.00 0.04 0.00 0.00 61.00 62.28 1wp1 s PRO 328 Cb -0.08 -1.87 0.31 0.00 0.04 0.00 0.00 34.50 32.90 1wp1 s PRO 328 CO -0.06 -1.86 0.98 0.43 0.04 0.00 0.00 177.00 176.53 1wp1 n SER 329 N -3.64 -1.64 -4.71 6.66 7.64 -0.17 -4.93 113.62 112.83 1wp1 n SER 329 Ca 0.08 -3.46 -0.43 0.00 1.01 0.00 0.00 58.87 56.07 1wp1 n SER 329 Cb 0.54 1.27 -0.03 0.00 -1.01 0.00 0.00 64.21 64.98 1wp1 n SER 329 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1wp1 n ILE 330 N 0.57 0.24 -3.78 0.44 3.06 -1.26 -3.83 119.36 114.79 1wp1 n ILE 330 Ca 0.11 -0.06 -0.25 0.00 -2.50 0.00 0.00 62.75 60.06 1wp1 n ILE 330 Cb 0.67 -1.85 -0.17 0.00 0.54 0.00 0.00 39.64 38.83 1wp1 n ILE 330 CO 0.00 0.00 0.00 0.21 -2.50 0.00 0.00 176.55 174.26 1wp1 s ASN 331 N 0.94 2.01 -0.33 9.51 3.84 -0.99 -4.91 114.94 125.01 1wp1 s ASN 331 Ca 0.74 -0.30 -0.05 0.00 0.21 0.00 0.00 52.86 53.45 1wp1 s ASN 331 Cb -0.55 -0.54 0.05 0.00 -0.55 0.00 0.00 41.25 39.66 1wp1 s ASN 331 CO 0.37 -0.21 0.08 -0.22 -2.79 0.00 0.00 177.10 174.33 1wp1 s LEU 332 N 1.90 4.28 0.38 3.21 2.96 -1.26 -0.81 118.68 129.34 1wp1 s LEU 332 Ca 0.03 -1.27 -0.25 0.00 -0.22 0.00 0.00 54.13 52.42 1wp1 s LEU 332 Cb -0.14 -1.82 -0.12 0.00 0.50 0.00 0.00 46.19 44.62 1wp1 s LEU 332 CO -0.06 -0.33 0.94 -2.65 -1.32 0.00 0.00 176.35 172.93 1wp1 n PRO 333 N 4.73 1.23 0.00 0.98 -0.02 -1.26 -4.94 135.00 135.72 1wp1 n PRO 333 Ca -0.12 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 61.80 1wp1 n PRO 333 Cb 0.44 -1.90 0.00 0.00 -0.02 0.00 0.00 33.50 32.02 1wp1 n PRO 333 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1wp1 n ILE 334 N -0.32 0.00 -3.89 4.25 5.41 -1.26 -5.00 119.36 118.55 1wp1 n ILE 334 Ca 0.10 0.00 -0.30 0.00 1.00 0.00 0.00 62.75 63.55 1wp1 n ILE 334 Cb 0.37 -0.77 -0.15 0.00 -0.71 0.00 0.00 39.64 38.37 1wp1 n ILE 334 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 176.55 176.67 1wp1 s PHE 335 N -1.84 2.38 0.25 1.39 5.36 -1.26 -5.08 117.98 119.18 1wp1 s PHE 335 Ca 0.00 -1.90 0.06 0.00 -0.96 0.00 0.00 56.93 54.13 1wp1 s PHE 335 Cb 0.00 -1.80 -0.03 0.00 -0.34 0.00 0.00 43.02 40.85 1wp1 s PHE 335 CO 0.00 -0.82 0.30 0.99 -1.46 0.00 0.00 175.22 174.24 1wp1 s THR 336 N 1.39 4.84 -0.26 0.12 2.01 -1.26 -4.99 115.64 117.49 1wp1 s THR 336 Ca 0.01 -1.15 -0.01 0.00 0.31 0.00 0.00 61.69 60.85 1wp1 s THR 336 Cb -0.18 -3.64 0.19 0.00 0.01 0.00 0.00 72.50 68.87 1wp1 s THR 336 CO -0.11 -0.32 1.96 0.00 -0.69 0.00 0.00 174.62 175.46 1wp1 n ALA 337 N -1.34 4.84 -0.07 7.40 0.00 -1.26 -4.65 120.51 125.42 1wp1 n ALA 337 Ca -0.08 -1.38 0.00 0.00 0.00 0.00 0.00 53.44 51.98 1wp1 n ALA 337 Cb 0.57 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.72 1wp1 n ALA 337 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wp1 n GLY 338 N 0.46 0.55 0.26 0.00 0.00 -1.26 -4.98 105.19 100.22 1wp1 n GLY 338 Ca 0.25 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.23 1wp1 n GLY 338 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1wp1 h SER 339 N 0.00 -0.73 -0.34 1.61 0.87 -1.99 0.16 113.55 113.13 1wp1 h SER 339 Ca 0.00 0.18 -0.08 0.00 -1.23 0.00 0.00 61.79 60.65 1wp1 h SER 339 Cb 0.00 0.41 -0.02 0.00 -0.44 0.00 0.00 62.40 62.35 1wp1 h SER 339 CO 0.00 -0.24 -0.07 -0.07 -0.53 0.00 0.00 176.83 175.92 1wp1 h LEU 340 N -0.09 0.74 -0.77 2.23 3.38 -1.93 0.44 115.31 119.30 1wp1 h LEU 340 Ca 0.24 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 1wp1 h LEU 340 Cb 0.46 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 1wp1 h LEU 340 CO -0.57 0.85 0.21 -0.09 0.09 0.00 0.00 178.44 178.94 1wp1 h ARG 341 N 0.70 1.14 -0.34 1.13 2.43 -1.76 -1.95 114.38 115.73 1wp1 h ARG 341 Ca 0.13 -0.25 -0.07 0.00 -0.81 0.00 0.00 59.98 58.98 1wp1 h ARG 341 Cb 0.53 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.91 1wp1 h ARG 341 CO 0.03 0.98 -0.06 0.00 -1.51 0.00 0.00 179.97 179.41 1wp1 h ALA 342 N 1.14 0.46 -0.30 2.80 0.00 -0.06 0.21 119.26 123.52 1wp1 h ALA 342 Ca 0.23 -0.28 0.02 0.00 0.00 0.00 0.00 54.91 54.88 1wp1 h ALA 342 Cb 0.32 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1wp1 h ALA 342 CO -0.00 0.28 0.20 0.77 0.00 0.00 0.00 179.25 180.49 1wp1 h SER 343 N 0.42 0.29 0.66 0.00 0.02 -0.87 0.14 113.55 114.20 1wp1 h SER 343 Ca 0.09 -0.01 -0.25 0.00 -0.84 0.00 0.00 61.79 60.78 1wp1 h SER 343 Cb 0.54 -0.07 -0.00 0.00 0.14 0.00 0.00 62.40 63.01 1wp1 h SER 343 CO 0.03 0.21 -1.12 0.25 -1.14 0.00 0.00 176.83 175.06 1wp1 h LEU 344 N 0.34 0.34 -0.05 5.07 5.85 -0.72 -2.73 115.31 123.41 1wp1 h LEU 344 Ca 0.12 -0.34 -0.00 0.00 0.84 0.00 0.00 57.88 58.50 1wp1 h LEU 344 Cb 0.05 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 40.97 1wp1 h LEU 344 CO -0.03 1.23 0.03 0.44 -0.34 0.00 0.00 178.44 179.78 1wp1 h ASP 345 N 0.08 0.06 -0.70 1.25 3.32 0.16 -2.49 116.42 118.11 1wp1 h ASP 345 Ca -0.09 -0.06 0.14 0.00 0.02 0.00 0.00 57.03 57.04 1wp1 h ASP 345 Cb 1.83 -0.02 -0.10 0.00 0.22 0.00 0.00 39.33 41.27 1wp1 h ASP 345 CO 0.18 0.10 0.20 0.22 -1.72 0.00 0.00 179.24 178.22 1wp1 h TYR 346 N 0.02 0.32 -0.31 4.55 3.20 -0.76 0.48 116.97 124.48 1wp1 h TYR 346 Ca 0.02 0.04 -0.15 0.00 3.14 0.00 0.00 58.73 61.77 1wp1 h TYR 346 Cb 0.05 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.28 1wp1 h TYR 346 CO -0.06 -0.03 -0.42 0.00 -1.64 0.00 0.00 178.16 176.01 1wp1 h ALA 347 N 1.56 0.68 -0.37 1.82 0.00 -1.33 -0.62 119.26 120.99 1wp1 h ALA 347 Ca 0.39 -0.46 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 1wp1 h ALA 347 Cb 0.62 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1wp1 h ALA 347 CO -0.45 0.67 -0.11 0.87 0.00 0.00 0.00 179.25 180.23 1wp1 h LYS 348 N 0.62 0.73 -0.57 0.00 1.57 -0.94 -1.71 116.57 116.27 1wp1 h LYS 348 Ca 0.05 -0.29 0.05 0.00 -1.87 0.00 0.00 60.65 58.58 1wp1 h LYS 348 Cb 0.98 -0.04 -0.05 0.00 0.08 0.00 0.00 32.23 33.21 1wp1 h LYS 348 CO 0.09 0.89 0.31 0.82 -0.57 0.00 0.00 179.45 180.99 1wp1 h ILE 349 N 0.53 0.98 -0.55 1.86 2.04 -0.75 0.14 117.51 121.76 1wp1 h ILE 349 Ca 0.09 -0.20 0.04 0.00 1.00 0.00 0.00 64.86 65.79 1wp1 h ILE 349 Cb 0.63 0.34 -0.03 0.00 -0.74 0.00 0.00 36.82 37.01 1wp1 h ILE 349 CO 0.04 0.11 0.37 1.56 0.00 0.00 0.00 178.15 180.22 1wp1 h GLN 350 N 0.59 0.56 -0.26 2.37 1.08 -0.91 0.20 115.11 118.74 1wp1 h GLN 350 Ca 0.25 -0.03 -0.06 0.00 -1.45 0.00 0.00 58.65 57.35 1wp1 h GLN 350 Cb 0.13 -0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 27.42 1wp1 h GLN 350 CO -0.15 0.37 -0.08 -0.22 -0.95 0.00 0.00 178.83 177.80 1wp1 h LYS 351 N 0.58 0.52 -0.23 1.46 3.64 -0.21 -2.28 116.57 120.05 1wp1 h LYS 351 Ca 0.23 -0.21 -0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1wp1 h LYS 351 Cb 0.18 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.96 1wp1 h LYS 351 CO -0.06 0.75 0.14 -0.44 -2.27 0.00 0.00 179.45 177.57 1wp1 h ASP 352 N 0.27 0.28 -0.75 4.20 3.32 0.10 0.11 116.42 123.94 1wp1 h ASP 352 Ca 0.06 -0.05 0.17 0.00 0.02 0.00 0.00 57.03 57.24 1wp1 h ASP 352 Cb 0.57 -0.07 -0.12 0.00 0.22 0.00 0.00 39.33 39.92 1wp1 h ASP 352 CO 0.03 0.25 0.10 0.40 -1.72 0.00 0.00 179.24 178.29 1wp1 h ILE 353 N 0.29 0.41 0.00 0.35 2.04 -0.70 -0.88 117.51 119.03 1wp1 h ILE 353 Ca 0.08 -0.06 -0.10 0.00 1.00 0.00 0.00 64.86 65.78 1wp1 h ILE 353 Cb 0.02 0.22 -0.01 0.00 -0.74 0.00 0.00 36.82 36.30 1wp1 h ILE 353 CO -0.02 0.03 -0.47 0.78 0.00 0.00 0.00 178.15 178.47 1wp1 h ASN 354 N 0.17 0.00 -0.29 1.72 2.35 -0.39 -0.70 115.58 118.45 1wp1 h ASN 354 Ca 0.42 0.00 0.04 0.00 -0.55 0.00 0.00 56.30 56.22 1wp1 h ASN 354 Cb 0.76 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 39.09 1wp1 h ASN 354 CO -0.60 0.47 0.04 0.58 -1.65 0.00 0.00 177.43 176.28 1wp1 h VAL 355 N 0.00 0.85 -0.25 2.81 2.07 0.47 -1.27 116.25 120.93 1wp1 h VAL 355 Ca -0.00 -0.05 -0.16 0.00 0.82 0.00 0.00 66.70 67.31 1wp1 h VAL 355 Cb 1.02 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 31.47 1wp1 h VAL 355 CO 0.06 0.03 -0.48 0.00 0.02 0.00 0.00 177.57 177.19 1wp1 h ALA 356 N 1.22 0.68 -0.19 1.67 0.00 -0.70 -0.50 119.26 121.44 1wp1 h ALA 356 Ca 0.13 -0.48 -0.10 0.00 0.00 0.00 0.00 54.91 54.46 1wp1 h ALA 356 Cb 0.15 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1wp1 h ALA 356 CO -0.19 0.67 -0.30 1.96 0.00 0.00 0.00 179.25 181.39 1wp1 h GLN 357 N 0.54 0.38 -0.41 0.00 4.20 -1.09 -0.89 115.11 117.83 1wp1 h GLN 357 Ca 0.03 -0.15 -0.12 0.00 0.06 0.00 0.00 58.65 58.46 1wp1 h GLN 357 Cb 1.04 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.78 1wp1 h GLN 357 CO 0.10 0.65 -0.23 -0.92 -0.67 0.00 0.00 178.83 177.76 1wp1 h TYR 358 N 0.34 0.97 -0.41 2.96 3.20 -0.55 -1.35 116.97 122.12 1wp1 h TYR 358 Ca 0.05 -0.23 -0.08 0.00 3.14 0.00 0.00 58.73 61.61 1wp1 h TYR 358 Cb 0.70 -0.23 -0.01 0.00 1.54 0.00 0.00 36.73 38.73 1wp1 h TYR 358 CO 0.02 0.99 -0.03 0.93 -1.64 0.00 0.00 178.16 178.42 1wp1 h GLU 359 N 0.73 0.76 0.10 1.82 5.08 -0.74 -2.63 114.58 119.69 1wp1 h GLU 359 Ca 0.10 -0.26 0.02 0.00 -1.00 0.00 0.00 59.36 58.22 1wp1 h GLU 359 Cb 0.77 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.93 1wp1 h GLU 359 CO 0.06 0.85 -0.23 -0.22 -1.00 0.00 0.00 179.01 178.48 1wp1 h LYS 360 N 0.58 -0.40 -0.92 2.33 1.63 -0.87 0.12 116.57 119.05 1wp1 h LYS 360 Ca 0.11 0.03 0.18 0.00 -0.85 0.00 0.00 60.65 60.12 1wp1 h LYS 360 Cb 0.53 0.09 -0.11 0.00 -0.60 0.00 0.00 32.23 32.15 1wp1 h LYS 360 CO 0.03 -0.27 0.49 0.00 -3.45 0.00 0.00 179.45 176.25 1wp1 h ALA 361 N 0.37 1.47 -0.24 5.00 0.00 -1.20 0.31 119.26 124.97 1wp1 h ALA 361 Ca 0.03 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1wp1 h ALA 361 Cb 0.45 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1wp1 h ALA 361 CO -0.14 -0.15 0.10 0.82 0.00 0.00 0.00 179.25 179.88 1wp1 h ILE 362 N 0.61 1.17 -0.32 0.00 2.04 -0.79 -1.40 117.51 118.82 1wp1 h ILE 362 Ca 0.53 -0.51 0.00 0.00 1.00 0.00 0.00 64.86 65.88 1wp1 h ILE 362 Cb 0.86 1.05 -0.02 0.00 -0.74 0.00 0.00 36.82 37.98 1wp1 h ILE 362 CO -0.41 0.17 0.20 1.56 0.00 0.00 0.00 178.15 179.67 1wp1 h GLN 363 N 0.24 0.43 -0.40 2.37 4.20 0.96 -0.57 115.11 122.33 1wp1 h GLN 363 Ca 0.08 -0.03 0.06 0.00 0.06 0.00 0.00 58.65 58.82 1wp1 h GLN 363 Cb 0.18 -0.09 -0.05 0.00 0.30 0.00 0.00 27.48 27.81 1wp1 h GLN 363 CO -0.01 0.31 0.10 1.15 -0.67 0.00 0.00 178.83 179.71 1wp1 h THR 364 N 0.42 0.81 -0.42 -0.54 2.02 -0.43 -1.50 112.91 113.27 1wp1 h THR 364 Ca 0.12 -0.08 0.03 0.00 0.77 0.00 0.00 66.41 67.24 1wp1 h THR 364 Cb -0.02 0.56 -0.03 0.00 -1.74 0.00 0.00 68.15 66.92 1wp1 h THR 364 CO -0.02 0.04 0.23 0.00 0.37 0.00 0.00 175.52 176.14 1wp1 h ALA 365 N 1.29 0.53 0.12 6.16 0.00 -0.62 -1.30 119.26 125.45 1wp1 h ALA 365 Ca 0.19 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.12 1wp1 h ALA 365 Cb 0.22 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1wp1 h ALA 365 CO -0.24 -0.11 -0.24 0.35 0.00 0.00 0.00 179.25 179.01 1wp1 h PHE 366 N 0.46 -0.64 -0.59 0.00 3.57 -0.45 -2.34 116.94 116.95 1wp1 h PHE 366 Ca 0.18 0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.81 1wp1 h PHE 366 Cb 0.05 0.26 -0.10 0.00 2.79 0.00 0.00 35.95 38.96 1wp1 h PHE 366 CO -0.09 -0.34 0.01 0.37 -2.23 0.00 0.00 178.31 176.03 1wp1 h GLN 367 N -0.44 0.12 -0.57 1.11 -0.00 -0.94 0.21 115.11 114.59 1wp1 h GLN 367 Ca 0.03 -0.01 -0.07 0.00 -0.00 0.00 0.00 58.65 58.60 1wp1 h GLN 367 Cb 0.46 -0.03 -0.02 0.00 0.00 0.00 0.00 27.48 27.89 1wp1 h GLN 367 CO -0.13 0.08 0.07 0.93 0.00 0.00 0.00 178.83 179.78 1wp1 h GLU 368 N 0.12 0.94 -0.02 1.69 5.08 -0.92 -0.07 114.58 121.40 1wp1 h GLU 368 Ca 0.31 -0.24 -0.04 0.00 -1.00 0.00 0.00 59.36 58.38 1wp1 h GLU 368 Cb 0.49 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1wp1 h GLU 368 CO -0.50 0.88 -0.16 0.28 -1.00 0.00 0.00 179.01 178.51 1wp1 h VAL 369 N 0.88 1.51 -0.44 3.13 2.07 -0.90 -1.34 116.25 121.16 1wp1 h VAL 369 Ca 0.18 -1.74 0.08 0.00 0.82 0.00 0.00 66.70 66.04 1wp1 h VAL 369 Cb 0.42 2.59 -0.10 0.00 -1.52 0.00 0.00 31.29 32.69 1wp1 h VAL 369 CO 0.01 0.47 -0.35 0.00 0.02 0.00 0.00 177.57 177.72 1wp1 h ALA 370 N 0.33 -0.21 -0.92 1.67 0.00 -0.55 0.36 119.26 119.94 1wp1 h ALA 370 Ca -0.01 0.11 0.14 0.00 0.00 0.00 0.00 54.91 55.14 1wp1 h ALA 370 Cb 0.86 0.77 -0.09 0.00 0.00 0.00 0.00 17.79 19.33 1wp1 h ALA 370 CO 0.03 -0.75 0.53 -0.44 0.00 0.00 0.00 179.25 178.63 1wp1 h ASP 371 N -0.25 0.72 -0.73 0.00 3.32 -0.99 0.15 116.42 118.65 1wp1 h ASP 371 Ca 0.18 0.07 0.04 0.00 0.02 0.00 0.00 57.03 57.34 1wp1 h ASP 371 Cb 0.55 -0.06 -0.05 0.00 0.22 0.00 0.00 39.33 39.99 1wp1 h ASP 371 CO -0.58 0.34 0.45 1.23 -1.72 0.00 0.00 179.24 178.96 1wp1 h GLY 372 N 0.79 1.06 2.00 2.75 0.00 0.12 -0.97 103.07 108.82 1wp1 h GLY 372 Ca 0.48 -0.33 -0.13 0.00 0.00 0.00 0.00 47.33 47.35 1wp1 h GLY 372 CO -0.32 0.26 -0.62 1.41 0.00 0.00 0.00 176.54 177.27 1wp1 h LEU 373 N 0.85 0.00 -0.85 3.11 3.38 0.05 -0.39 115.31 121.46 1wp1 h LEU 373 Ca 0.30 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.18 1wp1 h LEU 373 Cb 0.07 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 1wp1 h LEU 373 CO -0.13 0.62 -0.10 0.00 0.09 0.00 0.00 178.44 178.91 1wp1 h ALA 374 N 1.38 1.03 -0.13 1.53 0.00 0.15 0.18 119.26 123.41 1wp1 h ALA 374 Ca -0.01 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.57 1wp1 h ALA 374 Cb 1.14 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.75 1wp1 h ALA 374 CO 0.08 0.59 -0.02 0.00 0.00 0.00 0.00 179.25 179.89 1wp1 h ALA 375 N 1.21 0.17 -0.29 0.00 0.00 -0.93 -3.02 119.26 116.41 1wp1 h ALA 375 Ca 0.12 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1wp1 h ALA 375 Cb 0.57 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1wp1 h ALA 375 CO 0.04 -0.09 0.13 -0.09 0.00 0.00 0.00 179.25 179.23 1wp1 h ARG 376 N -0.07 0.40 0.00 0.00 2.43 -0.69 -0.31 114.38 116.14 1wp1 h ARG 376 Ca 0.03 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1wp1 h ARG 376 Cb 0.43 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 1wp1 h ARG 376 CO 0.01 0.32 0.00 0.41 -1.51 0.00 0.00 179.97 179.20 1wp1 n GLY 377 N -1.32 -1.18 0.00 2.80 0.00 0.02 -4.37 105.19 101.14 1wp1 n GLY 377 Ca 0.01 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1wp1 n GLY 377 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1wp1 n THR 378 N -1.18 0.00 0.24 2.61 -2.24 -0.49 -4.69 114.28 108.53 1wp1 n THR 378 Ca 0.18 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 62.04 1wp1 n THR 378 Cb 0.19 -0.58 0.59 0.00 -2.10 0.00 0.00 70.33 68.43 1wp1 n THR 378 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 1wp1 h PHE 379 N 0.00 0.00 -0.35 4.78 -1.00 -1.31 -1.73 116.94 117.33 1wp1 h PHE 379 Ca 0.00 0.00 -0.07 0.00 2.81 0.00 0.00 57.97 60.71 1wp1 h PHE 379 Cb 0.73 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.28 1wp1 h PHE 379 CO 0.00 0.16 -0.07 1.15 -1.61 0.00 0.00 178.31 177.94 1wp1 h THR 380 N 0.00 1.28 -0.63 -1.55 2.02 -1.82 -1.06 112.91 111.14 1wp1 h THR 380 Ca -0.00 -1.12 -0.04 0.00 0.77 0.00 0.00 66.41 66.02 1wp1 h THR 380 Cb 0.32 1.29 -0.03 0.00 -1.74 0.00 0.00 68.15 67.99 1wp1 h THR 380 CO 0.02 0.37 0.24 -0.33 0.37 0.00 0.00 175.52 176.19 1wp1 h GLU 381 N 0.46 0.93 -0.06 6.66 3.07 -1.78 -1.56 114.58 122.29 1wp1 h GLU 381 Ca 0.09 -0.16 -0.06 0.00 -0.50 0.00 0.00 59.36 58.73 1wp1 h GLU 381 Cb 0.57 -0.16 0.00 0.00 -0.84 0.00 0.00 28.75 28.32 1wp1 h GLU 381 CO 0.03 0.77 -0.19 0.37 -1.40 0.00 0.00 179.01 178.59 1wp1 h GLN 382 N 0.92 0.24 -0.75 2.33 4.15 -1.14 -1.42 115.11 119.45 1wp1 h GLN 382 Ca 0.21 -0.18 -0.06 0.00 0.77 0.00 0.00 58.65 59.39 1wp1 h GLN 382 Cb 0.20 0.03 -0.03 0.00 0.21 0.00 0.00 27.48 27.88 1wp1 h GLN 382 CO -0.02 0.80 0.22 -0.07 -1.93 0.00 0.00 178.83 177.83 1wp1 h LEU 383 N -0.26 1.10 -0.61 -2.39 3.38 -1.22 0.12 115.31 115.42 1wp1 h LEU 383 Ca -0.01 -0.21 0.02 0.00 0.09 0.00 0.00 57.88 57.77 1wp1 h LEU 383 Cb 0.82 -0.29 -0.04 0.00 0.09 0.00 0.00 40.66 41.24 1wp1 h LEU 383 CO 0.04 1.02 0.39 -0.61 0.09 0.00 0.00 178.44 179.37 1wp1 h GLN 384 N 1.12 0.75 -0.40 1.13 5.75 -1.19 0.25 115.11 122.51 1wp1 h GLN 384 Ca 0.24 -0.05 -0.14 0.00 -0.15 0.00 0.00 58.65 58.55 1wp1 h GLN 384 Cb 0.32 -0.17 -0.01 0.00 1.07 0.00 0.00 27.48 28.69 1wp1 h GLN 384 CO -0.01 0.50 -0.32 0.00 -2.65 0.00 0.00 178.83 176.35 1wp1 h ALA 385 N 1.25 0.68 -0.23 3.38 0.00 -0.90 -1.88 119.26 121.56 1wp1 h ALA 385 Ca 0.23 -0.42 -0.11 0.00 0.00 0.00 0.00 54.91 54.61 1wp1 h ALA 385 Cb -0.03 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1wp1 h ALA 385 CO -0.08 0.67 -0.32 0.37 0.00 0.00 0.00 179.25 179.89 1wp1 h GLN 386 N 0.75 0.47 -0.48 0.00 5.75 -0.21 0.25 115.11 121.64 1wp1 h GLN 386 Ca 0.08 -0.20 -0.08 0.00 -0.15 0.00 0.00 58.65 58.29 1wp1 h GLN 386 Cb 0.89 -0.02 -0.02 0.00 1.07 0.00 0.00 27.48 29.40 1wp1 h GLN 386 CO 0.08 0.74 -0.02 0.00 -2.65 0.00 0.00 178.83 176.98 1wp1 h ARG 387 N 0.41 0.87 -0.72 1.69 3.08 -0.43 -0.55 114.38 118.73 1wp1 h ARG 387 Ca 0.05 -0.29 0.01 0.00 0.07 0.00 0.00 59.98 59.82 1wp1 h ARG 387 Cb 0.76 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.70 1wp1 h ARG 387 CO 0.06 0.92 0.48 -0.44 -1.07 0.00 0.00 179.97 179.91 1wp1 h ASP 388 N 0.72 0.83 -0.69 7.04 3.32 -0.73 -1.21 116.42 125.71 1wp1 h ASP 388 Ca 0.14 -0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.16 1wp1 h ASP 388 Cb 0.54 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.85 1wp1 h ASP 388 CO 0.03 0.61 0.43 0.25 -1.72 0.00 0.00 179.24 178.83 1wp1 h LEU 389 N 0.98 0.82 0.29 1.55 5.85 -0.65 -0.61 115.31 123.54 1wp1 h LEU 389 Ca 0.26 -0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.93 1wp1 h LEU 389 Cb -0.11 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.70 1wp1 h LEU 389 CO -0.06 0.63 -0.27 0.58 -0.34 0.00 0.00 178.44 178.98 1wp1 h VAL 390 N 0.94 0.43 -0.50 1.05 2.07 -0.75 0.90 116.25 120.38 1wp1 h VAL 390 Ca 0.25 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.87 1wp1 h VAL 390 Cb -0.05 0.43 -0.09 0.00 -1.52 0.00 0.00 31.29 30.05 1wp1 h VAL 390 CO -0.05 0.00 -0.11 0.50 0.02 0.00 0.00 177.57 177.93 1wp1 h LYS 391 N -0.59 0.01 -0.30 1.57 3.64 -0.71 0.23 116.57 120.42 1wp1 h LYS 391 Ca -0.01 -0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 59.23 1wp1 h LYS 391 Cb 0.53 -0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.35 1wp1 h LYS 391 CO -0.04 0.01 -0.34 0.00 -2.27 0.00 0.00 179.45 176.81 1wp1 h ALA 392 N 1.50 0.45 -0.98 5.00 0.00 -1.07 0.14 119.26 124.30 1wp1 h ALA 392 Ca 0.24 -0.43 0.08 0.00 0.00 0.00 0.00 54.91 54.81 1wp1 h ALA 392 Cb 0.37 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.00 1wp1 h ALA 392 CO -0.51 0.51 0.63 0.77 0.00 0.00 0.00 179.25 180.65 1wp1 h SER 393 N 0.52 0.98 -0.24 0.00 0.02 -0.07 0.31 113.55 115.07 1wp1 h SER 393 Ca 0.04 0.02 -0.10 0.00 -0.84 0.00 0.00 61.79 60.92 1wp1 h SER 393 Cb 0.92 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 63.27 1wp1 h SER 393 CO 0.08 0.60 -0.22 -0.78 -1.14 0.00 0.00 176.83 175.37 1wp1 h ASP 394 N 1.10 0.62 -0.55 3.07 3.58 0.06 0.26 116.42 124.56 1wp1 h ASP 394 Ca 0.44 -0.46 0.04 0.00 0.42 0.00 0.00 57.03 57.46 1wp1 h ASP 394 Cb 0.24 -0.17 -0.04 0.00 1.72 0.00 0.00 39.33 41.07 1wp1 h ASP 394 CO -0.20 0.95 0.30 -0.33 -2.88 0.00 0.00 179.24 177.09 1wp1 h GLU 395 N 0.29 0.57 -0.35 0.28 4.39 -0.37 -0.82 114.58 118.57 1wp1 h GLU 395 Ca 0.04 -0.03 0.06 0.00 0.34 0.00 0.00 59.36 59.77 1wp1 h GLU 395 Cb 0.77 -0.13 -0.06 0.00 -0.10 0.00 0.00 28.75 29.23 1wp1 h GLU 395 CO 0.06 0.38 -0.01 -0.92 -1.16 0.00 0.00 179.01 177.36 1wp1 h TYR 396 N 0.59 -0.03 -0.35 4.33 3.20 -0.09 -1.85 116.97 122.77 1wp1 h TYR 396 Ca 0.23 0.03 0.04 0.00 3.14 0.00 0.00 58.73 62.17 1wp1 h TYR 396 Cb 0.10 0.07 -0.04 0.00 1.54 0.00 0.00 36.73 38.40 1wp1 h TYR 396 CO -0.08 -0.07 0.13 -0.92 -1.64 0.00 0.00 178.16 175.57 1wp1 h TYR 397 N 0.09 0.23 0.02 -3.82 3.20 -0.43 -0.83 116.97 115.43 1wp1 h TYR 397 Ca 0.17 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.06 1wp1 h TYR 397 Cb 0.24 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.45 1wp1 h TYR 397 CO -0.25 0.10 -0.04 1.96 -1.64 0.00 0.00 178.16 178.29 1wp1 h GLN 398 N 0.28 -0.08 0.15 1.82 4.20 -0.39 -0.88 115.11 120.20 1wp1 h GLN 398 Ca 0.15 0.01 0.02 0.00 0.06 0.00 0.00 58.65 58.89 1wp1 h GLN 398 Cb 0.12 0.02 -0.04 0.00 0.30 0.00 0.00 27.48 27.88 1wp1 h GLN 398 CO -0.15 -0.05 -0.31 -0.07 -0.67 0.00 0.00 178.83 177.58 1wp1 h LEU 399 N -0.08 -0.88 -0.78 1.46 3.38 -1.30 -2.04 115.31 115.07 1wp1 h LEU 399 Ca 0.01 0.10 0.09 0.00 0.09 0.00 0.00 57.88 58.17 1wp1 h LEU 399 Cb 0.09 0.33 -0.07 0.00 0.09 0.00 0.00 40.66 41.09 1wp1 h LEU 399 CO -0.02 -0.40 0.43 0.00 0.09 0.00 0.00 178.44 178.54 1wp1 h ALA 400 N 0.10 1.10 -0.08 1.53 0.00 -0.86 0.27 119.26 121.33 1wp1 h ALA 400 Ca 0.02 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1wp1 h ALA 400 Cb 0.57 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 1wp1 h ALA 400 CO -0.16 0.06 0.03 0.22 0.00 0.00 0.00 179.25 179.40 1wp1 h ASP 401 N 0.74 0.11 0.03 0.00 1.82 -1.08 -0.54 116.42 117.50 1wp1 h ASP 401 Ca 0.38 -0.17 0.03 0.00 -0.39 0.00 0.00 57.03 56.88 1wp1 h ASP 401 Cb 0.35 -0.03 -0.04 0.00 0.68 0.00 0.00 39.33 40.29 1wp1 h ASP 401 CO -0.25 0.24 -0.25 0.50 -1.61 0.00 0.00 179.24 177.87 1wp1 h LYS 402 N -0.04 -0.40 -0.55 0.28 3.64 -0.59 -0.99 116.57 117.92 1wp1 h LYS 402 Ca 0.03 0.03 0.06 0.00 -1.27 0.00 0.00 60.65 59.49 1wp1 h LYS 402 Cb 0.17 0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.05 1wp1 h LYS 402 CO -0.00 -0.26 0.36 0.00 -2.27 0.00 0.00 179.45 177.28 1wp1 h ARG 403 N -0.41 0.49 0.22 1.90 3.08 -0.39 -2.07 114.38 117.20 1wp1 h ARG 403 Ca 0.05 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.06 1wp1 h ARG 403 Cb 0.48 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.42 1wp1 h ARG 403 CO -0.20 0.32 -0.11 -0.92 -1.07 0.00 0.00 179.97 177.99 1wp1 h TYR 404 N 0.50 -0.28 -0.37 3.04 3.20 -0.62 0.17 116.97 122.61 1wp1 h TYR 404 Ca 0.24 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.19 1wp1 h TYR 404 Cb 0.29 0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.64 1wp1 h TYR 404 CO -0.00 0.08 0.26 0.00 -1.64 0.00 0.00 178.16 176.86 1wp1 h ARG 405 N -0.69 0.10 -0.01 1.82 2.47 -0.87 -2.13 114.38 115.07 1wp1 h ARG 405 Ca -0.03 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.68 1wp1 h ARG 405 Cb 0.48 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.78 1wp1 h ARG 405 CO 0.05 0.06 -0.15 2.41 0.56 0.00 0.00 179.97 182.90 1wp1 n THR 406 N -4.45 0.00 -0.32 2.04 -1.04 -0.81 -4.89 114.28 104.81 1wp1 n THR 406 Ca 0.06 -0.21 0.00 0.00 -2.04 0.00 0.00 64.05 61.86 1wp1 n THR 406 Cb 0.38 0.56 0.00 0.00 -1.82 0.00 0.00 70.33 69.45 1wp1 n THR 406 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1wp1 n GLY 407 N 1.28 2.27 0.25 3.41 0.00 -0.80 -4.88 105.19 106.71 1wp1 n GLY 407 Ca 0.15 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.27 1wp1 n GLY 407 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1wp1 h VAL 408 N 0.00 0.73 -3.42 1.61 2.07 -1.51 -3.47 116.25 112.25 1wp1 h VAL 408 Ca 0.00 -0.61 -0.01 0.00 0.82 0.00 0.00 66.70 66.90 1wp1 h VAL 408 Cb 0.00 1.37 -0.08 0.00 -1.52 0.00 0.00 31.29 31.06 1wp1 h VAL 408 CO 0.00 0.15 0.00 -0.62 0.02 0.00 0.00 177.57 177.12 1wp1 s ASP 409 N -6.38 -0.16 0.65 0.57 -1.08 -0.05 -4.99 116.67 105.23 1wp1 s ASP 409 Ca -0.03 -0.80 -0.08 0.00 -0.52 0.00 0.00 52.55 51.12 1wp1 s ASP 409 Cb 0.14 0.63 0.02 0.00 -1.46 0.00 0.00 42.92 42.25 1wp1 s ASP 409 CO 0.62 -1.20 0.98 0.54 0.52 0.00 0.00 175.17 176.63 1wp1 s ASN 410 N -2.98 5.39 0.38 -0.34 2.20 -1.26 -4.01 114.94 114.32 1wp1 s ASN 410 Ca 0.18 0.79 0.19 0.00 -0.94 0.00 0.00 52.86 53.08 1wp1 s ASN 410 Cb -0.02 -1.66 0.72 0.00 -2.00 0.00 0.00 41.25 38.29 1wp1 s ASN 410 CO 0.08 -1.26 1.75 0.22 -2.94 0.00 0.00 177.10 174.95 1wp1 h TYR 411 N -0.41 0.00 -0.96 1.54 3.20 -1.96 -3.15 116.97 115.23 1wp1 h TYR 411 Ca -0.45 0.00 0.01 0.00 3.14 0.00 0.00 58.73 61.43 1wp1 h TYR 411 Cb 1.27 0.00 -0.05 0.00 1.54 0.00 0.00 36.73 39.49 1wp1 h TYR 411 CO 0.45 0.35 0.63 1.25 -1.64 0.00 0.00 178.16 179.20 1wp1 h LEU 412 N 0.00 1.11 -0.33 2.82 5.85 -1.98 0.26 115.31 123.05 1wp1 h LEU 412 Ca -0.00 -0.04 -0.06 0.00 0.84 0.00 0.00 57.88 58.62 1wp1 h LEU 412 Cb 0.86 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.60 1wp1 h LEU 412 CO 0.05 0.82 -0.04 0.74 -0.34 0.00 0.00 178.44 179.66 1wp1 h THR 413 N 1.31 1.27 -0.41 1.05 2.02 -1.96 0.42 112.91 116.61 1wp1 h THR 413 Ca 0.35 -1.05 0.02 0.00 0.77 0.00 0.00 66.41 66.50 1wp1 h THR 413 Cb -0.14 1.29 -0.03 0.00 -1.74 0.00 0.00 68.15 67.54 1wp1 h THR 413 CO -0.07 0.34 0.24 0.25 0.37 0.00 0.00 175.52 176.64 1wp1 h LEU 414 N 0.40 0.38 -0.08 2.58 5.85 -1.39 0.84 115.31 123.89 1wp1 h LEU 414 Ca 0.09 0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.82 1wp1 h LEU 414 Cb 0.51 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 1wp1 h LEU 414 CO 0.02 0.27 0.01 0.25 -0.34 0.00 0.00 178.44 178.66 1wp1 h LEU 415 N 0.48 0.00 -0.37 2.25 5.85 -0.21 0.21 115.31 123.52 1wp1 h LEU 415 Ca 0.17 0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.96 1wp1 h LEU 415 Cb 0.02 0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.01 1wp1 h LEU 415 CO -0.08 0.01 0.02 -0.78 -0.34 0.00 0.00 178.44 177.27 1wp1 h ASP 416 N 0.04 -0.10 -0.74 1.25 1.82 0.32 -1.06 116.42 117.96 1wp1 h ASP 416 Ca 0.03 0.08 -0.05 0.00 -0.39 0.00 0.00 57.03 56.70 1wp1 h ASP 416 Cb 0.03 0.13 -0.03 0.00 0.68 0.00 0.00 39.33 40.13 1wp1 h ASP 416 CO -0.05 -0.01 0.28 0.00 -1.61 0.00 0.00 179.24 177.85 1wp1 h ALA 417 N 1.31 1.08 -0.06 -0.78 0.00 -0.10 -0.81 119.26 119.89 1wp1 h ALA 417 Ca 0.18 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 54.91 1wp1 h ALA 417 Cb 0.24 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1wp1 h ALA 417 CO -0.28 0.65 -0.03 1.96 0.00 0.00 0.00 179.25 181.54 1wp1 h GLN 418 N 1.10 -0.03 -0.34 0.00 4.20 -0.02 -0.24 115.11 119.78 1wp1 h GLN 418 Ca 0.25 0.00 0.02 0.00 0.06 0.00 0.00 58.65 58.98 1wp1 h GLN 418 Cb 0.24 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.00 1wp1 h GLN 418 CO -0.02 -0.02 0.18 0.00 -0.67 0.00 0.00 178.83 178.30 1wp1 h ARG 419 N -0.03 0.36 -0.72 1.46 3.08 -1.03 -1.53 114.38 115.97 1wp1 h ARG 419 Ca 0.04 -0.02 0.01 0.00 0.07 0.00 0.00 59.98 60.07 1wp1 h ARG 419 Cb 0.09 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.02 1wp1 h ARG 419 CO -0.09 0.24 0.48 0.77 -1.07 0.00 0.00 179.97 180.30 1wp1 h SER 420 N 0.37 0.83 -0.31 7.04 0.02 -0.84 -0.73 113.55 119.93 1wp1 h SER 420 Ca 0.14 -0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 61.04 1wp1 h SER 420 Cb 0.04 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.36 1wp1 h SER 420 CO -0.09 0.60 0.08 0.25 -1.14 0.00 0.00 176.83 176.53 1wp1 h LEU 421 N 0.98 0.46 -0.45 5.07 5.85 -0.80 -2.02 115.31 124.39 1wp1 h LEU 421 Ca 0.27 -0.22 -0.16 0.00 0.84 0.00 0.00 57.88 58.61 1wp1 h LEU 421 Cb -0.11 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 40.79 1wp1 h LEU 421 CO -0.06 0.57 -0.43 0.15 -0.34 0.00 0.00 178.44 178.33 1wp1 h PHE 422 N 0.34 0.99 -0.03 1.25 -0.00 -0.91 -1.90 116.94 116.67 1wp1 h PHE 422 Ca 0.10 -0.31 -0.17 0.00 -0.00 0.00 0.00 57.97 57.59 1wp1 h PHE 422 Cb 0.28 -0.20 -0.01 0.00 -0.00 0.00 0.00 35.95 36.01 1wp1 h PHE 422 CO 0.01 1.10 -0.73 1.79 -0.00 0.00 0.00 178.31 180.48 1wp1 h THR 423 N 0.66 1.44 -0.45 4.41 1.35 -1.13 -2.02 112.91 117.18 1wp1 h THR 423 Ca 0.05 -2.28 -0.08 0.00 -0.55 0.00 0.00 66.41 63.54 1wp1 h THR 423 Cb 1.00 2.22 -0.02 0.00 -1.73 0.00 0.00 68.15 69.62 1wp1 h THR 423 CO 0.10 0.67 -0.03 0.00 -0.25 0.00 0.00 175.52 176.00 1wp1 h ALA 424 N 1.11 0.61 -0.20 6.62 0.00 -1.20 0.90 119.26 127.10 1wp1 h ALA 424 Ca -0.02 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 1wp1 h ALA 424 Cb 1.28 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 1wp1 h ALA 424 CO 0.11 0.43 0.10 1.96 0.00 0.00 0.00 179.25 181.85 1wp1 h GLN 425 N 0.65 0.29 -0.15 0.00 4.20 -1.26 0.26 115.11 119.10 1wp1 h GLN 425 Ca 0.12 -0.04 0.03 0.00 0.06 0.00 0.00 58.65 58.82 1wp1 h GLN 425 Cb 0.54 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.24 1wp1 h GLN 425 CO 0.03 0.30 -0.02 1.96 -0.67 0.00 0.00 178.83 180.43 1wp1 h GLN 426 N 0.20 0.02 -0.49 1.46 4.20 -1.24 -1.49 115.11 117.78 1wp1 h GLN 426 Ca 0.07 -0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.78 1wp1 h GLN 426 Cb 0.10 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.85 1wp1 h GLN 426 CO -0.01 0.02 0.32 0.37 -0.67 0.00 0.00 178.83 178.86 1wp1 h GLN 427 N 0.02 0.63 -0.36 1.46 5.75 -0.62 -1.68 115.11 120.32 1wp1 h GLN 427 Ca 0.07 -0.04 -0.08 0.00 -0.15 0.00 0.00 58.65 58.45 1wp1 h GLN 427 Cb 0.09 -0.14 -0.02 0.00 1.07 0.00 0.00 27.48 28.49 1wp1 h GLN 427 CO -0.13 0.42 -0.13 1.25 -2.65 0.00 0.00 178.83 177.59 1wp1 h LEU 428 N 0.65 0.62 -0.38 -2.39 5.85 0.52 -0.01 115.31 120.16 1wp1 h LEU 428 Ca 0.18 -0.18 -0.06 0.00 0.84 0.00 0.00 57.88 58.66 1wp1 h LEU 428 Cb -0.06 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 40.79 1wp1 h LEU 428 CO -0.04 0.78 -0.01 0.40 -0.34 0.00 0.00 178.44 179.23 1wp1 h ILE 429 N 0.58 1.26 -0.36 4.05 2.04 -0.60 -2.12 117.51 122.35 1wp1 h ILE 429 Ca 0.10 -1.01 -0.04 0.00 1.00 0.00 0.00 64.86 64.91 1wp1 h ILE 429 Cb 0.56 1.17 -0.01 0.00 -0.74 0.00 0.00 36.82 37.79 1wp1 h ILE 429 CO 0.04 0.34 0.09 0.74 0.00 0.00 0.00 178.15 179.35 1wp1 h THR 430 N 0.49 1.23 -0.95 -0.27 2.02 -0.98 -0.75 112.91 113.69 1wp1 h THR 430 Ca 0.11 -0.77 0.02 0.00 0.77 0.00 0.00 66.41 66.54 1wp1 h THR 430 Cb 0.48 1.04 -0.05 0.00 -1.74 0.00 0.00 68.15 67.87 1wp1 h THR 430 CO 0.02 0.26 0.62 0.44 0.37 0.00 0.00 175.52 177.24 1wp1 h ASP 431 N 0.44 1.06 -0.35 4.18 3.32 -0.95 0.92 116.42 125.03 1wp1 h ASP 431 Ca 0.11 -0.02 -0.09 0.00 0.02 0.00 0.00 57.03 57.06 1wp1 h ASP 431 Cb 0.31 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 1wp1 h ASP 431 CO 0.00 0.74 -0.11 -0.09 -1.72 0.00 0.00 179.24 178.06 1wp1 h ARG 432 N 1.24 0.70 -0.37 3.56 9.65 -1.16 -0.41 114.38 127.60 1wp1 h ARG 432 Ca 0.37 -0.28 0.07 0.00 -1.10 0.00 0.00 59.98 59.04 1wp1 h ARG 432 Cb -0.07 -0.03 -0.07 0.00 -1.39 0.00 0.00 29.97 28.41 1wp1 h ARG 432 CO -0.10 0.87 -0.08 1.25 2.80 0.00 0.00 179.97 184.71 1wp1 h LEU 433 N 0.49 -0.32 -1.34 3.80 5.85 -0.60 -1.03 115.31 122.15 1wp1 h LEU 433 Ca 0.09 0.11 -0.07 0.00 0.84 0.00 0.00 57.88 58.85 1wp1 h LEU 433 Cb 0.63 0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.87 1wp1 h LEU 433 CO 0.04 -0.11 -0.33 0.78 -0.34 0.00 0.00 178.44 178.48 1wp1 h ASN 434 N 0.01 0.00 0.29 1.25 2.35 -0.50 -0.66 115.58 118.32 1wp1 h ASN 434 Ca 0.18 0.00 -0.30 0.00 -0.55 0.00 0.00 56.30 55.63 1wp1 h ASN 434 Cb 0.27 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.66 1wp1 h ASN 434 CO -0.37 0.33 -1.28 0.06 -1.65 0.00 0.00 177.43 174.52 1wp1 h GLN 435 N 0.00 0.51 -0.57 0.81 -0.00 -0.66 -1.84 115.11 113.35 1wp1 h GLN 435 Ca -0.00 -0.74 0.00 0.00 -0.00 0.00 0.00 58.65 57.91 1wp1 h GLN 435 Cb 0.61 0.26 -0.03 0.00 -0.00 0.00 0.00 27.48 28.32 1wp1 h GLN 435 CO 0.04 1.33 0.36 -0.07 -0.00 0.00 0.00 178.83 180.50 1wp1 h LEU 436 N 0.20 0.67 -0.99 0.06 3.38 -0.98 -2.78 115.31 114.86 1wp1 h LEU 436 Ca -0.18 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.71 1wp1 h LEU 436 Cb 1.96 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 42.51 1wp1 h LEU 436 CO 0.23 0.50 0.23 0.74 0.09 0.00 0.00 178.44 180.23 1wp1 h THR 437 N 0.77 1.23 -0.66 0.22 2.02 -1.12 -0.73 112.91 114.64 1wp1 h THR 437 Ca 0.21 -0.76 -0.04 0.00 0.77 0.00 0.00 66.41 66.58 1wp1 h THR 437 Cb -0.06 0.50 -0.03 0.00 -1.74 0.00 0.00 68.15 66.82 1wp1 h THR 437 CO -0.04 0.30 0.25 0.28 0.37 0.00 0.00 175.52 176.68 1wp1 h SER 438 N 0.93 0.89 0.27 4.18 0.02 -1.07 -1.20 113.55 117.57 1wp1 h SER 438 Ca 0.21 -0.13 -0.21 0.00 -0.84 0.00 0.00 61.79 60.83 1wp1 h SER 438 Cb 0.23 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 62.53 1wp1 h SER 438 CO -0.01 0.80 -0.83 -0.33 -1.14 0.00 0.00 176.83 175.32 1wp1 h GLU 439 N 0.95 0.43 -0.17 3.45 4.39 -1.17 0.52 114.58 122.99 1wp1 h GLU 439 Ca 0.22 -0.40 -0.00 0.00 0.34 0.00 0.00 59.36 59.52 1wp1 h GLU 439 Cb 0.20 0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 1wp1 h GLU 439 CO -0.02 1.05 0.10 0.28 -1.16 0.00 0.00 179.01 179.26 1wp1 h VAL 440 N 0.27 1.08 -0.38 3.13 2.07 -0.89 0.86 116.25 122.39 1wp1 h VAL 440 Ca -0.05 -0.20 -0.10 0.00 0.82 0.00 0.00 66.70 67.17 1wp1 h VAL 440 Cb 1.43 0.91 -0.02 0.00 -1.52 0.00 0.00 31.29 32.10 1wp1 h VAL 440 CO 0.14 0.07 -0.18 0.78 0.02 0.00 0.00 177.57 178.41 1wp1 h ASN 441 N 0.19 0.71 -0.28 0.57 -0.26 -1.14 -1.21 115.58 114.15 1wp1 h ASN 441 Ca 0.06 -0.23 0.00 0.00 -0.56 0.00 0.00 56.30 55.57 1wp1 h ASN 441 Cb 0.03 -0.19 -0.01 0.00 -1.06 0.00 0.00 38.32 37.09 1wp1 h ASN 441 CO -0.01 0.89 0.18 0.25 -1.06 0.00 0.00 177.43 177.68 1wp1 h LEU 442 N 0.63 0.33 0.07 1.61 5.85 -0.56 0.73 115.31 123.97 1wp1 h LEU 442 Ca 0.10 -0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.80 1wp1 h LEU 442 Cb 0.66 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.58 1wp1 h LEU 442 CO 0.05 0.27 -0.14 0.22 -0.34 0.00 0.00 178.44 178.50 1wp1 h TYR 443 N 0.37 -0.35 -0.69 1.25 3.20 -0.39 -0.70 116.97 119.66 1wp1 h TYR 443 Ca 0.10 0.01 0.13 0.00 3.14 0.00 0.00 58.73 62.11 1wp1 h TYR 443 Cb -0.01 0.15 -0.09 0.00 1.54 0.00 0.00 36.73 38.31 1wp1 h TYR 443 CO -0.05 -0.21 0.23 -0.22 -1.64 0.00 0.00 178.16 176.27 1wp1 h LYS 444 N -0.27 0.36 0.00 1.82 3.11 -1.00 -0.12 116.57 120.47 1wp1 h LYS 444 Ca 0.02 -0.02 -0.08 0.00 -2.81 0.00 0.00 60.65 57.76 1wp1 h LYS 444 Cb 0.29 -0.08 -0.01 0.00 -1.00 0.00 0.00 32.23 31.42 1wp1 h LYS 444 CO -0.08 0.24 -0.39 0.00 -2.81 0.00 0.00 179.45 176.41 1wp1 h ALA 445 N 1.52 0.95 0.00 5.00 0.00 -0.19 -2.56 119.26 123.98 1wp1 h ALA 445 Ca 0.37 -0.35 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1wp1 h ALA 445 Cb 0.56 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1wp1 h ALA 445 CO -0.40 0.48 -0.36 -0.07 0.00 0.00 0.00 179.25 178.90 1wp1 h LEU 446 N 0.00 0.00 0.00 0.00 3.38 -0.63 -3.46 115.31 114.60 1wp1 h LEU 446 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1wp1 h LEU 446 Cb 0.95 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.70 1wp1 h LEU 446 CO 0.05 0.36 0.00 0.61 0.09 0.00 0.00 178.44 179.55 1wp1 n GLY 447 N 0.15 -0.32 5.24 0.83 0.00 -0.97 -4.25 105.19 105.88 1wp1 n GLY 447 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1wp1 n GLY 447 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wp1 n GLY 448 N 0.00 -0.12 2.39 -0.02 0.00 -0.11 -4.43 105.19 102.89 1wp1 n GLY 448 Ca 0.00 -1.25 -0.24 0.00 0.00 0.00 0.00 46.02 44.53 1wp1 n GLY 448 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wp1 n GLY 449 N 0.00 4.04 0.15 -0.02 0.00 -1.26 -4.66 105.19 103.44 1wp1 n GLY 449 Ca 0.00 -2.14 -0.22 0.00 0.00 0.00 0.00 46.02 43.66 1wp1 n GLY 449 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1wp1 h TRP 450 N 3.63 0.86 -3.60 1.61 2.91 -1.85 -3.41 115.95 116.10 1wp1 h TRP 450 Ca 0.12 -0.58 -0.51 0.00 1.13 0.00 0.00 58.89 59.05 1wp1 h TRP 450 Cb 0.77 -0.05 -0.01 0.00 -0.51 0.00 0.00 29.16 29.36 1wp1 h TRP 450 CO 0.57 1.44 0.40 -0.80 -1.03 0.00 0.00 178.44 179.02 1wp1 s ASN 451 N -7.31 7.44 -0.03 2.65 0.01 -1.26 -4.98 114.94 111.45 1wp1 s ASN 451 Ca -0.11 1.94 -0.24 0.00 -0.71 0.00 0.00 52.86 53.73 1wp1 s ASN 451 Cb 0.04 -2.60 -0.19 0.00 0.41 0.00 0.00 41.25 38.91 1wp1 s ASN 451 CO 0.90 -0.08 1.11 -0.61 -1.51 0.00 0.00 177.10 176.91 1wp1 h GLN 452 N 5.13 -0.12 -6.22 -0.60 4.15 -1.93 -2.25 115.11 113.27 1wp1 h GLN 452 Ca -0.44 0.01 -0.54 0.00 0.77 0.00 0.00 58.65 58.45 1wp1 h GLN 452 Cb 1.21 0.03 -0.07 0.00 0.21 0.00 0.00 27.48 28.85 1wp1 h GLN 452 CO 0.71 0.36 -0.59 -0.65 -1.93 0.00 0.00 178.83 176.73 1wp1 s GLN 453 N -3.93 2.64 0.14 1.69 -1.52 -1.26 -2.50 119.66 114.92 1wp1 s GLN 453 Ca -0.15 -1.16 -0.33 0.00 -1.95 0.00 0.00 55.36 51.78 1wp1 s GLN 453 Cb 0.01 -2.41 -0.13 0.00 -0.22 0.00 0.00 33.01 30.26 1wp1 s GLN 453 CO 0.59 0.41 1.70 2.41 -0.25 0.00 0.00 175.29 180.16 1wp1 n THR 454 N -0.83 0.14 -3.33 -0.19 -1.04 -1.26 -3.84 114.28 103.94 1wp1 n THR 454 Ca -0.08 -0.03 -0.38 0.00 -2.04 0.00 0.00 64.05 61.53 1wp1 n THR 454 Cb 0.57 -1.81 -0.07 0.00 -1.82 0.00 0.00 70.33 67.21 1wp1 n THR 454 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1wp1 s VAL 455 N 1.71 5.18 -2.35 12.58 1.01 -0.56 -4.88 120.40 133.08 1wp1 s VAL 455 Ca 0.80 0.86 0.29 0.00 0.00 0.00 0.00 61.98 63.93 1wp1 s VAL 455 Cb -0.59 -3.79 0.66 0.00 0.00 0.00 0.00 36.38 32.65 1wp1 s VAL 455 CO 0.38 0.27 1.89 0.35 0.00 0.00 0.00 175.10 177.98