#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 -0.44 -0.26 0.00 1.04 -1.26 -3.87 113.70 108.91 1wp1 s SER 2 Ca 0.00 0.31 -0.03 0.00 0.48 0.00 0.00 55.95 56.71 1wp1 s SER 2 Cb 0.00 1.54 0.02 0.00 0.10 0.00 0.00 66.02 67.68 1wp1 s SER 2 CO 0.00 -0.30 -0.01 -1.48 0.98 0.00 0.00 173.24 172.43 1wp1 s LEU 3 N 2.67 3.40 -0.09 2.42 2.34 -1.26 -4.98 118.68 123.18 1wp1 s LEU 3 Ca 0.14 -0.79 -0.03 0.00 0.06 0.00 0.00 54.13 53.51 1wp1 s LEU 3 Cb -0.14 -1.74 0.05 0.00 -0.56 0.00 0.00 46.19 43.79 1wp1 s LEU 3 CO -0.21 -0.14 0.14 -0.63 -1.06 0.00 0.00 176.35 174.45 1wp1 s ILE 4 N 1.39 -0.23 0.42 1.48 1.01 -1.26 -4.23 121.20 119.78 1wp1 s ILE 4 Ca 0.01 0.31 -0.26 0.00 0.00 0.00 0.00 60.65 60.70 1wp1 s ILE 4 Cb -0.17 -0.31 -0.10 0.00 0.01 0.00 0.00 42.46 41.89 1wp1 s ILE 4 CO -0.02 0.10 1.45 -2.65 0.00 0.00 0.00 174.94 173.82 1wp1 n PRO 5 N 5.32 2.42 -1.77 2.79 -0.02 -1.26 -4.91 135.00 137.56 1wp1 n PRO 5 Ca -0.04 0.85 -0.42 0.00 -2.02 0.00 0.00 63.50 61.87 1wp1 n PRO 5 Cb 0.50 -2.64 -0.03 0.00 -0.02 0.00 0.00 33.50 31.31 1wp1 n PRO 5 CO 0.00 0.00 0.00 0.16 1.98 0.00 0.00 175.50 177.64 1wp1 s ASP 6 N -0.33 6.42 -0.31 2.55 -4.77 -1.26 -4.89 116.67 114.07 1wp1 s ASP 6 Ca 0.58 2.84 -0.29 0.00 -3.30 0.00 0.00 52.55 52.38 1wp1 s ASP 6 Cb -0.46 -2.60 -0.02 0.00 -1.09 0.00 0.00 42.92 38.74 1wp1 s ASP 6 CO 0.60 -0.94 1.75 -0.47 0.70 0.00 0.00 175.17 176.82 1wp1 s TYR 7 N 0.98 1.88 -0.46 2.11 5.04 -1.26 -4.96 117.35 120.68 1wp1 s TYR 7 Ca 0.72 0.60 -0.11 0.00 -2.44 0.00 0.00 57.07 55.84 1wp1 s TYR 7 Cb -0.48 -4.12 0.10 0.00 0.35 0.00 0.00 41.96 37.81 1wp1 s TYR 7 CO 0.34 -2.94 0.34 1.14 -1.34 0.00 0.00 175.55 173.09 1wp1 s GLN 8 N 5.45 2.64 -0.07 4.97 -2.07 -1.26 -5.07 119.66 124.24 1wp1 s GLN 8 Ca 0.78 -1.60 -0.30 0.00 -1.82 0.00 0.00 55.36 52.42 1wp1 s GLN 8 Cb -0.23 -3.94 -0.04 0.00 -1.09 0.00 0.00 33.01 27.72 1wp1 s GLN 8 CO 0.33 -1.10 1.32 0.50 -1.32 0.00 0.00 175.29 175.02 1wp1 s ARG 9 N 1.44 4.28 0.98 9.60 3.52 -1.26 -5.00 118.95 132.51 1wp1 s ARG 9 Ca 0.04 1.80 -0.12 0.00 -0.13 0.00 0.00 55.73 57.32 1wp1 s ARG 9 Cb -0.25 -3.67 0.18 0.00 -1.56 0.00 0.00 34.95 29.65 1wp1 s ARG 9 CO 0.02 -0.60 1.08 -2.14 -0.81 0.00 0.00 175.30 172.85 1wp1 s PRO 10 N 2.84 0.56 0.33 5.12 0.02 -1.26 -4.98 135.00 137.64 1wp1 s PRO 10 Ca 0.59 0.73 -0.27 0.00 0.02 0.00 0.00 61.00 62.07 1wp1 s PRO 10 Cb -0.26 -1.74 -0.09 0.00 0.02 0.00 0.00 34.50 32.43 1wp1 s PRO 10 CO 0.22 -2.69 1.07 -1.21 -0.33 0.00 0.00 177.00 174.06 1wp1 s GLU 11 N -4.86 4.45 -0.10 5.54 2.02 -1.26 -4.99 118.70 119.50 1wp1 s GLU 11 Ca 0.65 1.67 -0.29 0.00 0.02 0.00 0.00 54.97 57.02 1wp1 s GLU 11 Cb -0.19 -2.93 -0.05 0.00 0.10 0.00 0.00 34.13 31.06 1wp1 s GLU 11 CO 0.58 0.08 1.75 0.00 0.02 0.00 0.00 175.26 177.69 1wp1 s ALA 12 N -1.36 3.44 -0.48 5.21 0.00 -1.26 -4.89 121.76 122.41 1wp1 s ALA 12 Ca 0.50 0.87 0.23 0.00 0.00 0.00 0.00 51.96 53.56 1wp1 s ALA 12 Cb -0.28 -3.82 0.98 0.00 0.00 0.00 0.00 23.12 20.00 1wp1 s ALA 12 CO 0.35 -1.70 1.69 -2.30 0.00 0.00 0.00 175.76 173.80 1wp1 n PRO 13 N 7.49 0.18 -2.48 0.00 -0.02 -1.26 -4.82 135.00 134.10 1wp1 n PRO 13 Ca 0.19 0.44 -0.29 0.00 -2.02 0.00 0.00 63.50 61.82 1wp1 n PRO 13 Cb 0.43 -1.86 -0.01 0.00 -0.02 0.00 0.00 33.50 32.04 1wp1 n PRO 13 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1wp1 s VAL 14 N -3.32 4.82 0.73 -1.45 -7.23 -1.26 -5.05 120.40 107.63 1wp1 s VAL 14 Ca 0.04 0.49 -0.15 0.00 -1.81 0.00 0.00 61.98 60.54 1wp1 s VAL 14 Cb 0.09 -3.84 0.04 0.00 0.56 0.00 0.00 36.38 33.23 1wp1 s VAL 14 CO 0.37 -0.86 1.24 0.00 -0.31 0.00 0.00 175.10 175.54 1wp1 s ALA 15 N -2.78 2.10 0.12 1.32 0.00 -1.26 -4.97 121.76 116.29 1wp1 s ALA 15 Ca 0.50 0.98 -0.21 0.00 0.00 0.00 0.00 51.96 53.24 1wp1 s ALA 15 Cb -0.10 -3.51 -0.06 0.00 0.00 0.00 0.00 23.12 19.44 1wp1 s ALA 15 CO 0.44 -1.94 1.71 0.00 0.00 0.00 0.00 175.76 175.97 1wp1 h ALA 16 N -0.23 0.08 -2.30 0.00 0.00 -1.96 -3.44 119.26 111.40 1wp1 h ALA 16 Ca -0.48 0.05 -0.53 0.00 0.00 0.00 0.00 54.91 53.95 1wp1 h ALA 16 Cb 1.31 0.12 -0.06 0.00 0.00 0.00 0.00 17.79 19.16 1wp1 h ALA 16 CO 0.49 -0.49 -0.56 0.00 0.00 0.00 0.00 179.25 178.70 1wp1 s ALA 17 N -6.20 3.50 0.60 0.00 0.00 -1.26 -4.37 121.76 114.03 1wp1 s ALA 17 Ca -0.13 -1.43 -0.18 0.00 0.00 0.00 0.00 51.96 50.22 1wp1 s ALA 17 Cb 0.09 -1.21 -0.03 0.00 0.00 0.00 0.00 23.12 21.97 1wp1 s ALA 17 CO 0.68 0.30 1.14 0.71 0.00 0.00 0.00 175.76 178.58 1wp1 s TYR 18 N -2.09 2.58 0.83 0.00 4.12 -1.26 -4.97 117.35 116.56 1wp1 s TYR 18 Ca 0.32 1.55 -0.12 0.00 0.02 0.00 0.00 57.07 58.84 1wp1 s TYR 18 Cb -0.08 -3.28 0.10 0.00 -1.52 0.00 0.00 41.96 37.18 1wp1 s TYR 18 CO 0.24 -1.75 1.15 -2.14 0.02 0.00 0.00 175.55 173.07 1wp1 s PRO 19 N -3.61 1.61 0.35 -1.71 0.02 -1.26 -4.97 135.00 125.43 1wp1 s PRO 19 Ca 0.71 1.52 0.07 0.00 0.02 0.00 0.00 61.00 63.32 1wp1 s PRO 19 Cb -0.24 -1.80 -0.07 0.00 0.02 0.00 0.00 34.50 32.42 1wp1 s PRO 19 CO 0.34 -2.19 -0.01 -0.65 -0.33 0.00 0.00 177.00 174.16 1wp1 s GLN 20 N -4.50 1.77 0.00 5.54 -1.52 -1.26 -4.91 119.66 114.78 1wp1 s GLN 20 Ca 0.67 -1.96 0.00 0.00 -1.95 0.00 0.00 55.36 52.12 1wp1 s GLN 20 Cb -0.23 -1.37 0.00 0.00 -0.22 0.00 0.00 33.01 31.19 1wp1 s GLN 20 CO 0.54 -0.03 0.00 0.41 -0.25 0.00 0.00 175.29 175.96 1wp1 n GLY 21 N -0.79 0.96 0.47 3.09 0.00 -1.26 -4.89 105.19 102.76 1wp1 n GLY 21 Ca -0.04 -1.96 0.25 0.00 0.00 0.00 0.00 46.02 44.27 1wp1 n GLY 21 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1wp1 h GLN 22 N 7.48 0.00 -0.58 1.61 1.08 -2.01 -0.00 115.11 122.70 1wp1 h GLN 22 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1wp1 h GLN 22 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 1wp1 h GLN 22 CO 0.00 0.00 0.00 0.00 -0.95 0.00 0.00 178.83 177.88 1wp1 n ALA 23 N -2.32 2.36 -3.40 3.87 0.00 -1.26 -4.93 120.51 114.82 1wp1 n ALA 23 Ca 0.16 -1.19 -0.27 0.00 0.00 0.00 0.00 53.44 52.14 1wp1 n ALA 23 Cb 1.09 -0.82 -0.17 0.00 0.00 0.00 0.00 19.45 19.55 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 -1.11 1.82 0.84 0.00 1.51 -0.02 -3.85 117.35 116.53 1wp1 s TYR 24 Ca 0.42 -0.71 -0.14 0.00 -1.01 0.00 0.00 57.07 55.63 1wp1 s TYR 24 Cb 0.22 -1.28 0.03 0.00 -0.11 0.00 0.00 41.96 40.83 1wp1 s TYR 24 CO 0.30 -0.33 0.72 0.41 -1.11 0.00 0.00 175.55 175.54 1wp1 n GLY 25 N 3.75 -1.17 3.64 0.71 0.00 -1.26 -4.54 105.19 106.32 1wp1 n GLY 25 Ca -0.22 -0.56 -0.32 0.00 0.00 0.00 0.00 46.02 44.93 1wp1 n GLY 25 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1wp1 n GLN 26 N -2.01 -0.27 -2.51 1.61 1.13 -1.26 -4.91 117.38 109.16 1wp1 n GLN 26 Ca 0.10 -0.01 -0.41 0.00 -1.94 0.00 0.00 57.00 54.74 1wp1 n GLN 26 Cb 0.51 -2.33 -0.04 0.00 0.11 0.00 0.00 30.24 28.49 1wp1 n GLN 26 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 1wp1 s ASN 27 N -2.42 7.28 0.17 1.08 0.01 -1.26 -4.96 114.94 114.84 1wp1 s ASN 27 Ca 0.68 2.16 0.00 0.00 -0.71 0.00 0.00 52.86 54.99 1wp1 s ASN 27 Cb -0.25 -2.61 0.03 0.00 0.41 0.00 0.00 41.25 38.83 1wp1 s ASN 27 CO 0.57 -0.17 1.40 0.74 -1.51 0.00 0.00 177.10 178.14 1wp1 h THR 28 N 3.42 1.43 0.00 1.60 2.02 -1.93 -3.50 112.91 115.95 1wp1 h THR 28 Ca -0.45 -2.37 0.00 0.00 0.77 0.00 0.00 66.41 64.36 1wp1 h THR 28 Cb 1.21 2.30 0.00 0.00 -1.74 0.00 0.00 68.15 69.92 1wp1 h THR 28 CO 0.70 0.70 0.00 0.61 0.37 0.00 0.00 175.52 177.90 1wp1 n GLY 29 N 0.72 -1.69 3.77 2.16 0.00 -1.26 -4.93 105.19 103.97 1wp1 n GLY 29 Ca -0.04 -1.54 -0.38 0.00 0.00 0.00 0.00 46.02 44.06 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 -1.30 3.20 -0.19 4.61 0.00 -1.26 -3.93 121.76 122.90 1wp1 s ALA 30 Ca 0.00 0.72 -0.14 0.00 0.00 0.00 0.00 51.96 52.54 1wp1 s ALA 30 Cb 0.00 -3.27 -0.04 0.00 0.00 0.00 0.00 23.12 19.81 1wp1 s ALA 30 CO 0.00 -0.12 0.32 0.00 0.00 0.00 0.00 175.76 175.96 1wp1 s ALA 31 N -1.49 3.58 0.06 0.00 0.00 -1.26 -4.93 121.76 117.71 1wp1 s ALA 31 Ca 0.52 -0.55 -0.20 0.00 0.00 0.00 0.00 51.96 51.73 1wp1 s ALA 31 Cb -0.24 -2.49 -0.09 0.00 0.00 0.00 0.00 23.12 20.31 1wp1 s ALA 31 CO 0.31 -0.12 1.31 0.00 0.00 0.00 0.00 175.76 177.26 1wp1 h ALA 32 N 7.11 -0.83 -3.06 0.00 0.00 -2.01 -3.34 119.26 117.12 1wp1 h ALA 32 Ca -0.38 -0.07 -0.70 0.00 0.00 0.00 0.00 54.91 53.75 1wp1 h ALA 32 Cb 1.16 0.68 -0.30 0.00 0.00 0.00 0.00 17.79 19.33 1wp1 h ALA 32 CO 0.72 -0.90 -0.55 0.54 0.00 0.00 0.00 179.25 179.06 1wp1 s VAL 33 N -4.56 3.71 0.96 0.00 0.11 -1.26 -5.09 120.40 114.27 1wp1 s VAL 33 Ca -0.09 -1.51 -0.11 0.00 -2.93 0.00 0.00 61.98 57.34 1wp1 s VAL 33 Cb 0.03 -3.28 0.17 0.00 -1.53 0.00 0.00 36.38 31.77 1wp1 s VAL 33 CO 0.34 -0.42 1.10 -2.16 -3.33 0.00 0.00 175.10 170.63 1wp1 s PRO 34 N 1.32 0.71 0.20 1.54 0.04 -1.26 -4.87 135.00 132.69 1wp1 s PRO 34 Ca 0.02 1.21 -0.10 0.00 0.04 0.00 0.00 61.00 62.17 1wp1 s PRO 34 Cb -0.22 -1.72 0.24 0.00 0.04 0.00 0.00 34.50 32.85 1wp1 s PRO 34 CO 0.00 -2.73 1.76 0.00 0.04 0.00 0.00 177.00 176.07 1wp1 h ALA 35 N -1.92 0.77 0.00 8.56 0.00 -1.90 -2.07 119.26 122.69 1wp1 h ALA 35 Ca -0.49 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1wp1 h ALA 35 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1wp1 h ALA 35 CO 0.47 -0.14 0.00 0.00 0.00 0.00 0.00 179.25 179.58 1wp1 n ALA 36 N -2.42 1.39 0.45 0.00 0.00 -1.26 -1.36 120.51 117.31 1wp1 n ALA 36 Ca 0.08 -0.02 0.11 0.00 0.00 0.00 0.00 53.44 53.60 1wp1 n ALA 36 Cb 0.23 -1.09 -0.12 0.00 0.00 0.00 0.00 19.45 18.46 1wp1 n ALA 36 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1wp1 n ASP 37 N -1.36 0.47 -4.73 0.00 8.00 -0.78 -4.69 116.55 113.46 1wp1 n ASP 37 Ca 0.02 -0.40 -0.41 0.00 0.71 0.00 0.00 54.79 54.71 1wp1 n ASP 37 Cb 0.05 1.44 -0.03 0.00 -0.02 0.00 0.00 41.12 42.56 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 -3.28 3.56 0.34 0.53 1.01 -0.46 -2.78 121.20 120.12 1wp1 s ILE 38 Ca -0.00 1.26 -0.26 0.00 0.00 0.00 0.00 60.65 61.65 1wp1 s ILE 38 Cb 0.15 -3.81 -0.09 0.00 0.01 0.00 0.00 42.46 38.72 1wp1 s ILE 38 CO 0.88 0.18 1.05 -0.83 0.00 0.00 0.00 174.94 176.22 1wp1 s GLY 39 N 0.35 2.88 0.00 6.18 0.00 -1.25 -4.60 107.32 110.89 1wp1 s GLY 39 Ca 0.55 0.75 0.06 0.00 0.00 0.00 0.00 44.72 46.08 1wp1 s GLY 39 CO 0.35 1.25 1.08 -2.67 0.00 0.00 0.00 173.10 173.11 1wp1 n TRP 40 N 0.52 0.00 1.14 1.90 4.27 -0.26 -0.03 117.44 124.98 1wp1 n TRP 40 Ca 0.02 0.00 0.13 0.00 -3.89 0.00 0.00 57.50 53.76 1wp1 n TRP 40 Cb 0.48 -0.35 0.41 0.00 -1.36 0.00 0.00 31.31 30.49 1wp1 n TRP 40 CO 0.00 0.00 0.00 0.54 -2.29 0.00 0.00 177.69 175.94 1wp1 n ARG 41 N -1.35 0.32 -0.08 -2.67 5.12 -0.93 -3.47 116.66 113.60 1wp1 n ARG 41 Ca 0.02 -0.15 -0.13 0.00 -1.93 0.00 0.00 57.85 55.66 1wp1 n ARG 41 Cb 0.05 -1.50 -0.07 0.00 -1.16 0.00 0.00 32.46 29.79 1wp1 n ARG 41 CO 0.00 0.00 0.00 -1.91 -1.93 0.00 0.00 177.63 173.79 1wp1 n GLU 42 N -1.21 0.38 -0.18 5.56 2.13 0.96 -4.64 120.64 123.65 1wp1 n GLU 42 Ca 0.09 0.11 -0.07 0.00 0.66 0.00 0.00 57.16 57.95 1wp1 n GLU 42 Cb 0.33 -1.25 0.02 0.00 0.27 0.00 0.00 31.44 30.81 1wp1 n GLU 42 CO 0.00 0.00 0.00 0.35 -0.41 0.00 0.00 177.13 177.07 1wp1 h PHE 43 N -0.18 0.71 -3.22 4.31 3.57 -1.30 -3.37 116.94 117.46 1wp1 h PHE 43 Ca -0.37 -0.01 -0.71 0.00 3.53 0.00 0.00 57.97 60.40 1wp1 h PHE 43 Cb 1.49 -0.23 -0.20 0.00 2.79 0.00 0.00 35.95 39.80 1wp1 h PHE 43 CO -0.00 0.51 -0.11 -0.06 -2.23 0.00 0.00 178.31 176.42 1wp1 s PHE 44 N -5.90 3.13 -0.83 0.41 0.40 -1.23 -1.47 117.98 112.50 1wp1 s PHE 44 Ca -0.13 -0.79 0.15 0.00 -0.60 0.00 0.00 56.93 55.56 1wp1 s PHE 44 Cb 0.12 -3.47 0.64 0.00 0.51 0.00 0.00 43.02 40.82 1wp1 s PHE 44 CO 0.76 -0.97 1.46 0.54 0.70 0.00 0.00 175.22 177.71 1wp1 n ARG 45 N 5.75 0.05 -2.96 0.44 1.74 -0.59 -4.71 116.66 116.39 1wp1 n ARG 45 Ca -0.10 0.35 -0.43 0.00 -0.77 0.00 0.00 57.85 56.91 1wp1 n ARG 45 Cb 0.44 -1.61 -0.05 0.00 -1.02 0.00 0.00 32.46 30.21 1wp1 n ARG 45 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1wp1 s ASP 46 N -3.35 6.41 0.29 0.55 -1.08 -1.26 -4.94 116.67 113.28 1wp1 s ASP 46 Ca 0.05 -0.11 0.03 0.00 -0.52 0.00 0.00 52.55 52.00 1wp1 s ASP 46 Cb 0.08 -2.39 0.64 0.00 -1.46 0.00 0.00 42.92 39.79 1wp1 s ASP 46 CO 0.25 -0.92 1.78 -0.65 0.52 0.00 0.00 175.17 176.15 1wp1 h PRO 47 N 8.99 0.73 -0.35 4.34 0.11 -1.85 -0.71 132.00 143.25 1wp1 h PRO 47 Ca -0.25 -0.04 -0.16 0.00 0.11 0.00 0.00 66.00 65.66 1wp1 h PRO 47 Cb 1.09 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.03 1wp1 h PRO 47 CO 0.96 0.48 -0.42 0.37 -0.21 0.00 0.00 178.00 179.18 1wp1 h GLN 48 N 0.75 0.90 -0.80 1.05 4.15 -1.79 -1.72 115.11 117.66 1wp1 h GLN 48 Ca 0.53 -0.49 0.00 0.00 0.77 0.00 0.00 58.65 59.45 1wp1 h GLN 48 Cb 0.75 0.03 -0.04 0.00 0.21 0.00 0.00 27.48 28.43 1wp1 h GLN 48 CO -0.36 1.14 0.50 1.25 -1.93 0.00 0.00 178.83 179.43 1wp1 h LEU 49 N 0.73 0.94 0.03 -2.39 5.85 -1.59 -2.24 115.31 116.63 1wp1 h LEU 49 Ca 0.05 -0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.73 1wp1 h LEU 49 Cb 1.02 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.80 1wp1 h LEU 49 CO 0.10 0.71 -0.08 1.56 -0.34 0.00 0.00 178.44 180.40 1wp1 h GLN 50 N 1.09 -0.14 -0.12 1.25 4.20 -0.65 0.92 115.11 121.65 1wp1 h GLN 50 Ca 0.29 0.01 -0.01 0.00 0.06 0.00 0.00 58.65 59.00 1wp1 h GLN 50 Cb -0.07 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.73 1wp1 h GLN 50 CO -0.06 -0.09 0.03 1.96 -0.67 0.00 0.00 178.83 180.00 1wp1 h GLN 51 N -0.15 0.17 0.08 1.46 1.08 -1.22 -1.66 115.11 114.88 1wp1 h GLN 51 Ca 0.02 -0.02 -0.23 0.00 -1.45 0.00 0.00 58.65 56.97 1wp1 h GLN 51 Cb 0.17 -0.04 0.02 0.00 -0.05 0.00 0.00 27.48 27.59 1wp1 h GLN 51 CO -0.06 0.17 -0.95 -0.07 -0.95 0.00 0.00 178.83 176.96 1wp1 h LEU 52 N 0.17 0.69 -0.16 1.46 3.38 -0.76 -1.30 115.31 118.79 1wp1 h LEU 52 Ca 0.04 -0.83 0.05 0.00 0.09 0.00 0.00 57.88 57.23 1wp1 h LEU 52 Cb 0.08 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.56 1wp1 h LEU 52 CO -0.00 1.45 -0.15 0.40 0.09 0.00 0.00 178.44 180.23 1wp1 h ILE 53 N 0.03 0.60 -0.51 1.22 2.04 -0.63 -1.23 117.51 119.03 1wp1 h ILE 53 Ca -0.14 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.81 1wp1 h ILE 53 Cb 1.67 0.60 -0.08 0.00 -0.74 0.00 0.00 36.82 38.27 1wp1 h ILE 53 CO 0.18 0.00 0.06 1.23 0.00 0.00 0.00 178.15 179.62 1wp1 h GLY 54 N -0.16 0.59 0.68 5.37 0.00 -1.30 0.41 103.07 108.67 1wp1 h GLY 54 Ca 0.11 0.01 0.09 0.00 0.00 0.00 0.00 47.33 47.54 1wp1 h GLY 54 CO -0.26 -0.11 0.61 -2.08 0.00 0.00 0.00 176.54 174.70 1wp1 h VAL 55 N 0.18 1.00 -0.12 4.60 2.07 -0.78 -2.42 116.25 120.78 1wp1 h VAL 55 Ca 0.26 -0.34 -0.19 0.00 0.82 0.00 0.00 66.70 67.24 1wp1 h VAL 55 Cb 0.38 -0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 30.06 1wp1 h VAL 55 CO -0.38 0.18 -0.72 0.00 0.02 0.00 0.00 177.57 176.67 1wp1 h ALA 56 N 1.52 0.52 -0.84 1.67 0.00 0.24 -1.62 119.26 120.74 1wp1 h ALA 56 Ca 0.44 -0.59 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 1wp1 h ALA 56 Cb 0.35 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 1wp1 h ALA 56 CO -0.19 0.73 0.40 -0.07 0.00 0.00 0.00 179.25 180.11 1wp1 h LEU 57 N 0.38 1.11 -0.15 0.00 3.38 -0.76 0.30 115.31 119.58 1wp1 h LEU 57 Ca -0.03 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1wp1 h LEU 57 Cb 1.31 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.78 1wp1 h LEU 57 CO 0.13 0.94 -0.03 -0.62 0.09 0.00 0.00 178.44 178.95 1wp1 n GLU 58 N -4.30 0.79 0.00 1.13 1.02 -0.99 -4.37 120.64 113.92 1wp1 n GLU 58 Ca 0.08 -0.15 0.00 0.00 -0.02 0.00 0.00 57.16 57.07 1wp1 n GLU 58 Cb 0.15 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.07 1wp1 n GLU 58 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1wp1 n ASN 59 N -0.97 0.76 -4.73 1.62 3.02 -0.63 -5.08 115.26 109.25 1wp1 n ASN 59 Ca 0.18 -0.01 -0.42 0.00 -0.03 0.00 0.00 54.58 54.31 1wp1 n ASN 59 Cb 0.22 0.16 -0.02 0.00 -0.61 0.00 0.00 39.78 39.53 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 -0.32 6.57 0.02 6.41 3.84 0.10 -4.52 114.94 127.04 1wp1 s ASN 60 Ca 0.00 2.70 0.09 0.00 0.21 0.00 0.00 52.86 55.86 1wp1 s ASN 60 Cb 0.00 -2.61 -0.23 0.00 -0.55 0.00 0.00 41.25 37.86 1wp1 s ASN 60 CO 0.00 -0.79 0.89 0.03 -2.79 0.00 0.00 177.10 174.44 1wp1 h ARG 61 N 5.71 0.03 -0.98 0.43 2.47 -1.90 -2.65 114.38 117.49 1wp1 h ARG 61 Ca -0.45 -0.06 0.01 0.00 -1.26 0.00 0.00 59.98 58.23 1wp1 h ARG 61 Cb 1.21 0.02 -0.05 0.00 -1.65 0.00 0.00 29.97 29.50 1wp1 h ARG 61 CO 0.84 0.75 0.65 -0.44 0.56 0.00 0.00 179.97 182.33 1wp1 h ASP 62 N 0.01 1.12 -0.04 7.04 3.32 -1.98 -0.97 116.42 124.92 1wp1 h ASP 62 Ca -0.19 -0.03 -0.03 0.00 0.02 0.00 0.00 57.03 56.80 1wp1 h ASP 62 Cb 1.93 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 41.20 1wp1 h ASP 62 CO 0.11 0.81 -0.10 0.25 -1.72 0.00 0.00 179.24 178.59 1wp1 h LEU 63 N 1.32 0.16 -0.82 1.55 5.85 -1.91 -2.35 115.31 119.10 1wp1 h LEU 63 Ca 0.36 -0.58 0.16 0.00 0.84 0.00 0.00 57.88 58.66 1wp1 h LEU 63 Cb -0.14 -0.05 -0.10 0.00 0.37 0.00 0.00 40.66 40.75 1wp1 h LEU 63 CO -0.08 0.71 0.38 0.03 -0.34 0.00 0.00 178.44 179.14 1wp1 h ARG 64 N -0.39 0.50 -0.00 1.25 3.08 -1.39 -0.62 114.38 116.81 1wp1 h ARG 64 Ca -0.00 -0.03 0.03 0.00 0.07 0.00 0.00 59.98 60.05 1wp1 h ARG 64 Cb 0.69 -0.11 -0.04 0.00 0.08 0.00 0.00 29.97 30.59 1wp1 h ARG 64 CO 0.02 0.33 -0.21 0.28 -1.07 0.00 0.00 179.97 179.32 1wp1 h VAL 65 N 0.52 0.51 0.00 2.04 2.07 -1.03 0.28 116.25 120.63 1wp1 h VAL 65 Ca 0.46 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.98 1wp1 h VAL 65 Cb 0.71 0.51 -0.00 0.00 -1.52 0.00 0.00 31.29 30.99 1wp1 h VAL 65 CO -0.41 0.00 -0.00 0.00 0.02 0.00 0.00 177.57 177.18 1wp1 h ALA 66 N 0.55 1.52 0.01 1.67 0.00 -0.75 0.10 119.26 122.37 1wp1 h ALA 66 Ca 0.06 -0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.82 1wp1 h ALA 66 Cb 0.41 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.21 1wp1 h ALA 66 CO -0.19 0.00 -0.58 0.00 0.00 0.00 0.00 179.25 178.48 1wp1 h ALA 67 N 2.00 0.06 0.00 0.00 0.00 -0.29 -3.07 119.26 117.95 1wp1 h ALA 67 Ca -0.00 -0.57 -0.00 0.00 0.00 0.00 0.00 54.91 54.34 1wp1 h ALA 67 Cb 0.01 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1wp1 h ALA 67 CO 0.00 0.33 -0.01 -0.07 0.00 0.00 0.00 179.25 179.50 1wp1 h LEU 68 N -0.17 0.00 -0.56 0.00 3.38 1.00 0.11 115.31 119.07 1wp1 h LEU 68 Ca -0.08 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.81 1wp1 h LEU 68 Cb 1.31 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.04 1wp1 h LEU 68 CO 0.11 0.01 0.00 0.78 0.09 0.00 0.00 178.44 179.43 1wp1 h ASN 69 N 0.00 0.97 -0.11 -0.43 4.21 -0.86 -1.05 115.58 118.31 1wp1 h ASN 69 Ca -0.00 -0.31 0.03 0.00 1.21 0.00 0.00 56.30 57.23 1wp1 h ASN 69 Cb 0.02 -0.26 -0.06 0.00 -1.12 0.00 0.00 38.32 36.90 1wp1 h ASN 69 CO 0.00 1.04 -0.53 0.58 -1.29 0.00 0.00 177.43 177.23 1wp1 h VAL 70 N 0.87 0.00 -0.58 2.81 2.07 -0.67 0.31 116.25 121.06 1wp1 h VAL 70 Ca 0.16 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.62 1wp1 h VAL 70 Cb 0.54 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.28 1wp1 h VAL 70 CO 0.03 0.00 0.12 -0.33 0.02 0.00 0.00 177.57 177.41 1wp1 h GLU 71 N -0.58 0.90 0.00 1.57 4.39 -1.57 -2.60 114.58 116.69 1wp1 h GLU 71 Ca 0.03 -0.20 0.00 0.00 0.34 0.00 0.00 59.36 59.53 1wp1 h GLU 71 Cb 0.67 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 29.19 1wp1 h GLU 71 CO -0.42 0.82 0.00 0.00 -1.16 0.00 0.00 179.01 178.25 1wp1 h ALA 72 N 1.27 1.00 0.00 3.43 0.00 -0.19 -1.59 119.26 123.18 1wp1 h ALA 72 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1wp1 h ALA 72 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1wp1 h ALA 72 CO 0.00 0.00 -1.29 1.19 0.00 0.00 0.00 179.25 179.15 1wp1 n PHE 73 N -2.57 0.59 0.13 0.00 3.01 0.10 -3.54 117.46 115.18 1wp1 n PHE 73 Ca 0.03 0.17 0.01 0.00 1.01 0.00 0.00 57.45 58.67 1wp1 n PHE 73 Cb 0.35 -0.75 0.05 0.00 -0.01 0.00 0.00 39.48 39.12 1wp1 n PHE 73 CO 0.00 0.00 0.00 0.07 1.01 0.00 0.00 176.76 177.84 1wp1 h ARG 74 N 0.00 0.00 0.06 -1.08 0.11 -1.01 -1.62 114.38 110.84 1wp1 h ARG 74 Ca 0.00 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.08 1wp1 h ARG 74 Cb 0.96 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.04 1wp1 h ARG 74 CO 0.00 0.60 -0.03 0.00 0.10 0.00 0.00 179.97 180.64 1wp1 h ALA 75 N 1.40 -0.09 0.00 0.08 0.00 -1.45 -1.85 119.26 117.36 1wp1 h ALA 75 Ca -0.01 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1wp1 h ALA 75 Cb 1.38 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.20 1wp1 h ALA 75 CO 0.08 -0.34 0.00 1.96 0.00 0.00 0.00 179.25 180.95 1wp1 h GLN 76 N -0.50 0.00 -0.00 0.00 1.08 -1.59 0.15 115.11 114.24 1wp1 h GLN 76 Ca -0.01 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 57.14 1wp1 h GLN 76 Cb 0.43 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.87 1wp1 h GLN 76 CO 0.01 0.00 -0.18 -0.92 -0.95 0.00 0.00 178.83 176.79 1wp1 h TYR 77 N 0.00 0.19 0.00 2.96 3.20 -1.04 -3.23 116.97 119.05 1wp1 h TYR 77 Ca 0.00 -0.10 -0.02 0.00 3.14 0.00 0.00 58.73 61.75 1wp1 h TYR 77 Cb 0.08 -0.02 -0.00 0.00 1.54 0.00 0.00 36.73 38.33 1wp1 h TYR 77 CO 0.00 0.89 -0.10 0.00 -1.64 0.00 0.00 178.16 177.31 1wp1 h ARG 78 N -0.56 0.00 0.13 1.82 3.08 -0.23 -2.36 114.38 116.26 1wp1 h ARG 78 Ca -0.02 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 1wp1 h ARG 78 Cb 0.93 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.99 1wp1 h ARG 78 CO 0.04 0.10 -0.06 0.82 -1.07 0.00 0.00 179.97 179.79 1wp1 h ILE 79 N 0.00 1.03 0.00 2.04 2.04 -0.91 -3.13 117.51 118.59 1wp1 h ILE 79 Ca -0.00 -1.02 0.00 0.00 1.00 0.00 0.00 64.86 64.84 1wp1 h ILE 79 Cb 0.74 1.63 0.00 0.00 -0.74 0.00 0.00 36.82 38.45 1wp1 h ILE 79 CO 0.01 0.23 0.00 0.00 0.00 0.00 0.00 178.15 178.39 1wp1 n GLN 80 N -4.94 0.91 -0.06 2.37 6.02 -1.19 -3.92 117.38 116.57 1wp1 n GLN 80 Ca -0.08 0.00 -0.05 0.00 -0.01 0.00 0.00 57.00 56.86 1wp1 n GLN 80 Cb 0.26 -1.15 -0.02 0.00 1.02 0.00 0.00 30.24 30.36 1wp1 n GLN 80 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.06 173.92 1wp1 n ARG 81 N -0.65 0.38 -0.16 -1.09 0.63 -0.89 -4.35 116.66 110.53 1wp1 n ARG 81 Ca 0.06 0.40 0.00 0.00 -0.92 0.00 0.00 57.85 57.39 1wp1 n ARG 81 Cb 0.03 -1.45 0.00 0.00 0.45 0.00 0.00 32.46 31.49 1wp1 n ARG 81 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1wp1 n ALA 82 N -3.55 2.48 -0.04 5.13 0.00 -1.19 -3.53 120.51 119.82 1wp1 n ALA 82 Ca -0.07 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.39 1wp1 n ALA 82 Cb 0.26 -1.34 -0.15 0.00 0.00 0.00 0.00 19.45 18.22 1wp1 n ALA 82 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1wp1 n ASP 83 N 1.43 0.12 0.18 0.00 9.92 -1.26 -3.57 116.55 123.36 1wp1 n ASP 83 Ca 0.00 0.05 0.04 0.00 -0.53 0.00 0.00 54.79 54.35 1wp1 n ASP 83 Cb 0.24 1.37 0.29 0.00 -0.64 0.00 0.00 41.12 42.38 1wp1 n ASP 83 CO 0.00 0.00 0.00 0.25 0.13 0.00 0.00 177.20 177.58 1wp1 h LEU 84 N 0.00 0.00 -9.78 0.64 5.85 -1.88 -3.44 115.31 106.70 1wp1 h LEU 84 Ca -0.23 0.00 -0.52 0.00 0.84 0.00 0.00 57.88 57.97 1wp1 h LEU 84 Cb 1.55 0.00 0.04 0.00 0.37 0.00 0.00 40.66 42.62 1wp1 h LEU 84 CO 0.02 0.43 0.60 -0.36 -0.34 0.00 0.00 178.44 178.79 1wp1 s PHE 85 N -3.57 3.26 0.29 1.25 0.40 -1.23 -4.98 117.98 113.39 1wp1 s PHE 85 Ca 0.00 1.41 -0.28 0.00 -0.60 0.00 0.00 56.93 57.46 1wp1 s PHE 85 Cb 0.11 -3.55 -0.09 0.00 0.51 0.00 0.00 43.02 39.99 1wp1 s PHE 85 CO 0.70 -1.55 0.96 -1.25 0.70 0.00 0.00 175.22 174.79 1wp1 s PRO 86 N -1.04 4.69 -0.14 0.24 0.05 -1.26 -4.96 135.00 132.59 1wp1 s PRO 86 Ca 0.51 1.46 -0.21 0.00 0.05 0.00 0.00 61.00 62.80 1wp1 s PRO 86 Cb -0.37 -3.04 -0.03 0.00 0.05 0.00 0.00 34.50 31.11 1wp1 s PRO 86 CO 0.44 0.36 0.63 1.03 0.05 0.00 0.00 177.00 179.51 1wp1 s ARG 87 N -1.62 4.31 -0.24 4.56 0.52 -1.26 -5.06 118.95 120.16 1wp1 s ARG 87 Ca 0.46 0.68 0.02 0.00 -0.52 0.00 0.00 55.73 56.38 1wp1 s ARG 87 Cb -0.23 -3.51 0.05 0.00 0.52 0.00 0.00 34.95 31.78 1wp1 s ARG 87 CO 0.29 -0.07 -0.12 0.42 0.02 0.00 0.00 175.30 175.85 1wp1 s ILE 88 N 1.30 2.04 -0.28 1.52 1.01 -1.26 -1.09 121.20 124.44 1wp1 s ILE 88 Ca 0.31 -1.43 0.03 0.00 0.00 0.00 0.00 60.65 59.56 1wp1 s ILE 88 Cb -0.16 -2.11 0.07 0.00 0.01 0.00 0.00 42.46 40.26 1wp1 s ILE 88 CO 0.13 0.07 -0.06 -0.83 0.00 0.00 0.00 174.94 174.25 1wp1 s GLY 89 N 1.19 1.74 -0.88 6.18 0.00 -1.26 -4.95 107.32 109.33 1wp1 s GLY 89 Ca -0.06 -1.95 -0.25 0.00 0.00 0.00 0.00 44.72 42.46 1wp1 s GLY 89 CO -0.07 0.70 1.39 0.14 0.00 0.00 0.00 173.10 175.27 1wp1 s VAL 90 N 1.07 3.81 -0.11 1.40 1.01 -1.26 -4.91 120.40 121.42 1wp1 s VAL 90 Ca -0.04 -0.21 -0.14 0.00 0.00 0.00 0.00 61.98 61.60 1wp1 s VAL 90 Cb -0.20 -4.95 -0.12 0.00 0.00 0.00 0.00 36.38 31.12 1wp1 s VAL 90 CO -0.05 -1.86 0.42 0.44 0.00 0.00 0.00 175.10 174.04 1wp1 h ASP 91 N 10.05 -0.04 0.00 3.32 3.32 -2.07 -3.57 116.42 127.43 1wp1 h ASP 91 Ca -0.03 -0.40 0.00 0.00 0.02 0.00 0.00 57.03 56.62 1wp1 h ASP 91 Cb 1.03 0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.59 1wp1 h ASP 91 CO 1.35 0.64 0.00 1.07 -1.72 0.00 0.00 179.24 180.58 1wp1 n THR 122 N -4.75 0.00 1.66 0.35 5.66 -0.25 -5.38 114.28 111.57 1wp1 n THR 122 Ca -0.05 0.00 0.09 0.00 -3.05 0.00 0.00 64.05 61.05 1wp1 n THR 122 Cb 0.21 0.00 0.56 0.00 -1.55 0.00 0.00 70.33 69.55 1wp1 n THR 122 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1wp1 n ALA 123 N 0.00 2.44 -1.03 1.79 0.00 -1.26 -4.25 120.51 118.20 1wp1 n ALA 123 Ca 0.00 -0.12 -0.36 0.00 0.00 0.00 0.00 53.44 52.96 1wp1 n ALA 123 Cb 0.00 -1.31 0.06 0.00 0.00 0.00 0.00 19.45 18.20 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 -0.85 -3.32 -4.09 0.00 -0.00 -1.26 -4.83 117.44 103.09 1wp1 n TRP 124 Ca 0.14 0.16 -0.33 0.00 -0.00 0.00 0.00 57.50 57.47 1wp1 n TRP 124 Cb 0.06 -1.63 -0.16 0.00 -0.00 0.00 0.00 31.31 29.59 1wp1 n TRP 124 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 177.69 176.48 1wp1 s GLU 125 N -2.35 2.99 -1.54 5.87 2.02 -1.26 -3.64 118.70 120.80 1wp1 s GLU 125 Ca 0.50 -0.84 -0.10 0.00 0.02 0.00 0.00 54.97 54.55 1wp1 s GLU 125 Cb -0.26 -2.66 -0.07 0.00 0.10 0.00 0.00 34.13 31.24 1wp1 s GLU 125 CO 0.73 -0.23 2.77 -0.11 0.02 0.00 0.00 175.26 178.44 1wp1 n LEU 126 N 4.63 8.13 -4.62 1.80 7.94 -1.21 -4.85 117.00 128.83 1wp1 n LEU 126 Ca -0.20 -4.20 -0.40 0.00 -1.11 0.00 0.00 56.01 50.09 1wp1 n LEU 126 Cb 0.50 -1.54 -0.07 0.00 0.53 0.00 0.00 43.42 42.84 1wp1 n LEU 126 CO 0.26 1.78 0.31 -1.81 -1.11 0.00 0.00 177.39 176.82 1wp1 s ASP 127 N 2.47 6.49 -0.39 1.96 1.01 -1.26 -4.73 116.67 122.21 1wp1 s ASP 127 Ca 0.64 0.60 0.10 0.00 0.71 0.00 0.00 52.55 54.60 1wp1 s ASP 127 Cb 0.17 -2.30 0.44 0.00 1.01 0.00 0.00 42.92 42.23 1wp1 s ASP 127 CO -0.06 -0.32 1.05 0.18 0.21 0.00 0.00 175.17 176.23 1wp1 n LEU 128 N 5.60 3.48 0.00 1.23 4.77 -1.26 -4.90 117.00 125.92 1wp1 n LEU 128 Ca -0.03 -4.65 0.00 0.00 -0.03 0.00 0.00 56.01 51.31 1wp1 n LEU 128 Cb 0.49 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.46 1wp1 n LEU 128 CO 0.41 1.98 0.00 0.49 -1.33 0.00 0.00 177.39 178.95 1wp1 n PHE 129 N -0.32 0.00 -3.25 -1.77 0.99 -1.25 -4.76 117.46 107.10 1wp1 n PHE 129 Ca 0.28 0.00 -0.25 0.00 -0.00 0.00 0.00 57.45 57.48 1wp1 n PHE 129 Cb 0.72 0.00 -0.07 0.00 -1.00 0.00 0.00 39.48 39.13 1wp1 n PHE 129 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1wp1 n GLY 130 N 5.00 3.65 2.11 1.37 0.00 -1.26 -4.16 105.19 111.89 1wp1 n GLY 130 Ca 0.00 -2.01 0.00 0.00 0.00 0.00 0.00 46.02 44.01 1wp1 n GLY 130 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1wp1 n ARG 131 N 1.08 0.00 -0.16 1.61 0.63 -1.26 -3.62 116.66 114.94 1wp1 n ARG 131 Ca 0.25 0.00 -0.10 0.00 -0.92 0.00 0.00 57.85 57.07 1wp1 n ARG 131 Cb 0.50 0.00 -0.00 0.00 0.45 0.00 0.00 32.46 33.40 1wp1 n ARG 131 CO 0.00 0.00 0.00 1.25 -2.51 0.00 0.00 177.63 176.37 1wp1 h LEU 132 N 0.00 0.85 -0.02 6.15 6.46 -1.90 0.96 115.31 127.81 1wp1 h LEU 132 Ca 0.00 -0.33 0.00 0.00 -0.12 0.00 0.00 57.88 57.43 1wp1 h LEU 132 Cb 0.00 -0.23 0.00 0.00 -0.73 0.00 0.00 40.66 39.70 1wp1 h LEU 132 CO 0.00 0.98 -0.09 0.54 -0.62 0.00 0.00 178.44 179.25 1wp1 n ARG 133 N -4.31 0.11 -0.13 1.25 1.74 -1.26 -3.06 116.66 111.00 1wp1 n ARG 133 Ca 0.00 -0.02 -0.27 0.00 -0.77 0.00 0.00 57.85 56.79 1wp1 n ARG 133 Cb 0.34 -1.50 -0.11 0.00 -1.02 0.00 0.00 32.46 30.18 1wp1 n ARG 133 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1wp1 n SER 134 N -1.43 1.92 0.00 0.55 2.88 -1.00 -3.21 113.62 113.34 1wp1 n SER 134 Ca 0.08 0.37 0.10 0.00 -1.33 0.00 0.00 58.87 58.09 1wp1 n SER 134 Cb 0.32 -0.87 0.53 0.00 -0.75 0.00 0.00 64.21 63.44 1wp1 n SER 134 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1wp1 n LEU 135 N -4.31 0.00 -0.00 2.46 4.77 0.30 -2.00 117.00 118.22 1wp1 n LEU 135 Ca -0.47 0.25 0.01 0.00 -0.03 0.00 0.00 56.01 55.78 1wp1 n LEU 135 Cb 0.82 -0.25 -0.11 0.00 -2.33 0.00 0.00 43.42 41.54 1wp1 n LEU 135 CO 0.09 -0.08 -0.57 -2.11 -1.33 0.00 0.00 177.39 173.38 1wp1 n ARG 136 N -1.25 0.64 -0.07 3.23 -4.01 -1.17 -3.85 116.66 110.18 1wp1 n ARG 136 Ca 0.10 0.06 -0.13 0.00 -1.04 0.00 0.00 57.85 56.85 1wp1 n ARG 136 Cb 0.15 -1.68 -0.06 0.00 -3.04 0.00 0.00 32.46 27.83 1wp1 n ARG 136 CO 0.00 0.00 0.00 -0.44 -3.04 0.00 0.00 177.63 174.15 1wp1 h ASP 137 N 0.00 0.46 -0.66 2.89 3.45 -1.37 -3.03 116.42 118.17 1wp1 h ASP 137 Ca -0.20 -0.46 -0.04 0.00 0.43 0.00 0.00 57.03 56.76 1wp1 h ASP 137 Cb 1.55 -0.13 -0.03 0.00 -0.56 0.00 0.00 39.33 40.16 1wp1 h ASP 137 CO 0.03 0.83 0.27 0.06 -1.57 0.00 0.00 179.24 178.86 1wp1 h GLN 138 N 0.10 0.99 -0.40 3.56 3.07 -1.72 -2.89 115.11 117.83 1wp1 h GLN 138 Ca 0.03 -0.18 0.05 0.00 0.09 0.00 0.00 58.65 58.65 1wp1 h GLN 138 Cb 0.69 -0.16 -0.08 0.00 0.08 0.00 0.00 27.48 28.00 1wp1 h GLN 138 CO 0.04 0.82 -0.53 0.00 0.09 0.00 0.00 178.83 179.25 1wp1 h ALA 139 N 1.12 -0.71 -1.03 0.06 0.00 -1.66 0.18 119.26 117.22 1wp1 h ALA 139 Ca 0.22 0.01 0.26 0.00 0.00 0.00 0.00 54.91 55.40 1wp1 h ALA 139 Cb 0.20 1.07 -0.11 0.00 0.00 0.00 0.00 17.79 18.95 1wp1 h ALA 139 CO -0.02 -1.02 0.64 1.25 0.00 0.00 0.00 179.25 180.10 1wp1 h LEU 140 N -0.39 0.55 0.16 0.00 5.85 -1.39 0.23 115.31 120.32 1wp1 h LEU 140 Ca 0.09 0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.90 1wp1 h LEU 140 Cb 0.60 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.65 1wp1 h LEU 140 CO -0.59 0.10 -0.08 -0.33 -0.34 0.00 0.00 178.44 177.21 1wp1 h GLU 141 N 0.48 -0.20 0.00 1.25 4.39 -0.82 0.50 114.58 120.17 1wp1 h GLU 141 Ca 0.62 0.01 0.00 0.00 0.34 0.00 0.00 59.36 60.33 1wp1 h GLU 141 Cb 1.38 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 30.08 1wp1 h GLU 141 CO -0.38 0.22 0.25 1.04 -1.16 0.00 0.00 179.01 178.99 1wp1 n GLN 142 N -4.91 0.10 -0.06 2.33 6.02 0.43 0.13 117.38 121.42 1wp1 n GLN 142 Ca -0.07 0.58 -0.04 0.00 -0.01 0.00 0.00 57.00 57.46 1wp1 n GLN 142 Cb 0.26 -2.07 -0.03 0.00 1.02 0.00 0.00 30.24 29.41 1wp1 n GLN 142 CO 0.00 0.00 0.00 -0.92 -1.01 0.00 0.00 177.06 175.13 1wp1 h TYR 143 N 0.00 0.00 0.00 1.08 3.20 -0.13 -3.05 116.97 118.07 1wp1 h TYR 143 Ca 0.00 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.83 1wp1 h TYR 143 Cb 0.50 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.77 1wp1 h TYR 143 CO 0.00 0.26 -0.17 -0.07 -1.64 0.00 0.00 178.16 176.54 1wp1 h LEU 144 N -1.00 0.00 -0.29 2.82 3.38 0.23 0.18 115.31 120.63 1wp1 h LEU 144 Ca -0.00 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.80 1wp1 h LEU 144 Cb 0.27 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 1wp1 h LEU 144 CO -0.00 0.17 -0.46 0.00 0.09 0.00 0.00 178.44 178.24 1wp1 h ALA 145 N 1.83 0.45 -0.62 1.53 0.00 0.89 -1.47 119.26 121.86 1wp1 h ALA 145 Ca -0.00 -0.48 -0.05 0.00 0.00 0.00 0.00 54.91 54.38 1wp1 h ALA 145 Cb 0.32 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1wp1 h ALA 145 CO 0.02 0.60 0.18 1.15 0.00 0.00 0.00 179.25 181.21 1wp1 h THR 146 N 0.59 1.25 0.00 0.00 2.02 -0.95 0.22 112.91 116.05 1wp1 h THR 146 Ca 0.02 -0.86 -0.01 0.00 0.77 0.00 0.00 66.41 66.33 1wp1 h THR 146 Cb 1.06 0.62 -0.00 0.00 -1.74 0.00 0.00 68.15 68.10 1wp1 h THR 146 CO 0.11 0.33 -0.05 -0.08 0.37 0.00 0.00 175.52 176.19 1wp1 h GLU 147 N 0.90 0.00 0.12 6.66 4.81 -0.63 -0.92 114.58 125.52 1wp1 h GLU 147 Ca 0.20 0.00 -0.30 0.00 -0.13 0.00 0.00 59.36 59.13 1wp1 h GLU 147 Cb 0.31 0.00 0.03 0.00 0.63 0.00 0.00 28.75 29.72 1wp1 h GLU 147 CO -0.00 0.05 -1.25 1.96 -0.73 0.00 0.00 179.01 179.03 1wp1 h GLN 148 N 0.00 0.63 -0.61 1.92 1.08 -0.41 -2.88 115.11 114.84 1wp1 h GLN 148 Ca -0.00 -0.84 0.17 0.00 -1.45 0.00 0.00 58.65 56.52 1wp1 h GLN 148 Cb 0.09 0.28 -0.03 0.00 -0.05 0.00 0.00 27.48 27.77 1wp1 h GLN 148 CO 0.01 1.39 0.44 0.00 -0.95 0.00 0.00 178.83 179.71 1wp1 h ALA 149 N 0.28 2.51 -0.08 3.87 0.00 0.70 0.24 119.26 126.78 1wp1 h ALA 149 Ca -0.19 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 1wp1 h ALA 149 Cb 1.93 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.75 1wp1 h ALA 149 CO 0.24 -0.68 -0.19 0.37 0.00 0.00 0.00 179.25 178.99 1wp1 h GLN 150 N 0.05 0.27 -0.43 0.00 4.15 -1.28 -1.41 115.11 116.46 1wp1 h GLN 150 Ca 0.29 -0.19 0.04 0.00 0.77 0.00 0.00 58.65 59.56 1wp1 h GLN 150 Cb 1.10 0.03 -0.04 0.00 0.21 0.00 0.00 27.48 28.78 1wp1 h GLN 150 CO -0.02 0.79 0.22 0.00 -1.93 0.00 0.00 178.83 177.89 1wp1 h ARG 151 N -0.21 0.42 -0.19 1.69 3.08 -0.44 -0.08 114.38 118.65 1wp1 h ARG 151 Ca -0.00 -0.03 0.05 0.00 0.07 0.00 0.00 59.98 60.07 1wp1 h ARG 151 Cb 0.80 -0.09 -0.05 0.00 0.08 0.00 0.00 29.97 30.70 1wp1 h ARG 151 CO 0.04 0.28 -0.11 1.03 -1.07 0.00 0.00 179.97 180.14 1wp1 h SER 152 N 0.43 -0.37 -0.40 7.04 0.87 -0.80 -0.95 113.55 119.38 1wp1 h SER 152 Ca 0.19 0.08 0.09 0.00 -1.23 0.00 0.00 61.79 60.92 1wp1 h SER 152 Cb 0.10 0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 62.23 1wp1 h SER 152 CO -0.13 -0.15 0.28 0.00 -0.53 0.00 0.00 176.83 176.30 1wp1 h ALA 153 N 1.05 2.20 -0.14 6.23 0.00 0.05 -1.40 119.26 127.25 1wp1 h ALA 153 Ca 0.11 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.84 1wp1 h ALA 153 Cb 0.26 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.05 1wp1 h ALA 153 CO -0.25 -0.30 -0.55 0.37 0.00 0.00 0.00 179.25 178.52 1wp1 h GLN 154 N 0.14 0.62 -0.41 0.00 4.15 0.23 -2.41 115.11 117.43 1wp1 h GLN 154 Ca 0.19 -0.48 -0.11 0.00 0.77 0.00 0.00 58.65 59.02 1wp1 h GLN 154 Cb 0.56 0.09 -0.02 0.00 0.21 0.00 0.00 27.48 28.33 1wp1 h GLN 154 CO -0.02 1.10 -0.18 1.79 -1.93 0.00 0.00 178.83 179.59 1wp1 h THR 155 N 0.27 1.27 -0.97 2.39 1.35 -0.74 -0.58 112.91 115.90 1wp1 h THR 155 Ca -0.03 -1.28 0.01 0.00 -0.55 0.00 0.00 66.41 64.57 1wp1 h THR 155 Cb 1.18 1.15 -0.05 0.00 -1.73 0.00 0.00 68.15 68.70 1wp1 h THR 155 CO 0.12 0.43 0.64 0.74 -0.25 0.00 0.00 175.52 177.20 1wp1 h THR 156 N 0.69 1.24 -0.17 6.82 2.02 -1.32 -2.02 112.91 120.18 1wp1 h THR 156 Ca 0.10 -0.45 -0.12 0.00 0.77 0.00 0.00 66.41 66.72 1wp1 h THR 156 Cb 0.68 -0.18 0.00 0.00 -1.74 0.00 0.00 68.15 66.91 1wp1 h THR 156 CO 0.05 0.24 -0.36 0.25 0.37 0.00 0.00 175.52 176.07 1wp1 h LEU 157 N 1.31 0.60 -0.23 2.58 5.85 -0.88 -0.25 115.31 124.29 1wp1 h LEU 157 Ca 0.36 -0.56 0.06 0.00 0.84 0.00 0.00 57.88 58.58 1wp1 h LEU 157 Cb -0.13 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 40.66 1wp1 h LEU 157 CO -0.08 1.05 -0.19 0.58 -0.34 0.00 0.00 178.44 179.46 1wp1 h VAL 158 N 0.18 0.49 -0.67 1.05 2.07 -1.08 0.34 116.25 118.63 1wp1 h VAL 158 Ca 0.00 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.53 1wp1 h VAL 158 Cb 0.96 0.49 -0.03 0.00 -1.52 0.00 0.00 31.29 31.18 1wp1 h VAL 158 CO 0.08 0.00 0.44 0.00 0.02 0.00 0.00 177.57 178.11 1wp1 h ALA 159 N 0.92 0.85 -0.19 1.67 0.00 -1.16 0.96 119.26 122.30 1wp1 h ALA 159 Ca 0.13 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.88 1wp1 h ALA 159 Cb 0.39 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1wp1 h ALA 159 CO -0.34 0.28 -0.37 0.77 0.00 0.00 0.00 179.25 179.59 1wp1 h SER 160 N 0.91 0.43 0.40 0.00 0.02 -0.35 0.81 113.55 115.77 1wp1 h SER 160 Ca 0.24 -0.17 -0.02 0.00 -0.84 0.00 0.00 61.79 61.00 1wp1 h SER 160 Cb -0.10 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.33 1wp1 h SER 160 CO -0.05 0.76 -0.19 0.58 -1.14 0.00 0.00 176.83 176.79 1wp1 h VAL 161 N 0.35 0.50 -0.48 2.27 2.07 0.65 0.10 116.25 121.70 1wp1 h VAL 161 Ca 0.04 -0.54 0.09 0.00 0.82 0.00 0.00 66.70 67.11 1wp1 h VAL 161 Cb 0.81 0.72 -0.10 0.00 -1.52 0.00 0.00 31.29 31.19 1wp1 h VAL 161 CO 0.06 0.08 -0.27 0.00 0.02 0.00 0.00 177.57 177.46 1wp1 h ALA 162 N -0.51 0.01 -0.23 1.67 0.00 -0.71 0.75 119.26 120.24 1wp1 h ALA 162 Ca -0.06 0.15 0.04 0.00 0.00 0.00 0.00 54.91 55.04 1wp1 h ALA 162 Cb 0.55 0.64 -0.04 0.00 0.00 0.00 0.00 17.79 18.94 1wp1 h ALA 162 CO 0.09 -0.63 -0.02 1.15 0.00 0.00 0.00 179.25 179.84 1wp1 h THR 163 N -0.17 0.81 -0.73 0.00 2.02 -0.81 0.18 112.91 114.21 1wp1 h THR 163 Ca 0.21 -0.02 0.06 0.00 0.77 0.00 0.00 66.41 67.44 1wp1 h THR 163 Cb 0.51 0.76 -0.06 0.00 -1.74 0.00 0.00 68.15 67.63 1wp1 h THR 163 CO -0.58 0.01 0.42 0.00 0.37 0.00 0.00 175.52 175.74 1wp1 h ALA 164 N 1.21 0.99 -0.02 6.16 0.00 0.20 0.94 119.26 128.75 1wp1 h ALA 164 Ca 0.11 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1wp1 h ALA 164 Cb 0.15 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1wp1 h ALA 164 CO -0.20 0.11 0.01 -0.92 0.00 0.00 0.00 179.25 178.25 1wp1 h TYR 165 N 0.77 0.03 -0.73 0.00 3.20 -0.40 -1.75 116.97 118.09 1wp1 h TYR 165 Ca 0.33 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 62.15 1wp1 h TYR 165 Cb 0.20 -0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.43 1wp1 h TYR 165 CO -0.07 0.17 0.28 -0.07 -1.64 0.00 0.00 178.16 176.83 1wp1 h LEU 166 N -0.12 1.02 -0.77 2.82 3.38 -0.26 -1.11 115.31 120.27 1wp1 h LEU 166 Ca 0.01 -0.18 0.01 0.00 0.09 0.00 0.00 57.88 57.81 1wp1 h LEU 166 Cb 0.15 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.60 1wp1 h LEU 166 CO -0.00 0.92 0.51 0.74 0.09 0.00 0.00 178.44 180.70 1wp1 h THR 167 N 1.05 1.19 -0.32 0.22 2.02 -0.75 0.61 112.91 116.94 1wp1 h THR 167 Ca 0.24 -0.35 -0.04 0.00 0.77 0.00 0.00 66.41 67.03 1wp1 h THR 167 Cb 0.23 0.07 -0.01 0.00 -1.74 0.00 0.00 68.15 66.69 1wp1 h THR 167 CO -0.02 0.19 0.04 0.25 0.37 0.00 0.00 175.52 176.35 1wp1 h LEU 168 N 1.03 0.51 -0.88 2.58 5.85 -0.71 -1.83 115.31 121.86 1wp1 h LEU 168 Ca 0.28 -0.27 0.06 0.00 0.84 0.00 0.00 57.88 58.80 1wp1 h LEU 168 Cb -0.11 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 40.72 1wp1 h LEU 168 CO -0.07 0.65 0.55 0.50 -0.34 0.00 0.00 178.44 179.74 1wp1 h LYS 169 N 0.35 0.99 -0.07 1.25 3.64 -0.86 0.38 116.57 122.24 1wp1 h LYS 169 Ca 0.10 -0.06 -0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1wp1 h LYS 169 Cb 0.36 -0.22 -0.00 0.00 -0.41 0.00 0.00 32.23 31.96 1wp1 h LYS 169 CO 0.01 0.65 0.04 0.00 -2.27 0.00 0.00 179.45 177.88 1wp1 h ALA 170 N 1.41 0.09 0.00 5.00 0.00 -0.66 -1.70 119.26 123.40 1wp1 h ALA 170 Ca 0.38 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 55.16 1wp1 h ALA 170 Cb 0.16 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1wp1 h ALA 170 CO -0.17 -0.37 -0.40 -0.44 0.00 0.00 0.00 179.25 177.87 1wp1 h ASP 171 N 0.02 0.00 -0.23 0.00 3.32 -0.94 -0.25 116.42 118.34 1wp1 h ASP 171 Ca 0.03 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 1wp1 h ASP 171 Cb 0.08 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 1wp1 h ASP 171 CO -0.00 0.40 0.10 1.56 -1.72 0.00 0.00 179.24 179.58 1wp1 h GLN 172 N 0.00 0.33 -0.65 3.56 4.20 -0.73 0.88 115.11 122.70 1wp1 h GLN 172 Ca -0.00 -0.05 0.11 0.00 0.06 0.00 0.00 58.65 58.77 1wp1 h GLN 172 Cb 0.76 -0.06 -0.08 0.00 0.30 0.00 0.00 27.48 28.40 1wp1 h GLN 172 CO 0.05 0.36 0.22 0.00 -0.67 0.00 0.00 178.83 178.79 1wp1 h ALA 173 N 0.95 0.85 -0.57 3.87 0.00 -0.72 0.11 119.26 123.75 1wp1 h ALA 173 Ca 0.08 0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.06 1wp1 h ALA 173 Cb 0.14 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1wp1 h ALA 173 CO -0.01 -0.23 0.22 1.96 0.00 0.00 0.00 179.25 181.19 1wp1 h GLN 174 N 0.38 0.86 -0.09 0.00 1.08 -0.75 0.19 115.11 116.78 1wp1 h GLN 174 Ca 0.34 -0.16 0.00 0.00 -1.45 0.00 0.00 58.65 57.38 1wp1 h GLN 174 Cb 0.48 -0.14 -0.00 0.00 -0.05 0.00 0.00 27.48 27.77 1wp1 h GLN 174 CO -0.36 0.75 0.06 1.25 -0.95 0.00 0.00 178.83 179.57 1wp1 h LEU 175 N 0.78 0.10 -0.44 1.46 5.85 -0.27 0.18 115.31 122.98 1wp1 h LEU 175 Ca 0.19 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.88 1wp1 h LEU 175 Cb 0.22 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 1wp1 h LEU 175 CO -0.01 0.09 0.23 -0.61 -0.34 0.00 0.00 178.44 177.80 1wp1 h GLN 176 N 0.10 0.62 -0.37 1.25 5.75 -0.49 -0.08 115.11 121.90 1wp1 h GLN 176 Ca 0.03 -0.08 -0.01 0.00 -0.15 0.00 0.00 58.65 58.44 1wp1 h GLN 176 Cb 0.01 -0.12 -0.02 0.00 1.07 0.00 0.00 27.48 28.42 1wp1 h GLN 176 CO -0.01 0.51 0.19 1.25 -2.65 0.00 0.00 178.83 178.12 1wp1 h LEU 177 N 0.57 0.47 -0.52 -2.39 5.85 -0.47 -1.49 115.31 117.33 1wp1 h LEU 177 Ca 0.15 -0.10 0.04 0.00 0.84 0.00 0.00 57.88 58.81 1wp1 h LEU 177 Cb 0.08 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 40.95 1wp1 h LEU 177 CO -0.02 0.43 0.27 0.74 -0.34 0.00 0.00 178.44 179.52 1wp1 h THR 178 N 0.46 0.97 -0.19 1.05 2.02 -0.47 -0.43 112.91 116.31 1wp1 h THR 178 Ca 0.13 -0.18 0.05 0.00 0.77 0.00 0.00 66.41 67.18 1wp1 h THR 178 Cb 0.08 0.40 -0.05 0.00 -1.74 0.00 0.00 68.15 66.84 1wp1 h THR 178 CO -0.02 0.10 -0.12 0.11 0.37 0.00 0.00 175.52 175.96 1wp1 h LYS 179 N 0.52 -0.11 -0.58 6.66 1.57 -0.38 0.28 116.57 124.53 1wp1 h LYS 179 Ca 0.23 0.01 0.08 0.00 -1.87 0.00 0.00 60.65 59.10 1wp1 h LYS 179 Cb 0.12 0.02 -0.07 0.00 0.08 0.00 0.00 32.23 32.39 1wp1 h LYS 179 CO -0.15 -0.07 0.22 -0.44 -0.57 0.00 0.00 179.45 178.44 1wp1 h ASP 180 N -0.11 0.23 -0.18 0.86 3.32 -1.14 -1.64 116.42 117.76 1wp1 h ASP 180 Ca 0.11 0.07 -0.05 0.00 0.02 0.00 0.00 57.03 57.18 1wp1 h ASP 180 Cb 0.28 0.05 -0.00 0.00 0.22 0.00 0.00 39.33 39.87 1wp1 h ASP 180 CO -0.26 0.15 -0.09 0.74 -1.72 0.00 0.00 179.24 178.06 1wp1 h THR 181 N 0.41 1.31 -0.46 0.35 2.02 -0.15 -1.59 112.91 114.80 1wp1 h THR 181 Ca 0.29 -1.14 0.06 0.00 0.77 0.00 0.00 66.41 66.39 1wp1 h THR 181 Cb 0.33 1.68 -0.06 0.00 -1.74 0.00 0.00 68.15 68.36 1wp1 h THR 181 CO -0.28 0.34 0.15 0.25 0.37 0.00 0.00 175.52 176.35 1wp1 h LEU 182 N 0.06 0.13 -1.11 2.58 5.85 -0.29 -1.22 115.31 121.32 1wp1 h LEU 182 Ca 0.04 0.06 0.14 0.00 0.84 0.00 0.00 57.88 58.96 1wp1 h LEU 182 Cb 0.57 0.06 -0.08 0.00 0.37 0.00 0.00 40.66 41.57 1wp1 h LEU 182 CO 0.03 0.11 0.61 1.23 -0.34 0.00 0.00 178.44 180.07 1wp1 h GLY 183 N 0.31 1.51 0.56 3.75 0.00 -1.06 0.22 103.07 108.37 1wp1 h GLY 183 Ca 0.22 -0.37 -0.00 0.00 0.00 0.00 0.00 47.33 47.18 1wp1 h GLY 183 CO -0.24 0.10 -0.02 -0.84 0.00 0.00 0.00 176.54 175.54 1wp1 h THR 184 N 0.86 1.25 0.00 4.70 2.02 -0.71 -2.64 112.91 118.38 1wp1 h THR 184 Ca 0.49 -0.99 -0.01 0.00 0.77 0.00 0.00 66.41 66.67 1wp1 h THR 184 Cb 0.63 1.90 -0.00 0.00 -1.74 0.00 0.00 68.15 68.94 1wp1 h THR 184 CO -0.26 0.25 -0.04 1.88 0.37 0.00 0.00 175.52 177.72 1wp1 h TYR 185 N -0.50 0.00 -0.23 3.16 0.99 -0.83 -0.16 116.97 119.40 1wp1 h TYR 185 Ca -0.01 0.00 -0.13 0.00 2.00 0.00 0.00 58.73 60.59 1wp1 h TYR 185 Cb 0.45 0.00 -0.00 0.00 1.00 0.00 0.00 36.73 38.18 1wp1 h TYR 185 CO 0.07 0.04 -0.37 0.37 -0.00 0.00 0.00 178.16 178.27 1wp1 h GLN 186 N 0.00 0.65 -0.27 4.88 5.75 -0.57 -1.68 115.11 123.88 1wp1 h GLN 186 Ca -0.00 -0.40 -0.15 0.00 -0.15 0.00 0.00 58.65 57.96 1wp1 h GLN 186 Cb 0.08 0.04 -0.01 0.00 1.07 0.00 0.00 27.48 28.67 1wp1 h GLN 186 CO 0.01 1.01 -0.43 0.87 -2.65 0.00 0.00 178.83 177.64 1wp1 h LYS 187 N 0.35 0.66 -0.56 1.69 1.57 -1.03 -2.39 116.57 116.86 1wp1 h LYS 187 Ca 0.02 -0.35 -0.04 0.00 -1.87 0.00 0.00 60.65 58.40 1wp1 h LYS 187 Cb 0.96 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.26 1wp1 h LYS 187 CO 0.08 0.96 0.19 1.03 -0.57 0.00 0.00 179.45 181.15 1wp1 h SER 188 N 0.53 0.80 -0.88 0.86 0.87 -1.04 -0.66 113.55 114.02 1wp1 h SER 188 Ca 0.04 -0.19 0.02 0.00 -1.23 0.00 0.00 61.79 60.42 1wp1 h SER 188 Cb 0.96 -0.21 -0.05 0.00 -0.44 0.00 0.00 62.40 62.67 1wp1 h SER 188 CO 0.09 0.78 0.58 0.15 -0.53 0.00 0.00 176.83 177.90 1wp1 h PHE 189 N 0.77 1.10 0.00 2.24 3.57 -1.22 -0.91 116.94 122.48 1wp1 h PHE 189 Ca 0.18 0.03 -0.10 0.00 3.53 0.00 0.00 57.97 61.61 1wp1 h PHE 189 Cb 0.25 -0.37 -0.01 0.00 2.79 0.00 0.00 35.95 38.61 1wp1 h PHE 189 CO 0.01 0.67 -0.45 -0.44 -2.23 0.00 0.00 178.31 175.87 1wp1 h ASP 190 N 1.16 0.00 -0.23 0.41 3.32 -1.04 0.27 116.42 120.32 1wp1 h ASP 190 Ca 0.33 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 57.25 1wp1 h ASP 190 Cb -0.08 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 1wp1 h ASP 190 CO -0.08 0.45 -0.34 -0.07 -1.72 0.00 0.00 179.24 177.48 1wp1 h LEU 191 N 0.00 0.78 -0.04 1.55 3.38 -0.67 -2.71 115.31 117.61 1wp1 h LEU 191 Ca -0.00 -0.33 -0.19 0.00 0.09 0.00 0.00 57.88 57.45 1wp1 h LEU 191 Cb 1.03 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.54 1wp1 h LEU 191 CO 0.06 1.05 -0.91 0.74 0.09 0.00 0.00 178.44 179.47 1wp1 h THR 192 N 0.62 1.58 -0.29 0.22 2.02 -0.94 -2.51 112.91 113.63 1wp1 h THR 192 Ca 0.06 -3.19 -0.02 0.00 0.77 0.00 0.00 66.41 64.03 1wp1 h THR 192 Cb 0.87 2.75 -0.01 0.00 -1.74 0.00 0.00 68.15 70.02 1wp1 h THR 192 CO 0.08 0.89 0.09 -0.61 0.37 0.00 0.00 175.52 176.34 1wp1 h GLN 193 N 0.00 0.44 -0.01 6.66 5.75 -0.45 -1.68 115.11 125.83 1wp1 h GLN 193 Ca -0.01 -0.09 -0.17 0.00 -0.15 0.00 0.00 58.65 58.23 1wp1 h GLN 193 Cb 1.68 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 30.15 1wp1 h GLN 193 CO 0.12 0.50 -0.76 0.00 -2.65 0.00 0.00 178.83 176.03 1wp1 h ARG 194 N 0.30 0.11 -0.20 1.69 3.08 -1.53 -2.35 114.38 115.48 1wp1 h ARG 194 Ca 0.09 -0.10 -0.15 0.00 0.07 0.00 0.00 59.98 59.89 1wp1 h ARG 194 Cb 0.23 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.31 1wp1 h ARG 194 CO -0.00 0.81 -0.47 1.03 -1.07 0.00 0.00 179.97 180.27 1wp1 h SER 195 N 0.07 0.76 -0.66 7.04 0.87 -1.43 -1.88 113.55 118.31 1wp1 h SER 195 Ca -0.02 -0.57 -0.01 0.00 -1.23 0.00 0.00 61.79 59.97 1wp1 h SER 195 Cb 1.34 -0.22 -0.03 0.00 -0.44 0.00 0.00 62.40 63.05 1wp1 h SER 195 CO 0.11 1.19 0.39 0.22 -0.53 0.00 0.00 176.83 178.21 1wp1 h TYR 196 N 0.36 0.88 -0.04 2.24 3.20 -1.33 0.06 116.97 122.34 1wp1 h TYR 196 Ca -0.00 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.86 1wp1 h TYR 196 Cb 1.08 -0.29 -0.00 0.00 1.54 0.00 0.00 36.73 39.06 1wp1 h TYR 196 CO 0.09 0.60 0.02 -0.44 -1.64 0.00 0.00 178.16 176.78 1wp1 h ASP 197 N 0.92 0.06 0.00 -2.11 3.32 -1.16 -1.02 116.42 116.44 1wp1 h ASP 197 Ca 0.24 -0.14 0.00 0.00 0.02 0.00 0.00 57.03 57.15 1wp1 h ASP 197 Cb -0.02 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.51 1wp1 h ASP 197 CO -0.04 0.18 0.00 1.33 -1.72 0.00 0.00 179.24 178.99 1wp1 n VAL 198 N -4.98 0.00 -3.14 -1.35 0.24 -0.73 -4.89 118.33 103.48 1wp1 n VAL 198 Ca -0.07 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.09 1wp1 n VAL 198 Cb 0.10 -0.30 0.06 0.00 -1.47 0.00 0.00 33.84 32.23 1wp1 n VAL 198 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1wp1 n GLY 199 N 0.16 -0.10 0.67 7.63 0.00 -0.39 -4.97 105.19 108.20 1wp1 n GLY 199 Ca 0.03 -0.05 -0.10 0.00 0.00 0.00 0.00 46.02 45.90 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 -3.76 0.53 -3.51 1.61 0.31 -0.03 -5.00 118.33 108.47 1wp1 n VAL 200 Ca -0.09 -0.14 -0.35 0.00 -0.01 0.00 0.00 64.34 63.75 1wp1 n VAL 200 Cb 0.58 -1.59 -0.06 0.00 -0.91 0.00 0.00 33.84 31.86 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 -2.18 3.68 0.87 3.52 0.00 -1.20 -4.95 121.76 121.50 1wp1 s ALA 201 Ca -0.13 -0.29 -0.13 0.00 0.00 0.00 0.00 51.96 51.40 1wp1 s ALA 201 Cb 0.05 -2.35 0.13 0.00 0.00 0.00 0.00 23.12 20.95 1wp1 s ALA 201 CO 0.17 0.53 1.23 -1.54 0.00 0.00 0.00 175.76 176.15 1wp1 s SER 202 N -1.67 3.92 0.26 0.00 1.04 -1.26 -4.10 113.70 111.90 1wp1 s SER 202 Ca 0.33 0.53 0.03 0.00 0.48 0.00 0.00 55.95 57.32 1wp1 s SER 202 Cb -0.15 -0.84 0.33 0.00 0.10 0.00 0.00 66.02 65.47 1wp1 s SER 202 CO 0.18 -2.25 1.64 0.00 0.98 0.00 0.00 173.24 173.79 1wp1 h ALA 203 N -1.28 0.97 0.12 5.32 0.00 -1.98 -2.42 119.26 119.99 1wp1 h ALA 203 Ca -0.45 -0.44 0.01 0.00 0.00 0.00 0.00 54.91 54.03 1wp1 h ALA 203 Cb 1.29 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.97 1wp1 h ALA 203 CO 0.53 0.63 -0.14 1.25 0.00 0.00 0.00 179.25 181.52 1wp1 h LEU 204 N 0.30 -0.38 -0.46 0.00 5.85 -1.99 -1.00 115.31 117.64 1wp1 h LEU 204 Ca 0.02 0.04 0.07 0.00 0.84 0.00 0.00 57.88 58.85 1wp1 h LEU 204 Cb 0.89 0.14 -0.09 0.00 0.37 0.00 0.00 40.66 41.97 1wp1 h LEU 204 CO 0.07 -0.21 -0.49 0.44 -0.34 0.00 0.00 178.44 177.91 1wp1 h ASP 205 N -0.30 -1.65 -0.36 1.25 3.32 -1.88 0.22 116.42 117.01 1wp1 h ASP 205 Ca 0.01 0.24 0.07 0.00 0.02 0.00 0.00 57.03 57.37 1wp1 h ASP 205 Cb 0.30 0.71 -0.06 0.00 0.22 0.00 0.00 39.33 40.49 1wp1 h ASP 205 CO -0.06 -0.38 -0.05 0.25 -1.72 0.00 0.00 179.24 177.28 1wp1 h LEU 206 N -0.33 -0.26 -0.76 1.55 5.85 -1.20 0.61 115.31 120.77 1wp1 h LEU 206 Ca 0.12 0.10 -0.08 0.00 0.84 0.00 0.00 57.88 58.86 1wp1 h LEU 206 Cb 0.58 0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.78 1wp1 h LEU 206 CO -0.62 -0.09 0.08 0.03 -0.34 0.00 0.00 178.44 177.51 1wp1 h ARG 207 N 0.04 1.03 0.46 1.25 2.47 -0.52 -1.62 114.38 117.48 1wp1 h ARG 207 Ca 0.18 -0.27 -0.01 0.00 -1.26 0.00 0.00 59.98 58.61 1wp1 h ARG 207 Cb 0.26 -0.12 -0.01 0.00 -1.65 0.00 0.00 29.97 28.45 1wp1 h ARG 207 CO -0.34 0.95 -0.30 1.96 0.56 0.00 0.00 179.97 182.80 1wp1 h GLN 208 N 0.96 -0.71 -0.85 0.04 4.20 -0.04 -1.94 115.11 116.78 1wp1 h GLN 208 Ca 0.19 0.05 0.22 0.00 0.06 0.00 0.00 58.65 59.16 1wp1 h GLN 208 Cb 0.44 0.16 -0.14 0.00 0.30 0.00 0.00 27.48 28.24 1wp1 h GLN 208 CO 0.01 -0.47 0.19 0.00 -0.67 0.00 0.00 178.83 177.90 1wp1 h ALA 209 N -0.26 1.16 -0.65 3.87 0.00 -0.67 -1.20 119.26 121.50 1wp1 h ALA 209 Ca -0.05 0.22 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 1wp1 h ALA 209 Cb 0.61 0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.69 1wp1 h ALA 209 CO 0.04 -0.44 0.18 0.37 0.00 0.00 0.00 179.25 179.40 1wp1 h GLN 210 N 0.20 1.01 -0.54 0.00 4.15 -0.96 -2.66 115.11 116.30 1wp1 h GLN 210 Ca 0.51 -0.21 0.07 0.00 0.77 0.00 0.00 58.65 59.79 1wp1 h GLN 210 Cb 1.00 -0.15 -0.06 0.00 0.21 0.00 0.00 27.48 28.49 1wp1 h GLN 210 CO -0.64 0.88 0.24 1.15 -1.93 0.00 0.00 178.83 178.53 1wp1 h THR 211 N 0.97 0.87 -0.53 2.39 2.02 -0.44 -1.38 112.91 116.82 1wp1 h THR 211 Ca 0.21 -0.15 0.09 0.00 0.77 0.00 0.00 66.41 67.32 1wp1 h THR 211 Cb 0.31 0.38 -0.07 0.00 -1.74 0.00 0.00 68.15 67.03 1wp1 h THR 211 CO -0.00 0.08 0.13 0.00 0.37 0.00 0.00 175.52 176.10 1wp1 h ALA 212 N 1.33 0.62 0.27 6.16 0.00 -1.32 -2.78 119.26 123.54 1wp1 h ALA 212 Ca 0.26 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.25 1wp1 h ALA 212 Cb 0.24 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1wp1 h ALA 212 CO -0.22 -0.28 -0.13 0.28 0.00 0.00 0.00 179.25 178.90 1wp1 h VAL 213 N 0.28 0.75 -0.47 0.00 2.07 -1.14 -2.00 116.25 115.74 1wp1 h VAL 213 Ca 0.27 -0.11 -0.02 0.00 0.82 0.00 0.00 66.70 67.65 1wp1 h VAL 213 Cb 0.35 0.81 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 1wp1 h VAL 213 CO -0.32 0.02 0.21 -0.33 0.02 0.00 0.00 177.57 177.17 1wp1 h GLU 214 N -0.42 0.70 -0.21 1.57 4.39 -1.41 -0.17 114.58 119.03 1wp1 h GLU 214 Ca -0.04 -0.12 0.05 0.00 0.34 0.00 0.00 59.36 59.60 1wp1 h GLU 214 Cb 0.32 -0.12 -0.07 0.00 -0.10 0.00 0.00 28.75 28.78 1wp1 h GLU 214 CO 0.06 0.61 -0.42 0.78 -1.16 0.00 0.00 179.01 178.89 1wp1 h GLY 215 N 0.62 -0.65 1.36 -3.84 0.00 -1.42 -0.46 103.07 98.68 1wp1 h GLY 215 Ca 0.16 0.52 -0.01 0.00 0.00 0.00 0.00 47.33 48.00 1wp1 h GLY 215 CO -0.02 -0.21 0.32 0.00 0.00 0.00 0.00 176.54 176.63 1wp1 h ALA 216 N 0.22 1.42 -0.57 3.60 0.00 -0.91 -1.31 119.26 121.72 1wp1 h ALA 216 Ca 0.09 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1wp1 h ALA 216 Cb 0.61 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 1wp1 h ALA 216 CO -0.44 0.47 0.34 -0.09 0.00 0.00 0.00 179.25 179.53 1wp1 h ARG 217 N 0.85 0.77 -0.40 0.00 2.43 -0.62 0.14 114.38 117.55 1wp1 h ARG 217 Ca 0.22 -0.07 0.02 0.00 -0.81 0.00 0.00 59.98 59.34 1wp1 h ARG 217 Cb 0.04 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.40 1wp1 h ARG 217 CO -0.03 0.56 0.22 0.00 -1.51 0.00 0.00 179.97 179.21 1wp1 h ALA 218 N 1.17 0.51 -0.54 2.80 0.00 -0.30 -2.31 119.26 120.59 1wp1 h ALA 218 Ca 0.20 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.04 1wp1 h ALA 218 Cb -0.01 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1wp1 h ALA 218 CO -0.04 -0.12 0.04 1.15 0.00 0.00 0.00 179.25 180.28 1wp1 h THR 219 N 0.45 1.25 -0.07 0.00 2.02 -0.79 -1.51 112.91 114.27 1wp1 h THR 219 Ca 0.16 -1.01 0.04 0.00 0.77 0.00 0.00 66.41 66.37 1wp1 h THR 219 Cb 0.04 0.79 -0.06 0.00 -1.74 0.00 0.00 68.15 67.18 1wp1 h THR 219 CO -0.09 0.36 -0.32 0.25 0.37 0.00 0.00 175.52 176.09 1wp1 h LEU 220 N 0.84 -0.98 -0.42 2.58 5.85 -0.41 -0.11 115.31 122.65 1wp1 h LEU 220 Ca 0.16 0.14 0.08 0.00 0.84 0.00 0.00 57.88 59.10 1wp1 h LEU 220 Cb 0.45 0.41 -0.07 0.00 0.37 0.00 0.00 40.66 41.81 1wp1 h LEU 220 CO 0.02 -0.37 0.02 0.00 -0.34 0.00 0.00 178.44 177.77 1wp1 h ALA 221 N 0.34 0.41 -0.15 1.25 0.00 -1.00 -0.72 119.26 119.38 1wp1 h ALA 221 Ca 0.08 0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.12 1wp1 h ALA 221 Cb 0.55 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 1wp1 h ALA 221 CO -0.31 -0.37 0.04 0.37 0.00 0.00 0.00 179.25 178.98 1wp1 h GLN 222 N 0.14 0.10 0.00 0.00 4.15 -0.69 -1.79 115.11 117.02 1wp1 h GLN 222 Ca 0.21 -0.01 -0.05 0.00 0.77 0.00 0.00 58.65 59.57 1wp1 h GLN 222 Cb 0.29 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.95 1wp1 h GLN 222 CO -0.33 0.07 -0.26 1.88 -1.93 0.00 0.00 178.83 178.26 1wp1 h TYR 223 N 0.11 0.00 -0.31 3.99 0.99 -0.63 -1.57 116.97 119.56 1wp1 h TYR 223 Ca 0.06 0.00 0.02 0.00 2.00 0.00 0.00 58.73 60.81 1wp1 h TYR 223 Cb 0.05 0.00 -0.02 0.00 1.00 0.00 0.00 36.73 37.75 1wp1 h TYR 223 CO -0.12 0.26 0.16 1.15 -0.00 0.00 0.00 178.16 179.61 1wp1 h THR 224 N 0.00 1.01 -0.14 -2.88 2.02 -0.75 -1.36 112.91 110.80 1wp1 h THR 224 Ca -0.00 -0.11 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 1wp1 h THR 224 Cb 0.71 0.64 -0.01 0.00 -1.74 0.00 0.00 68.15 67.75 1wp1 h THR 224 CO 0.03 0.06 0.06 -0.09 0.37 0.00 0.00 175.52 175.95 1wp1 h ARG 225 N 0.34 0.21 -0.40 6.66 2.43 -0.62 -3.00 114.38 120.00 1wp1 h ARG 225 Ca 0.12 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.20 1wp1 h ARG 225 Cb 0.03 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 1wp1 h ARG 225 CO -0.08 0.31 0.02 -0.07 -1.51 0.00 0.00 179.97 178.65 1wp1 h LEU 226 N 0.07 0.60 0.78 3.80 3.38 -1.16 0.40 115.31 123.18 1wp1 h LEU 226 Ca 0.05 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 57.86 1wp1 h LEU 226 Cb 0.18 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 1wp1 h LEU 226 CO -0.00 0.65 -0.46 0.58 0.09 0.00 0.00 178.44 179.30 1wp1 h VAL 227 N 0.60 0.00 -0.96 1.22 2.07 -1.27 0.89 116.25 118.81 1wp1 h VAL 227 Ca 0.13 0.00 0.23 0.00 0.82 0.00 0.00 66.70 67.87 1wp1 h VAL 227 Cb 0.35 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 30.00 1wp1 h VAL 227 CO 0.01 0.00 0.52 0.00 0.02 0.00 0.00 177.57 178.12 1wp1 h ALA 228 N -1.27 1.63 0.00 1.67 0.00 -1.34 -0.51 119.26 119.44 1wp1 h ALA 228 Ca -0.11 0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 1wp1 h ALA 228 Cb 0.92 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 1wp1 h ALA 228 CO 0.12 -0.27 -0.49 1.96 0.00 0.00 0.00 179.25 180.58 1wp1 h GLN 229 N 0.54 0.00 -0.44 0.00 4.20 -0.37 -2.46 115.11 116.59 1wp1 h GLN 229 Ca 0.60 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 59.19 1wp1 h GLN 229 Cb 1.11 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.88 1wp1 h GLN 229 CO -0.48 0.49 -0.22 -0.44 -0.67 0.00 0.00 178.83 177.50 1wp1 h ASP 230 N 0.00 0.91 -0.25 1.46 3.32 0.78 -1.40 116.42 121.24 1wp1 h ASP 230 Ca -0.00 -0.34 -0.01 0.00 0.02 0.00 0.00 57.03 56.70 1wp1 h ASP 230 Cb 0.93 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.22 1wp1 h ASP 230 CO 0.06 1.09 0.11 1.56 -1.72 0.00 0.00 179.24 180.35 1wp1 h GLN 231 N 0.77 0.36 -0.77 3.56 4.20 -1.17 -0.51 115.11 121.56 1wp1 h GLN 231 Ca 0.10 -0.06 0.04 0.00 0.06 0.00 0.00 58.65 58.79 1wp1 h GLN 231 Cb 0.77 -0.06 -0.05 0.00 0.30 0.00 0.00 27.48 28.44 1wp1 h GLN 231 CO 0.06 0.38 0.48 -0.91 -0.67 0.00 0.00 178.83 178.17 1wp1 h ASN 232 N 0.26 0.78 -0.67 1.46 2.35 -1.31 0.35 115.58 118.80 1wp1 h ASN 232 Ca 0.08 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.81 1wp1 h ASN 232 Cb 0.14 -0.16 -0.03 0.00 0.05 0.00 0.00 38.32 38.32 1wp1 h ASN 232 CO -0.01 0.53 0.32 0.00 -1.65 0.00 0.00 177.43 176.62 1wp1 h ALA 233 N 1.34 0.87 -0.29 -0.83 0.00 -1.01 -2.02 119.26 117.31 1wp1 h ALA 233 Ca 0.32 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1wp1 h ALA 233 Cb 0.06 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1wp1 h ALA 233 CO -0.13 0.43 0.11 1.25 0.00 0.00 0.00 179.25 180.91 1wp1 h LEU 234 N 0.93 0.41 -0.15 0.00 5.85 -0.17 -2.57 115.31 119.61 1wp1 h LEU 234 Ca 0.23 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.77 1wp1 h LEU 234 Cb 0.12 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 1wp1 h LEU 234 CO -0.03 0.48 0.10 0.58 -0.34 0.00 0.00 178.44 179.23 1wp1 h VAL 235 N 0.31 1.05 -0.37 1.05 2.07 -0.87 -1.10 116.25 118.38 1wp1 h VAL 235 Ca 0.10 -0.10 0.07 0.00 0.82 0.00 0.00 66.70 67.58 1wp1 h VAL 235 Cb 0.21 0.84 -0.09 0.00 -1.52 0.00 0.00 31.29 30.73 1wp1 h VAL 235 CO -0.01 0.05 -0.40 0.25 0.02 0.00 0.00 177.57 177.48 1wp1 h LEU 236 N 0.20 -1.33 -2.70 2.57 5.85 -1.16 0.33 115.31 119.07 1wp1 h LEU 236 Ca 0.06 0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.99 1wp1 h LEU 236 Cb -0.01 0.59 -0.00 0.00 0.37 0.00 0.00 40.66 41.61 1wp1 h LEU 236 CO -0.01 -0.36 0.02 -0.07 -0.34 0.00 0.00 178.44 177.67 1wp1 h LEU 237 N -0.33 0.00 0.00 2.25 3.38 -1.15 -1.15 115.31 118.31 1wp1 h LEU 237 Ca 0.14 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.96 1wp1 h LEU 237 Cb 0.58 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.31 1wp1 h LEU 237 CO -0.55 0.00 -0.83 -0.07 0.09 0.00 0.00 178.44 177.08 1wp1 h LEU 238 N 0.00 0.00 0.00 1.67 3.38 0.77 -3.42 115.31 117.72 1wp1 h LEU 238 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1wp1 h LEU 238 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1wp1 h LEU 238 CO -0.00 0.66 0.00 0.61 0.09 0.00 0.00 178.44 179.80 1wp1 n GLY 239 N 1.30 0.81 3.56 0.83 0.00 0.71 -3.50 105.19 108.90 1wp1 n GLY 239 Ca -0.01 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.23 3.11 1.00 1.61 1.04 -1.26 -4.91 113.70 112.06 1wp1 s SER 240 Ca 0.00 -1.48 -0.12 0.00 0.48 0.00 0.00 55.95 54.83 1wp1 s SER 240 Cb 0.00 0.05 0.19 0.00 0.10 0.00 0.00 66.02 66.36 1wp1 s SER 240 CO 0.00 -0.67 1.08 -0.83 0.98 0.00 0.00 173.24 173.80 1wp1 s GLY 241 N -3.63 1.58 -0.09 7.32 0.00 -1.26 -4.78 107.32 106.46 1wp1 s GLY 241 Ca 0.29 -0.20 -0.30 0.00 0.00 0.00 0.00 44.72 44.51 1wp1 s GLY 241 CO 0.14 0.39 1.56 -0.42 0.00 0.00 0.00 173.10 174.77 1wp1 s ILE 242 N -2.86 3.76 1.05 0.90 1.01 -1.26 -5.00 121.20 118.81 1wp1 s ILE 242 Ca 0.65 0.92 -0.12 0.00 0.00 0.00 0.00 60.65 62.10 1wp1 s ILE 242 Cb -0.20 -3.60 0.21 0.00 0.01 0.00 0.00 42.46 38.88 1wp1 s ILE 242 CO 0.59 -0.09 0.98 -2.65 0.00 0.00 0.00 174.94 173.77 1wp1 n PRO 243 N 7.03 -1.47 0.12 2.79 -0.02 -1.26 -5.01 135.00 137.19 1wp1 n PRO 243 Ca 0.17 -0.38 -0.05 0.00 -2.02 0.00 0.00 63.50 61.21 1wp1 n PRO 243 Cb 0.43 -2.21 -0.02 0.00 -0.02 0.00 0.00 33.50 31.68 1wp1 n PRO 243 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1wp1 h ALA 244 N -2.27 -0.71 -2.08 3.55 0.00 -2.06 -3.38 119.26 112.31 1wp1 h ALA 244 Ca -0.52 -0.07 -0.64 0.00 0.00 0.00 0.00 54.91 53.67 1wp1 h ALA 244 Cb 1.31 0.12 -0.39 0.00 0.00 0.00 0.00 17.79 18.83 1wp1 h ALA 244 CO 0.44 -0.69 -0.26 0.27 0.00 0.00 0.00 179.25 179.02 1wp1 n ASN 245 N -3.25 4.85 -4.69 0.00 0.23 -1.26 -5.06 115.26 106.09 1wp1 n ASN 245 Ca -0.04 -3.59 -0.38 0.00 -0.53 0.00 0.00 54.58 50.04 1wp1 n ASN 245 Cb 0.13 -0.75 0.04 0.00 -2.08 0.00 0.00 39.78 37.12 1wp1 n ASN 245 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1wp1 n LEU 246 N 0.28 4.65 -4.77 -4.53 4.77 -1.26 -5.00 117.00 111.14 1wp1 n LEU 246 Ca 0.32 0.92 -0.36 0.00 -0.03 0.00 0.00 56.01 56.86 1wp1 n LEU 246 Cb 0.37 -1.49 -0.01 0.00 -2.33 0.00 0.00 43.42 39.96 1wp1 n LEU 246 CO 0.42 -1.13 0.81 -2.84 -1.33 0.00 0.00 177.39 173.32 1wp1 s PRO 247 N -2.78 3.68 -0.44 3.23 0.02 -1.26 -4.96 135.00 132.49 1wp1 s PRO 247 Ca 0.73 1.70 -0.44 0.00 0.02 0.00 0.00 61.00 63.01 1wp1 s PRO 247 Cb -0.43 -2.30 -0.18 0.00 0.02 0.00 0.00 34.50 31.60 1wp1 s PRO 247 CO 0.49 -0.60 1.79 0.94 -0.33 0.00 0.00 177.00 179.29 1wp1 n GLN 248 N -0.68 0.32 -0.41 5.54 -0.06 -1.26 -4.25 117.38 116.58 1wp1 n GLN 248 Ca 0.08 0.11 -0.06 0.00 -2.00 0.00 0.00 57.00 55.14 1wp1 n GLN 248 Cb 0.49 -1.70 0.04 0.00 -4.06 0.00 0.00 30.24 25.02 1wp1 n GLN 248 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1wp1 n GLY 249 N 4.97 -1.16 3.36 1.69 0.00 -1.26 -4.48 105.19 108.31 1wp1 n GLY 249 Ca 0.36 -1.69 -0.30 0.00 0.00 0.00 0.00 46.02 44.39 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 2.23 0.97 0.99 1.43 -1.26 -4.99 118.68 118.04 1wp1 s LEU 250 Ca 0.16 -0.62 -0.12 0.00 -1.03 0.00 0.00 54.13 52.52 1wp1 s LEU 250 Cb -0.00 -1.29 0.17 0.00 0.03 0.00 0.00 46.19 45.10 1wp1 s LEU 250 CO 0.11 0.24 1.09 -0.83 0.23 0.00 0.00 176.35 177.19 1wp1 s GLY 251 N -1.43 1.61 0.14 -3.19 0.00 -1.26 -4.93 107.32 98.26 1wp1 s GLY 251 Ca 0.12 -0.02 0.25 0.00 0.00 0.00 0.00 44.72 45.08 1wp1 s GLY 251 CO 0.03 0.53 1.78 1.04 0.00 0.00 0.00 173.10 176.47 1wp1 n LEU 252 N -4.19 0.49 -0.68 0.66 4.77 -1.26 -2.27 117.00 114.52 1wp1 n LEU 252 Ca 0.07 0.56 0.04 0.00 -0.03 0.00 0.00 56.01 56.65 1wp1 n LEU 252 Cb 0.55 -0.43 0.14 0.00 -2.33 0.00 0.00 43.42 41.35 1wp1 n LEU 252 CO 0.55 -0.20 0.59 -0.90 -1.33 0.00 0.00 177.39 176.10 1wp1 n ASP 253 N -1.98 1.92 -4.40 -1.43 5.75 -1.26 -4.88 116.55 110.28 1wp1 n ASP 253 Ca 0.05 -2.09 -0.27 0.00 -0.01 0.00 0.00 54.79 52.48 1wp1 n ASP 253 Cb 0.35 -0.29 -0.12 0.00 -1.03 0.00 0.00 41.12 40.03 1wp1 n ASP 253 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 1wp1 s GLN 254 N -1.62 1.46 -0.28 0.11 -0.21 -0.96 -5.08 119.66 113.08 1wp1 s GLN 254 Ca 0.21 -1.47 -0.28 0.00 0.02 0.00 0.00 55.36 53.84 1wp1 s GLN 254 Cb 0.12 -1.79 -0.04 0.00 1.00 0.00 0.00 33.01 32.30 1wp1 s GLN 254 CO 0.12 0.40 2.06 0.99 -2.12 0.00 0.00 175.29 176.74 1wp1 s THR 255 N -1.56 3.19 -0.03 -0.19 2.01 -1.26 -4.85 115.64 112.94 1wp1 s THR 255 Ca 0.18 0.19 0.20 0.00 0.31 0.00 0.00 61.69 62.57 1wp1 s THR 255 Cb -0.08 -3.26 -0.31 0.00 0.01 0.00 0.00 72.50 68.86 1wp1 s THR 255 CO 0.09 -0.17 0.42 0.18 -0.69 0.00 0.00 174.62 174.45 1wp1 n LEU 256 N 11.35 0.00 -4.06 4.42 4.77 -1.26 -4.85 117.00 127.37 1wp1 n LEU 256 Ca 0.27 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 56.09 1wp1 n LEU 256 Cb 0.46 0.02 -0.13 0.00 -2.33 0.00 0.00 43.42 41.44 1wp1 n LEU 256 CO 0.67 0.02 -0.42 -0.76 -1.33 0.00 0.00 177.39 175.57 1wp1 s LEU 257 N -4.43 2.16 0.09 2.23 1.43 -1.26 -1.54 118.68 117.37 1wp1 s LEU 257 Ca -0.07 -0.40 -0.30 0.00 -1.03 0.00 0.00 54.13 52.32 1wp1 s LEU 257 Cb 0.13 -0.34 -0.05 0.00 0.03 0.00 0.00 46.19 45.95 1wp1 s LEU 257 CO 0.83 -0.05 1.05 -0.89 0.23 0.00 0.00 176.35 177.51 1wp1 s THR 258 N -0.88 4.34 -0.04 5.49 2.01 -0.54 -4.96 115.64 121.06 1wp1 s THR 258 Ca -0.03 1.83 -0.30 0.00 0.31 0.00 0.00 61.69 63.50 1wp1 s THR 258 Cb -0.07 -4.17 -0.06 0.00 0.01 0.00 0.00 72.50 68.21 1wp1 s THR 258 CO 0.01 0.22 1.63 -0.70 -0.69 0.00 0.00 174.62 175.09 1wp1 s GLU 259 N 0.40 4.19 -0.14 4.92 2.12 -1.26 -4.94 118.70 123.99 1wp1 s GLU 259 Ca 0.51 2.18 -0.09 0.00 0.36 0.00 0.00 54.97 57.93 1wp1 s GLU 259 Cb -0.25 -3.92 -0.04 0.00 0.26 0.00 0.00 34.13 30.17 1wp1 s GLU 259 CO 0.30 -0.82 0.16 0.08 -0.54 0.00 0.00 175.26 174.45 1wp1 s VAL 260 N 3.79 5.44 0.43 3.70 1.01 -1.26 -5.07 120.40 128.45 1wp1 s VAL 260 Ca 0.72 0.25 -0.22 0.00 0.00 0.00 0.00 61.98 62.73 1wp1 s VAL 260 Cb -0.33 -3.45 -0.09 0.00 0.00 0.00 0.00 36.38 32.50 1wp1 s VAL 260 CO 0.29 0.54 1.03 -2.16 0.00 0.00 0.00 175.10 174.81 1wp1 s PRO 261 N -0.48 4.05 0.31 2.72 0.04 -1.26 -4.95 135.00 135.43 1wp1 s PRO 261 Ca 0.13 1.40 0.00 0.00 0.04 0.00 0.00 61.00 62.58 1wp1 s PRO 261 Cb -0.12 -2.34 0.49 0.00 0.04 0.00 0.00 34.50 32.58 1wp1 s PRO 261 CO 0.02 -0.23 1.91 0.00 0.04 0.00 0.00 177.00 178.75 1wp1 h ALA 262 N 2.09 1.36 -0.84 8.56 0.00 -1.97 -3.39 119.26 125.08 1wp1 h ALA 262 Ca -0.49 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.30 1wp1 h ALA 262 Cb 1.21 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1wp1 h ALA 262 CO 0.61 0.50 0.00 0.41 0.00 0.00 0.00 179.25 180.77 1wp1 n GLY 263 N -1.15 0.57 3.52 0.00 0.00 -1.26 -4.82 105.19 102.05 1wp1 n GLY 263 Ca 0.05 -0.89 -0.30 0.00 0.00 0.00 0.00 46.02 44.89 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 2.82 0.55 0.99 1.43 -1.25 -4.49 118.68 118.73 1wp1 s LEU 264 Ca 0.00 -0.49 0.38 0.00 -1.03 0.00 0.00 54.13 52.99 1wp1 s LEU 264 Cb 0.00 -1.64 1.55 0.00 0.03 0.00 0.00 46.19 46.13 1wp1 s LEU 264 CO 0.00 0.18 1.75 -0.65 0.23 0.00 0.00 176.35 177.87 1wp1 h PRO 265 N 3.75 0.00 -0.15 1.29 0.11 -1.88 -1.04 132.00 134.07 1wp1 h PRO 265 Ca -0.49 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.50 1wp1 h PRO 265 Cb 1.17 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 1wp1 h PRO 265 CO 0.48 0.00 -0.42 0.66 -0.21 0.00 0.00 178.00 178.51 1wp1 h SER 266 N 0.00 0.37 0.00 -2.05 4.64 -1.92 -2.85 113.55 111.74 1wp1 h SER 266 Ca 0.60 -0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.76 1wp1 h SER 266 Cb 2.47 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 64.46 1wp1 h SER 266 CO -0.01 0.75 0.37 0.44 -0.87 0.00 0.00 176.83 177.52 1wp1 h ASP 267 N 0.29 0.00 0.27 4.97 3.32 -1.60 0.14 116.42 123.82 1wp1 h ASP 267 Ca 0.02 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.95 1wp1 h ASP 267 Cb 0.87 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.40 1wp1 h ASP 267 CO 0.07 0.00 -0.48 -0.07 -1.72 0.00 0.00 179.24 177.04 1wp1 h LEU 268 N 0.00 0.27 -1.85 1.55 3.38 -1.67 -2.46 115.31 114.52 1wp1 h LEU 268 Ca 0.00 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 1wp1 h LEU 268 Cb 0.74 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 1wp1 h LEU 268 CO 0.00 0.71 -0.12 -0.07 0.09 0.00 0.00 178.44 179.05 1wp1 h LEU 269 N 0.20 0.00 -0.99 1.67 3.38 -0.91 -2.82 115.31 115.84 1wp1 h LEU 269 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1wp1 h LEU 269 Cb 0.92 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.67 1wp1 h LEU 269 CO 0.07 0.12 0.00 0.00 0.09 0.00 0.00 178.44 178.72 1wp1 n GLN 270 N -3.54 -0.97 0.00 1.13 3.00 -1.20 -4.69 117.38 111.11 1wp1 n GLN 270 Ca -0.01 -0.50 0.00 0.00 -0.01 0.00 0.00 57.00 56.48 1wp1 n GLN 270 Cb 0.26 -1.00 0.00 0.00 0.00 0.00 0.00 30.24 29.50 1wp1 n GLN 270 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 1wp1 n ARG 271 N -0.00 0.23 -3.30 -1.09 1.74 -0.93 -5.02 116.66 108.28 1wp1 n ARG 271 Ca 0.00 -0.03 -0.44 0.00 -0.77 0.00 0.00 57.85 56.60 1wp1 n ARG 271 Cb 0.00 -0.36 -0.07 0.00 -1.02 0.00 0.00 32.46 31.01 1wp1 n ARG 271 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1wp1 s ARG 272 N -0.04 3.02 0.37 5.56 3.00 -1.07 -4.58 118.95 125.21 1wp1 s ARG 272 Ca 0.00 -1.28 0.21 0.00 -1.00 0.00 0.00 55.73 53.66 1wp1 s ARG 272 Cb 0.00 -4.15 1.31 0.00 0.00 0.00 0.00 34.95 32.11 1wp1 s ARG 272 CO 0.00 -1.14 1.60 -1.35 0.00 0.00 0.00 175.30 174.41 1wp1 h PRO 273 N 8.86 0.07 -0.01 5.12 0.11 -1.90 0.26 132.00 144.51 1wp1 h PRO 273 Ca -0.28 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1wp1 h PRO 273 Cb 1.10 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1wp1 h PRO 273 CO 0.93 0.05 -0.30 -0.40 -0.21 0.00 0.00 178.00 178.07 1wp1 n ASP 274 N -5.14 1.33 0.01 -2.05 5.75 -1.26 -0.96 116.55 114.22 1wp1 n ASP 274 Ca 0.37 -1.09 -0.21 0.00 -0.01 0.00 0.00 54.79 53.85 1wp1 n ASP 274 Cb 1.26 0.22 -0.14 0.00 -1.03 0.00 0.00 41.12 41.42 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 1.61 1.21 -0.02 2.12 2.04 -0.87 -2.82 117.51 120.79 1wp1 h ILE 275 Ca 0.00 -2.42 -0.02 0.00 1.00 0.00 0.00 64.86 63.42 1wp1 h ILE 275 Cb 0.58 2.86 -0.00 0.00 -0.74 0.00 0.00 36.82 39.52 1wp1 h ILE 275 CO 0.00 0.67 -0.08 -0.07 0.00 0.00 0.00 178.15 178.67 1wp1 h LEU 276 N -0.43 0.02 -0.12 1.44 3.38 -1.20 0.26 115.31 118.66 1wp1 h LEU 276 Ca -0.24 -0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.62 1wp1 h LEU 276 Cb 1.64 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.38 1wp1 h LEU 276 CO 0.06 0.10 -0.35 -0.08 0.09 0.00 0.00 178.44 178.26 1wp1 h GLU 277 N 0.02 0.44 -0.17 1.13 4.81 -1.16 -2.57 114.58 117.08 1wp1 h GLU 277 Ca 0.00 -0.32 -0.00 0.00 -0.13 0.00 0.00 59.36 58.91 1wp1 h GLU 277 Cb 0.15 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 1wp1 h GLU 277 CO 0.01 0.94 0.09 0.00 -0.73 0.00 0.00 179.01 179.32 1wp1 h ALA 278 N 0.51 1.84 -0.29 2.92 0.00 -1.09 -1.49 119.26 121.65 1wp1 h ALA 278 Ca -0.01 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 1wp1 h ALA 278 Cb 0.97 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1wp1 h ALA 278 CO 0.07 0.14 -0.12 1.49 0.00 0.00 0.00 179.25 180.84 1wp1 h GLU 279 N 0.24 0.59 0.00 0.00 4.81 -0.90 -1.67 114.58 117.65 1wp1 h GLU 279 Ca 0.06 -0.25 -0.05 0.00 -0.13 0.00 0.00 59.36 58.99 1wp1 h GLU 279 Cb 0.01 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 1wp1 h GLU 279 CO -0.01 0.82 -0.25 0.45 -0.73 0.00 0.00 179.01 179.29 1wp1 h HIS 280 N 0.35 0.00 0.00 0.92 3.86 -0.98 0.18 115.15 119.47 1wp1 h HIS 280 Ca 0.07 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.28 1wp1 h HIS 280 Cb 0.62 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.09 1wp1 h HIS 280 CO 0.06 0.25 -0.08 1.96 0.86 0.00 0.00 177.93 180.97 1wp1 h GLN 281 N 0.00 0.00 0.11 2.45 1.08 -1.09 -0.81 115.11 116.85 1wp1 h GLN 281 Ca -0.00 0.00 -0.24 0.00 -1.45 0.00 0.00 58.65 56.95 1wp1 h GLN 281 Cb 0.54 0.00 0.03 0.00 -0.05 0.00 0.00 27.48 27.99 1wp1 h GLN 281 CO 0.03 0.00 -1.02 1.25 -0.95 0.00 0.00 178.83 178.14 1wp1 h LEU 282 N 0.00 0.70 -1.19 1.46 5.85 -0.29 -3.06 115.31 118.79 1wp1 h LEU 282 Ca 0.00 -0.85 -0.00 0.00 0.84 0.00 0.00 57.88 57.86 1wp1 h LEU 282 Cb 0.83 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.64 1wp1 h LEU 282 CO 0.00 1.49 -0.00 0.24 -0.34 0.00 0.00 178.44 179.82 1wp1 h MET 283 N 0.01 0.00 0.07 1.25 2.86 -0.95 -1.10 114.93 117.06 1wp1 h MET 283 Ca -0.16 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.38 1wp1 h MET 283 Cb 1.74 0.00 0.01 0.00 0.06 0.00 0.00 31.60 33.41 1wp1 h MET 283 CO 0.19 0.00 -0.44 0.00 1.06 0.00 0.00 176.91 177.73 1wp1 h ALA 284 N 2.00 -0.03 -0.08 6.32 0.00 -1.25 -3.16 119.26 123.06 1wp1 h ALA 284 Ca -0.00 -0.63 0.02 0.00 0.00 0.00 0.00 54.91 54.31 1wp1 h ALA 284 Cb 0.61 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.47 1wp1 h ALA 284 CO 0.00 0.21 0.07 0.00 0.00 0.00 0.00 179.25 179.53 1wp1 h ALA 285 N 0.02 1.97 -0.29 0.00 0.00 -1.45 -2.77 119.26 116.74 1wp1 h ALA 285 Ca -0.08 -0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.66 1wp1 h ALA 285 Cb 1.32 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.11 1wp1 h ALA 285 CO 0.06 -0.11 -0.49 -0.97 0.00 0.00 0.00 179.25 177.75 1wp1 h ASN 286 N 0.00 0.85 0.90 0.00 -0.00 -1.26 -2.65 115.58 113.42 1wp1 h ASN 286 Ca 0.04 -0.43 -0.04 0.00 -0.00 0.00 0.00 56.30 55.87 1wp1 h ASN 286 Cb 0.17 -0.24 -0.01 0.00 -0.00 0.00 0.00 38.32 38.24 1wp1 h ASN 286 CO -0.00 1.19 -0.19 0.00 -0.00 0.00 0.00 177.43 178.44 1wp1 h ALA 287 N 0.83 1.04 0.00 1.57 0.00 -1.46 -2.83 119.26 118.41 1wp1 h ALA 287 Ca 0.03 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1wp1 h ALA 287 Cb 1.06 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1wp1 h ALA 287 CO 0.11 0.23 0.00 0.45 0.00 0.00 0.00 179.25 180.04 1wp1 n SER 288 N -3.36 0.07 -0.03 0.00 2.88 -1.01 -2.67 113.62 109.50 1wp1 n SER 288 Ca 0.00 0.51 -0.14 0.00 -1.33 0.00 0.00 58.87 57.91 1wp1 n SER 288 Cb 0.40 -0.53 -0.10 0.00 -0.75 0.00 0.00 64.21 63.23 1wp1 n SER 288 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 1wp1 h ILE 289 N 0.00 1.48 -0.37 2.46 2.04 -1.42 -3.11 117.51 118.59 1wp1 h ILE 289 Ca 0.00 -1.70 0.02 0.00 1.00 0.00 0.00 64.86 64.18 1wp1 h ILE 289 Cb 0.45 2.49 -0.03 0.00 -0.74 0.00 0.00 36.82 38.99 1wp1 h ILE 289 CO 0.00 0.47 0.21 1.23 0.00 0.00 0.00 178.15 180.05 1wp1 h GLY 290 N -0.40 0.51 2.00 5.37 0.00 -1.64 -0.95 103.07 107.96 1wp1 h GLY 290 Ca -0.01 -0.15 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 1wp1 h GLY 290 CO 0.04 0.13 -0.03 0.00 0.00 0.00 0.00 176.54 176.68 1wp1 h ALA 291 N 1.17 1.25 0.00 3.60 0.00 -1.57 -2.22 119.26 121.49 1wp1 h ALA 291 Ca 0.15 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.87 1wp1 h ALA 291 Cb 0.02 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1wp1 h ALA 291 CO -0.08 0.04 -1.36 0.00 0.00 0.00 0.00 179.25 177.85 1wp1 h ALA 292 N 1.97 0.65 0.00 0.00 0.00 -1.30 -3.40 119.26 117.18 1wp1 h ALA 292 Ca -0.00 -0.81 0.00 0.00 0.00 0.00 0.00 54.91 54.10 1wp1 h ALA 292 Cb 0.13 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1wp1 h ALA 292 CO 0.00 0.89 -1.20 0.54 0.00 0.00 0.00 179.25 179.48 1wp1 n ARG 293 N -2.90 0.52 0.00 0.00 1.74 -0.43 -3.59 116.66 112.00 1wp1 n ARG 293 Ca -0.09 0.02 0.15 0.00 -0.77 0.00 0.00 57.85 57.16 1wp1 n ARG 293 Cb 0.83 -1.70 0.78 0.00 -1.02 0.00 0.00 32.46 31.36 1wp1 n ARG 293 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1wp1 n ALA 294 N -2.09 2.62 0.27 7.54 0.00 -0.93 -3.05 120.51 124.87 1wp1 n ALA 294 Ca -0.00 -0.20 0.13 0.00 0.00 0.00 0.00 53.44 53.37 1wp1 n ALA 294 Cb 0.52 -1.45 0.78 0.00 0.00 0.00 0.00 19.45 19.30 1wp1 n ALA 294 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wp1 h ALA 295 N 3.71 1.40 -2.26 0.00 0.00 -1.77 -3.29 119.26 117.04 1wp1 h ALA 295 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1wp1 h ALA 295 Cb 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1wp1 h ALA 295 CO 0.00 0.10 0.00 1.19 0.00 0.00 0.00 179.25 180.54 1wp1 n PHE 296 N -3.76 0.00 -3.09 0.00 3.01 -1.17 -4.76 117.46 107.69 1wp1 n PHE 296 Ca -0.02 0.00 -0.39 0.00 1.01 0.00 0.00 57.45 58.04 1wp1 n PHE 296 Cb 0.18 -0.12 -0.05 0.00 -0.01 0.00 0.00 39.48 39.48 1wp1 n PHE 296 CO 0.00 0.00 0.00 -0.59 1.01 0.00 0.00 176.76 177.18 1wp1 s PHE 297 N -1.49 3.57 0.23 1.38 -0.12 -1.24 -4.52 117.98 115.79 1wp1 s PHE 297 Ca 0.00 1.20 -0.05 0.00 -0.05 0.00 0.00 56.93 58.03 1wp1 s PHE 297 Cb 0.00 -2.76 -0.04 0.00 -0.63 0.00 0.00 43.02 39.59 1wp1 s PHE 297 CO 0.00 0.11 -0.15 -2.30 -0.05 0.00 0.00 175.22 172.84 1wp1 n PRO 298 N 3.71 0.00 -4.22 1.99 -0.02 -1.23 -4.95 135.00 130.29 1wp1 n PRO 298 Ca -0.02 0.00 -0.24 0.00 -2.02 0.00 0.00 63.50 61.22 1wp1 n PRO 298 Cb 0.51 -0.29 -0.07 0.00 -0.02 0.00 0.00 33.50 33.63 1wp1 n PRO 298 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1wp1 s SER 299 N -0.29 4.47 -0.12 2.55 1.04 -1.26 -4.91 113.70 115.17 1wp1 s SER 299 Ca 0.14 -0.84 -0.04 0.00 0.48 0.00 0.00 55.95 55.69 1wp1 s SER 299 Cb -0.09 -0.67 0.05 0.00 0.10 0.00 0.00 66.02 65.41 1wp1 s SER 299 CO 0.22 -0.23 0.08 0.27 0.98 0.00 0.00 173.24 174.56 1wp1 s ILE 300 N -2.45 -0.10 -0.58 -1.02 -4.36 -1.25 -3.96 121.20 107.48 1wp1 s ILE 300 Ca 0.36 0.05 -0.17 0.00 -0.26 0.00 0.00 60.65 60.62 1wp1 s ILE 300 Cb -0.02 -0.42 0.12 0.00 1.25 0.00 0.00 42.46 43.39 1wp1 s ILE 300 CO 0.21 -0.12 0.62 -0.55 0.24 0.00 0.00 174.94 175.35 1wp1 s SER 301 N 2.15 6.21 -0.69 4.36 0.15 -1.26 -3.34 113.70 121.29 1wp1 s SER 301 Ca 0.03 -1.64 -0.24 0.00 0.70 0.00 0.00 55.95 54.79 1wp1 s SER 301 Cb -0.15 -2.26 -0.20 0.00 -1.71 0.00 0.00 66.02 61.70 1wp1 s SER 301 CO -0.07 -0.99 1.86 -0.11 1.20 0.00 0.00 173.24 175.14 1wp1 n LEU 302 N 5.78 3.04 -4.91 3.45 7.94 -1.24 -3.49 117.00 127.57 1wp1 n LEU 302 Ca -0.10 -2.60 -0.32 0.00 -1.11 0.00 0.00 56.01 51.88 1wp1 n LEU 302 Cb 0.42 -1.12 -0.04 0.00 0.53 0.00 0.00 43.42 43.20 1wp1 n LEU 302 CO 0.55 -1.19 -0.12 0.28 -1.11 0.00 0.00 177.39 175.80 1wp1 s THR 303 N 7.27 5.36 0.00 1.96 -1.32 -1.26 -4.67 115.64 122.99 1wp1 s THR 303 Ca 0.63 -0.25 0.00 0.00 -1.21 0.00 0.00 61.69 60.87 1wp1 s THR 303 Cb 0.11 -3.61 0.00 0.00 -1.51 0.00 0.00 72.50 67.49 1wp1 s THR 303 CO 0.18 0.18 0.00 -1.54 -2.21 0.00 0.00 174.62 171.23 1wp1 n SER 323 N 0.45 0.00 -3.64 8.08 3.41 -1.26 -4.34 113.62 116.33 1wp1 n SER 323 Ca -0.06 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.45 1wp1 n SER 323 Cb 0.52 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.40 1wp1 n SER 323 CO 0.00 0.00 0.00 -1.66 -0.16 0.00 0.00 175.04 173.22 1wp1 s TRP 324 N 0.00 -0.52 -0.13 7.33 1.48 -1.26 -5.18 118.94 120.67 1wp1 s TRP 324 Ca 0.00 1.26 -0.28 0.00 -1.06 0.00 0.00 56.10 56.02 1wp1 s TRP 324 Cb 0.00 0.35 0.07 0.00 -1.16 0.00 0.00 33.47 32.73 1wp1 s TRP 324 CO 0.00 -0.25 0.67 -0.51 -4.06 0.00 0.00 176.95 172.80 1wp1 s LEU 325 N 0.24 -0.61 -0.19 -4.66 1.43 -1.26 -5.17 118.68 108.46 1wp1 s LEU 325 Ca 0.03 0.96 0.00 0.00 -1.03 0.00 0.00 54.13 54.09 1wp1 s LEU 325 Cb -0.05 2.44 0.05 0.00 0.03 0.00 0.00 46.19 48.66 1wp1 s LEU 325 CO -0.05 -0.46 -0.07 -0.36 0.23 0.00 0.00 176.35 175.64 1wp1 s PHE 326 N -0.59 2.06 -0.51 0.29 0.40 -1.26 -4.98 117.98 113.39 1wp1 s PHE 326 Ca -0.07 -1.38 -0.00 0.00 -0.60 0.00 0.00 56.93 54.89 1wp1 s PHE 326 Cb -0.02 -1.47 0.13 0.00 0.51 0.00 0.00 43.02 42.17 1wp1 s PHE 326 CO 0.06 -0.69 0.28 -1.14 0.70 0.00 0.00 175.22 174.44 1wp1 s GLN 327 N 1.51 2.12 0.02 0.44 2.00 -1.26 -4.95 119.66 119.54 1wp1 s GLN 327 Ca -0.01 -2.30 -0.30 0.00 -2.00 0.00 0.00 55.36 50.75 1wp1 s GLN 327 Cb -0.16 -3.51 -0.06 0.00 0.80 0.00 0.00 33.01 30.08 1wp1 s GLN 327 CO -0.08 -1.10 1.37 -2.14 -0.50 0.00 0.00 175.29 172.84 1wp1 s PRO 328 N 0.29 4.30 0.21 1.67 0.02 -1.23 -4.14 135.00 136.12 1wp1 s PRO 328 Ca 0.14 1.95 0.06 0.00 0.02 0.00 0.00 61.00 63.17 1wp1 s PRO 328 Cb -0.22 -3.50 -0.04 0.00 0.02 0.00 0.00 34.50 30.76 1wp1 s PRO 328 CO -0.03 -0.52 0.16 -1.12 -0.33 0.00 0.00 177.00 175.16 1wp1 s SER 329 N 1.67 5.49 0.17 2.53 0.01 -1.26 -4.89 113.70 117.41 1wp1 s SER 329 Ca 0.63 -0.20 0.05 0.00 1.31 0.00 0.00 55.95 57.74 1wp1 s SER 329 Cb -0.32 -1.40 -0.04 0.00 0.21 0.00 0.00 66.02 64.47 1wp1 s SER 329 CO 0.27 0.02 0.14 -0.63 0.41 0.00 0.00 173.24 173.45 1wp1 s ILE 330 N -1.94 4.52 -0.24 1.44 1.01 -1.26 -3.95 121.20 120.77 1wp1 s ILE 330 Ca 0.32 -1.08 -0.03 0.00 0.00 0.00 0.00 60.65 59.86 1wp1 s ILE 330 Cb -0.09 -3.31 0.13 0.00 0.01 0.00 0.00 42.46 39.20 1wp1 s ILE 330 CO 0.24 -0.12 0.37 0.21 0.00 0.00 0.00 174.94 175.64 1wp1 s ASN 331 N -3.14 0.27 -0.17 3.58 3.84 -1.25 -4.95 114.94 113.12 1wp1 s ASN 331 Ca 0.31 0.24 0.01 0.00 0.21 0.00 0.00 52.86 53.63 1wp1 s ASN 331 Cb -0.10 1.09 0.03 0.00 -0.55 0.00 0.00 41.25 41.72 1wp1 s ASN 331 CO 0.24 -0.30 -0.15 -0.22 -2.79 0.00 0.00 177.10 173.88 1wp1 s LEU 332 N 2.54 1.98 0.63 3.21 2.96 -1.26 -3.47 118.68 125.27 1wp1 s LEU 332 Ca 0.12 -0.65 -0.16 0.00 -0.22 0.00 0.00 54.13 53.22 1wp1 s LEU 332 Cb -0.15 -1.27 -0.02 0.00 0.50 0.00 0.00 46.19 45.25 1wp1 s LEU 332 CO -0.15 -0.07 1.11 -2.84 -1.32 0.00 0.00 176.35 173.07 1wp1 s PRO 333 N 1.41 2.97 0.05 0.98 0.02 -1.26 -5.03 135.00 134.13 1wp1 s PRO 333 Ca 0.03 1.40 0.00 0.00 0.02 0.00 0.00 61.00 62.45 1wp1 s PRO 333 Cb -0.14 -1.97 0.00 0.00 0.02 0.00 0.00 34.50 32.41 1wp1 s PRO 333 CO -0.11 -1.12 0.00 -0.89 -0.33 0.00 0.00 177.00 174.56 1wp1 n ILE 334 N -2.17 0.08 -3.15 2.83 5.41 -1.26 -5.11 119.36 115.99 1wp1 n ILE 334 Ca 0.10 0.02 0.05 0.00 1.00 0.00 0.00 62.75 63.93 1wp1 n ILE 334 Cb 0.52 -0.82 -0.01 0.00 -0.71 0.00 0.00 39.64 38.62 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 -2.00 -0.92 0.00 1.39 5.36 -1.26 -5.22 117.98 115.33 1wp1 s PHE 335 Ca 0.00 0.83 0.00 0.00 -0.96 0.00 0.00 56.93 56.80 1wp1 s PHE 335 Cb 0.00 0.27 0.00 0.00 -0.34 0.00 0.00 43.02 42.95 1wp1 s PHE 335 CO 0.00 -0.52 0.00 0.45 -1.46 0.00 0.00 175.22 173.69 1wp1 n SER 339 N 5.39 0.00 -0.10 6.13 2.88 -1.26 -5.28 113.62 121.38 1wp1 n SER 339 Ca -0.01 0.00 -0.19 0.00 -1.33 0.00 0.00 58.87 57.33 1wp1 n SER 339 Cb 0.54 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.92 1wp1 n SER 339 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 1wp1 n LEU 340 N 0.00 2.00 -0.04 2.46 7.94 -1.26 -4.23 117.00 123.87 1wp1 n LEU 340 Ca 0.00 0.13 0.15 0.00 -1.11 0.00 0.00 56.01 55.18 1wp1 n LEU 340 Cb 0.00 -0.64 0.70 0.00 0.53 0.00 0.00 43.42 44.02 1wp1 n LEU 340 CO 0.00 0.57 0.96 -1.14 -1.11 0.00 0.00 177.39 176.68 1wp1 n ARG 341 N -3.64 0.51 0.01 1.96 0.63 -1.26 -2.20 116.66 112.67 1wp1 n ARG 341 Ca -0.39 -0.07 -0.02 0.00 -0.92 0.00 0.00 57.85 56.45 1wp1 n ARG 341 Cb 0.82 -1.50 -0.01 0.00 0.45 0.00 0.00 32.46 32.22 1wp1 n ARG 341 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1wp1 h ALA 342 N 3.48 -0.14 -0.67 5.13 0.00 -2.01 -3.26 119.26 121.79 1wp1 h ALA 342 Ca 0.00 -0.03 0.14 0.00 0.00 0.00 0.00 54.91 55.02 1wp1 h ALA 342 Cb 0.31 0.05 -0.12 0.00 0.00 0.00 0.00 17.79 18.03 1wp1 h ALA 342 CO 0.00 -0.13 -0.05 1.03 0.00 0.00 0.00 179.25 180.10 1wp1 h SER 343 N -0.91 -0.40 -0.42 0.00 0.87 -1.73 -1.74 113.55 109.22 1wp1 h SER 343 Ca -0.01 0.18 0.04 0.00 -1.23 0.00 0.00 61.79 60.76 1wp1 h SER 343 Cb 0.10 0.34 -0.05 0.00 -0.44 0.00 0.00 62.40 62.34 1wp1 h SER 343 CO 0.02 -0.17 -0.25 -0.11 -0.53 0.00 0.00 176.83 175.79 1wp1 n LEU 344 N -5.35 -0.45 -0.25 2.23 7.94 -0.93 -1.21 117.00 118.98 1wp1 n LEU 344 Ca 0.10 1.23 -0.08 0.00 -1.11 0.00 0.00 56.01 56.16 1wp1 n LEU 344 Cb 0.39 -0.34 0.04 0.00 0.53 0.00 0.00 43.42 44.04 1wp1 n LEU 344 CO 0.07 -0.85 0.93 0.44 -1.11 0.00 0.00 177.39 176.86 1wp1 h ASP 345 N 0.00 1.08 0.01 1.96 5.19 -1.39 -2.85 116.42 120.43 1wp1 h ASP 345 Ca 0.07 -0.25 0.01 0.00 -0.62 0.00 0.00 57.03 56.24 1wp1 h ASP 345 Cb 0.17 -0.29 -0.03 0.00 0.18 0.00 0.00 39.33 39.37 1wp1 h ASP 345 CO -0.40 1.05 -0.30 0.22 -3.12 0.00 0.00 179.24 176.69 1wp1 h TYR 346 N 1.06 -0.89 -0.94 4.55 3.20 -0.76 0.42 116.97 123.62 1wp1 h TYR 346 Ca 0.22 0.03 0.24 0.00 3.14 0.00 0.00 58.73 62.35 1wp1 h TYR 346 Cb 0.41 0.39 -0.06 0.00 1.54 0.00 0.00 36.73 39.00 1wp1 h TYR 346 CO 0.03 -0.33 0.64 0.00 -1.64 0.00 0.00 178.16 176.86 1wp1 h ALA 347 N -0.91 2.45 0.03 1.82 0.00 -1.11 0.50 119.26 122.03 1wp1 h ALA 347 Ca 0.00 0.01 -0.26 0.00 0.00 0.00 0.00 54.91 54.66 1wp1 h ALA 347 Cb 0.41 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 1wp1 h ALA 347 CO -0.19 -0.75 -1.37 0.87 0.00 0.00 0.00 179.25 177.80 1wp1 h LYS 348 N 0.26 0.06 0.09 0.00 1.57 -1.18 -2.57 116.57 114.80 1wp1 h LYS 348 Ca 0.48 -0.11 -0.26 0.00 -1.87 0.00 0.00 60.65 58.90 1wp1 h LYS 348 Cb 1.45 0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.80 1wp1 h LYS 348 CO -0.14 0.86 -1.13 -0.84 -0.57 0.00 0.00 179.45 177.63 1wp1 h ILE 349 N 0.02 1.46 -0.90 1.86 3.07 0.72 -2.20 117.51 121.53 1wp1 h ILE 349 Ca -0.16 -2.81 0.18 0.00 1.55 0.00 0.00 64.86 63.61 1wp1 h ILE 349 Cb 1.91 2.75 -0.07 0.00 -0.27 0.00 0.00 36.82 41.14 1wp1 h ILE 349 CO 0.12 0.83 0.59 -0.61 -1.05 0.00 0.00 178.15 178.02 1wp1 h GLN 350 N 0.13 0.52 0.00 0.16 5.75 -0.14 0.73 115.11 122.26 1wp1 h GLN 350 Ca -0.12 -0.03 -0.09 0.00 -0.15 0.00 0.00 58.65 58.26 1wp1 h GLN 350 Cb 1.82 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 30.24 1wp1 h GLN 350 CO 0.19 0.34 -0.44 -0.22 -2.65 0.00 0.00 178.83 176.05 1wp1 h LYS 351 N 0.53 0.00 -0.04 1.69 3.64 -1.25 -2.93 116.57 118.22 1wp1 h LYS 351 Ca 0.47 0.00 -0.25 0.00 -1.27 0.00 0.00 60.65 59.60 1wp1 h LYS 351 Cb 0.98 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.82 1wp1 h LYS 351 CO -0.21 0.44 -0.96 -0.44 -2.27 0.00 0.00 179.45 176.02 1wp1 h ASP 352 N 0.00 0.92 -0.37 4.20 3.32 0.50 -2.05 116.42 122.95 1wp1 h ASP 352 Ca -0.00 -0.71 0.07 0.00 0.02 0.00 0.00 57.03 56.41 1wp1 h ASP 352 Cb 0.84 -0.28 -0.06 0.00 0.22 0.00 0.00 39.33 40.05 1wp1 h ASP 352 CO 0.06 1.50 -0.05 0.40 -1.72 0.00 0.00 179.24 179.43 1wp1 h ILE 353 N 0.42 0.68 0.00 0.35 2.04 0.21 0.84 117.51 122.05 1wp1 h ILE 353 Ca -0.11 -0.02 -0.03 0.00 1.00 0.00 0.00 64.86 65.71 1wp1 h ILE 353 Cb 1.61 0.63 -0.00 0.00 -0.74 0.00 0.00 36.82 38.31 1wp1 h ILE 353 CO 0.19 0.01 -0.15 0.78 0.00 0.00 0.00 178.15 178.98 1wp1 h ASN 354 N 0.05 0.00 0.01 1.72 4.21 -1.46 -0.67 115.58 119.43 1wp1 h ASN 354 Ca 0.18 0.00 -0.00 0.00 1.21 0.00 0.00 56.30 57.69 1wp1 h ASN 354 Cb 0.26 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.46 1wp1 h ASN 354 CO -0.34 0.15 -0.00 0.58 -1.29 0.00 0.00 177.43 176.52 1wp1 h VAL 355 N 0.00 1.32 -0.34 2.81 2.07 -0.38 0.12 116.25 121.85 1wp1 h VAL 355 Ca -0.00 -0.99 0.02 0.00 0.82 0.00 0.00 66.70 66.56 1wp1 h VAL 355 Cb 0.34 1.99 -0.03 0.00 -1.52 0.00 0.00 31.29 32.07 1wp1 h VAL 355 CO 0.02 0.25 0.17 0.00 0.02 0.00 0.00 177.57 178.03 1wp1 h ALA 356 N 0.55 0.41 -0.91 1.67 0.00 -0.13 -1.33 119.26 119.53 1wp1 h ALA 356 Ca -0.00 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1wp1 h ALA 356 Cb 0.43 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 1wp1 h ALA 356 CO 0.00 -0.21 0.57 1.96 0.00 0.00 0.00 179.25 181.57 1wp1 h GLN 357 N 0.35 1.22 -0.12 0.00 4.20 -1.21 -0.50 115.11 119.05 1wp1 h GLN 357 Ca 0.14 -0.10 0.04 0.00 0.06 0.00 0.00 58.65 58.79 1wp1 h GLN 357 Cb 0.05 -0.26 -0.04 0.00 0.30 0.00 0.00 27.48 27.53 1wp1 h GLN 357 CO -0.10 0.84 -0.11 -0.92 -0.67 0.00 0.00 178.83 177.87 1wp1 h TYR 358 N 1.25 -0.28 -0.40 2.96 3.20 0.08 -1.37 116.97 122.39 1wp1 h TYR 358 Ca 0.33 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.19 1wp1 h TYR 358 Cb -0.08 0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.31 1wp1 h TYR 358 CO -0.00 -0.17 0.14 0.93 -1.64 0.00 0.00 178.16 177.41 1wp1 h GLU 359 N -0.14 0.62 -0.96 1.82 5.08 -1.12 -2.75 114.58 117.14 1wp1 h GLU 359 Ca 0.08 -0.13 0.11 0.00 -1.00 0.00 0.00 59.36 58.43 1wp1 h GLU 359 Cb 0.26 -0.09 -0.08 0.00 0.50 0.00 0.00 28.75 29.34 1wp1 h GLU 359 CO -0.20 0.61 0.61 -0.22 -1.00 0.00 0.00 179.01 178.81 1wp1 h LYS 360 N 0.51 0.91 -0.00 2.33 3.64 -0.86 0.99 116.57 124.09 1wp1 h LYS 360 Ca 0.13 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.40 1wp1 h LYS 360 Cb 0.24 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 1wp1 h LYS 360 CO -0.01 0.60 -0.25 0.00 -2.27 0.00 0.00 179.45 177.53 1wp1 h ALA 361 N 1.55 1.58 0.03 5.00 0.00 -0.96 -0.32 119.26 126.14 1wp1 h ALA 361 Ca 0.46 -0.23 -0.24 0.00 0.00 0.00 0.00 54.91 54.90 1wp1 h ALA 361 Cb 0.47 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1wp1 h ALA 361 CO -0.22 0.32 -1.01 0.82 0.00 0.00 0.00 179.25 179.15 1wp1 h ILE 362 N 0.01 1.42 -0.09 0.00 2.04 -0.71 -2.81 117.51 117.37 1wp1 h ILE 362 Ca -0.00 -2.59 -0.03 0.00 1.00 0.00 0.00 64.86 63.23 1wp1 h ILE 362 Cb 0.45 2.54 -0.00 0.00 -0.74 0.00 0.00 36.82 39.07 1wp1 h ILE 362 CO 0.03 0.77 -0.08 1.56 0.00 0.00 0.00 178.15 180.43 1wp1 h GLN 363 N 0.19 0.22 -0.83 2.37 4.20 0.05 -1.52 115.11 119.79 1wp1 h GLN 363 Ca -0.09 -0.11 0.06 0.00 0.06 0.00 0.00 58.65 58.57 1wp1 h GLN 363 Cb 1.67 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 29.39 1wp1 h GLN 363 CO 0.17 0.62 0.51 1.15 -0.67 0.00 0.00 178.83 180.61 1wp1 h THR 364 N -0.19 1.03 -0.47 -0.54 2.02 -1.22 -0.54 112.91 113.00 1wp1 h THR 364 Ca 0.02 -0.32 -0.04 0.00 0.77 0.00 0.00 66.41 66.84 1wp1 h THR 364 Cb 0.58 0.03 -0.02 0.00 -1.74 0.00 0.00 68.15 66.99 1wp1 h THR 364 CO 0.02 0.17 0.13 0.00 0.37 0.00 0.00 175.52 176.21 1wp1 h ALA 365 N 1.40 1.35 -0.24 6.16 0.00 -1.24 -1.70 119.26 124.98 1wp1 h ALA 365 Ca 0.36 -0.17 -0.18 0.00 0.00 0.00 0.00 54.91 54.93 1wp1 h ALA 365 Cb 0.17 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1wp1 h ALA 365 CO -0.17 0.47 -0.54 0.35 0.00 0.00 0.00 179.25 179.36 1wp1 h PHE 366 N 0.69 1.00 -0.27 0.00 3.57 -0.40 -1.69 116.94 119.84 1wp1 h PHE 366 Ca 0.16 -0.38 0.04 0.00 3.53 0.00 0.00 57.97 61.32 1wp1 h PHE 366 Cb 0.23 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 38.76 1wp1 h PHE 366 CO 0.01 1.19 0.06 0.37 -2.23 0.00 0.00 178.31 177.70 1wp1 h GLN 367 N 0.53 0.15 -0.29 1.11 -0.00 -0.68 0.03 115.11 115.95 1wp1 h GLN 367 Ca -0.00 -0.01 -0.12 0.00 -0.00 0.00 0.00 58.65 58.52 1wp1 h GLN 367 Cb 1.15 -0.03 -0.01 0.00 0.00 0.00 0.00 27.48 28.59 1wp1 h GLN 367 CO 0.12 0.10 -0.27 0.93 0.00 0.00 0.00 178.83 179.71 1wp1 h GLU 368 N 0.16 0.70 0.46 1.69 5.08 -1.26 0.21 114.58 121.62 1wp1 h GLU 368 Ca 0.12 -0.36 -0.02 0.00 -1.00 0.00 0.00 59.36 58.10 1wp1 h GLU 368 Cb 0.12 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.38 1wp1 h GLU 368 CO -0.16 0.97 -0.22 0.28 -1.00 0.00 0.00 179.01 178.89 1wp1 h VAL 369 N 0.45 0.55 -0.77 3.13 2.07 -1.23 -0.54 116.25 119.90 1wp1 h VAL 369 Ca 0.05 -0.15 0.18 0.00 0.82 0.00 0.00 66.70 67.60 1wp1 h VAL 369 Cb 0.83 0.62 -0.12 0.00 -1.52 0.00 0.00 31.29 31.10 1wp1 h VAL 369 CO 0.07 0.03 0.19 0.00 0.02 0.00 0.00 177.57 177.87 1wp1 h ALA 370 N -0.19 1.03 -0.82 1.67 0.00 -0.91 -0.34 119.26 119.71 1wp1 h ALA 370 Ca -0.06 0.18 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1wp1 h ALA 370 Cb 0.51 0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.52 1wp1 h ALA 370 CO 0.10 -0.36 0.50 -0.44 0.00 0.00 0.00 179.25 179.05 1wp1 h ASP 371 N 0.26 0.98 -0.31 0.00 3.32 -0.29 -0.92 116.42 119.45 1wp1 h ASP 371 Ca 0.45 -0.06 0.02 0.00 0.02 0.00 0.00 57.03 57.46 1wp1 h ASP 371 Cb 0.80 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 40.09 1wp1 h ASP 371 CO -0.55 0.75 0.21 1.23 -1.72 0.00 0.00 179.24 179.16 1wp1 h GLY 372 N 1.12 0.38 1.38 2.75 0.00 0.53 -2.35 103.07 106.87 1wp1 h GLY 372 Ca 0.29 -0.13 -0.27 0.00 0.00 0.00 0.00 47.33 47.22 1wp1 h GLY 372 CO -0.06 0.12 -1.43 1.41 0.00 0.00 0.00 176.54 176.59 1wp1 h LEU 373 N 0.34 0.15 -1.29 3.11 3.38 -0.46 -0.85 115.31 119.70 1wp1 h LEU 373 Ca 0.12 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1wp1 h LEU 373 Cb 0.08 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 1wp1 h LEU 373 CO -0.03 1.18 0.44 0.00 0.09 0.00 0.00 178.44 180.12 1wp1 h ALA 374 N 0.80 1.47 -0.00 1.53 0.00 -0.83 0.15 119.26 122.38 1wp1 h ALA 374 Ca -0.19 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 1wp1 h ALA 374 Cb 1.94 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 19.45 1wp1 h ALA 374 CO 0.12 0.47 -0.00 0.00 0.00 0.00 0.00 179.25 179.85 1wp1 h ALA 375 N 1.54 0.01 -0.92 0.00 0.00 -1.41 -2.47 119.26 116.01 1wp1 h ALA 375 Ca 0.25 -0.21 0.16 0.00 0.00 0.00 0.00 54.91 55.12 1wp1 h ALA 375 Cb -0.08 -0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.63 1wp1 h ALA 375 CO -0.05 -0.29 0.59 -0.09 0.00 0.00 0.00 179.25 179.41 1wp1 h ARG 376 N -0.40 0.64 0.00 0.00 2.43 -0.75 0.76 114.38 117.07 1wp1 h ARG 376 Ca 0.00 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1wp1 h ARG 376 Cb 0.41 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.82 1wp1 h ARG 376 CO 0.00 0.43 0.00 0.41 -1.51 0.00 0.00 179.97 179.30 1wp1 n GLY 377 N -1.43 -1.55 0.02 2.80 0.00 0.48 -4.17 105.19 101.34 1wp1 n GLY 377 Ca 0.19 -0.03 -0.02 0.00 0.00 0.00 0.00 46.02 46.16 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 -2.03 0.30 0.11 2.61 -2.24 -0.35 -4.73 114.28 107.94 1wp1 n THR 378 Ca 0.05 -0.19 -0.03 0.00 -2.27 0.00 0.00 64.05 61.62 1wp1 n THR 378 Cb 0.36 -0.83 0.18 0.00 -2.10 0.00 0.00 70.33 67.94 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 0.21 -0.69 4.78 -1.00 -1.08 -1.24 116.94 117.93 1wp1 h PHE 379 Ca -0.12 -0.07 0.02 0.00 2.81 0.00 0.00 57.97 60.61 1wp1 h PHE 379 Cb 1.24 -0.04 -0.04 0.00 3.61 0.00 0.00 35.95 40.72 1wp1 h PHE 379 CO 0.00 0.67 0.44 1.15 -1.61 0.00 0.00 178.31 178.96 1wp1 h THR 380 N 0.13 1.13 -0.23 -1.55 2.02 -1.82 0.11 112.91 112.70 1wp1 h THR 380 Ca 0.00 -0.30 -0.12 0.00 0.77 0.00 0.00 66.41 66.76 1wp1 h THR 380 Cb 0.99 0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 67.57 1wp1 h THR 380 CO 0.08 0.16 -0.36 -0.33 0.37 0.00 0.00 175.52 175.44 1wp1 h GLU 381 N 0.88 0.51 -0.18 6.66 3.07 -1.76 -2.00 114.58 121.76 1wp1 h GLU 381 Ca 0.26 -0.24 -0.22 0.00 -0.50 0.00 0.00 59.36 58.67 1wp1 h GLU 381 Cb -0.04 -0.01 0.01 0.00 -0.84 0.00 0.00 28.75 27.87 1wp1 h GLU 381 CO -0.08 0.80 -0.74 0.37 -1.40 0.00 0.00 179.01 177.96 1wp1 h GLN 382 N 0.43 0.82 -0.13 2.33 4.15 -0.58 -2.68 115.11 119.45 1wp1 h GLN 382 Ca 0.04 -0.64 -0.12 0.00 0.77 0.00 0.00 58.65 58.71 1wp1 h GLN 382 Cb 0.83 0.12 -0.01 0.00 0.21 0.00 0.00 27.48 28.63 1wp1 h GLN 382 CO 0.07 1.25 -0.44 -0.07 -1.93 0.00 0.00 178.83 177.71 1wp1 h LEU 383 N 0.57 0.31 -0.46 -2.39 3.38 -0.70 -1.02 115.31 115.00 1wp1 h LEU 383 Ca -0.04 -0.14 -0.09 0.00 0.09 0.00 0.00 57.88 57.70 1wp1 h LEU 383 Cb 1.36 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 42.01 1wp1 h LEU 383 CO 0.15 0.72 -0.05 -0.61 0.09 0.00 0.00 178.44 178.74 1wp1 h GLN 384 N 0.24 0.85 -0.42 1.13 5.75 -1.32 0.28 115.11 121.63 1wp1 h GLN 384 Ca 0.02 -0.30 -0.07 0.00 -0.15 0.00 0.00 58.65 58.15 1wp1 h GLN 384 Cb 0.87 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 29.34 1wp1 h GLN 384 CO 0.07 0.93 -0.04 0.00 -2.65 0.00 0.00 178.83 177.14 1wp1 h ALA 385 N 0.90 1.15 -0.13 3.38 0.00 -1.32 -1.42 119.26 121.82 1wp1 h ALA 385 Ca 0.12 -0.27 -0.20 0.00 0.00 0.00 0.00 54.91 54.57 1wp1 h ALA 385 Cb 0.58 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1wp1 h ALA 385 CO 0.03 0.55 -0.73 0.37 0.00 0.00 0.00 179.25 179.47 1wp1 h GLN 386 N 0.65 0.60 -0.47 0.00 5.75 -0.85 0.22 115.11 121.02 1wp1 h GLN 386 Ca 0.13 -0.48 -0.03 0.00 -0.15 0.00 0.00 58.65 58.12 1wp1 h GLN 386 Cb 0.46 0.09 -0.02 0.00 1.07 0.00 0.00 27.48 29.09 1wp1 h GLN 386 CO 0.02 1.10 0.17 0.00 -2.65 0.00 0.00 178.83 177.47 1wp1 h ARG 387 N 0.42 0.71 -0.75 1.69 3.08 -0.28 -1.59 114.38 117.66 1wp1 h ARG 387 Ca -0.03 -0.14 -0.04 0.00 0.07 0.00 0.00 59.98 59.84 1wp1 h ARG 387 Cb 1.32 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 31.23 1wp1 h ARG 387 CO 0.14 0.66 0.33 -0.44 -1.07 0.00 0.00 179.97 179.58 1wp1 h ASP 388 N 0.61 0.99 -0.79 7.04 3.32 -0.96 0.26 116.42 126.89 1wp1 h ASP 388 Ca 0.15 -0.13 -0.01 0.00 0.02 0.00 0.00 57.03 57.07 1wp1 h ASP 388 Cb 0.23 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 39.48 1wp1 h ASP 388 CO -0.01 0.86 0.47 0.25 -1.72 0.00 0.00 179.24 179.09 1wp1 h LEU 389 N 1.07 0.96 -0.42 1.55 5.85 -0.11 0.12 115.31 124.32 1wp1 h LEU 389 Ca 0.25 -0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.87 1wp1 h LEU 389 Cb 0.16 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 1wp1 h LEU 389 CO -0.03 0.74 0.14 0.58 -0.34 0.00 0.00 178.44 179.54 1wp1 h VAL 390 N 1.09 1.21 -0.14 1.05 2.07 -0.28 -0.56 116.25 120.69 1wp1 h VAL 390 Ca 0.28 -0.69 0.03 0.00 0.82 0.00 0.00 66.70 67.14 1wp1 h VAL 390 Cb -0.03 0.88 -0.03 0.00 -1.52 0.00 0.00 31.29 30.59 1wp1 h VAL 390 CO -0.05 0.25 -0.03 0.50 0.02 0.00 0.00 177.57 178.25 1wp1 h LYS 391 N 0.53 0.00 -0.01 1.57 3.64 0.08 -0.41 116.57 121.97 1wp1 h LYS 391 Ca 0.14 -0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 59.35 1wp1 h LYS 391 Cb 0.24 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.05 1wp1 h LYS 391 CO -0.01 0.00 -0.75 0.00 -2.27 0.00 0.00 179.45 176.42 1wp1 h ALA 392 N 1.14 0.71 -0.24 5.00 0.00 -0.71 -2.59 119.26 122.56 1wp1 h ALA 392 Ca 0.07 -0.66 -0.11 0.00 0.00 0.00 0.00 54.91 54.21 1wp1 h ALA 392 Cb 0.10 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1wp1 h ALA 392 CO -0.14 0.87 -0.32 0.77 0.00 0.00 0.00 179.25 180.44 1wp1 h SER 393 N 0.08 0.51 0.19 0.00 0.02 -0.88 0.36 113.55 113.83 1wp1 h SER 393 Ca -0.02 -0.19 -0.01 0.00 -0.84 0.00 0.00 61.79 60.73 1wp1 h SER 393 Cb 1.33 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.73 1wp1 h SER 393 CO 0.11 0.80 -0.09 -0.78 -1.14 0.00 0.00 176.83 175.72 1wp1 h ASP 394 N 0.42 -0.22 -0.46 3.07 3.58 -0.70 0.37 116.42 122.48 1wp1 h ASP 394 Ca 0.05 -0.06 -0.01 0.00 0.42 0.00 0.00 57.03 57.44 1wp1 h ASP 394 Cb 0.76 0.06 -0.02 0.00 1.72 0.00 0.00 39.33 41.85 1wp1 h ASP 394 CO 0.06 -0.09 0.27 -0.33 -2.88 0.00 0.00 179.24 176.28 1wp1 h GLU 395 N -0.34 0.66 -0.30 0.28 4.39 -1.32 0.64 114.58 118.58 1wp1 h GLU 395 Ca -0.03 -0.06 -0.05 0.00 0.34 0.00 0.00 59.36 59.57 1wp1 h GLU 395 Cb 0.26 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 1wp1 h GLU 395 CO 0.04 0.48 0.00 -0.92 -1.16 0.00 0.00 179.01 177.46 1wp1 h TYR 396 N 0.67 0.58 -0.72 4.33 3.20 -0.40 -1.81 116.97 122.81 1wp1 h TYR 396 Ca 0.17 -0.10 0.00 0.00 3.14 0.00 0.00 58.73 61.95 1wp1 h TYR 396 Cb 0.00 -0.15 -0.04 0.00 1.54 0.00 0.00 36.73 38.09 1wp1 h TYR 396 CO 0.00 0.66 0.46 -0.92 -1.64 0.00 0.00 178.16 176.72 1wp1 h TYR 397 N 0.33 0.93 -0.14 -3.82 3.20 0.69 -1.22 116.97 116.93 1wp1 h TYR 397 Ca 0.09 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.93 1wp1 h TYR 397 Cb 0.43 -0.31 -0.00 0.00 1.54 0.00 0.00 36.73 38.38 1wp1 h TYR 397 CO 0.03 0.60 -0.05 1.96 -1.64 0.00 0.00 178.16 179.07 1wp1 h GLN 398 N 0.98 0.28 0.28 1.82 4.20 -0.71 -1.60 115.11 120.36 1wp1 h GLN 398 Ca 0.26 -0.11 -0.00 0.00 0.06 0.00 0.00 58.65 58.85 1wp1 h GLN 398 Cb -0.08 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.67 1wp1 h GLN 398 CO -0.05 0.59 -0.37 -0.07 -0.67 0.00 0.00 178.83 178.25 1wp1 h LEU 399 N -0.04 -1.06 -1.98 1.46 3.38 -1.32 -2.17 115.31 113.58 1wp1 h LEU 399 Ca 0.03 0.09 0.25 0.00 0.09 0.00 0.00 57.88 58.35 1wp1 h LEU 399 Cb 0.50 0.36 -0.03 0.00 0.09 0.00 0.00 40.66 41.57 1wp1 h LEU 399 CO 0.02 -0.46 0.66 0.00 0.09 0.00 0.00 178.44 178.74 1wp1 h ALA 400 N -1.04 2.80 0.00 1.53 0.00 -1.17 0.17 119.26 121.55 1wp1 h ALA 400 Ca -0.03 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 1wp1 h ALA 400 Cb 0.61 0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.47 1wp1 h ALA 400 CO -0.10 -1.11 -0.36 0.22 0.00 0.00 0.00 179.25 177.91 1wp1 h ASP 401 N 0.00 0.31 0.23 0.00 3.58 -1.13 -2.22 116.42 117.19 1wp1 h ASP 401 Ca 0.41 -0.78 0.01 0.00 0.42 0.00 0.00 57.03 57.10 1wp1 h ASP 401 Cb 1.72 -0.10 -0.03 0.00 1.72 0.00 0.00 39.33 42.65 1wp1 h ASP 401 CO -0.00 1.05 -0.33 0.50 -2.88 0.00 0.00 179.24 177.58 1wp1 h LYS 402 N -0.39 -0.60 -0.03 0.28 3.64 -0.55 -2.63 116.57 116.29 1wp1 h LYS 402 Ca -0.04 0.04 0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1wp1 h LYS 402 Cb 1.10 0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 33.06 1wp1 h LYS 402 CO 0.07 -0.40 0.04 0.00 -2.27 0.00 0.00 179.45 176.89 1wp1 h ARG 403 N -0.62 0.00 0.09 1.90 3.08 -0.78 -1.61 114.38 116.44 1wp1 h ARG 403 Ca 0.01 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 1wp1 h ARG 403 Cb 0.60 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.65 1wp1 h ARG 403 CO -0.13 0.00 -0.04 -0.92 -1.07 0.00 0.00 179.97 177.81 1wp1 h TYR 404 N 0.00 -0.11 0.00 3.04 3.20 -1.28 -1.41 116.97 120.41 1wp1 h TYR 404 Ca 0.01 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.88 1wp1 h TYR 404 Cb 0.10 0.04 -0.00 0.00 1.54 0.00 0.00 36.73 38.41 1wp1 h TYR 404 CO 0.00 0.39 -0.02 0.00 -1.64 0.00 0.00 178.16 176.89 1wp1 h ARG 405 N -0.90 0.00 -0.06 1.82 2.47 -1.03 -0.65 114.38 116.04 1wp1 h ARG 405 Ca -0.01 0.00 -0.13 0.00 -1.26 0.00 0.00 59.98 58.58 1wp1 h ARG 405 Cb 0.56 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.87 1wp1 h ARG 405 CO 0.02 0.02 -0.54 1.15 0.56 0.00 0.00 179.97 181.18 1wp1 h THR 406 N 0.00 1.37 0.00 2.04 2.02 -1.43 -3.47 112.91 113.44 1wp1 h THR 406 Ca -0.00 -1.85 0.00 0.00 0.77 0.00 0.00 66.41 65.33 1wp1 h THR 406 Cb 0.16 1.93 0.00 0.00 -1.74 0.00 0.00 68.15 68.50 1wp1 h THR 406 CO 0.00 0.54 0.00 0.61 0.37 0.00 0.00 175.52 177.05 1wp1 n GLY 407 N 0.10 0.49 0.24 2.16 0.00 -0.25 -4.96 105.19 102.98 1wp1 n GLY 407 Ca -0.02 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.14 1wp1 n GLY 407 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1wp1 h VAL 408 N 0.00 0.09 -3.86 1.61 -1.51 -1.74 -3.46 116.25 107.38 1wp1 h VAL 408 Ca 0.00 -0.85 -0.36 0.00 -1.23 0.00 0.00 66.70 64.26 1wp1 h VAL 408 Cb 0.00 1.78 -0.30 0.00 -2.13 0.00 0.00 31.29 30.64 1wp1 h VAL 408 CO 0.00 0.04 -0.77 -1.81 -1.23 0.00 0.00 177.57 173.81 1wp1 s ASP 409 N -5.99 0.82 0.76 4.19 1.01 -0.54 -5.02 116.67 111.90 1wp1 s ASP 409 Ca 0.04 -0.12 -0.11 0.00 0.71 0.00 0.00 52.55 53.06 1wp1 s ASP 409 Cb 0.07 -0.16 0.05 0.00 1.01 0.00 0.00 42.92 43.89 1wp1 s ASP 409 CO 0.61 0.05 1.09 0.54 0.21 0.00 0.00 175.17 177.67 1wp1 s ASN 410 N 0.07 4.84 0.50 0.27 2.20 -1.26 -4.16 114.94 117.39 1wp1 s ASN 410 Ca -0.00 1.38 0.21 0.00 -0.94 0.00 0.00 52.86 53.51 1wp1 s ASN 410 Cb -0.05 -2.16 1.28 0.00 -2.00 0.00 0.00 41.25 38.31 1wp1 s ASN 410 CO -0.00 -1.76 2.06 0.22 -2.94 0.00 0.00 177.10 174.68 1wp1 h TYR 411 N -0.94 0.00 -0.78 1.54 3.20 -1.97 -3.05 116.97 114.97 1wp1 h TYR 411 Ca -0.46 0.00 0.13 0.00 3.14 0.00 0.00 58.73 61.54 1wp1 h TYR 411 Cb 1.25 0.00 -0.05 0.00 1.54 0.00 0.00 36.73 39.46 1wp1 h TYR 411 CO 0.51 0.13 0.52 1.25 -1.64 0.00 0.00 178.16 178.93 1wp1 h LEU 412 N 0.00 0.52 -0.23 2.82 5.85 -1.99 -0.75 115.31 121.52 1wp1 h LEU 412 Ca -0.00 0.02 -0.21 0.00 0.84 0.00 0.00 57.88 58.53 1wp1 h LEU 412 Cb 0.28 -0.08 0.01 0.00 0.37 0.00 0.00 40.66 41.23 1wp1 h LEU 412 CO 0.02 0.28 -0.77 0.74 -0.34 0.00 0.00 178.44 178.36 1wp1 h THR 413 N 0.56 1.31 -0.22 1.05 2.02 -1.92 -2.36 112.91 113.33 1wp1 h THR 413 Ca 0.38 -2.03 -0.00 0.00 0.77 0.00 0.00 66.41 65.53 1wp1 h THR 413 Cb 0.69 2.03 -0.01 0.00 -1.74 0.00 0.00 68.15 69.12 1wp1 h THR 413 CO -0.14 0.63 0.13 0.25 0.37 0.00 0.00 175.52 176.77 1wp1 h LEU 414 N 0.46 0.27 -0.59 2.58 5.85 -1.42 -1.43 115.31 121.03 1wp1 h LEU 414 Ca -0.05 -0.05 0.05 0.00 0.84 0.00 0.00 57.88 58.67 1wp1 h LEU 414 Cb 1.39 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 42.30 1wp1 h LEU 414 CO 0.15 0.24 0.32 0.25 -0.34 0.00 0.00 178.44 179.06 1wp1 h LEU 415 N 0.27 0.48 -0.67 2.25 5.85 -1.11 0.23 115.31 122.60 1wp1 h LEU 415 Ca 0.08 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.79 1wp1 h LEU 415 Cb 0.02 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 1wp1 h LEU 415 CO -0.02 0.32 0.30 -0.78 -0.34 0.00 0.00 178.44 177.93 1wp1 h ASP 416 N 0.61 0.90 -0.56 1.25 1.82 -1.29 0.11 116.42 119.27 1wp1 h ASP 416 Ca 0.26 -0.15 -0.03 0.00 -0.39 0.00 0.00 57.03 56.72 1wp1 h ASP 416 Cb 0.13 -0.23 -0.03 0.00 0.68 0.00 0.00 39.33 39.89 1wp1 h ASP 416 CO -0.16 0.80 0.25 0.00 -1.61 0.00 0.00 179.24 178.52 1wp1 h ALA 417 N 1.14 0.73 -0.30 -0.78 0.00 -0.27 -0.33 119.26 119.44 1wp1 h ALA 417 Ca 0.23 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1wp1 h ALA 417 Cb 0.15 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1wp1 h ALA 417 CO -0.02 0.31 0.19 1.96 0.00 0.00 0.00 179.25 181.69 1wp1 h GLN 418 N 0.76 0.40 -0.58 0.00 4.20 -0.76 -0.19 115.11 118.94 1wp1 h GLN 418 Ca 0.19 -0.03 -0.04 0.00 0.06 0.00 0.00 58.65 58.83 1wp1 h GLN 418 Cb 0.15 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.82 1wp1 h GLN 418 CO -0.02 0.28 0.20 0.00 -0.67 0.00 0.00 178.83 178.62 1wp1 h ARG 419 N 0.40 0.90 0.15 1.46 3.08 -0.78 -1.19 114.38 118.40 1wp1 h ARG 419 Ca 0.11 -0.18 -0.00 0.00 0.07 0.00 0.00 59.98 59.97 1wp1 h ARG 419 Cb -0.03 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 29.88 1wp1 h ARG 419 CO -0.02 0.79 -0.09 0.77 -1.07 0.00 0.00 179.97 180.35 1wp1 h SER 420 N 0.82 -0.23 0.47 7.04 0.02 -0.92 -1.31 113.55 119.44 1wp1 h SER 420 Ca 0.19 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.14 1wp1 h SER 420 Cb 0.26 0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.85 1wp1 h SER 420 CO -0.01 -0.15 -0.38 0.25 -1.14 0.00 0.00 176.83 175.40 1wp1 h LEU 421 N -0.24 -1.01 -0.47 5.07 5.85 -0.81 0.25 115.31 123.97 1wp1 h LEU 421 Ca -0.01 0.08 0.05 0.00 0.84 0.00 0.00 57.88 58.83 1wp1 h LEU 421 Cb 0.20 0.32 -0.04 0.00 0.37 0.00 0.00 40.66 41.51 1wp1 h LEU 421 CO 0.02 -0.55 0.21 0.15 -0.34 0.00 0.00 178.44 177.93 1wp1 h PHE 422 N -0.84 0.39 -0.56 1.25 -0.00 -1.27 -0.46 116.94 115.44 1wp1 h PHE 422 Ca -0.05 0.02 -0.10 0.00 -0.00 0.00 0.00 57.97 57.84 1wp1 h PHE 422 Cb 0.72 -0.11 -0.02 0.00 -0.00 0.00 0.00 35.95 36.55 1wp1 h PHE 422 CO -0.17 0.18 -0.06 1.15 -0.00 0.00 0.00 178.31 179.41 1wp1 h THR 423 N 0.43 1.27 -0.06 4.41 2.02 -1.08 -1.62 112.91 118.28 1wp1 h THR 423 Ca 0.21 -1.21 -0.10 0.00 0.77 0.00 0.00 66.41 66.08 1wp1 h THR 423 Cb 0.15 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 67.46 1wp1 h THR 423 CO -0.17 0.43 -0.41 0.00 0.37 0.00 0.00 175.52 175.74 1wp1 h ALA 424 N 0.95 1.20 -0.18 6.16 0.00 -0.19 -1.22 119.26 125.98 1wp1 h ALA 424 Ca 0.15 -0.40 -0.11 0.00 0.00 0.00 0.00 54.91 54.55 1wp1 h ALA 424 Cb 0.62 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1wp1 h ALA 424 CO 0.04 0.56 -0.33 1.96 0.00 0.00 0.00 179.25 181.48 1wp1 h GLN 425 N 0.11 0.54 -0.59 0.00 4.20 -0.82 -1.34 115.11 117.21 1wp1 h GLN 425 Ca 0.01 -0.34 -0.06 0.00 0.06 0.00 0.00 58.65 58.32 1wp1 h GLN 425 Cb 0.78 0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.58 1wp1 h GLN 425 CO 0.06 0.95 0.13 1.96 -0.67 0.00 0.00 178.83 181.26 1wp1 h GLN 426 N 0.20 0.92 -0.30 1.46 4.20 -1.20 -2.27 115.11 118.12 1wp1 h GLN 426 Ca 0.01 -0.21 -0.12 0.00 0.06 0.00 0.00 58.65 58.39 1wp1 h GLN 426 Cb 0.92 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.56 1wp1 h GLN 426 CO 0.07 0.83 -0.31 0.37 -0.67 0.00 0.00 178.83 179.12 1wp1 h GLN 427 N 0.88 0.65 -0.47 1.46 5.75 -1.14 -2.88 115.11 119.36 1wp1 h GLN 427 Ca 0.19 -0.29 0.05 0.00 -0.15 0.00 0.00 58.65 58.45 1wp1 h GLN 427 Cb 0.34 -0.01 -0.05 0.00 1.07 0.00 0.00 27.48 28.83 1wp1 h GLN 427 CO 0.00 0.88 0.19 1.25 -2.65 0.00 0.00 178.83 178.50 1wp1 h LEU 428 N 0.55 0.24 0.34 -2.39 5.85 -0.66 0.25 115.31 119.49 1wp1 h LEU 428 Ca 0.06 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 1wp1 h LEU 428 Cb 0.81 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.83 1wp1 h LEU 428 CO 0.07 0.17 -0.34 0.40 -0.34 0.00 0.00 178.44 178.40 1wp1 h ILE 429 N 0.39 0.30 -0.48 4.05 2.04 -1.39 0.78 117.51 123.19 1wp1 h ILE 429 Ca 0.22 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.17 1wp1 h ILE 429 Cb 0.18 0.30 -0.08 0.00 -0.74 0.00 0.00 36.82 36.49 1wp1 h ILE 429 CO -0.19 0.00 0.01 0.74 0.00 0.00 0.00 178.15 178.70 1wp1 h THR 430 N -0.71 0.63 -0.49 -0.27 2.02 -1.26 0.34 112.91 113.17 1wp1 h THR 430 Ca -0.02 -0.04 0.06 0.00 0.77 0.00 0.00 66.41 67.18 1wp1 h THR 430 Cb 0.64 0.50 -0.05 0.00 -1.74 0.00 0.00 68.15 67.50 1wp1 h THR 430 CO -0.06 0.02 0.20 0.44 0.37 0.00 0.00 175.52 176.49 1wp1 h ASP 431 N 0.12 0.24 -0.38 4.18 3.32 -0.06 0.24 116.42 124.07 1wp1 h ASP 431 Ca 0.24 0.05 -0.02 0.00 0.02 0.00 0.00 57.03 57.32 1wp1 h ASP 431 Cb 0.36 0.02 -0.02 0.00 0.22 0.00 0.00 39.33 39.91 1wp1 h ASP 431 CO -0.39 0.17 0.15 -0.09 -1.72 0.00 0.00 179.24 177.35 1wp1 h ARG 432 N 0.40 0.58 -0.87 3.56 9.65 0.60 -0.89 114.38 127.41 1wp1 h ARG 432 Ca 0.23 -0.11 0.05 0.00 -1.10 0.00 0.00 59.98 59.05 1wp1 h ARG 432 Cb 0.21 -0.09 -0.05 0.00 -1.39 0.00 0.00 29.97 28.65 1wp1 h ARG 432 CO -0.21 0.56 0.57 1.25 2.80 0.00 0.00 179.97 184.94 1wp1 h LEU 433 N 0.47 0.91 -0.69 3.80 5.85 0.17 -2.30 115.31 123.52 1wp1 h LEU 433 Ca 0.13 -0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.71 1wp1 h LEU 433 Cb 0.20 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 1wp1 h LEU 433 CO -0.01 0.61 -0.38 0.78 -0.34 0.00 0.00 178.44 179.10 1wp1 h ASN 434 N 1.04 0.61 -0.36 1.25 2.35 0.17 -1.74 115.58 118.91 1wp1 h ASN 434 Ca 0.36 -0.26 -0.08 0.00 -0.55 0.00 0.00 56.30 55.76 1wp1 h ASN 434 Cb 0.09 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 1wp1 h ASN 434 CO -0.12 0.93 -0.11 0.06 -1.65 0.00 0.00 177.43 176.55 1wp1 h GLN 435 N 0.49 0.71 -0.35 0.81 3.07 -0.93 -2.16 115.11 116.74 1wp1 h GLN 435 Ca 0.05 -0.28 -0.02 0.00 0.09 0.00 0.00 58.65 58.49 1wp1 h GLN 435 Cb 0.88 -0.04 -0.02 0.00 0.08 0.00 0.00 27.48 28.39 1wp1 h GLN 435 CO 0.08 0.87 0.15 -0.07 0.09 0.00 0.00 178.83 179.95 1wp1 h LEU 436 N 0.50 0.48 -0.98 0.06 3.38 -1.38 -1.81 115.31 115.55 1wp1 h LEU 436 Ca 0.09 -0.15 -0.10 0.00 0.09 0.00 0.00 57.88 57.81 1wp1 h LEU 436 Cb 0.62 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 1wp1 h LEU 436 CO 0.04 0.50 -0.31 0.71 0.09 0.00 0.00 178.44 179.46 1wp1 h THR 437 N 0.43 1.28 -0.18 0.22 1.35 -1.29 0.48 112.91 115.19 1wp1 h THR 437 Ca 0.12 -1.33 -0.00 0.00 -0.55 0.00 0.00 66.41 64.64 1wp1 h THR 437 Cb 0.16 1.49 -0.01 0.00 -1.73 0.00 0.00 68.15 68.06 1wp1 h THR 437 CO -0.01 0.41 0.10 0.28 -0.25 0.00 0.00 175.52 176.05 1wp1 h SER 438 N 0.31 0.23 -0.47 5.36 0.02 -1.22 0.61 113.55 118.38 1wp1 h SER 438 Ca 0.04 -0.07 -0.08 0.00 -0.84 0.00 0.00 61.79 60.84 1wp1 h SER 438 Cb 0.71 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 63.17 1wp1 h SER 438 CO 0.05 0.23 -0.01 -0.08 -1.14 0.00 0.00 176.83 175.89 1wp1 h GLU 439 N 0.20 0.84 -0.00 3.45 4.57 -0.95 0.54 114.58 123.23 1wp1 h GLU 439 Ca 0.07 -0.27 0.01 0.00 -1.18 0.00 0.00 59.36 57.98 1wp1 h GLU 439 Cb 0.05 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.56 1wp1 h GLU 439 CO -0.01 0.90 -0.06 0.28 -1.18 0.00 0.00 179.01 178.94 1wp1 h VAL 440 N 0.70 0.85 -0.58 0.32 2.07 0.24 -1.59 116.25 118.26 1wp1 h VAL 440 Ca 0.13 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.68 1wp1 h VAL 440 Cb 0.52 0.85 -0.03 0.00 -1.52 0.00 0.00 31.29 31.11 1wp1 h VAL 440 CO 0.03 0.00 0.38 0.78 0.02 0.00 0.00 177.57 178.78 1wp1 h ASN 441 N -0.10 0.61 -0.32 0.57 2.35 0.69 -2.15 115.58 117.22 1wp1 h ASN 441 Ca 0.03 -0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.74 1wp1 h ASN 441 Cb 0.13 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.34 1wp1 h ASN 441 CO -0.06 0.43 0.11 0.25 -1.65 0.00 0.00 177.43 176.50 1wp1 h LEU 442 N 0.71 0.45 -0.11 1.61 5.85 0.43 0.14 115.31 124.40 1wp1 h LEU 442 Ca 0.23 -0.19 0.03 0.00 0.84 0.00 0.00 57.88 58.79 1wp1 h LEU 442 Cb 0.03 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 40.90 1wp1 h LEU 442 CO -0.06 0.52 -0.11 0.22 -0.34 0.00 0.00 178.44 178.68 1wp1 h TYR 443 N 0.36 -0.27 -0.87 1.25 3.20 -0.87 -1.62 116.97 118.15 1wp1 h TYR 443 Ca 0.10 0.02 0.11 0.00 3.14 0.00 0.00 58.73 62.10 1wp1 h TYR 443 Cb 0.22 0.14 -0.08 0.00 1.54 0.00 0.00 36.73 38.55 1wp1 h TYR 443 CO 0.00 -0.17 0.50 -0.22 -1.64 0.00 0.00 178.16 176.64 1wp1 h LYS 444 N -0.13 0.77 -0.94 1.82 3.64 -1.28 -1.66 116.57 118.79 1wp1 h LYS 444 Ca 0.08 -0.05 0.03 0.00 -1.27 0.00 0.00 60.65 59.44 1wp1 h LYS 444 Cb 0.25 -0.17 -0.05 0.00 -0.41 0.00 0.00 32.23 31.84 1wp1 h LYS 444 CO -0.19 0.51 0.62 0.00 -2.27 0.00 0.00 179.45 178.12 1wp1 h ALA 445 N 1.50 1.37 0.00 5.00 0.00 0.18 -0.59 119.26 126.72 1wp1 h ALA 445 Ca 0.44 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1wp1 h ALA 445 Cb 0.46 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1wp1 h ALA 445 CO -0.28 0.55 0.00 1.28 0.00 0.00 0.00 179.25 180.81 1wp1 n LEU 446 N -4.42 0.00 0.00 0.00 4.77 -0.72 -4.90 117.00 111.72 1wp1 n LEU 446 Ca 0.12 0.45 0.00 0.00 -0.03 0.00 0.00 56.01 56.55 1wp1 n LEU 446 Cb 0.07 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.71 1wp1 n LEU 446 CO 0.35 -0.08 0.00 0.61 -1.33 0.00 0.00 177.39 176.94 1wp1 n GLY 447 N 0.92 1.47 0.23 -0.72 0.00 -0.23 -4.07 105.19 102.79 1wp1 n GLY 447 Ca 0.07 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.98 1wp1 n GLY 447 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1wp1 h GLY 448 N 0.00 -0.52 -1.92 -0.02 0.00 -1.43 -3.40 103.07 95.78 1wp1 h GLY 448 Ca 0.00 0.19 -0.03 0.00 0.00 0.00 0.00 47.33 47.49 1wp1 h GLY 448 CO 0.00 -0.19 0.03 0.61 0.00 0.00 0.00 176.54 177.00 1wp1 n GLY 449 N 0.12 2.04 0.07 4.60 0.00 -1.26 -3.95 105.19 106.81 1wp1 n GLY 449 Ca -0.08 -0.07 -0.14 0.00 0.00 0.00 0.00 46.02 45.72 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 0.11 0.05 -3.23 1.61 2.91 -1.87 -3.40 115.95 112.12 1wp1 h TRP 450 Ca 0.03 -0.03 -0.59 0.00 1.13 0.00 0.00 58.89 59.43 1wp1 h TRP 450 Cb 1.01 -0.00 -0.08 0.00 -0.51 0.00 0.00 29.16 29.58 1wp1 h TRP 450 CO 0.10 0.94 0.55 -0.80 -1.03 0.00 0.00 178.44 178.20 1wp1 s ASN 451 N -6.20 6.91 0.26 2.65 0.01 -1.25 -4.90 114.94 112.42 1wp1 s ASN 451 Ca -0.18 1.13 -0.01 0.00 -0.71 0.00 0.00 52.86 53.09 1wp1 s ASN 451 Cb -0.02 -2.46 0.47 0.00 0.41 0.00 0.00 41.25 39.65 1wp1 s ASN 451 CO 0.70 -0.55 1.83 -0.61 -1.51 0.00 0.00 177.10 176.96 1wp1 h GLN 452 N 7.59 0.90 -6.07 -0.60 4.15 -1.91 -0.69 115.11 118.48 1wp1 h GLN 452 Ca -0.22 -0.05 -0.54 0.00 0.77 0.00 0.00 58.65 58.60 1wp1 h GLN 452 Cb 1.09 -0.20 -0.20 0.00 0.21 0.00 0.00 27.48 28.37 1wp1 h GLN 452 CO 0.90 0.59 -0.81 -0.65 -1.93 0.00 0.00 178.83 176.94 1wp1 s GLN 453 N -6.00 1.19 0.68 1.69 -1.52 -1.26 -2.19 119.66 112.26 1wp1 s GLN 453 Ca -0.12 -1.27 -0.16 0.00 -1.95 0.00 0.00 55.36 51.86 1wp1 s GLN 453 Cb 0.21 -1.37 0.01 0.00 -0.22 0.00 0.00 33.01 31.64 1wp1 s GLN 453 CO 0.80 0.30 1.17 -0.08 -0.25 0.00 0.00 175.29 177.23 1wp1 s THR 454 N -1.56 2.73 0.04 -0.19 -1.32 -1.26 -3.98 115.64 110.09 1wp1 s THR 454 Ca 0.11 0.36 0.02 0.00 -1.21 0.00 0.00 61.69 60.98 1wp1 s THR 454 Cb -0.08 -2.94 -0.02 0.00 -1.51 0.00 0.00 72.50 67.95 1wp1 s THR 454 CO 0.05 -0.18 -0.08 0.68 -2.21 0.00 0.00 174.62 172.88 1wp1 s VAL 455 N -2.06 0.59 -0.78 5.08 -7.23 -1.12 -4.88 120.40 110.02 1wp1 s VAL 455 Ca 0.72 -0.98 -0.07 0.00 -1.81 0.00 0.00 61.98 59.84 1wp1 s VAL 455 Cb -0.26 -0.63 0.20 0.00 0.56 0.00 0.00 36.38 36.25 1wp1 s VAL 455 CO 0.41 -0.28 0.66 0.42 -0.31 0.00 0.00 175.10 176.00 1wp1 s THR 456 N -1.18 4.63 0.00 5.32 -4.23 -1.26 -4.90 115.64 114.02 1wp1 s THR 456 Ca -0.07 -3.00 0.00 0.00 -1.18 0.00 0.00 61.69 57.43 1wp1 s THR 456 Cb -0.09 -3.91 0.00 0.00 1.34 0.00 0.00 72.50 69.84 1wp1 s THR 456 CO 0.01 -0.99 0.00 0.00 -0.54 0.00 0.00 174.62 173.10