#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1w1u n ASN 6 N 0.00 2.67 -4.23 1.20 5.03 -1.26 -3.00 115.26 115.66 1w1u n ASN 6 Ca 0.00 -1.79 -0.31 0.00 0.87 0.00 0.00 54.58 53.35 1w1u n ASN 6 Cb 0.00 -0.14 -0.17 0.00 -1.02 0.00 0.00 39.78 38.45 1w1u n ASN 6 CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.26 174.96 1w1u s TYR 7 N -1.10 2.43 -0.17 3.10 5.04 -1.26 -3.69 117.35 121.70 1w1u s TYR 7 Ca 0.23 -0.86 -0.06 0.00 -2.44 0.00 0.00 57.07 53.93 1w1u s TYR 7 Cb 0.14 -1.61 0.08 0.00 0.35 0.00 0.00 41.96 40.91 1w1u s TYR 7 CO 0.19 -0.31 0.36 0.50 -1.34 0.00 0.00 175.55 174.95 1w1u s ARG 8 N 0.11 0.27 -1.35 4.97 3.52 -0.14 -5.01 118.95 121.31 1w1u s ARG 8 Ca -0.11 0.90 -0.15 0.00 -0.13 0.00 0.00 55.73 56.23 1w1u s ARG 8 Cb -0.16 0.16 0.00 0.00 -1.56 0.00 0.00 34.95 33.39 1w1u s ARG 8 CO 0.06 -0.25 2.21 -3.47 -0.81 0.00 0.00 175.30 173.04 1w1u n ASP 9 N 5.21 3.84 -4.25 -2.12 4.64 -1.26 -4.59 116.55 118.03 1w1u n ASP 9 Ca -0.10 -2.80 -0.14 0.00 -1.38 0.00 0.00 54.79 50.37 1w1u n ASP 9 Cb 0.50 -1.56 -0.10 0.00 -1.04 0.00 0.00 41.12 38.92 1w1u n ASP 9 CO 0.00 0.00 0.00 0.68 -0.82 0.00 0.00 177.20 177.06 1w1u s VAL 10 N 3.46 0.90 -0.22 5.18 -7.23 -1.26 -5.14 120.40 116.09 1w1u s VAL 10 Ca 0.50 -2.01 -0.02 0.00 -1.81 0.00 0.00 61.98 58.63 1w1u s VAL 10 Cb 0.14 -2.00 0.01 0.00 0.56 0.00 0.00 36.38 35.09 1w1u s VAL 10 CO -0.05 -0.60 -0.08 -1.61 -0.31 0.00 0.00 175.10 172.45 1w1u s GLU 11 N -3.84 3.13 -0.12 4.82 2.02 -1.26 -4.73 118.70 118.72 1w1u s GLU 11 Ca 0.20 -0.78 -0.01 0.00 0.02 0.00 0.00 54.97 54.41 1w1u s GLU 11 Cb 0.05 -2.92 -0.02 0.00 0.10 0.00 0.00 34.13 31.33 1w1u s GLU 11 CO 0.02 -0.27 -0.08 0.42 0.02 0.00 0.00 175.26 175.37 1w1u s ILE 12 N 1.40 3.52 -0.01 -1.63 1.01 -1.26 -5.05 121.20 119.17 1w1u s ILE 12 Ca 0.04 -0.51 -0.04 0.00 0.00 0.00 0.00 60.65 60.14 1w1u s ILE 12 Cb -0.15 -2.49 0.00 0.00 0.01 0.00 0.00 42.46 39.84 1w1u s ILE 12 CO -0.06 0.53 0.09 0.00 0.00 0.00 0.00 174.94 175.51 1w1u s ARG 13 N 0.01 0.28 0.29 2.79 1.70 -1.26 -2.66 118.95 120.10 1w1u s ARG 13 Ca -0.02 -0.18 -0.29 0.00 -0.47 0.00 0.00 55.73 54.77 1w1u s ARG 13 Cb -0.14 0.12 -0.10 0.00 -0.57 0.00 0.00 34.95 34.26 1w1u s ARG 13 CO 0.03 -0.06 1.39 0.00 -1.08 0.00 0.00 175.30 175.59 1w1u s ALA 14 N -0.72 3.57 0.55 7.88 0.00 -1.26 -4.86 121.76 126.92 1w1u s ALA 14 Ca -0.08 1.32 -0.21 0.00 0.00 0.00 0.00 51.96 52.99 1w1u s ALA 14 Cb -0.05 -3.53 -0.05 0.00 0.00 0.00 0.00 23.12 19.49 1w1u s ALA 14 CO 0.00 -0.73 1.25 -2.30 0.00 0.00 0.00 175.76 173.99 1w1u n PRO 15 N 1.64 1.49 -4.05 0.00 -0.02 -1.26 -5.00 135.00 127.78 1w1u n PRO 15 Ca 0.04 0.55 -0.25 0.00 -2.02 0.00 0.00 63.50 61.82 1w1u n PRO 15 Cb 0.41 -2.45 -0.05 0.00 -0.02 0.00 0.00 33.50 31.39 1w1u n PRO 15 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1w1u s ARG 16 N -2.80 2.27 1.31 -0.52 1.81 -1.26 -4.90 118.95 114.86 1w1u s ARG 16 Ca 0.72 -1.88 0.00 0.00 -1.72 0.00 0.00 55.73 52.85 1w1u s ARG 16 Cb -0.43 -2.02 0.00 0.00 -0.45 0.00 0.00 34.95 32.05 1w1u s ARG 16 CO 0.49 -0.25 0.00 0.41 -0.68 0.00 0.00 175.30 175.27 1w1u n GLY 17 N -1.39 -1.90 0.50 -3.53 0.00 -0.79 -4.49 105.19 93.59 1w1u n GLY 17 Ca -0.02 -1.40 0.11 0.00 0.00 0.00 0.00 46.02 44.71 1w1u n GLY 17 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1w1u n ASN 18 N 0.64 2.02 -4.63 1.61 4.13 -1.26 -4.58 115.26 113.20 1w1u n ASN 18 Ca 0.00 -1.51 -0.43 0.00 1.68 0.00 0.00 54.58 54.32 1w1u n ASN 18 Cb 0.00 0.45 -0.02 0.00 -1.54 0.00 0.00 39.78 38.66 1w1u n ASN 18 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 1w1u s LYS 19 N -2.46 3.97 0.57 3.52 2.36 -1.26 -5.00 119.74 121.43 1w1u s LYS 19 Ca 0.19 1.03 -0.17 0.00 -2.55 0.00 0.00 55.97 54.47 1w1u s LYS 19 Cb 0.18 -3.80 -0.05 0.00 -1.05 0.00 0.00 37.83 33.11 1w1u s LYS 19 CO 0.56 -1.05 1.08 -0.51 1.55 0.00 0.00 175.35 176.98 1w1u s LEU 20 N 3.99 3.62 -0.15 5.43 1.02 -1.26 -4.96 118.68 126.36 1w1u s LEU 20 Ca 0.49 1.96 -0.07 0.00 0.02 0.00 0.00 54.13 56.53 1w1u s LEU 20 Cb -0.12 -4.55 -0.07 0.00 0.02 0.00 0.00 46.19 41.46 1w1u s LEU 20 CO 0.20 -1.17 -0.19 0.41 0.02 0.00 0.00 176.35 175.62 1w1u n THR 21 N -1.68 0.84 -0.72 5.49 -1.04 -1.26 -5.02 114.28 110.88 1w1u n THR 21 Ca 0.10 -0.23 0.00 0.00 -2.04 0.00 0.00 64.05 61.88 1w1u n THR 21 Cb 0.52 -1.62 0.00 0.00 -1.82 0.00 0.00 70.33 67.41 1w1u n THR 21 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1w1u n ALA 22 N -3.59 0.00 0.14 2.41 0.00 -1.26 -4.95 120.51 113.26 1w1u n ALA 22 Ca -0.30 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.25 1w1u n ALA 22 Cb 0.72 0.00 0.05 0.00 0.00 0.00 0.00 19.45 20.22 1w1u n ALA 22 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1w1u h LYS 23 N 0.00 0.00 -3.33 0.00 1.57 -1.80 -3.47 116.57 109.54 1w1u h LYS 23 Ca 0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1w1u h LYS 23 Cb 0.00 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.24 1w1u h LYS 23 CO 0.00 0.04 0.06 -1.54 -0.57 0.00 0.00 179.45 177.44 1w1u s SER 24 N -5.71 -0.13 0.35 0.86 1.04 -1.26 -5.04 113.70 103.81 1w1u s SER 24 Ca 0.02 -0.81 0.08 0.00 0.48 0.00 0.00 55.95 55.72 1w1u s SER 24 Cb 0.08 0.67 0.65 0.00 0.10 0.00 0.00 66.02 67.52 1w1u s SER 24 CO 0.75 -1.27 1.83 -0.50 0.98 0.00 0.00 173.24 175.03 1w1u h TRP 25 N 2.12 0.26 0.00 5.02 4.06 -1.97 0.89 115.95 126.33 1w1u h TRP 25 Ca -0.23 -0.05 -0.00 0.00 2.06 0.00 0.00 58.89 60.67 1w1u h TRP 25 Cb 1.25 -0.07 -0.00 0.00 -1.00 0.00 0.00 29.16 29.34 1w1u h TRP 25 CO 0.50 0.47 -0.01 -0.07 -3.56 0.00 0.00 178.44 175.77 1w1u h LEU 26 N 0.22 0.00 0.00 -4.49 3.38 -1.98 0.51 115.31 112.95 1w1u h LEU 26 Ca 0.04 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 1w1u h LEU 26 Cb 0.55 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 1w1u h LEU 26 CO 0.04 0.01 -1.64 0.35 0.09 0.00 0.00 178.44 177.29 1w1u n THR 27 N -3.18 0.19 -0.01 0.22 -2.24 -0.89 -4.41 114.28 103.96 1w1u n THR 27 Ca -0.02 -0.34 -0.10 0.00 -2.27 0.00 0.00 64.05 61.32 1w1u n THR 27 Cb 0.14 -0.00 0.05 0.00 -2.10 0.00 0.00 70.33 68.42 1w1u n THR 27 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1w1u h GLU 28 N 0.00 0.61 0.50 -0.78 4.57 -0.37 -3.10 114.58 116.02 1w1u h GLU 28 Ca -0.08 -0.36 -0.01 0.00 -1.18 0.00 0.00 59.36 57.73 1w1u h GLU 28 Cb 0.85 0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 29.46 1w1u h GLU 28 CO 0.00 0.97 -0.40 0.00 -1.18 0.00 0.00 179.01 178.40 1w1u h ALA 29 N 0.97 -0.93 -0.02 2.92 0.00 -1.12 0.14 119.26 121.21 1w1u h ALA 29 Ca 0.02 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1w1u h ALA 29 Cb 1.04 0.54 -0.00 0.00 0.00 0.00 0.00 17.79 19.37 1w1u h ALA 29 CO 0.10 -1.05 -0.10 -1.00 0.00 0.00 0.00 179.25 177.20 1w1u h PRO 30 N -0.89 0.03 -0.41 0.00 0.13 -1.77 0.03 132.00 129.12 1w1u h PRO 30 Ca -0.05 -0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.00 1w1u h PRO 30 Cb 0.76 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.87 1w1u h PRO 30 CO -0.00 0.13 -0.01 1.25 -0.23 0.00 0.00 178.00 179.14 1w1u h LEU 31 N 0.03 0.72 -0.49 1.56 6.46 -1.37 -0.34 115.31 121.88 1w1u h LEU 31 Ca 0.01 -0.31 -0.17 0.00 -0.12 0.00 0.00 57.88 57.28 1w1u h LEU 31 Cb 0.19 -0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 39.92 1w1u h LEU 31 CO 0.01 0.85 -0.64 0.03 -0.62 0.00 0.00 178.44 178.07 1w1u h ARG 32 N 0.56 0.43 -0.01 1.25 3.08 -0.05 -2.93 114.38 116.71 1w1u h ARG 32 Ca 0.12 -0.31 -0.15 0.00 0.07 0.00 0.00 59.98 59.70 1w1u h ARG 32 Cb 0.49 0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.58 1w1u h ARG 32 CO 0.02 0.93 -0.70 0.52 -1.07 0.00 0.00 179.97 179.67 1w1u h MET 33 N 0.31 0.05 -0.06 0.04 2.86 -0.93 -0.16 114.93 117.04 1w1u h MET 33 Ca -0.01 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.58 1w1u h MET 33 Cb 1.19 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 32.86 1w1u h MET 33 CO 0.11 0.73 0.02 1.25 1.06 0.00 0.00 176.91 180.08 1w1u h LEU 34 N 0.03 0.08 -1.14 1.22 5.85 -1.05 -2.08 115.31 118.22 1w1u h LEU 34 Ca -0.01 -0.20 -0.04 0.00 0.84 0.00 0.00 57.88 58.47 1w1u h LEU 34 Cb 1.24 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 42.22 1w1u h LEU 34 CO 0.09 0.26 0.15 0.24 -0.34 0.00 0.00 178.44 178.85 1w1u h MET 35 N -0.10 0.75 -0.03 1.25 2.86 -1.42 -2.31 114.93 115.94 1w1u h MET 35 Ca 0.02 -0.13 -0.07 0.00 -2.06 0.00 0.00 59.70 57.46 1w1u h MET 35 Cb 0.21 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.73 1w1u h MET 35 CO -0.00 0.66 -0.30 -0.97 1.06 0.00 0.00 176.91 177.36 1w1u h ASN 36 N 0.74 0.05 0.49 1.22 -1.24 -0.86 -1.71 115.58 114.27 1w1u h ASN 36 Ca 0.17 -0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.16 1w1u h ASN 36 Cb 0.23 -0.01 0.00 0.00 0.73 0.00 0.00 38.32 39.27 1w1u h ASN 36 CO -0.01 0.35 0.00 0.78 -1.29 0.00 0.00 177.43 177.26 1w1u h ASN 37 N 0.05 0.00 -0.05 1.15 4.21 -0.78 -2.54 115.58 117.61 1w1u h ASN 37 Ca 0.01 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.52 1w1u h ASN 37 Cb 0.55 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.75 1w1u h ASN 37 CO 0.04 0.00 0.00 0.18 -1.29 0.00 0.00 177.43 176.36 1w1u n LEU 38 N -2.91 2.10 -4.70 1.61 4.77 -0.68 -4.15 117.00 113.04 1w1u n LEU 38 Ca -0.01 -1.11 -0.44 0.00 -0.03 0.00 0.00 56.01 54.42 1w1u n LEU 38 Cb 0.18 -0.03 -0.03 0.00 -2.33 0.00 0.00 43.42 41.21 1w1u n LEU 38 CO 0.22 0.41 1.24 -0.67 -1.33 0.00 0.00 177.39 177.26 1w1u n ASP 39 N 0.66 3.50 -0.05 -1.43 4.64 -0.96 -4.40 116.55 118.51 1w1u n ASP 39 Ca 0.08 1.09 0.25 0.00 -1.38 0.00 0.00 54.79 54.83 1w1u n ASP 39 Cb 0.31 -1.51 0.72 0.00 -1.04 0.00 0.00 41.12 39.60 1w1u n ASP 39 CO 0.00 0.00 0.00 -0.65 -0.82 0.00 0.00 177.20 175.73 1w1u h PRO 40 N 5.80 0.00 -0.00 -0.67 0.11 -1.88 0.36 132.00 135.73 1w1u h PRO 40 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1w1u h PRO 40 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1w1u h PRO 40 CO 0.88 0.00 -0.34 0.94 -0.21 0.00 0.00 178.00 179.27 1w1u n GLN 41 N -3.94 0.04 -0.06 1.05 7.27 -1.26 -4.48 117.38 116.00 1w1u n GLN 41 Ca 0.13 -0.02 -0.11 0.00 0.07 0.00 0.00 57.00 57.07 1w1u n GLN 41 Cb 0.84 -1.50 -0.04 0.00 2.41 0.00 0.00 30.24 31.95 1w1u n GLN 41 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 1w1u n VAL 42 N -1.46 1.12 -2.87 1.69 0.31 0.11 -4.61 118.33 112.62 1w1u n VAL 42 Ca 0.06 0.01 -0.34 0.00 -0.01 0.00 0.00 64.34 64.06 1w1u n VAL 42 Cb 0.33 -1.87 -0.07 0.00 -0.91 0.00 0.00 33.84 31.33 1w1u n VAL 42 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1w1u s ALA 43 N -2.40 3.16 0.06 3.52 0.00 -0.40 -4.48 121.76 121.22 1w1u s ALA 43 Ca -0.19 0.37 -0.20 0.00 0.00 0.00 0.00 51.96 51.94 1w1u s ALA 43 Cb 0.05 -3.08 -0.11 0.00 0.00 0.00 0.00 23.12 19.98 1w1u s ALA 43 CO 0.26 0.19 1.47 0.93 0.00 0.00 0.00 175.76 178.61 1w1u h GLU 44 N 2.47 0.35 -1.31 0.00 4.39 -1.23 -3.40 114.58 115.84 1w1u h GLU 44 Ca -0.48 -0.12 -0.41 0.00 0.34 0.00 0.00 59.36 58.68 1w1u h GLU 44 Cb 1.18 -0.02 -0.31 0.00 -0.10 0.00 0.00 28.75 29.50 1w1u h GLU 44 CO 0.63 0.59 -0.93 -1.71 -1.16 0.00 0.00 179.01 176.43 1w1u n ASN 45 N -4.67 -0.45 0.26 1.42 5.15 -0.56 -5.00 115.26 111.41 1w1u n ASN 45 Ca -0.05 -3.15 0.16 0.00 -0.60 0.00 0.00 54.58 50.94 1w1u n ASN 45 Cb 0.25 0.25 0.87 0.00 -0.53 0.00 0.00 39.78 40.62 1w1u n ASN 45 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 1w1u h PRO 46 N 3.29 0.00 0.00 1.20 0.13 -1.71 -1.31 132.00 133.61 1w1u h PRO 46 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 1w1u h PRO 46 Cb 0.99 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.12 1w1u h PRO 46 CO 0.39 0.00 0.00 0.87 -0.23 0.00 0.00 178.00 179.03 1w1u h LYS 47 N 0.00 0.00 -0.21 0.86 1.57 -1.85 0.15 116.57 117.10 1w1u h LYS 47 Ca 0.04 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.76 1w1u h LYS 47 Cb 0.21 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.49 1w1u h LYS 47 CO -0.00 0.00 -0.08 0.39 -0.57 0.00 0.00 179.45 179.19 1w1u n GLU 48 N -3.01 2.05 -1.05 3.15 1.02 -0.68 -0.97 120.64 121.14 1w1u n GLU 48 Ca -0.01 -2.96 -0.02 0.00 -0.02 0.00 0.00 57.16 54.15 1w1u n GLU 48 Cb 0.17 -1.74 -0.01 0.00 -0.02 0.00 0.00 31.44 29.84 1w1u n GLU 48 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1w1u n LEU 49 N -0.99 0.78 -4.65 -4.62 4.77 0.52 -4.87 117.00 107.93 1w1u n LEU 49 Ca 0.24 0.04 -0.41 0.00 -0.03 0.00 0.00 56.01 55.85 1w1u n LEU 49 Cb 0.87 -2.51 -0.04 0.00 -2.33 0.00 0.00 43.42 39.40 1w1u n LEU 49 CO 0.11 -1.00 0.61 -0.69 -1.33 0.00 0.00 177.39 175.10 1w1u s VAL 50 N -1.16 4.87 -0.17 4.08 1.01 -0.58 -2.54 120.40 125.91 1w1u s VAL 50 Ca 0.00 1.56 -0.14 0.00 0.00 0.00 0.00 61.98 63.40 1w1u s VAL 50 Cb 0.00 -4.11 -0.09 0.00 0.00 0.00 0.00 36.38 32.18 1w1u s VAL 50 CO 0.00 -0.02 -0.05 0.52 0.00 0.00 0.00 175.10 175.54 1w1u n VAL 51 N 5.03 1.46 -3.71 2.92 0.31 0.76 -1.49 118.33 123.60 1w1u n VAL 51 Ca 0.05 0.12 -0.02 0.00 -0.01 0.00 0.00 64.34 64.48 1w1u n VAL 51 Cb 0.48 -2.27 0.01 0.00 -0.91 0.00 0.00 33.84 31.16 1w1u n VAL 51 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1w1u n TYR 52 N -4.55 -1.13 -3.63 3.52 4.11 -1.21 -1.25 117.16 113.03 1w1u n TYR 52 Ca -0.17 -0.84 -0.21 0.00 -0.00 0.00 0.00 57.90 56.69 1w1u n TYR 52 Cb 0.42 0.41 0.00 0.00 -0.00 0.00 0.00 39.34 40.17 1w1u n TYR 52 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1w1u n GLY 53 N -0.45 -1.23 7.00 -7.48 0.00 -1.26 -1.83 105.19 99.94 1w1u n GLY 53 Ca -0.02 0.62 0.00 0.00 0.00 0.00 0.00 46.02 46.62 1w1u n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w1u n GLY 54 N -1.58 1.90 2.57 -0.02 0.00 -1.26 -3.50 105.19 103.31 1w1u n GLY 54 Ca -0.25 -0.45 -0.35 0.00 0.00 0.00 0.00 46.02 44.98 1w1u n GLY 54 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1w1u n ILE 55 N 0.00 3.28 -2.37 -0.61 -5.35 -1.26 -4.90 119.36 108.15 1w1u n ILE 55 Ca 0.00 -4.01 -0.43 0.00 -0.27 0.00 0.00 62.75 58.04 1w1u n ILE 55 Cb 0.00 -1.21 -0.02 0.00 -1.74 0.00 0.00 39.64 36.67 1w1u n ILE 55 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1w1u s GLY 56 N -2.00 1.47 0.27 3.28 0.00 -0.76 -4.32 107.32 105.26 1w1u s GLY 56 Ca 0.55 0.31 0.11 0.00 0.00 0.00 0.00 44.72 45.68 1w1u s GLY 56 CO -0.21 2.61 -0.09 0.50 0.00 0.00 0.00 173.10 175.91 1w1u s ARG 57 N 3.96 2.03 0.16 2.90 0.52 -0.12 -0.17 118.95 128.22 1w1u s ARG 57 Ca 0.58 -1.56 0.19 0.00 -0.52 0.00 0.00 55.73 54.41 1w1u s ARG 57 Cb -0.20 -1.99 -0.03 0.00 0.52 0.00 0.00 34.95 33.24 1w1u s ARG 57 CO 0.21 0.35 1.03 0.00 0.02 0.00 0.00 175.30 176.91 1w1u h ALA 58 N 2.08 0.63 -2.46 2.13 0.00 -1.61 -2.74 119.26 117.29 1w1u h ALA 58 Ca -0.43 -0.47 -0.09 0.00 0.00 0.00 0.00 54.91 53.92 1w1u h ALA 58 Cb 1.25 0.12 -0.18 0.00 0.00 0.00 0.00 17.79 18.98 1w1u h ALA 58 CO 0.60 0.53 -0.15 0.00 0.00 0.00 0.00 179.25 180.23 1w1u s ALA 59 N -3.08 -0.98 0.20 0.00 0.00 -1.26 -4.79 121.76 111.84 1w1u s ALA 59 Ca -0.01 0.40 -0.11 0.00 0.00 0.00 0.00 51.96 52.24 1w1u s ALA 59 Cb 0.09 0.21 0.22 0.00 0.00 0.00 0.00 23.12 23.63 1w1u s ALA 59 CO 0.79 -0.37 1.76 -0.09 0.00 0.00 0.00 175.76 177.84 1w1u h ARG 60 N 3.33 0.41 -2.77 0.00 2.43 -1.28 -3.46 114.38 113.04 1w1u h ARG 60 Ca -0.30 -0.02 0.08 0.00 -0.81 0.00 0.00 59.98 58.93 1w1u h ARG 60 Cb 1.19 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 30.61 1w1u h ARG 60 CO 0.42 0.27 0.37 0.54 -1.51 0.00 0.00 179.97 180.06 1w1u s ASN 61 N -5.42 -0.11 0.35 -3.80 2.20 -1.26 -4.94 114.94 101.95 1w1u s ASN 61 Ca -0.13 -0.75 0.04 0.00 -0.94 0.00 0.00 52.86 51.08 1w1u s ASN 61 Cb 0.16 0.67 0.64 0.00 -2.00 0.00 0.00 41.25 40.72 1w1u s ASN 61 CO 0.74 -1.29 1.94 -0.50 -2.94 0.00 0.00 177.10 175.04 1w1u h TRP 62 N 2.00 0.62 -0.64 1.54 4.06 -1.87 0.42 115.95 122.09 1w1u h TRP 62 Ca -0.26 -0.03 -0.06 0.00 2.06 0.00 0.00 58.89 60.61 1w1u h TRP 62 Cb 1.24 -0.19 -0.03 0.00 -1.00 0.00 0.00 29.16 29.18 1w1u h TRP 62 CO 0.88 0.50 0.17 1.49 -3.56 0.00 0.00 178.44 177.92 1w1u h GLU 63 N 0.62 0.99 -0.12 0.49 4.81 -1.98 0.55 114.58 119.94 1w1u h GLU 63 Ca 0.15 -0.21 -0.17 0.00 -0.13 0.00 0.00 59.36 59.00 1w1u h GLU 63 Cb 0.16 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.39 1w1u h GLU 63 CO -0.01 0.87 -0.63 0.00 -0.73 0.00 0.00 179.01 178.51 1w1u h TYR 65 N 0.33 -0.15 -0.71 0.00 5.03 -0.42 0.68 116.97 121.73 1w1u h TYR 65 Ca -0.01 -0.00 0.09 0.00 2.58 0.00 0.00 58.73 61.38 1w1u h TYR 65 Cb 1.18 0.05 -0.07 0.00 1.55 0.00 0.00 36.73 39.44 1w1u h TYR 65 CO 0.04 -0.09 0.36 -0.44 -1.32 0.00 0.00 178.16 176.71 1w1u h ASP 66 N -0.16 0.48 0.14 -2.11 3.32 -0.79 -1.79 116.42 115.51 1w1u h ASP 66 Ca -0.02 0.06 -0.10 0.00 0.02 0.00 0.00 57.03 56.99 1w1u h ASP 66 Cb 0.12 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 1w1u h ASP 66 CO 0.03 0.28 -0.37 0.50 -1.72 0.00 0.00 179.24 177.96 1w1u h LYS 67 N 0.62 0.31 -0.35 3.56 1.63 -0.92 -1.45 116.57 119.97 1w1u h LYS 67 Ca 0.34 -0.14 -0.08 0.00 -0.85 0.00 0.00 60.65 59.93 1w1u h LYS 67 Cb 0.34 -0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 31.95 1w1u h LYS 67 CO -0.25 0.64 -0.09 0.82 -3.45 0.00 0.00 179.45 177.11 1w1u h ILE 68 N 0.27 1.28 -0.49 2.00 2.04 -0.22 0.62 117.51 123.00 1w1u h ILE 68 Ca 0.03 -1.16 -0.11 0.00 1.00 0.00 0.00 64.86 64.62 1w1u h ILE 68 Cb 0.77 1.32 -0.02 0.00 -0.74 0.00 0.00 36.82 38.15 1w1u h ILE 68 CO 0.06 0.38 -0.12 0.58 0.00 0.00 0.00 178.15 179.05 1w1u h VAL 69 N 0.46 1.26 -0.26 1.67 2.07 -1.21 0.71 116.25 120.96 1w1u h VAL 69 Ca 0.09 -1.24 -0.07 0.00 0.82 0.00 0.00 66.70 66.29 1w1u h VAL 69 Cb 0.60 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 1w1u h VAL 69 CO 0.04 0.43 -0.13 -0.08 0.02 0.00 0.00 177.57 177.85 1w1u h GLU 70 N 0.82 0.54 -0.08 1.57 4.81 -1.16 -2.40 114.58 118.68 1w1u h GLU 70 Ca 0.13 -0.24 -0.02 0.00 -0.13 0.00 0.00 59.36 59.10 1w1u h GLU 70 Cb 0.65 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 30.01 1w1u h GLU 70 CO 0.05 0.80 -0.02 1.15 -0.73 0.00 0.00 179.01 180.25 1w1u h THR 71 N 0.27 1.30 -0.92 0.32 2.02 -0.78 -3.01 112.91 112.12 1w1u h THR 71 Ca 0.06 -0.96 0.15 0.00 0.77 0.00 0.00 66.41 66.43 1w1u h THR 71 Cb 0.63 1.78 -0.08 0.00 -1.74 0.00 0.00 68.15 68.75 1w1u h THR 71 CO 0.04 0.27 0.59 0.25 0.37 0.00 0.00 175.52 177.03 1w1u h LEU 72 N -0.19 0.66 -1.29 2.58 5.85 -0.90 0.28 115.31 122.31 1w1u h LEU 72 Ca 0.02 0.05 -0.07 0.00 0.84 0.00 0.00 57.88 58.71 1w1u h LEU 72 Cb 0.43 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.37 1w1u h LEU 72 CO 0.01 0.32 -0.35 0.74 -0.34 0.00 0.00 178.44 178.82 1w1u h THR 73 N 0.69 1.15 0.00 1.05 2.02 -1.30 -3.09 112.91 113.44 1w1u h THR 73 Ca 0.47 -1.24 0.00 0.00 0.77 0.00 0.00 66.41 66.41 1w1u h THR 73 Cb 0.78 1.69 0.00 0.00 -1.74 0.00 0.00 68.15 68.87 1w1u h THR 73 CO -0.23 0.34 -1.39 -2.11 0.37 0.00 0.00 175.52 172.50 1w1u n ARG 74 N -3.98 0.32 -1.62 6.66 1.85 -0.41 -3.66 116.66 115.83 1w1u n ARG 74 Ca -0.02 -0.08 -0.47 0.00 -1.00 0.00 0.00 57.85 56.29 1w1u n ARG 74 Cb 0.40 -1.53 -0.03 0.00 -1.05 0.00 0.00 32.46 30.25 1w1u n ARG 74 CO 0.00 0.00 0.00 -0.11 -0.01 0.00 0.00 177.63 177.51 1w1u n LEU 75 N -1.90 2.18 -4.92 2.89 7.94 -0.05 -4.94 117.00 118.20 1w1u n LEU 75 Ca 0.00 1.14 -0.26 0.00 -1.11 0.00 0.00 56.01 55.79 1w1u n LEU 75 Cb 0.45 -1.31 0.01 0.00 0.53 0.00 0.00 43.42 43.10 1w1u n LEU 75 CO 0.44 -0.98 0.38 -1.61 -1.11 0.00 0.00 177.39 174.51 1w1u s GLU 76 N -0.47 3.32 0.01 1.96 0.41 -1.26 -4.54 118.70 118.13 1w1u s GLU 76 Ca 0.70 -0.06 0.08 0.00 -0.41 0.00 0.00 54.97 55.28 1w1u s GLU 76 Cb -0.76 -2.44 0.37 0.00 -1.78 0.00 0.00 34.13 29.52 1w1u s GLU 76 CO 0.52 -0.25 1.27 -0.40 -0.49 0.00 0.00 175.26 175.91 1w1u n ASP 77 N -2.21 0.02 -0.06 -0.19 5.68 -1.26 -1.72 116.55 116.82 1w1u n ASP 77 Ca 0.00 0.51 0.07 0.00 -0.50 0.00 0.00 54.79 54.87 1w1u n ASP 77 Cb 0.56 -0.51 0.09 0.00 -1.14 0.00 0.00 41.12 40.12 1w1u n ASP 77 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 1w1u n ASP 78 N -1.53 2.17 -4.60 -1.12 5.75 -1.26 -3.49 116.55 112.47 1w1u n ASP 78 Ca 0.02 -2.73 -0.27 0.00 -0.01 0.00 0.00 54.79 51.80 1w1u n ASP 78 Cb 0.09 -0.30 -0.09 0.00 -1.03 0.00 0.00 41.12 39.80 1w1u n ASP 78 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 1w1u s GLU 79 N -2.24 2.18 -0.08 0.11 2.02 -0.70 -1.05 118.70 118.94 1w1u s GLU 79 Ca 0.22 -1.19 0.01 0.00 0.02 0.00 0.00 54.97 54.03 1w1u s GLU 79 Cb 0.19 -2.24 0.02 0.00 0.10 0.00 0.00 34.13 32.20 1w1u s GLU 79 CO 0.02 0.45 -0.09 0.99 0.02 0.00 0.00 175.26 176.65 1w1u s THR 80 N -1.67 1.00 -0.02 3.63 2.01 0.13 -4.59 115.64 116.12 1w1u s THR 80 Ca 0.25 -0.35 -0.20 0.00 0.31 0.00 0.00 61.69 61.70 1w1u s THR 80 Cb -0.09 -0.97 -0.05 0.00 0.01 0.00 0.00 72.50 71.40 1w1u s THR 80 CO 0.16 0.34 0.59 -0.22 -0.69 0.00 0.00 174.62 174.80 1w1u s LEU 81 N 1.11 4.40 -0.22 4.42 2.96 0.72 -1.60 118.68 130.46 1w1u s LEU 81 Ca -0.07 1.12 -0.08 0.00 -0.22 0.00 0.00 54.13 54.89 1w1u s LEU 81 Cb -0.14 -2.90 -0.04 0.00 0.50 0.00 0.00 46.19 43.61 1w1u s LEU 81 CO -0.01 0.08 0.08 -0.76 -1.32 0.00 0.00 176.35 174.42 1w1u s LEU 82 N -0.07 3.69 -0.23 -0.68 1.43 0.12 -0.52 118.68 122.42 1w1u s LEU 82 Ca 0.31 -0.05 -0.04 0.00 -1.03 0.00 0.00 54.13 53.32 1w1u s LEU 82 Cb -0.18 -1.97 -0.01 0.00 0.03 0.00 0.00 46.19 44.07 1w1u s LEU 82 CO 0.16 0.06 -0.03 -0.69 0.23 0.00 0.00 176.35 176.08 1w1u s VAL 83 N 1.07 3.41 -0.30 -1.59 1.01 0.19 -1.49 120.40 122.70 1w1u s VAL 83 Ca 0.05 -0.52 -0.07 0.00 0.00 0.00 0.00 61.98 61.44 1w1u s VAL 83 Cb -0.14 -2.58 0.01 0.00 0.00 0.00 0.00 36.38 33.68 1w1u s VAL 83 CO 0.03 0.39 0.09 -1.58 0.00 0.00 0.00 175.10 174.03 1w1u s GLN 84 N 1.48 3.01 -0.96 2.72 -0.44 0.60 -1.44 119.66 124.63 1w1u s GLN 84 Ca 0.05 -0.91 -0.23 0.00 -2.50 0.00 0.00 55.36 51.77 1w1u s GLN 84 Cb -0.15 -3.39 0.03 0.00 -1.64 0.00 0.00 33.01 27.86 1w1u s GLN 84 CO -0.03 -0.48 0.56 0.43 0.50 0.00 0.00 175.29 176.27 1w1u n SER 85 N 4.86 -3.64 -0.73 6.67 7.64 -0.19 -0.81 113.62 127.43 1w1u n SER 85 Ca -0.14 -1.06 -0.10 0.00 1.01 0.00 0.00 58.87 58.58 1w1u n SER 85 Cb 0.47 -1.35 -0.04 0.00 -1.01 0.00 0.00 64.21 62.28 1w1u n SER 85 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1w1u n GLY 86 N -1.83 1.09 3.04 0.23 0.00 -1.26 -4.24 105.19 102.22 1w1u n GLY 86 Ca -0.14 -0.41 -0.24 0.00 0.00 0.00 0.00 46.02 45.23 1w1u n GLY 86 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1w1u s LYS 87 N -2.66 1.48 -0.67 1.61 2.20 0.01 -1.08 119.74 120.63 1w1u s LYS 87 Ca 0.00 -0.43 -0.27 0.00 -0.36 0.00 0.00 55.97 54.91 1w1u s LYS 87 Cb 0.00 -1.28 0.03 0.00 -1.51 0.00 0.00 37.83 35.07 1w1u s LYS 87 CO 0.00 0.11 1.26 -1.25 -0.36 0.00 0.00 175.35 175.10 1w1u s PRO 88 N 0.37 3.31 -0.02 4.03 0.04 -1.26 -0.29 135.00 141.18 1w1u s PRO 88 Ca -0.08 -0.02 0.16 0.00 0.04 0.00 0.00 61.00 61.10 1w1u s PRO 88 Cb -0.13 -4.12 -0.19 0.00 0.04 0.00 0.00 34.50 30.11 1w1u s PRO 88 CO 0.02 -1.97 0.63 1.33 0.04 0.00 0.00 177.00 177.05 1w1u n VAL 89 N 6.52 1.23 -3.49 -0.36 0.24 -0.55 -4.98 118.33 116.93 1w1u n VAL 89 Ca 0.06 -0.73 -0.10 0.00 -2.04 0.00 0.00 64.34 61.52 1w1u n VAL 89 Cb 0.49 -0.71 -0.03 0.00 -1.47 0.00 0.00 33.84 32.13 1w1u n VAL 89 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1w1u s GLY 90 N -4.97 -0.49 -0.10 7.63 0.00 -1.22 -5.00 107.32 103.17 1w1u s GLY 90 Ca -0.05 1.02 0.01 0.00 0.00 0.00 0.00 44.72 45.70 1w1u s GLY 90 CO 0.82 0.42 -0.10 0.14 0.00 0.00 0.00 173.10 174.38 1w1u s VAL 91 N -2.91 1.11 0.14 1.40 1.01 -1.26 0.14 120.40 120.04 1w1u s VAL 91 Ca 0.02 -0.39 0.05 0.00 0.00 0.00 0.00 61.98 61.67 1w1u s VAL 91 Cb -0.01 -1.08 -0.04 0.00 0.00 0.00 0.00 36.38 35.25 1w1u s VAL 91 CO -0.07 0.37 -0.12 -0.36 0.00 0.00 0.00 175.10 174.92 1w1u s PHE 92 N 1.32 1.34 0.00 5.22 0.40 -0.63 -4.93 117.98 120.70 1w1u s PHE 92 Ca -0.02 -0.67 -0.30 0.00 -0.60 0.00 0.00 56.93 55.34 1w1u s PHE 92 Cb -0.14 -0.68 -0.03 0.00 0.51 0.00 0.00 43.02 42.68 1w1u s PHE 92 CO -0.04 0.13 0.99 0.15 0.70 0.00 0.00 175.22 177.14 1w1u s LYS 93 N -3.35 4.56 0.00 0.44 3.01 -1.26 -0.70 119.74 122.44 1w1u s LYS 93 Ca 0.14 1.43 0.00 0.00 -1.01 0.00 0.00 55.97 56.53 1w1u s LYS 93 Cb -0.00 -3.46 0.00 0.00 -1.01 0.00 0.00 37.83 33.36 1w1u s LYS 93 CO 0.02 -0.06 0.00 0.25 0.51 0.00 0.00 175.35 176.07 1w1u n THR 94 N 3.90 0.00 -3.82 2.17 -2.24 -0.22 -4.93 114.28 109.14 1w1u n THR 94 Ca 0.06 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 61.78 1w1u n THR 94 Cb 0.51 0.00 -0.00 0.00 -2.10 0.00 0.00 70.33 68.73 1w1u n THR 94 CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 1w1u s HIS 95 N 2.32 -0.08 0.22 4.78 -3.43 -1.24 -4.90 115.29 112.97 1w1u s HIS 95 Ca 0.00 -0.38 0.36 0.00 -0.80 0.00 0.00 55.06 54.24 1w1u s HIS 95 Cb 0.00 0.72 1.65 0.00 -1.43 0.00 0.00 32.58 33.52 1w1u s HIS 95 CO 0.00 -1.17 2.07 0.66 -2.00 0.00 0.00 174.74 174.30 1w1u h SER 96 N 2.00 0.00 -0.64 7.38 4.64 -1.87 -2.66 113.55 122.40 1w1u h SER 96 Ca -0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.08 1w1u h SER 96 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1w1u h SER 96 CO 0.29 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.84 1w1u n ASN 97 N -3.02 3.70 -4.95 4.97 3.02 -1.26 -4.91 115.26 112.82 1w1u n ASN 97 Ca -0.00 -1.99 -0.21 0.00 -0.03 0.00 0.00 54.58 52.35 1w1u n ASN 97 Cb 0.23 -0.43 -0.02 0.00 -0.61 0.00 0.00 39.78 38.95 1w1u n ASN 97 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1w1u s ALA 98 N -1.15 3.97 0.42 5.41 0.00 -1.00 -3.99 121.76 125.42 1w1u s ALA 98 Ca 0.46 -1.36 -0.26 0.00 0.00 0.00 0.00 51.96 50.79 1w1u s ALA 98 Cb 0.24 -1.61 -0.09 0.00 0.00 0.00 0.00 23.12 21.67 1w1u s ALA 98 CO 0.32 0.14 1.35 -2.14 0.00 0.00 0.00 175.76 175.43 1w1u s PRO 99 N -4.02 3.89 0.34 0.00 0.02 -1.23 -4.87 135.00 129.12 1w1u s PRO 99 Ca 0.38 2.26 0.18 0.00 0.02 0.00 0.00 61.00 63.84 1w1u s PRO 99 Cb -0.09 -2.74 0.36 0.00 0.02 0.00 0.00 34.50 32.05 1w1u s PRO 99 CO 0.29 -0.59 1.58 0.00 -0.33 0.00 0.00 177.00 177.94 1w1u h ARG 100 N 2.59 0.00 -4.11 5.54 2.47 -0.98 -3.42 114.38 116.47 1w1u h ARG 100 Ca -0.50 0.00 -0.36 0.00 -1.26 0.00 0.00 59.98 57.86 1w1u h ARG 100 Cb 1.25 0.00 -0.32 0.00 -1.65 0.00 0.00 29.97 29.26 1w1u h ARG 100 CO 0.62 0.40 -0.76 0.08 0.56 0.00 0.00 179.97 180.87 1w1u s VAL 101 N -3.22 0.42 -0.15 2.04 1.01 -1.15 -0.20 120.40 119.16 1w1u s VAL 101 Ca 0.03 -0.13 0.01 0.00 0.00 0.00 0.00 61.98 61.89 1w1u s VAL 101 Cb 0.09 -0.42 0.02 0.00 0.00 0.00 0.00 36.38 36.06 1w1u s VAL 101 CO 0.71 0.17 -0.19 -0.76 0.00 0.00 0.00 175.10 175.03 1w1u s LEU 102 N 0.47 1.98 -0.09 3.92 1.02 0.32 -2.07 118.68 124.22 1w1u s LEU 102 Ca -0.06 -0.57 0.03 0.00 0.02 0.00 0.00 54.13 53.56 1w1u s LEU 102 Cb -0.09 -1.35 0.01 0.00 0.02 0.00 0.00 46.19 44.77 1w1u s LEU 102 CO -0.00 0.02 -0.20 -0.63 0.02 0.00 0.00 176.35 175.56 1w1u s ILE 103 N 1.12 1.76 -0.25 -0.59 1.01 0.08 -0.64 121.20 123.69 1w1u s ILE 103 Ca -0.01 -0.84 -0.01 0.00 0.00 0.00 0.00 60.65 59.80 1w1u s ILE 103 Cb -0.14 -1.55 0.07 0.00 0.01 0.00 0.00 42.46 40.86 1w1u s ILE 103 CO -0.07 0.49 0.02 0.00 0.00 0.00 0.00 174.94 175.39 1w1u s ALA 104 N 0.50 1.62 -0.09 9.38 0.00 -0.52 -0.17 121.76 132.49 1w1u s ALA 104 Ca -0.16 -1.33 0.02 0.00 0.00 0.00 0.00 51.96 50.49 1w1u s ALA 104 Cb -0.17 -1.45 -0.02 0.00 0.00 0.00 0.00 23.12 21.48 1w1u s ALA 104 CO 0.06 -1.35 -0.16 -0.80 0.00 0.00 0.00 175.76 173.51 1w1u s ASN 105 N 1.56 3.84 -0.22 0.00 0.01 -0.72 -1.02 114.94 118.40 1w1u s ASN 105 Ca 0.01 -0.32 0.00 0.00 -0.71 0.00 0.00 52.86 51.85 1w1u s ASN 105 Cb -0.18 -1.22 0.00 0.00 0.41 0.00 0.00 41.25 40.26 1w1u s ASN 105 CO -0.12 0.24 0.00 -1.20 -1.51 0.00 0.00 177.10 174.51 1w1u n SER 106 N 3.00 -5.40 -4.70 -1.22 7.64 -1.22 -2.42 113.62 109.29 1w1u n SER 106 Ca -0.18 0.05 -0.42 0.00 1.01 0.00 0.00 58.87 59.33 1w1u n SER 106 Cb 0.52 -3.09 -0.03 0.00 -1.01 0.00 0.00 64.21 60.61 1w1u n SER 106 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1w1u s ASN 107 N -2.10 6.95 0.01 6.43 0.01 -1.26 -4.54 114.94 120.44 1w1u s ASN 107 Ca 0.00 2.08 0.04 0.00 -0.71 0.00 0.00 52.86 54.27 1w1u s ASN 107 Cb 0.00 -2.57 -0.01 0.00 0.41 0.00 0.00 41.25 39.07 1w1u s ASN 107 CO 0.00 -0.60 -0.11 -0.76 -1.51 0.00 0.00 177.10 174.11 1w1u s LEU 108 N 1.66 2.10 0.04 0.60 1.43 -1.26 -5.08 118.68 118.17 1w1u s LEU 108 Ca 0.61 -0.32 -0.34 0.00 -1.03 0.00 0.00 54.13 53.05 1w1u s LEU 108 Cb -0.31 -0.51 -0.13 0.00 0.03 0.00 0.00 46.19 45.26 1w1u s LEU 108 CO 0.27 0.06 1.69 0.52 0.23 0.00 0.00 176.35 179.12 1w1u n VAL 109 N 2.35 0.24 -0.20 -1.59 0.31 -1.26 -4.58 118.33 113.59 1w1u n VAL 109 Ca -0.16 -0.04 -0.02 0.00 -0.01 0.00 0.00 64.34 64.10 1w1u n VAL 109 Cb 0.56 -1.61 -0.00 0.00 -0.91 0.00 0.00 33.84 31.87 1w1u n VAL 109 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1w1u n PRO 110 N 4.70 -0.16 0.08 5.55 -0.02 -1.26 0.08 135.00 143.97 1w1u n PRO 110 Ca 0.20 0.79 0.20 0.00 -2.02 0.00 0.00 63.50 62.66 1w1u n PRO 110 Cb 0.28 -1.17 0.74 0.00 -0.02 0.00 0.00 33.50 33.34 1w1u n PRO 110 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1w1u h HIS 111 N 0.00 0.00 -0.50 6.00 2.76 -2.03 0.21 115.15 121.59 1w1u h HIS 111 Ca 0.15 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.32 1w1u h HIS 111 Cb 0.28 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.24 1w1u h HIS 111 CO -0.48 0.00 0.00 0.91 -1.30 0.00 0.00 177.93 177.06 1w1u n TRP 112 N -3.97 0.77 -2.56 5.26 8.01 0.11 -4.86 117.44 120.21 1w1u n TRP 112 Ca 0.07 -0.53 -0.43 0.00 -1.31 0.00 0.00 57.50 55.30 1w1u n TRP 112 Cb 0.56 -0.06 0.00 0.00 -2.01 0.00 0.00 31.31 29.81 1w1u n TRP 112 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1w1u n ALA 113 N 0.90 3.72 -2.78 6.99 0.00 0.75 -4.65 120.51 125.43 1w1u n ALA 113 Ca 0.18 -3.89 -0.09 0.00 0.00 0.00 0.00 53.44 49.63 1w1u n ALA 113 Cb 0.57 -3.55 -0.06 0.00 0.00 0.00 0.00 19.45 16.41 1w1u n ALA 113 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1w1u s ASN 114 N 4.01 -0.04 0.33 0.00 2.20 -1.26 -3.32 114.94 116.85 1w1u s ASN 114 Ca 0.52 -0.55 0.02 0.00 -0.94 0.00 0.00 52.86 51.91 1w1u s ASN 114 Cb 0.04 0.42 0.58 0.00 -2.00 0.00 0.00 41.25 40.28 1w1u s ASN 114 CO 0.06 -0.82 1.93 -0.50 -2.94 0.00 0.00 177.10 174.84 1w1u h TRP 115 N 2.55 0.73 0.03 1.54 -0.00 -1.90 -1.55 115.95 117.35 1w1u h TRP 115 Ca -0.33 -0.03 0.01 0.00 -0.00 0.00 0.00 58.89 58.54 1w1u h TRP 115 Cb 1.23 -0.23 -0.01 0.00 -0.00 0.00 0.00 29.16 30.14 1w1u h TRP 115 CO 0.38 0.56 -0.07 0.93 -0.00 0.00 0.00 178.44 180.24 1w1u h GLU 116 N 0.74 -0.13 -0.59 0.49 3.07 -1.96 0.63 114.58 116.83 1w1u h GLU 116 Ca 0.18 0.01 -0.10 0.00 -0.50 0.00 0.00 59.36 58.95 1w1u h GLU 116 Cb 0.11 0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 28.03 1w1u h GLU 116 CO -0.02 -0.09 -0.04 1.25 -1.40 0.00 0.00 179.01 178.71 1w1u h HIS 117 N -0.13 1.17 -0.72 4.33 2.76 -1.79 -1.81 115.15 118.95 1w1u h HIS 117 Ca 0.02 -0.22 0.02 0.00 -2.20 0.00 0.00 60.37 58.00 1w1u h HIS 117 Cb 0.15 -0.30 -0.04 0.00 1.55 0.00 0.00 27.41 28.77 1w1u h HIS 117 CO -0.12 1.05 0.46 0.35 -1.30 0.00 0.00 177.93 178.36 1w1u h PHE 118 N 0.96 0.87 -0.49 5.26 3.04 -0.80 -1.26 116.94 124.52 1w1u h PHE 118 Ca 0.16 0.02 -0.06 0.00 3.98 0.00 0.00 57.97 62.08 1w1u h PHE 118 Cb 0.61 -0.29 -0.02 0.00 2.56 0.00 0.00 35.95 38.81 1w1u h PHE 118 CO 0.04 0.51 0.06 -0.91 -2.02 0.00 0.00 178.31 175.99 1w1u h ASN 119 N 0.91 0.72 -0.49 0.41 -0.26 0.60 0.61 115.58 118.09 1w1u h ASN 119 Ca 0.28 -0.15 -0.02 0.00 -0.56 0.00 0.00 56.30 55.85 1w1u h ASN 119 Cb -0.02 -0.19 -0.02 0.00 -1.06 0.00 0.00 38.32 37.03 1w1u h ASN 119 CO -0.10 0.75 0.21 -0.08 -1.06 0.00 0.00 177.43 177.16 1w1u h GLU 120 N 0.73 0.72 -0.33 0.81 4.81 -0.62 -0.80 114.58 119.91 1w1u h GLU 120 Ca 0.15 -0.12 -0.13 0.00 -0.13 0.00 0.00 59.36 59.13 1w1u h GLU 120 Cb 0.36 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 1w1u h GLU 120 CO 0.01 0.63 -0.33 -0.07 -0.73 0.00 0.00 179.01 178.53 1w1u h LEU 121 N 0.65 0.77 -0.37 1.64 3.38 -0.90 -2.83 115.31 117.65 1w1u h LEU 121 Ca 0.17 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 1w1u h LEU 121 Cb 0.17 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1w1u h LEU 121 CO -0.02 1.03 0.21 -0.78 0.09 0.00 0.00 178.44 178.98 1w1u h ASP 122 N 0.62 0.45 -0.05 -0.43 1.82 -0.55 0.15 116.42 118.44 1w1u h ASP 122 Ca 0.07 -0.07 0.01 0.00 -0.39 0.00 0.00 57.03 56.65 1w1u h ASP 122 Cb 0.85 -0.11 -0.00 0.00 0.68 0.00 0.00 39.33 40.75 1w1u h ASP 122 CO 0.07 0.40 0.04 0.00 -1.61 0.00 0.00 179.24 178.14 1w1u h ALA 123 N 1.08 1.77 -0.22 -0.78 0.00 -1.01 0.32 119.26 120.42 1w1u h ALA 123 Ca 0.13 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1w1u h ALA 123 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1w1u h ALA 123 CO -0.02 -0.07 0.00 1.63 0.00 0.00 0.00 179.25 180.79 1w1u n LYS 124 N -4.11 1.85 -1.46 0.00 5.02 -0.48 -4.90 118.16 114.08 1w1u n LYS 124 Ca -0.02 -1.28 -0.08 0.00 -2.02 0.00 0.00 58.31 54.91 1w1u n LYS 124 Cb 0.14 -1.39 -0.03 0.00 -0.02 0.00 0.00 35.03 33.73 1w1u n LYS 124 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1w1u n GLY 125 N 1.17 0.74 0.92 0.72 0.00 0.11 -4.92 105.19 103.94 1w1u n GLY 125 Ca 0.16 -0.66 0.08 0.00 0.00 0.00 0.00 46.02 45.60 1w1u n GLY 125 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1w1u n LEU 126 N -0.94 3.30 -3.95 0.99 4.32 0.41 -5.00 117.00 116.14 1w1u n LEU 126 Ca -0.08 -1.94 -0.08 0.00 -0.02 0.00 0.00 56.01 53.89 1w1u n LEU 126 Cb 0.33 -0.32 -0.08 0.00 -1.62 0.00 0.00 43.42 41.73 1w1u n LEU 126 CO 0.12 0.81 -0.18 0.00 -1.22 0.00 0.00 177.39 176.92 1w1u s ALA 127 N -1.02 0.06 -0.23 -1.18 0.00 -1.23 -4.82 121.76 113.32 1w1u s ALA 127 Ca 0.33 -0.85 -0.18 0.00 0.00 0.00 0.00 51.96 51.26 1w1u s ALA 127 Cb 0.17 0.45 0.06 0.00 0.00 0.00 0.00 23.12 23.81 1w1u s ALA 127 CO 0.23 -0.47 0.60 1.41 0.00 0.00 0.00 175.76 177.53 1w1u s MET 128 N -3.89 0.67 -0.29 0.00 1.75 -1.26 -4.75 119.30 111.53 1w1u s MET 128 Ca 0.07 0.93 -0.19 0.00 -1.25 0.00 0.00 55.69 55.25 1w1u s MET 128 Cb 0.06 0.25 -0.02 0.00 2.84 0.00 0.00 34.83 37.96 1w1u s MET 128 CO -0.10 -0.11 0.55 -0.47 -0.65 0.00 0.00 175.02 174.24 1w1u s TYR 129 N 0.77 3.24 -2.47 4.11 5.04 -1.26 -3.45 117.35 123.33 1w1u s TYR 129 Ca -0.04 0.56 0.26 0.00 -2.44 0.00 0.00 57.07 55.42 1w1u s TYR 129 Cb -0.05 -2.83 0.96 0.00 0.35 0.00 0.00 41.96 40.40 1w1u s TYR 129 CO -0.06 -0.37 1.69 0.41 -1.34 0.00 0.00 175.55 175.88 1w1u n GLY 130 N 4.46 0.10 7.00 8.97 0.00 -1.26 -0.95 105.19 123.51 1w1u n GLY 130 Ca -0.03 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.54 1w1u n GLY 130 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1w1u n GLN 131 N 0.25 0.00 -0.00 1.61 1.13 -1.26 -1.37 117.38 117.74 1w1u n GLN 131 Ca 0.18 0.00 -0.01 0.00 -1.94 0.00 0.00 57.00 55.24 1w1u n GLN 131 Cb 0.36 0.00 -0.00 0.00 0.11 0.00 0.00 30.24 30.71 1w1u n GLN 131 CO 0.00 0.00 0.00 -1.33 -1.44 0.00 0.00 177.06 174.29 1w1u n MET 132 N 14.00 0.04 -0.08 -1.09 2.81 -1.26 -4.02 117.12 127.52 1w1u n MET 132 Ca 0.00 0.02 0.12 0.00 -1.81 0.00 0.00 57.70 56.03 1w1u n MET 132 Cb 0.00 -0.37 0.28 0.00 -0.71 0.00 0.00 33.22 32.43 1w1u n MET 132 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1w1u n THR 133 N -2.73 0.20 0.04 2.03 -2.24 -1.26 -4.13 114.28 106.19 1w1u n THR 133 Ca -0.01 -0.49 -0.10 0.00 -2.27 0.00 0.00 64.05 61.18 1w1u n THR 133 Cb 0.04 0.87 -0.07 0.00 -2.10 0.00 0.00 70.33 69.07 1w1u n THR 133 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1w1u h ALA 134 N 4.42 -0.19 0.00 6.98 0.00 -1.83 -2.79 119.26 125.85 1w1u h ALA 134 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1w1u h ALA 134 Cb 0.77 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1w1u h ALA 134 CO 0.00 -0.26 0.00 0.41 0.00 0.00 0.00 179.25 179.40 1w1u n GLY 135 N 0.78 -1.22 0.49 0.00 0.00 -0.47 -3.45 105.19 101.32 1w1u n GLY 135 Ca -0.07 -0.15 0.05 0.00 0.00 0.00 0.00 46.02 45.84 1w1u n GLY 135 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1w1u n SER 136 N -1.23 2.56 -3.69 1.61 3.41 -1.24 -4.92 113.62 110.12 1w1u n SER 136 Ca 0.16 -1.88 -0.23 0.00 -0.26 0.00 0.00 58.87 56.67 1w1u n SER 136 Cb 0.22 -0.15 0.03 0.00 -0.26 0.00 0.00 64.21 64.04 1w1u n SER 136 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 1w1u n TRP 137 N 0.37 -1.92 -2.50 7.33 8.01 -1.07 -4.91 117.44 122.75 1w1u n TRP 137 Ca 0.09 0.78 0.02 0.00 -1.31 0.00 0.00 57.50 57.07 1w1u n TRP 137 Cb 0.36 -4.17 0.02 0.00 -2.01 0.00 0.00 31.31 25.50 1w1u n TRP 137 CO 0.00 0.00 0.00 1.51 -1.01 0.00 0.00 177.69 178.19 1w1u n ILE 138 N -4.20 0.21 -3.34 -0.99 0.13 -1.10 -4.61 119.36 105.47 1w1u n ILE 138 Ca -0.26 -1.19 -0.38 0.00 -1.10 0.00 0.00 62.75 59.82 1w1u n ILE 138 Cb 0.66 0.98 -0.06 0.00 -0.84 0.00 0.00 39.64 40.39 1w1u n ILE 138 CO 0.00 0.00 0.00 -0.47 2.80 0.00 0.00 176.55 178.88 1w1u s TYR 139 N -0.64 3.69 -0.30 9.51 5.04 -1.23 -4.84 117.35 128.58 1w1u s TYR 139 Ca 0.27 1.08 0.14 0.00 -2.44 0.00 0.00 57.07 56.12 1w1u s TYR 139 Cb 0.33 -2.47 0.47 0.00 0.35 0.00 0.00 41.96 40.64 1w1u s TYR 139 CO -0.12 0.46 1.12 0.44 -1.34 0.00 0.00 175.55 176.10 1w1u n ILE 140 N 2.43 1.85 -4.23 3.14 -5.35 -1.26 -4.66 119.36 111.28 1w1u n ILE 140 Ca -0.10 -3.69 0.00 0.00 -0.27 0.00 0.00 62.75 58.69 1w1u n ILE 140 Cb 0.51 -0.03 0.00 0.00 -1.74 0.00 0.00 39.64 38.38 1w1u n ILE 140 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1w1u n GLY 141 N -0.55 -0.79 0.15 3.28 0.00 -1.26 -3.64 105.19 102.37 1w1u n GLY 141 Ca 0.25 -1.17 0.12 0.00 0.00 0.00 0.00 46.02 45.23 1w1u n GLY 141 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1w1u h SER 142 N 1.29 0.00 0.59 1.61 0.02 -1.87 -2.94 113.55 112.24 1w1u h SER 142 Ca 0.00 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.92 1w1u h SER 142 Cb 0.00 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.54 1w1u h SER 142 CO 0.00 0.00 -0.15 -0.61 -1.14 0.00 0.00 176.83 174.93 1w1u h GLN 143 N 0.00 0.00 -1.00 3.45 4.15 -1.90 -2.67 115.11 117.14 1w1u h GLN 143 Ca 0.00 0.00 0.07 0.00 0.77 0.00 0.00 58.65 59.49 1w1u h GLN 143 Cb 0.34 0.00 -0.07 0.00 0.21 0.00 0.00 27.48 27.96 1w1u h GLN 143 CO 0.00 0.15 0.64 0.78 -1.93 0.00 0.00 178.83 178.47 1w1u h GLY 144 N 1.32 1.53 0.00 2.39 0.00 -1.68 -3.16 103.07 103.47 1w1u h GLY 144 Ca -0.00 -0.47 0.00 0.00 0.00 0.00 0.00 47.33 46.86 1w1u h GLY 144 CO 0.02 0.32 -1.22 4.51 0.00 0.00 0.00 176.54 180.17 1w1u n ILE 145 N -4.52 0.00 -0.31 2.60 3.06 -1.17 -4.67 119.36 114.35 1w1u n ILE 145 Ca 0.16 -0.25 0.11 0.00 -2.50 0.00 0.00 62.75 60.27 1w1u n ILE 145 Cb 0.20 0.58 0.33 0.00 0.54 0.00 0.00 39.64 41.28 1w1u n ILE 145 CO 0.00 0.00 0.00 1.62 -2.50 0.00 0.00 176.55 175.67 1w1u h VAL 146 N 0.00 0.84 -0.17 9.51 3.04 -1.44 -0.61 116.25 127.42 1w1u h VAL 146 Ca 0.00 -0.28 -0.14 0.00 -1.01 0.00 0.00 66.70 65.28 1w1u h VAL 146 Cb 0.55 -0.03 -0.01 0.00 -2.01 0.00 0.00 31.29 29.78 1w1u h VAL 146 CO 0.00 0.15 -0.48 -0.61 -1.01 0.00 0.00 177.57 175.61 1w1u h GLN 147 N 0.80 0.45 -0.63 4.17 4.15 -1.83 -1.26 115.11 120.95 1w1u h GLN 147 Ca 0.49 -0.25 -0.08 0.00 0.77 0.00 0.00 58.65 59.58 1w1u h GLN 147 Cb 0.68 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.37 1w1u h GLN 147 CO -0.25 0.83 0.09 0.78 -1.93 0.00 0.00 178.83 178.35 1w1u h GLY 148 N 1.16 1.14 1.17 2.39 0.00 -1.46 0.40 103.07 107.87 1w1u h GLY 148 Ca 0.02 -0.77 -0.11 0.00 0.00 0.00 0.00 47.33 46.46 1w1u h GLY 148 CO 0.09 0.72 -0.11 -0.84 0.00 0.00 0.00 176.54 176.39 1w1u h THR 149 N 0.97 1.27 0.15 4.70 2.02 -1.21 -0.74 112.91 120.07 1w1u h THR 149 Ca 0.19 -1.26 -0.01 0.00 0.77 0.00 0.00 66.41 66.11 1w1u h THR 149 Cb 0.46 0.98 0.00 0.00 -1.74 0.00 0.00 68.15 67.85 1w1u h THR 149 CO 0.02 0.44 -0.07 0.22 0.37 0.00 0.00 175.52 176.50 1w1u h TYR 150 N 0.87 -0.18 -0.61 3.16 3.20 -0.88 -1.70 116.97 120.83 1w1u h TYR 150 Ca 0.14 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 62.03 1w1u h TYR 150 Cb 0.67 0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.96 1w1u h TYR 150 CO 0.04 -0.09 0.40 0.93 -1.64 0.00 0.00 178.16 177.80 1w1u h GLU 151 N -0.22 0.71 -0.41 1.82 4.39 -0.76 0.19 114.58 120.29 1w1u h GLU 151 Ca -0.02 -0.04 -0.08 0.00 0.34 0.00 0.00 59.36 59.56 1w1u h GLU 151 Cb 0.17 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 28.65 1w1u h GLU 151 CO 0.03 0.47 -0.05 1.15 -1.16 0.00 0.00 179.01 179.45 1w1u h THR 152 N 0.73 1.27 -0.27 1.13 2.02 -0.86 -1.34 112.91 115.59 1w1u h THR 152 Ca 0.24 -1.12 -0.17 0.00 0.77 0.00 0.00 66.41 66.13 1w1u h THR 152 Cb 0.04 1.16 0.00 0.00 -1.74 0.00 0.00 68.15 67.61 1w1u h THR 152 CO -0.06 0.38 -0.50 -0.26 0.37 0.00 0.00 175.52 175.44 1w1u h PHE 153 N 0.59 1.03 -0.12 3.16 0.04 -0.59 -1.83 116.94 119.22 1w1u h PHE 153 Ca 0.11 -0.37 0.01 0.00 2.80 0.00 0.00 57.97 60.53 1w1u h PHE 153 Cb 0.56 -0.19 -0.01 0.00 2.20 0.00 0.00 35.95 38.50 1w1u h PHE 153 CO 0.04 1.18 0.03 0.28 -0.60 0.00 0.00 178.31 179.24 1w1u h VAL 154 N 0.58 0.96 -0.45 -0.55 2.07 -0.59 0.87 116.25 119.14 1w1u h VAL 154 Ca 0.01 -0.03 -0.07 0.00 0.82 0.00 0.00 66.70 67.44 1w1u h VAL 154 Cb 1.11 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 31.73 1w1u h VAL 154 CO 0.11 0.02 0.01 -0.08 0.02 0.00 0.00 177.57 177.64 1w1u h GLU 155 N 0.08 0.74 -0.28 1.57 4.57 -1.27 -0.26 114.58 119.73 1w1u h GLU 155 Ca 0.05 -0.19 -0.12 0.00 -1.18 0.00 0.00 59.36 57.92 1w1u h GLU 155 Cb 0.04 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.53 1w1u h GLU 155 CO -0.06 0.75 -0.33 0.00 -1.18 0.00 0.00 179.01 178.18 1w1u h ALA 156 N 1.31 0.91 -0.49 2.92 0.00 -0.99 -1.39 119.26 121.54 1w1u h ALA 156 Ca 0.14 -0.40 -0.11 0.00 0.00 0.00 0.00 54.91 54.53 1w1u h ALA 156 Cb 0.42 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1w1u h ALA 156 CO 0.02 0.62 -0.13 0.78 0.00 0.00 0.00 179.25 180.54 1w1u h GLY 157 N 1.03 1.03 1.07 0.00 0.00 -0.17 -0.16 103.07 105.86 1w1u h GLY 157 Ca 0.06 -0.86 -0.05 0.00 0.00 0.00 0.00 47.33 46.47 1w1u h GLY 157 CO 0.07 0.78 0.26 3.21 0.00 0.00 0.00 176.54 180.87 1w1u h ARG 158 N 0.80 1.17 -0.05 4.80 3.08 -0.81 0.62 114.38 124.00 1w1u h ARG 158 Ca 0.12 -0.24 -0.18 0.00 0.07 0.00 0.00 59.98 59.75 1w1u h ARG 158 Cb 0.69 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.56 1w1u h ARG 158 CO 0.05 0.98 -0.76 1.96 -1.07 0.00 0.00 179.97 181.13 1w1u h GLN 159 N 1.13 0.30 0.00 0.04 4.20 -1.04 -3.24 115.11 116.50 1w1u h GLN 159 Ca 0.25 -0.26 0.00 0.00 0.06 0.00 0.00 58.65 58.70 1w1u h GLN 159 Cb 0.27 0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.12 1w1u h GLN 159 CO -0.01 0.93 -1.29 0.72 -0.67 0.00 0.00 178.83 178.51 1w1u n HIS 160 N -3.79 0.00 -2.03 2.96 8.25 -0.09 -4.73 115.22 115.79 1w1u n HIS 160 Ca -0.04 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.47 1w1u n HIS 160 Cb 0.72 -0.17 0.10 0.00 1.12 0.00 0.00 29.99 31.77 1w1u n HIS 160 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1w1u n TYR 161 N -1.73 0.00 -3.65 4.41 4.02 0.21 -5.00 117.16 115.42 1w1u n TYR 161 Ca -0.01 -0.90 -0.27 0.00 -0.01 0.00 0.00 57.90 56.70 1w1u n TYR 161 Cb 0.20 -0.18 -0.00 0.00 -0.02 0.00 0.00 39.34 39.33 1w1u n TYR 161 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1w1u n GLY 162 N -0.29 -0.48 0.00 2.72 0.00 -0.97 -4.27 105.19 101.90 1w1u n GLY 162 Ca 0.11 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.25 1w1u n GLY 162 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w1u n GLY 163 N -1.30 1.50 3.79 -0.02 0.00 -0.99 -4.93 105.19 103.23 1w1u n GLY 163 Ca 0.02 -0.89 -0.33 0.00 0.00 0.00 0.00 46.02 44.82 1w1u n GLY 163 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1w1u s SER 164 N -4.00 5.60 -0.11 1.61 0.15 -1.26 -3.89 113.70 111.81 1w1u s SER 164 Ca 0.00 1.93 0.15 0.00 0.70 0.00 0.00 55.95 58.73 1w1u s SER 164 Cb 0.00 -2.55 0.52 0.00 -1.71 0.00 0.00 66.02 62.29 1w1u s SER 164 CO 0.00 -1.29 1.44 0.18 1.20 0.00 0.00 173.24 174.77 1w1u n LEU 165 N -1.97 3.90 -4.67 3.45 4.77 -1.26 -4.89 117.00 116.33 1w1u n LEU 165 Ca 0.10 -2.53 -0.45 0.00 -0.03 0.00 0.00 56.01 53.09 1w1u n LEU 165 Cb 0.52 -0.46 -0.03 0.00 -2.33 0.00 0.00 43.42 41.12 1w1u n LEU 165 CO 0.46 0.73 1.09 1.17 -1.33 0.00 0.00 177.39 179.51 1w1u n LYS 166 N 0.31 2.09 -0.66 3.23 4.81 -1.22 -0.36 118.16 126.36 1w1u n LYS 166 Ca 0.20 0.75 0.00 0.00 -0.87 0.00 0.00 58.31 58.38 1w1u n LYS 166 Cb 0.76 -2.45 0.00 0.00 0.02 0.00 0.00 35.03 33.36 1w1u n LYS 166 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1w1u n GLY 167 N 2.62 1.53 3.88 3.14 0.00 -1.26 -5.01 105.19 110.09 1w1u n GLY 167 Ca 0.14 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.93 1w1u n GLY 167 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1w1u s LYS 168 N -0.04 3.13 0.04 1.61 -0.14 0.52 -4.77 119.74 120.10 1w1u s LYS 168 Ca 0.00 -0.89 0.02 0.00 -1.36 0.00 0.00 55.97 53.74 1w1u s LYS 168 Cb 0.00 -2.72 -0.02 0.00 -1.68 0.00 0.00 37.83 33.41 1w1u s LYS 168 CO 0.00 0.43 -0.08 1.67 -0.76 0.00 0.00 175.35 176.61 1w1u s TRP 169 N -1.99 0.70 -0.10 3.18 1.48 -1.26 -1.46 118.94 119.48 1w1u s TRP 169 Ca 0.33 -0.47 -0.04 0.00 -1.06 0.00 0.00 56.10 54.86 1w1u s TRP 169 Cb -0.09 -0.42 -0.04 0.00 -1.16 0.00 0.00 33.47 31.77 1w1u s TRP 169 CO 0.26 -0.07 0.06 0.08 -4.06 0.00 0.00 176.95 173.22 1w1u s VAL 170 N -1.30 4.79 -0.15 -0.66 1.01 -0.37 -0.90 120.40 122.82 1w1u s VAL 170 Ca -0.09 -0.06 -0.01 0.00 0.00 0.00 0.00 61.98 61.82 1w1u s VAL 170 Cb -0.10 -3.05 -0.01 0.00 0.00 0.00 0.00 36.38 33.22 1w1u s VAL 170 CO 0.00 0.60 -0.12 -0.22 0.00 0.00 0.00 175.10 175.37 1w1u s LEU 171 N -0.88 2.73 0.00 3.92 2.96 0.15 -0.81 118.68 126.76 1w1u s LEU 171 Ca 0.13 -0.34 -0.07 0.00 -0.22 0.00 0.00 54.13 53.63 1w1u s LEU 171 Cb -0.12 -1.63 0.03 0.00 0.50 0.00 0.00 46.19 44.98 1w1u s LEU 171 CO 0.03 0.13 0.43 1.07 -1.32 0.00 0.00 176.35 176.69 1w1u n THR 172 N 3.75 0.00 -3.82 3.68 5.66 -0.67 -2.15 114.28 120.74 1w1u n THR 172 Ca -0.18 -0.65 -0.10 0.00 -3.05 0.00 0.00 64.05 60.07 1w1u n THR 172 Cb 0.52 0.58 -0.08 0.00 -1.55 0.00 0.00 70.33 69.81 1w1u n THR 172 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1w1u s ALA 173 N -1.73 -0.41 0.00 1.79 0.00 -1.26 -1.87 121.76 118.28 1w1u s ALA 173 Ca 0.10 -0.32 0.00 0.00 0.00 0.00 0.00 51.96 51.74 1w1u s ALA 173 Cb -0.02 0.38 0.00 0.00 0.00 0.00 0.00 23.12 23.47 1w1u s ALA 173 CO 0.08 -0.44 0.00 0.41 0.00 0.00 0.00 175.76 175.81 1w1u n GLY 174 N 0.37 0.26 2.68 0.00 0.00 -0.42 -0.90 105.19 107.18 1w1u n GLY 174 Ca -0.17 -0.78 -0.31 0.00 0.00 0.00 0.00 46.02 44.76 1w1u n GLY 174 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1w1u n LEU 175 N 0.00 5.41 0.00 0.99 4.77 -1.26 -3.54 117.00 123.37 1w1u n LEU 175 Ca 0.00 -5.27 0.00 0.00 -0.03 0.00 0.00 56.01 50.71 1w1u n LEU 175 Cb 0.00 -0.65 0.00 0.00 -2.33 0.00 0.00 43.42 40.44 1w1u n LEU 175 CO 0.00 2.16 0.00 0.61 -1.33 0.00 0.00 177.39 178.83 1w1u n GLY 176 N -0.41 1.14 0.33 -0.72 0.00 -1.26 -4.41 105.19 99.86 1w1u n GLY 176 Ca 0.41 -1.87 -0.12 0.00 0.00 0.00 0.00 46.02 44.44 1w1u n GLY 176 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1w1u h GLY 177 N 0.00 -0.52 0.83 -0.02 0.00 -1.94 0.21 103.07 101.63 1w1u h GLY 177 Ca 0.00 0.38 -0.35 0.00 0.00 0.00 0.00 47.33 47.36 1w1u h GLY 177 CO 0.00 -0.23 -1.83 -0.33 0.00 0.00 0.00 176.54 174.15 1w1u h MET 178 N -0.46 0.28 -0.22 4.80 2.86 -1.93 -3.35 114.93 116.91 1w1u h MET 178 Ca 0.06 -0.48 -0.00 0.00 -2.06 0.00 0.00 59.70 57.21 1w1u h MET 178 Cb 0.55 0.18 -0.01 0.00 0.06 0.00 0.00 31.60 32.38 1w1u h MET 178 CO -0.26 1.17 0.12 0.78 1.06 0.00 0.00 176.91 179.77 1w1u h GLY 179 N 1.26 0.31 2.00 8.32 0.00 -1.72 -1.77 103.07 111.46 1w1u h GLY 179 Ca -0.36 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 46.84 1w1u h GLY 179 CO 0.13 0.12 0.00 -1.33 0.00 0.00 0.00 176.54 175.46 1w1u h GLY 180 N 0.36 0.00 2.00 4.60 0.00 -0.62 -0.71 103.07 108.69 1w1u h GLY 180 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.41 1w1u h GLY 180 CO -0.01 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.53 1w1u h ALA 181 N 2.01 1.00 -0.42 3.60 0.00 -1.51 -3.34 119.26 120.59 1w1u h ALA 181 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 54.91 54.98 1w1u h ALA 181 Cb 0.02 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.75 1w1u h ALA 181 CO 0.00 0.00 0.03 1.96 0.00 0.00 0.00 179.25 181.24 1w1u h GLN 182 N 0.00 0.14 -0.45 0.00 4.20 -1.27 -0.62 115.11 117.10 1w1u h GLN 182 Ca 0.00 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 1w1u h GLN 182 Cb 0.85 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.57 1w1u h GLN 182 CO 0.00 0.09 0.26 -1.00 -0.67 0.00 0.00 178.83 177.51 1w1u h PRO 183 N 0.14 0.62 -0.49 1.46 0.13 -1.77 -0.14 132.00 131.95 1w1u h PRO 183 Ca 0.21 -0.07 -0.09 0.00 -0.87 0.00 0.00 66.00 65.18 1w1u h PRO 183 Cb 0.29 -0.13 -0.02 0.00 0.13 0.00 0.00 31.00 31.28 1w1u h PRO 183 CO -0.32 0.48 -0.04 1.25 -0.23 0.00 0.00 178.00 179.13 1w1u h LEU 184 N 0.59 0.88 -0.64 1.56 6.46 -1.08 -1.35 115.31 121.73 1w1u h LEU 184 Ca 0.16 -0.33 0.01 0.00 -0.12 0.00 0.00 57.88 57.61 1w1u h LEU 184 Cb 0.03 -0.24 -0.03 0.00 -0.73 0.00 0.00 40.66 39.68 1w1u h LEU 184 CO -0.03 1.00 0.42 0.00 -0.62 0.00 0.00 178.44 179.21 1w1u h ALA 185 N 0.91 0.82 -0.04 1.25 0.00 -0.91 0.28 119.26 121.57 1w1u h ALA 185 Ca 0.13 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1w1u h ALA 185 Cb 0.57 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 1w1u h ALA 185 CO 0.03 0.22 0.03 0.00 0.00 0.00 0.00 179.25 179.53 1w1u h ALA 186 N 1.25 0.06 -0.42 0.00 0.00 -0.80 -1.27 119.26 118.08 1w1u h ALA 186 Ca 0.24 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.18 1w1u h ALA 186 Cb -0.06 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 1w1u h ALA 186 CO -0.07 -0.43 0.16 1.15 0.00 0.00 0.00 179.25 180.06 1w1u h THR 187 N 0.03 0.90 0.00 0.00 2.02 -0.74 0.22 112.91 115.34 1w1u h THR 187 Ca 0.02 -0.12 -0.02 0.00 0.77 0.00 0.00 66.41 67.06 1w1u h THR 187 Cb 0.02 0.53 -0.00 0.00 -1.74 0.00 0.00 68.15 66.96 1w1u h THR 187 CO -0.00 0.06 -0.07 -0.07 0.37 0.00 0.00 175.52 175.81 1w1u h LEU 188 N 0.34 0.00 -1.08 2.58 3.38 -0.23 -0.74 115.31 119.56 1w1u h LEU 188 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1w1u h LEU 188 Cb 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1w1u h LEU 188 CO -0.18 0.07 0.00 0.00 0.09 0.00 0.00 178.44 178.42 1w1u n ALA 189 N -2.19 2.53 -0.52 1.53 0.00 -0.50 -4.92 120.51 116.44 1w1u n ALA 189 Ca -0.01 -0.51 0.00 0.00 0.00 0.00 0.00 53.44 52.92 1w1u n ALA 189 Cb 0.24 -1.11 0.00 0.00 0.00 0.00 0.00 19.45 18.58 1w1u n ALA 189 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1w1u n GLY 190 N 1.15 0.75 3.79 0.00 0.00 -0.28 -4.03 105.19 106.55 1w1u n GLY 190 Ca 0.17 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 1w1u n GLY 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1w1u s ALA 191 N -2.54 3.59 0.59 4.61 0.00 -0.05 -3.43 121.76 124.53 1w1u s ALA 191 Ca 0.00 -1.64 0.03 0.00 0.00 0.00 0.00 51.96 50.35 1w1u s ALA 191 Cb 0.00 -1.04 0.07 0.00 0.00 0.00 0.00 23.12 22.15 1w1u s ALA 191 CO 0.00 0.11 0.82 0.00 0.00 0.00 0.00 175.76 176.69 1w1u s SER 193 N -4.54 -0.67 -0.29 0.00 1.04 -1.04 -1.24 113.70 106.95 1w1u s SER 193 Ca 0.60 0.81 -0.03 0.00 0.48 0.00 0.00 55.95 57.82 1w1u s SER 193 Cb -0.08 0.66 0.04 0.00 0.10 0.00 0.00 66.02 66.74 1w1u s SER 193 CO 0.40 -0.56 0.01 -0.22 0.98 0.00 0.00 173.24 173.84 1w1u s LEU 194 N -0.99 3.81 -0.39 2.42 2.96 0.01 -0.87 118.68 125.64 1w1u s LEU 194 Ca -0.10 -1.12 -0.04 0.00 -0.22 0.00 0.00 54.13 52.65 1w1u s LEU 194 Cb -0.01 -1.74 0.09 0.00 0.50 0.00 0.00 46.19 45.03 1w1u s LEU 194 CO 0.09 -0.24 0.17 0.20 -1.32 0.00 0.00 176.35 175.25 1w1u s ASN 195 N 1.31 5.27 -0.14 3.68 0.01 0.11 -1.66 114.94 123.52 1w1u s ASN 195 Ca -0.03 -1.71 -0.22 0.00 -0.71 0.00 0.00 52.86 50.19 1w1u s ASN 195 Cb -0.19 -1.84 -0.03 0.00 0.41 0.00 0.00 41.25 39.60 1w1u s ASN 195 CO -0.01 -0.47 0.66 -0.51 -1.51 0.00 0.00 177.10 175.26 1w1u s ILE 196 N 1.24 5.03 -0.05 0.60 -1.16 -0.78 -0.92 121.20 125.16 1w1u s ILE 196 Ca 0.04 1.31 0.01 0.00 -0.51 0.00 0.00 60.65 61.49 1w1u s ILE 196 Cb -0.22 -3.99 0.02 0.00 0.61 0.00 0.00 42.46 38.88 1w1u s ILE 196 CO -0.02 0.17 -0.07 -0.70 -2.81 0.00 0.00 174.94 171.52 1w1u s GLU 197 N 1.40 1.10 0.45 3.50 2.56 -0.06 -1.30 118.70 126.35 1w1u s GLU 197 Ca 0.33 -0.19 0.24 0.00 0.00 0.00 0.00 54.97 55.34 1w1u s GLU 197 Cb -0.16 -1.03 0.47 0.00 2.00 0.00 0.00 34.13 35.40 1w1u s GLU 197 CO 0.13 -0.06 1.66 0.66 -0.56 0.00 0.00 175.26 177.09 1w1u h SER 198 N 7.19 0.00 -3.45 -1.70 4.64 -1.73 -1.25 113.55 117.25 1w1u h SER 198 Ca -0.35 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.34 1w1u h SER 198 Cb 1.16 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 63.05 1w1u h SER 198 CO 0.46 0.01 -0.61 -1.10 -0.87 0.00 0.00 176.83 174.72 1w1u s GLN 199 N -3.27 3.78 0.31 4.77 -0.21 -1.26 -4.67 119.66 119.11 1w1u s GLN 199 Ca 0.06 -0.44 0.02 0.00 0.02 0.00 0.00 55.36 55.02 1w1u s GLN 199 Cb 0.06 -3.21 0.50 0.00 1.00 0.00 0.00 33.01 31.36 1w1u s GLN 199 CO 0.66 0.06 1.84 0.37 -2.12 0.00 0.00 175.29 176.10 1w1u h GLN 200 N 7.37 0.65 0.00 2.91 5.75 -2.01 -2.70 115.11 127.09 1w1u h GLN 200 Ca -0.36 -0.14 -0.04 0.00 -0.15 0.00 0.00 58.65 57.96 1w1u h GLN 200 Cb 1.18 -0.09 -0.01 0.00 1.07 0.00 0.00 27.48 29.63 1w1u h GLN 200 CO 0.63 0.65 -0.17 0.66 -2.65 0.00 0.00 178.83 177.95 1w1u h SER 201 N 0.62 0.00 0.25 -0.69 4.64 -1.99 -0.45 113.55 115.93 1w1u h SER 201 Ca 0.13 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.17 1w1u h SER 201 Cb 0.34 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.45 1w1u h SER 201 CO 0.01 0.17 -1.18 0.03 -0.87 0.00 0.00 176.83 174.99 1w1u h ARG 202 N 0.00 0.53 -0.53 4.77 2.47 -1.80 -0.57 114.38 119.25 1w1u h ARG 202 Ca -0.00 -0.69 -0.02 0.00 -1.26 0.00 0.00 59.98 58.01 1w1u h ARG 202 Cb 0.31 0.23 -0.02 0.00 -1.65 0.00 0.00 29.97 28.83 1w1u h ARG 202 CO 0.02 1.30 0.26 0.82 0.56 0.00 0.00 179.97 182.93 1w1u h ILE 203 N 0.24 1.19 -0.93 2.04 2.04 -1.20 -0.73 117.51 120.17 1w1u h ILE 203 Ca -0.16 -0.54 0.02 0.00 1.00 0.00 0.00 64.86 65.18 1w1u h ILE 203 Cb 1.85 0.58 -0.05 0.00 -0.74 0.00 0.00 36.82 38.46 1w1u h ILE 203 CO 0.22 0.22 0.61 0.44 0.00 0.00 0.00 178.15 179.64 1w1u h ASP 204 N 0.71 1.05 -0.34 1.72 3.32 -1.03 -0.97 116.42 120.88 1w1u h ASP 204 Ca 0.18 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.21 1w1u h ASP 204 Cb 0.10 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 1w1u h ASP 204 CO -0.02 0.75 0.20 0.15 -1.72 0.00 0.00 179.24 178.60 1w1u h PHE 205 N 1.24 0.45 -0.26 4.55 3.04 -0.32 0.42 116.94 126.06 1w1u h PHE 205 Ca 0.35 -0.00 -0.05 0.00 3.98 0.00 0.00 57.97 62.25 1w1u h PHE 205 Cb -0.11 -0.15 -0.01 0.00 2.56 0.00 0.00 35.95 38.24 1w1u h PHE 205 CO -0.01 0.33 -0.05 0.00 -2.02 0.00 0.00 178.31 176.56 1w1u h ARG 206 N 0.44 0.39 -0.21 1.11 -0.00 -0.65 -1.67 114.38 113.80 1w1u h ARG 206 Ca 0.12 -0.08 -0.11 0.00 -0.50 0.00 0.00 59.98 59.41 1w1u h ARG 206 Cb 0.01 -0.06 -0.00 0.00 0.00 0.00 0.00 29.97 29.92 1w1u h ARG 206 CO -0.02 0.46 -0.29 -0.07 0.00 0.00 0.00 179.97 180.05 1w1u h LEU 207 N 0.38 0.63 -1.54 3.04 3.38 -0.70 0.13 115.31 120.63 1w1u h LEU 207 Ca 0.08 -0.51 -0.03 0.00 0.09 0.00 0.00 57.88 57.52 1w1u h LEU 207 Cb 0.33 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1w1u h LEU 207 CO 0.01 1.01 -0.01 -0.33 0.09 0.00 0.00 178.44 179.21 1w1u h GLU 208 N 0.26 0.27 -0.65 1.13 5.08 -0.67 -1.55 114.58 118.45 1w1u h GLU 208 Ca 0.02 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1w1u h GLU 208 Cb 0.87 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.07 1w1u h GLU 208 CO 0.07 0.31 0.00 0.25 -1.00 0.00 0.00 179.01 178.64 1w1u n THR 209 N -4.37 1.22 -3.98 1.13 -2.24 -0.65 -4.95 114.28 100.45 1w1u n THR 209 Ca -0.00 -0.95 -0.28 0.00 -2.27 0.00 0.00 64.05 60.55 1w1u n THR 209 Cb 0.19 0.26 -0.01 0.00 -2.10 0.00 0.00 70.33 68.67 1w1u n THR 209 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1w1u n ARG 210 N 1.20 -3.92 -0.04 -0.78 1.74 -0.58 -4.64 116.66 109.64 1w1u n ARG 210 Ca 0.22 0.46 0.03 0.00 -0.77 0.00 0.00 57.85 57.80 1w1u n ARG 210 Cb 0.67 -4.94 -0.15 0.00 -1.02 0.00 0.00 32.46 27.02 1w1u n ARG 210 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1w1u n TYR 211 N -4.43 0.00 -4.40 -1.55 4.01 0.39 -4.92 117.16 106.25 1w1u n TYR 211 Ca -0.15 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.36 1w1u n TYR 211 Cb 0.61 -0.60 -0.13 0.00 -0.31 0.00 0.00 39.34 38.90 1w1u n TYR 211 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1w1u s VAL 212 N -3.01 1.55 -0.13 -0.72 0.11 -1.19 -1.48 120.40 115.53 1w1u s VAL 212 Ca -0.08 -1.32 -0.24 0.00 -2.93 0.00 0.00 61.98 57.41 1w1u s VAL 212 Cb 0.10 -1.39 -0.26 0.00 -1.53 0.00 0.00 36.38 33.30 1w1u s VAL 212 CO 0.78 0.02 0.66 0.44 -3.33 0.00 0.00 175.10 173.67 1w1u h ASP 213 N 4.49 0.14 -5.27 3.54 3.32 -1.83 -3.41 116.42 117.41 1w1u h ASP 213 Ca -0.43 -0.88 -0.10 0.00 0.02 0.00 0.00 57.03 55.64 1w1u h ASP 213 Cb 1.17 -0.05 -0.07 0.00 0.22 0.00 0.00 39.33 40.60 1w1u h ASP 213 CO 0.42 1.25 -0.07 -1.83 -1.72 0.00 0.00 179.24 177.29 1w1u s GLU 214 N -2.32 1.73 -0.09 3.56 -1.05 -0.98 -5.03 118.70 114.52 1w1u s GLU 214 Ca -0.20 -1.38 0.03 0.00 -0.15 0.00 0.00 54.97 53.27 1w1u s GLU 214 Cb 0.00 0.49 0.01 0.00 -0.44 0.00 0.00 34.13 34.19 1w1u s GLU 214 CO 0.71 -0.74 -0.17 -1.14 0.95 0.00 0.00 175.26 174.87 1w1u s GLN 215 N -3.57 2.33 0.78 -4.83 0.74 -1.26 -0.09 119.66 113.76 1w1u s GLN 215 Ca 0.23 -0.62 -0.11 0.00 0.05 0.00 0.00 55.36 54.90 1w1u s GLN 215 Cb -0.01 -1.87 0.06 0.00 1.10 0.00 0.00 33.01 32.28 1w1u s GLN 215 CO 0.12 0.04 1.10 0.00 -0.55 0.00 0.00 175.29 176.00 1w1u s ALA 216 N 0.67 2.38 -0.71 1.58 0.00 -0.34 -4.92 121.76 120.43 1w1u s ALA 216 Ca -0.13 -0.25 0.23 0.00 0.00 0.00 0.00 51.96 51.81 1w1u s ALA 216 Cb -0.16 -3.08 0.11 0.00 0.00 0.00 0.00 23.12 19.98 1w1u s ALA 216 CO 0.03 -1.62 1.09 0.25 0.00 0.00 0.00 175.76 175.52 1w1u n THR 217 N -3.35 0.14 -3.88 0.00 -2.24 -1.26 -4.70 114.28 98.99 1w1u n THR 217 Ca 0.07 -0.18 0.02 0.00 -2.27 0.00 0.00 64.05 61.68 1w1u n THR 217 Cb 0.57 0.27 0.01 0.00 -2.10 0.00 0.00 70.33 69.07 1w1u n THR 217 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1w1u s ASP 218 N -3.71 -0.01 0.09 3.42 1.47 -1.26 -5.01 116.67 111.65 1w1u s ASP 218 Ca 0.05 -0.24 -0.22 0.00 1.18 0.00 0.00 52.55 53.32 1w1u s ASP 218 Cb 0.15 0.20 -0.13 0.00 -0.34 0.00 0.00 42.92 42.80 1w1u s ASP 218 CO 0.79 -0.38 1.71 0.25 0.68 0.00 0.00 175.17 178.21 1w1u h LEU 219 N 2.00 0.09 -0.78 2.11 5.85 -1.95 -0.05 115.31 122.59 1w1u h LEU 219 Ca -0.25 -0.05 0.03 0.00 0.84 0.00 0.00 57.88 58.45 1w1u h LEU 219 Cb 1.19 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 42.16 1w1u h LEU 219 CO 0.31 0.12 0.50 0.44 -0.34 0.00 0.00 178.44 179.47 1w1u h ASP 220 N 0.06 0.84 -0.65 1.25 3.32 -1.99 -0.97 116.42 118.27 1w1u h ASP 220 Ca 0.03 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.02 1w1u h ASP 220 Cb 0.04 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.37 1w1u h ASP 220 CO -0.00 0.58 0.20 -0.78 -1.72 0.00 0.00 179.24 177.52 1w1u h ASP 221 N 0.99 0.94 -0.46 6.45 3.58 -1.90 -0.95 116.42 125.06 1w1u h ASP 221 Ca 0.31 -0.21 0.03 0.00 0.42 0.00 0.00 57.03 57.58 1w1u h ASP 221 Cb -0.02 -0.25 -0.04 0.00 1.72 0.00 0.00 39.33 40.75 1w1u h ASP 221 CO -0.10 0.90 0.25 0.00 -2.88 0.00 0.00 179.24 177.40 1w1u h ALA 222 N 1.08 0.59 -0.16 -0.78 0.00 -0.25 -1.82 119.26 117.91 1w1u h ALA 222 Ca 0.21 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 55.04 1w1u h ALA 222 Cb 0.29 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1w1u h ALA 222 CO -0.01 -0.09 -0.29 -0.07 0.00 0.00 0.00 179.25 178.79 1w1u h LEU 223 N 0.49 0.32 -0.81 0.00 3.38 -0.87 -1.67 115.31 116.14 1w1u h LEU 223 Ca 0.20 -0.11 -0.08 0.00 0.09 0.00 0.00 57.88 57.98 1w1u h LEU 223 Cb 0.08 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1w1u h LEU 223 CO -0.12 0.60 0.02 0.58 0.09 0.00 0.00 178.44 179.60 1w1u h VAL 224 N 0.28 1.25 -0.17 1.22 2.07 -0.48 -0.10 116.25 120.32 1w1u h VAL 224 Ca 0.04 -1.05 -0.08 0.00 0.82 0.00 0.00 66.70 66.43 1w1u h VAL 224 Cb 0.66 0.82 -0.00 0.00 -1.52 0.00 0.00 31.29 31.24 1w1u h VAL 224 CO 0.05 0.38 -0.21 0.03 0.02 0.00 0.00 177.57 177.84 1w1u h ARG 225 N 0.84 0.44 -0.57 1.57 3.08 -1.04 -1.58 114.38 117.12 1w1u h ARG 225 Ca 0.16 -0.25 0.03 0.00 0.07 0.00 0.00 59.98 60.00 1w1u h ARG 225 Cb 0.48 0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.50 1w1u h ARG 225 CO 0.02 0.82 0.33 0.82 -1.07 0.00 0.00 179.97 180.90 1w1u h ILE 226 N 0.09 1.03 -0.20 2.04 1.08 -1.15 0.23 117.51 120.64 1w1u h ILE 226 Ca 0.02 -0.22 0.02 0.00 -0.39 0.00 0.00 64.86 64.29 1w1u h ILE 226 Cb 0.76 0.32 -0.02 0.00 -3.07 0.00 0.00 36.82 34.81 1w1u h ILE 226 CO 0.05 0.12 0.06 0.00 -0.69 0.00 0.00 178.15 177.69 1w1u h ALA 227 N 1.27 0.21 0.88 1.87 0.00 -0.97 0.10 119.26 122.63 1w1u h ALA 227 Ca 0.24 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.13 1w1u h ALA 227 Cb 0.07 0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.87 1w1u h ALA 227 CO -0.12 -0.36 -0.42 -0.22 0.00 0.00 0.00 179.25 178.12 1w1u h LYS 228 N 0.16 -1.14 -0.75 0.00 3.64 -0.73 -1.99 116.57 115.75 1w1u h LYS 228 Ca 0.08 0.08 0.05 0.00 -1.27 0.00 0.00 60.65 59.59 1w1u h LYS 228 Cb 0.06 0.26 -0.05 0.00 -0.41 0.00 0.00 32.23 32.08 1w1u h LYS 228 CO -0.09 -0.76 0.45 1.88 -2.27 0.00 0.00 179.45 178.67 1w1u h TYR 229 N -1.29 0.84 -0.61 1.91 0.05 -0.53 -1.19 116.97 116.14 1w1u h TYR 229 Ca -0.12 0.03 -0.08 0.00 0.05 0.00 0.00 58.73 58.61 1w1u h TYR 229 Cb 0.91 -0.27 -0.02 0.00 1.01 0.00 0.00 36.73 38.36 1w1u h TYR 229 CO -0.00 0.43 0.08 1.79 -1.05 0.00 0.00 178.16 179.41 1w1u h THR 230 N 0.85 1.26 0.00 -2.88 1.35 -0.82 -1.32 112.91 111.35 1w1u h THR 230 Ca 0.32 -1.04 -0.02 0.00 -0.55 0.00 0.00 66.41 65.13 1w1u h THR 230 Cb 0.13 0.74 -0.00 0.00 -1.73 0.00 0.00 68.15 67.29 1w1u h THR 230 CO -0.16 0.38 -0.09 0.00 -0.25 0.00 0.00 175.52 175.40 1w1u h ALA 231 N 1.02 1.59 -0.01 6.62 0.00 -0.74 -0.83 119.26 126.91 1w1u h ALA 231 Ca 0.18 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1w1u h ALA 231 Cb 0.46 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1w1u h ALA 231 CO 0.02 0.12 -0.05 0.39 0.00 0.00 0.00 179.25 179.73 1w1u n GLU 232 N -4.06 1.48 -2.29 0.00 1.02 -0.51 -4.93 120.64 111.36 1w1u n GLU 232 Ca -0.03 -0.84 -0.18 0.00 -0.02 0.00 0.00 57.16 56.10 1w1u n GLU 232 Cb 0.18 -1.48 -0.01 0.00 -0.02 0.00 0.00 31.44 30.10 1w1u n GLU 232 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1w1u n GLY 233 N 1.20 -0.23 3.96 0.62 0.00 -0.32 -4.99 105.19 105.43 1w1u n GLY 233 Ca 0.18 -0.15 -0.22 0.00 0.00 0.00 0.00 46.02 45.83 1w1u n GLY 233 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1w1u s LYS 234 N -4.79 3.23 -0.49 1.61 -0.14 -0.57 -4.65 119.74 113.92 1w1u s LYS 234 Ca 0.00 -0.58 0.03 0.00 -1.36 0.00 0.00 55.97 54.06 1w1u s LYS 234 Cb 0.00 -2.67 0.13 0.00 -1.68 0.00 0.00 37.83 33.61 1w1u s LYS 234 CO 0.00 -0.02 0.25 0.00 -0.76 0.00 0.00 175.35 174.82 1w1u s ALA 235 N -2.36 2.91 -0.07 5.17 0.00 -1.26 -4.41 121.76 121.74 1w1u s ALA 235 Ca 0.44 -3.03 0.05 0.00 0.00 0.00 0.00 51.96 49.42 1w1u s ALA 235 Cb -0.10 -2.07 -0.01 0.00 0.00 0.00 0.00 23.12 20.95 1w1u s ALA 235 CO 0.35 -2.03 -0.23 0.42 0.00 0.00 0.00 175.76 174.27 1w1u s ILE 236 N -0.06 1.92 -0.09 0.00 1.01 -1.26 -4.79 121.20 117.93 1w1u s ILE 236 Ca 0.17 -0.97 -0.16 0.00 0.00 0.00 0.00 60.65 59.69 1w1u s ILE 236 Cb -0.25 -1.64 -0.05 0.00 0.01 0.00 0.00 42.46 40.53 1w1u s ILE 236 CO -0.00 0.53 0.42 -0.94 0.00 0.00 0.00 174.94 174.96 1w1u s SER 237 N 0.06 6.68 -0.09 3.58 1.04 -1.26 -2.50 113.70 121.21 1w1u s SER 237 Ca -0.09 0.81 0.04 0.00 0.48 0.00 0.00 55.95 57.20 1w1u s SER 237 Cb -0.15 -2.26 -0.00 0.00 0.10 0.00 0.00 66.02 63.71 1w1u s SER 237 CO 0.05 0.12 -0.23 -0.63 0.98 0.00 0.00 173.24 173.53 1w1u s ILE 238 N 0.05 1.97 -0.10 -1.02 1.01 -0.05 -2.31 121.20 120.77 1w1u s ILE 238 Ca 0.24 -0.98 -0.07 0.00 0.00 0.00 0.00 60.65 59.84 1w1u s ILE 238 Cb -0.15 -1.70 -0.04 0.00 0.01 0.00 0.00 42.46 40.57 1w1u s ILE 238 CO 0.10 0.54 0.17 0.00 0.00 0.00 0.00 174.94 175.75 1w1u s ALA 239 N 0.29 3.87 -0.14 9.38 0.00 0.88 0.06 121.76 136.10 1w1u s ALA 239 Ca -0.16 -0.62 -0.00 0.00 0.00 0.00 0.00 51.96 51.17 1w1u s ALA 239 Cb -0.17 -1.99 0.03 0.00 0.00 0.00 0.00 23.12 20.99 1w1u s ALA 239 CO 0.08 0.62 -0.06 -1.17 0.00 0.00 0.00 175.76 175.23 1w1u s LEU 240 N -1.14 1.42 -0.23 0.00 2.96 -0.09 -1.20 118.68 120.39 1w1u s LEU 240 Ca 0.17 -0.50 -0.29 0.00 -0.22 0.00 0.00 54.13 53.29 1w1u s LEU 240 Cb -0.12 -0.88 -0.02 0.00 0.50 0.00 0.00 46.19 45.66 1w1u s LEU 240 CO 0.06 -0.15 1.52 -2.28 -1.32 0.00 0.00 176.35 174.18 1w1u s HIS 241 N 1.66 2.28 -2.77 5.38 5.65 -1.26 -0.89 115.29 125.35 1w1u s HIS 241 Ca 0.03 0.63 0.00 0.00 0.25 0.00 0.00 55.06 55.97 1w1u s HIS 241 Cb -0.14 -3.95 0.00 0.00 -1.18 0.00 0.00 32.58 27.31 1w1u s HIS 241 CO -0.08 -2.61 0.00 0.41 -0.65 0.00 0.00 174.74 171.82 1w1u n GLY 242 N 4.52 -1.48 3.53 1.59 0.00 -0.47 -4.91 105.19 107.97 1w1u n GLY 242 Ca 0.17 -1.07 -0.35 0.00 0.00 0.00 0.00 46.02 44.78 1w1u n GLY 242 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1w1u s ASN 243 N -3.22 5.18 0.40 1.61 3.84 -1.26 -2.23 114.94 119.25 1w1u s ASN 243 Ca 0.00 -0.07 0.07 0.00 0.21 0.00 0.00 52.86 53.07 1w1u s ASN 243 Cb 0.00 -1.88 0.83 0.00 -0.55 0.00 0.00 41.25 39.65 1w1u s ASN 243 CO 0.00 0.12 2.03 0.00 -2.79 0.00 0.00 177.10 176.46 1w1u h ALA 244 N 7.09 1.72 0.00 1.71 0.00 -1.92 -0.82 119.26 127.05 1w1u h ALA 244 Ca -0.35 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1w1u h ALA 244 Cb 1.18 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1w1u h ALA 244 CO 0.64 0.23 0.00 0.00 0.00 0.00 0.00 179.25 180.13 1w1u n ALA 245 N -2.47 1.74 -0.12 0.00 0.00 -1.26 -1.80 120.51 116.59 1w1u n ALA 245 Ca 0.05 0.02 -0.24 0.00 0.00 0.00 0.00 53.44 53.27 1w1u n ALA 245 Cb 0.11 -1.34 -0.10 0.00 0.00 0.00 0.00 19.45 18.13 1w1u n ALA 245 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1w1u n GLU 246 N -1.93 0.55 -0.06 0.00 1.02 -0.55 -4.54 120.64 115.14 1w1u n GLU 246 Ca 0.03 0.21 -0.13 0.00 -0.02 0.00 0.00 57.16 57.24 1w1u n GLU 246 Cb 0.23 -1.42 -0.07 0.00 -0.02 0.00 0.00 31.44 30.15 1w1u n GLU 246 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1w1u h ILE 247 N -0.63 1.35 -0.80 -3.67 2.04 -1.17 -2.92 117.51 111.71 1w1u h ILE 247 Ca -0.61 -1.39 0.01 0.00 1.00 0.00 0.00 64.86 63.87 1w1u h ILE 247 Cb 1.64 1.91 -0.04 0.00 -0.74 0.00 0.00 36.82 39.59 1w1u h ILE 247 CO -0.30 0.41 0.52 -0.07 0.00 0.00 0.00 178.15 178.72 1w1u h LEU 248 N 0.02 0.90 -1.27 1.44 -0.00 -1.60 0.28 115.31 115.08 1w1u h LEU 248 Ca 0.02 -0.02 -0.07 0.00 -0.00 0.00 0.00 57.88 57.81 1w1u h LEU 248 Cb 0.75 -0.22 -0.01 0.00 -0.00 0.00 0.00 40.66 41.18 1w1u h LEU 248 CO 0.05 0.64 -0.34 -0.65 -0.00 0.00 0.00 178.44 178.14 1w1u h PRO 249 N 1.06 0.00 -0.14 1.13 0.11 -1.77 -2.26 132.00 130.13 1w1u h PRO 249 Ca 0.30 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 66.28 1w1u h PRO 249 Cb -0.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.02 1w1u h PRO 249 CO -0.07 0.34 -0.40 1.49 -0.21 0.00 0.00 178.00 179.14 1w1u h GLU 250 N 0.00 0.52 -0.06 1.05 4.57 -1.12 -2.13 114.58 117.41 1w1u h GLU 250 Ca -0.00 -0.37 -0.04 0.00 -1.18 0.00 0.00 59.36 57.76 1w1u h GLU 250 Cb 0.69 0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.33 1w1u h GLU 250 CO 0.04 0.99 -0.15 -0.07 -1.18 0.00 0.00 179.01 178.65 1w1u h LEU 251 N 0.15 0.09 -0.29 1.64 3.38 -0.82 -0.30 115.31 119.15 1w1u h LEU 251 Ca -0.01 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.85 1w1u h LEU 251 Cb 1.02 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.74 1w1u h LEU 251 CO 0.09 0.25 -0.17 0.58 0.09 0.00 0.00 178.44 179.28 1w1u h VAL 252 N 0.09 1.30 -0.96 1.22 2.07 -1.33 0.75 116.25 119.39 1w1u h VAL 252 Ca 0.02 -1.28 0.00 0.00 0.82 0.00 0.00 66.70 66.26 1w1u h VAL 252 Cb 0.33 1.50 -0.05 0.00 -1.52 0.00 0.00 31.29 31.55 1w1u h VAL 252 CO 0.02 0.41 0.62 0.11 0.02 0.00 0.00 177.57 178.75 1w1u h LYS 253 N 0.38 1.27 0.00 1.57 1.57 -0.60 -1.24 116.57 119.53 1w1u h LYS 253 Ca 0.06 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1w1u h LYS 253 Cb 0.70 -0.28 0.00 0.00 0.08 0.00 0.00 32.23 32.73 1w1u h LYS 253 CO 0.05 0.86 0.00 0.54 -0.57 0.00 0.00 179.45 180.33 1w1u n ARG 254 N -4.38 0.02 -1.24 3.15 1.74 -0.22 -4.89 116.66 110.85 1w1u n ARG 254 Ca 0.11 0.10 -0.04 0.00 -0.77 0.00 0.00 57.85 57.25 1w1u n ARG 254 Cb 0.03 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 29.95 1w1u n ARG 254 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1w1u n GLY 255 N 0.88 0.66 3.76 -0.13 0.00 -0.47 -4.99 105.19 104.89 1w1u n GLY 255 Ca 0.06 -0.85 -0.41 0.00 0.00 0.00 0.00 46.02 44.83 1w1u n GLY 255 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1w1u s VAL 256 N -2.17 3.20 -0.48 1.61 1.01 0.20 -4.99 120.40 118.77 1w1u s VAL 256 Ca 0.00 1.14 0.04 0.00 0.00 0.00 0.00 61.98 63.16 1w1u s VAL 256 Cb 0.00 -3.73 0.12 0.00 0.00 0.00 0.00 36.38 32.78 1w1u s VAL 256 CO 0.00 0.25 0.21 -0.60 0.00 0.00 0.00 175.10 174.96 1w1u s ARG 257 N -1.22 1.81 1.01 2.72 6.06 -1.26 -4.66 118.95 123.41 1w1u s ARG 257 Ca 0.49 -2.41 -0.12 0.00 -2.50 0.00 0.00 55.73 51.18 1w1u s ARG 257 Cb -0.35 -3.21 0.19 0.00 0.06 0.00 0.00 34.95 31.64 1w1u s ARG 257 CO 0.44 -1.08 1.08 -2.14 -2.50 0.00 0.00 175.30 171.10 1w1u s PRO 258 N 0.02 0.35 0.13 5.12 0.02 -1.26 -4.95 135.00 134.42 1w1u s PRO 258 Ca 0.16 0.75 0.23 0.00 0.02 0.00 0.00 61.00 62.16 1w1u s PRO 258 Cb -0.24 -1.71 0.06 0.00 0.02 0.00 0.00 34.50 32.63 1w1u s PRO 258 CO -0.02 -2.84 1.06 -0.25 -0.33 0.00 0.00 177.00 174.61 1w1u n ASP 259 N -4.29 0.69 -3.64 2.53 8.00 -0.08 -4.85 116.55 114.92 1w1u n ASP 259 Ca 0.06 0.12 -0.10 0.00 0.71 0.00 0.00 54.79 55.58 1w1u n ASP 259 Cb 0.56 0.59 -0.07 0.00 -0.02 0.00 0.00 41.12 42.18 1w1u n ASP 259 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1w1u s MET 260 N -3.29 0.58 0.02 -1.24 0.23 -1.17 -4.00 119.30 110.44 1w1u s MET 260 Ca 0.01 0.68 0.07 0.00 -1.03 0.00 0.00 55.69 55.43 1w1u s MET 260 Cb 0.12 0.28 -0.02 0.00 -1.53 0.00 0.00 34.83 33.68 1w1u s MET 260 CO 0.79 -0.07 -0.22 0.08 -2.03 0.00 0.00 175.02 173.57 1w1u s VAL 261 N 0.24 1.76 0.19 5.16 1.01 -0.20 -0.67 120.40 127.89 1w1u s VAL 261 Ca 0.02 -1.13 -0.09 0.00 0.00 0.00 0.00 61.98 60.78 1w1u s VAL 261 Cb -0.05 -1.50 0.03 0.00 0.00 0.00 0.00 36.38 34.86 1w1u s VAL 261 CO -0.05 0.33 0.47 1.07 0.00 0.00 0.00 175.10 176.93 1w1u n THR 262 N 2.09 0.00 -3.68 3.92 5.66 -0.91 -1.92 114.28 119.44 1w1u n THR 262 Ca -0.16 -0.49 -0.14 0.00 -3.05 0.00 0.00 64.05 60.20 1w1u n THR 262 Cb 0.53 0.52 -0.08 0.00 -1.55 0.00 0.00 70.33 69.74 1w1u n THR 262 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1w1u s ASP 263 N -2.19 -0.49 -0.25 1.09 -1.08 -1.26 -4.07 116.67 108.42 1w1u s ASP 263 Ca 0.10 0.78 0.23 0.00 -0.52 0.00 0.00 52.55 53.14 1w1u s ASP 263 Cb -0.02 0.80 0.50 0.00 -1.46 0.00 0.00 42.92 42.74 1w1u s ASP 263 CO 0.06 -0.32 1.13 1.67 0.52 0.00 0.00 175.17 178.23 1w1u n GLN 264 N 2.13 1.64 -1.76 4.34 7.27 -0.08 -4.01 117.38 126.91 1w1u n GLN 264 Ca -0.16 -3.37 -0.30 0.00 0.07 0.00 0.00 57.00 53.24 1w1u n GLN 264 Cb 0.56 -1.47 0.08 0.00 2.41 0.00 0.00 30.24 31.82 1w1u n GLN 264 CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 1w1u s THR 265 N -3.52 2.94 -1.31 1.69 -4.23 -1.22 -4.51 115.64 105.48 1w1u s THR 265 Ca 0.27 0.31 -0.07 0.00 -1.18 0.00 0.00 61.69 61.01 1w1u s THR 265 Cb 0.33 -3.21 0.02 0.00 1.34 0.00 0.00 72.50 70.98 1w1u s THR 265 CO -0.05 -0.40 2.70 -1.20 -0.54 0.00 0.00 174.62 175.13 1w1u n SER 266 N -3.26 8.08 0.20 3.99 7.64 -1.03 -4.58 113.62 124.66 1w1u n SER 266 Ca 0.07 -2.90 0.14 0.00 1.01 0.00 0.00 58.87 57.20 1w1u n SER 266 Cb 0.58 -1.43 0.64 0.00 -1.01 0.00 0.00 64.21 62.98 1w1u n SER 266 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1w1u h ALA 267 N 4.56 1.00 0.00 -0.43 0.00 -1.74 -2.54 119.26 120.11 1w1u h ALA 267 Ca 0.72 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.63 1w1u h ALA 267 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1w1u h ALA 267 CO 1.49 0.00 0.00 1.12 0.00 0.00 0.00 179.25 181.86 1w1u h HIS 268 N 0.00 0.00 -2.86 0.00 2.07 -1.28 -3.33 115.15 109.75 1w1u h HIS 268 Ca 0.00 0.00 -0.60 0.00 -2.85 0.00 0.00 60.37 56.92 1w1u h HIS 268 Cb 0.30 0.00 -0.40 0.00 2.57 0.00 0.00 27.41 29.88 1w1u h HIS 268 CO 0.00 0.00 -0.77 0.34 -3.07 0.00 0.00 177.93 174.43 1w1u s ASP 269 N -5.00 3.42 0.31 3.10 3.68 -0.96 -4.37 116.67 116.85 1w1u s ASP 269 Ca -0.04 -2.51 0.07 0.00 2.13 0.00 0.00 52.55 52.20 1w1u s ASP 269 Cb 0.12 -0.84 0.78 0.00 -1.45 0.00 0.00 42.92 41.52 1w1u s ASP 269 CO 0.39 -0.28 1.78 -0.65 0.13 0.00 0.00 175.17 176.54 1w1u h PRO 270 N 6.78 0.70 -0.39 4.34 0.11 -1.79 0.33 132.00 142.08 1w1u h PRO 270 Ca 0.02 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.99 1w1u h PRO 270 Cb 0.94 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.88 1w1u h PRO 270 CO 0.42 0.47 -0.11 1.25 -0.21 0.00 0.00 178.00 179.81 1w1u h LEU 271 N 0.72 0.78 0.00 2.35 5.85 -1.89 -3.38 115.31 119.74 1w1u h LEU 271 Ca 0.58 -0.37 0.00 0.00 0.84 0.00 0.00 57.88 58.93 1w1u h LEU 271 Cb 0.96 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.77 1w1u h LEU 271 CO -0.38 0.97 -1.31 0.59 -0.34 0.00 0.00 178.44 177.98 1w1u n ASN 272 N -4.33 3.21 -0.37 1.25 3.02 -1.06 -4.85 115.26 112.13 1w1u n ASN 272 Ca -0.01 -0.02 0.04 0.00 -0.03 0.00 0.00 54.58 54.56 1w1u n ASN 272 Cb 0.37 1.33 0.06 0.00 -0.61 0.00 0.00 39.78 40.93 1w1u n ASN 272 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1w1u n GLY 273 N 2.05 0.57 2.76 7.41 0.00 0.11 -4.93 105.19 113.16 1w1u n GLY 273 Ca -0.01 -0.25 -0.21 0.00 0.00 0.00 0.00 46.02 45.55 1w1u n GLY 273 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1w1u s TYR 274 N -0.79 0.45 -0.16 1.61 5.04 -1.24 -2.46 117.35 119.81 1w1u s TYR 274 Ca 0.12 -0.03 -0.24 0.00 -2.44 0.00 0.00 57.07 54.47 1w1u s TYR 274 Cb 0.07 -0.64 -0.02 0.00 0.35 0.00 0.00 41.96 41.73 1w1u s TYR 274 CO 0.11 -0.25 0.79 -1.17 -1.34 0.00 0.00 175.55 173.68 1w1u s LEU 275 N 1.76 4.19 0.48 6.97 2.96 -1.26 -4.73 118.68 129.06 1w1u s LEU 275 Ca 0.01 1.13 -0.23 0.00 -0.22 0.00 0.00 54.13 54.82 1w1u s LEU 275 Cb -0.13 -3.17 -0.07 0.00 0.50 0.00 0.00 46.19 43.33 1w1u s LEU 275 CO -0.04 -0.34 1.28 -2.84 -1.32 0.00 0.00 176.35 173.09 1w1u s PRO 276 N 1.91 3.55 0.19 0.98 0.02 -1.26 -4.86 135.00 135.53 1w1u s PRO 276 Ca 0.37 2.06 -0.33 0.00 0.02 0.00 0.00 61.00 63.12 1w1u s PRO 276 Cb -0.17 -2.43 -0.14 0.00 0.02 0.00 0.00 34.50 31.79 1w1u s PRO 276 CO 0.13 -0.80 1.50 0.00 -0.33 0.00 0.00 177.00 177.50 1w1u n ALA 277 N -0.57 1.14 0.00 -1.55 0.00 -1.26 -1.90 120.51 116.36 1w1u n ALA 277 Ca 0.08 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.95 1w1u n ALA 277 Cb 0.46 -2.31 0.00 0.00 0.00 0.00 0.00 19.45 17.60 1w1u n ALA 277 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1w1u n GLY 278 N 2.87 2.37 3.89 0.00 0.00 -1.26 -5.04 105.19 108.02 1w1u n GLY 278 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 1w1u n GLY 278 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1w1u s TRP 279 N -2.25 3.50 0.23 1.61 0.52 -0.80 -5.08 118.94 116.66 1w1u s TRP 279 Ca 0.00 0.89 0.02 0.00 0.02 0.00 0.00 56.10 57.03 1w1u s TRP 279 Cb 0.00 -2.33 -0.03 0.00 -1.15 0.00 0.00 33.47 29.95 1w1u s TRP 279 CO 0.00 -0.12 0.38 0.95 0.02 0.00 0.00 176.95 178.18 1w1u s THR 280 N -2.46 5.24 0.51 2.01 -4.23 -1.26 -4.87 115.64 110.57 1w1u s THR 280 Ca 0.49 -0.67 0.22 0.00 -1.18 0.00 0.00 61.69 60.54 1w1u s THR 280 Cb -0.10 -3.80 0.28 0.00 1.34 0.00 0.00 72.50 70.21 1w1u s THR 280 CO 0.36 -0.27 2.13 -0.25 -0.54 0.00 0.00 174.62 176.05 1w1u h TRP 281 N 1.54 0.00 -0.17 3.99 2.91 -1.98 -1.68 115.95 120.55 1w1u h TRP 281 Ca -0.50 0.00 -0.21 0.00 1.13 0.00 0.00 58.89 59.31 1w1u h TRP 281 Cb 1.21 0.00 0.01 0.00 -0.51 0.00 0.00 29.16 29.87 1w1u h TRP 281 CO 0.50 0.07 -0.72 0.93 -1.03 0.00 0.00 178.44 178.19 1w1u h GLU 282 N 0.00 0.76 -0.48 2.65 3.07 -1.99 -1.80 114.58 116.78 1w1u h GLU 282 Ca -0.00 -0.58 -0.10 0.00 -0.50 0.00 0.00 59.36 58.18 1w1u h GLU 282 Cb 0.14 0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.14 1w1u h GLU 282 CO 0.01 1.20 -0.09 1.96 -1.40 0.00 0.00 179.01 180.69 1w1u h GLN 283 N 0.53 0.87 -0.32 2.33 4.20 -1.78 -2.63 115.11 118.32 1w1u h GLN 283 Ca -0.03 -0.29 0.01 0.00 0.06 0.00 0.00 58.65 58.40 1w1u h GLN 283 Cb 1.33 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 29.02 1w1u h GLN 283 CO 0.15 0.93 0.19 -0.92 -0.67 0.00 0.00 178.83 178.50 1w1u h TYR 284 N 0.79 0.35 -0.52 2.96 -0.00 -1.23 -1.28 116.97 118.04 1w1u h TYR 284 Ca 0.13 0.01 -0.12 0.00 -0.00 0.00 0.00 58.73 58.75 1w1u h TYR 284 Cb 0.60 -0.11 -0.02 0.00 -0.00 0.00 0.00 36.73 37.20 1w1u h TYR 284 CO 0.03 0.21 -0.14 0.00 -0.00 0.00 0.00 178.16 178.26 1w1u h ARG 285 N 0.39 1.01 0.05 1.82 2.47 -1.22 -2.21 114.38 116.69 1w1u h ARG 285 Ca 0.13 -0.39 -0.00 0.00 -1.26 0.00 0.00 59.98 58.45 1w1u h ARG 285 Cb -0.00 -0.06 0.00 0.00 -1.65 0.00 0.00 29.97 28.26 1w1u h ARG 285 CO -0.06 1.07 -0.03 -0.44 0.56 0.00 0.00 179.97 181.08 1w1u h ASP 286 N 0.89 -0.06 -0.28 7.04 3.32 -1.32 -3.21 116.42 122.80 1w1u h ASP 286 Ca 0.13 -0.43 -0.00 0.00 0.02 0.00 0.00 57.03 56.75 1w1u h ASP 286 Cb 0.71 0.02 -0.02 0.00 0.22 0.00 0.00 39.33 40.26 1w1u h ASP 286 CO 0.05 0.41 0.17 0.03 -1.72 0.00 0.00 179.24 178.18 1w1u h ARG 287 N -0.55 0.41 -0.73 3.56 3.08 -1.30 -1.52 114.38 117.33 1w1u h ARG 287 Ca -0.01 -0.03 0.21 0.00 0.07 0.00 0.00 59.98 60.22 1w1u h ARG 287 Cb 0.48 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.42 1w1u h ARG 287 CO 0.01 0.30 0.56 0.00 -1.07 0.00 0.00 179.97 179.77 1w1u h ALA 288 N 1.77 2.65 0.00 0.04 0.00 -1.39 0.23 119.26 122.56 1w1u h ALA 288 Ca 0.11 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.85 1w1u h ALA 288 Cb 0.01 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1w1u h ALA 288 CO -0.02 -0.93 -1.33 1.96 0.00 0.00 0.00 179.25 178.92 1w1u h GLN 289 N 0.00 0.00 0.00 0.00 4.20 -1.38 -3.25 115.11 114.68 1w1u h GLN 289 Ca 0.35 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.06 1w1u h GLN 289 Cb 1.46 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.24 1w1u h GLN 289 CO -0.00 0.25 -0.07 1.15 -0.67 0.00 0.00 178.83 179.49 1w1u h THR 290 N 0.00 0.00 -2.31 -0.54 2.02 -0.62 -3.42 112.91 108.04 1w1u h THR 290 Ca -0.14 -0.28 -0.64 0.00 0.77 0.00 0.00 66.41 66.12 1w1u h THR 290 Cb 1.50 0.00 -0.39 0.00 -1.74 0.00 0.00 68.15 67.52 1w1u h THR 290 CO 0.04 0.00 -0.28 -1.84 0.37 0.00 0.00 175.52 173.81 1w1u n GLU 291 N -2.85 3.39 -0.22 6.66 0.28 0.51 -4.92 120.64 123.49 1w1u n GLU 291 Ca -0.01 -4.75 0.00 0.00 -0.16 0.00 0.00 57.16 52.24 1w1u n GLU 291 Cb 0.04 -2.30 0.08 0.00 1.43 0.00 0.00 31.44 30.69 1w1u n GLU 291 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 177.13 175.97 1w1u h PRO 292 N 3.77 0.03 -0.48 3.44 0.13 -1.62 0.20 132.00 137.47 1w1u h PRO 292 Ca 0.21 -0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.33 1w1u h PRO 292 Cb 0.54 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.64 1w1u h PRO 292 CO 0.92 0.02 0.28 0.00 -0.23 0.00 0.00 178.00 178.99 1w1u h ALA 293 N 1.63 1.59 -0.12 -0.56 0.00 -1.91 0.15 119.26 120.04 1w1u h ALA 293 Ca 0.32 -0.06 -0.21 0.00 0.00 0.00 0.00 54.91 54.96 1w1u h ALA 293 Cb 0.51 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1w1u h ALA 293 CO -0.63 0.35 -0.76 0.00 0.00 0.00 0.00 179.25 178.22 1w1u h ALA 294 N 1.65 0.44 -0.16 0.00 0.00 -1.24 -2.66 119.26 117.29 1w1u h ALA 294 Ca 0.17 -0.60 -0.01 0.00 0.00 0.00 0.00 54.91 54.47 1w1u h ALA 294 Cb -0.01 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1w1u h ALA 294 CO -0.03 0.72 0.06 0.28 0.00 0.00 0.00 179.25 180.28 1w1u h VAL 295 N 0.42 1.17 -0.33 0.00 2.07 0.06 -2.29 116.25 117.35 1w1u h VAL 295 Ca -0.04 -0.53 0.07 0.00 0.82 0.00 0.00 66.70 67.02 1w1u h VAL 295 Cb 1.36 1.22 -0.07 0.00 -1.52 0.00 0.00 31.29 32.28 1w1u h VAL 295 CO 0.14 0.16 -0.16 0.58 0.02 0.00 0.00 177.57 178.32 1w1u h VAL 296 N 0.09 0.52 -0.66 2.57 2.07 -1.01 -0.42 116.25 119.41 1w1u h VAL 296 Ca 0.05 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.61 1w1u h VAL 296 Cb 0.20 0.52 -0.04 0.00 -1.52 0.00 0.00 31.29 30.45 1w1u h VAL 296 CO -0.00 0.00 0.40 0.11 0.02 0.00 0.00 177.57 178.10 1w1u h LYS 297 N -0.10 0.76 -0.68 1.57 1.79 -1.35 -1.10 116.57 117.45 1w1u h LYS 297 Ca 0.17 -0.05 -0.07 0.00 -2.18 0.00 0.00 60.65 58.52 1w1u h LYS 297 Cb 0.36 -0.17 -0.03 0.00 -1.58 0.00 0.00 32.23 30.81 1w1u h LYS 297 CO -0.40 0.50 0.14 0.00 -1.08 0.00 0.00 179.45 178.61 1w1u h ALA 298 N 1.30 0.90 -0.37 3.86 0.00 -0.82 -0.78 119.26 123.35 1w1u h ALA 298 Ca 0.27 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1w1u h ALA 298 Cb 0.06 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1w1u h ALA 298 CO -0.12 0.65 0.21 0.00 0.00 0.00 0.00 179.25 179.98 1w1u h ALA 299 N 1.06 0.47 -0.07 0.00 0.00 -0.58 -2.29 119.26 117.85 1w1u h ALA 299 Ca 0.21 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.95 1w1u h ALA 299 Cb 0.41 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1w1u h ALA 299 CO 0.01 -0.02 -0.43 0.87 0.00 0.00 0.00 179.25 179.68 1w1u h LYS 300 N 0.47 0.17 -0.23 0.00 1.57 -1.00 -1.76 116.57 115.79 1w1u h LYS 300 Ca 0.13 -0.08 -0.10 0.00 -1.87 0.00 0.00 60.65 58.72 1w1u h LYS 300 Cb 0.04 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1w1u h LYS 300 CO -0.02 0.57 -0.30 1.96 -0.57 0.00 0.00 179.45 181.09 1w1u h GLN 301 N 0.14 0.47 -0.25 3.15 4.20 -0.92 -1.42 115.11 120.48 1w1u h GLN 301 Ca 0.01 -0.19 -0.17 0.00 0.06 0.00 0.00 58.65 58.36 1w1u h GLN 301 Cb 0.83 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.58 1w1u h GLN 301 CO 0.06 0.72 -0.52 0.77 -0.67 0.00 0.00 178.83 179.20 1w1u h SER 302 N 0.41 0.80 -0.54 1.46 0.02 -1.14 -2.74 113.55 111.82 1w1u h SER 302 Ca 0.05 -0.41 0.01 0.00 -0.84 0.00 0.00 61.79 60.60 1w1u h SER 302 Cb 0.74 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 63.02 1w1u h SER 302 CO 0.06 1.17 0.36 0.24 -1.14 0.00 0.00 176.83 177.51 1w1u h MET 303 N 0.56 0.69 -0.18 3.45 2.86 -0.86 0.26 114.93 121.71 1w1u h MET 303 Ca 0.02 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.61 1w1u h MET 303 Cb 1.09 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 32.59 1w1u h MET 303 CO 0.11 0.45 0.07 0.00 1.06 0.00 0.00 176.91 178.60 1w1u h ALA 304 N 1.67 0.23 -0.65 6.32 0.00 -1.02 0.11 119.26 125.92 1w1u h ALA 304 Ca 0.20 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 1w1u h ALA 304 Cb -0.05 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1w1u h ALA 304 CO -0.05 -0.17 0.14 0.28 0.00 0.00 0.00 179.25 179.45 1w1u h VAL 305 N 0.13 1.26 0.22 0.00 2.07 -1.09 -0.87 116.25 117.97 1w1u h VAL 305 Ca 0.06 -0.97 -0.01 0.00 0.82 0.00 0.00 66.70 66.60 1w1u h VAL 305 Cb 0.19 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 30.60 1w1u h VAL 305 CO -0.00 0.37 -0.10 -0.74 0.02 0.00 0.00 177.57 177.11 1w1u h HIS 306 N 0.97 -0.27 -0.06 1.57 6.17 -0.25 -1.74 115.15 121.55 1w1u h HIS 306 Ca 0.20 -0.01 -0.07 0.00 0.71 0.00 0.00 60.37 61.21 1w1u h HIS 306 Cb 0.39 0.09 -0.01 0.00 2.52 0.00 0.00 27.41 30.40 1w1u h HIS 306 CO 0.03 -0.14 -0.28 0.28 0.71 0.00 0.00 177.93 178.54 1w1u h VAL 307 N -0.33 1.22 0.00 5.26 2.07 -0.73 -1.44 116.25 122.30 1w1u h VAL 307 Ca -0.03 -1.06 -0.08 0.00 0.82 0.00 0.00 66.70 66.35 1w1u h VAL 307 Cb 0.25 1.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.50 1w1u h VAL 307 CO 0.05 0.31 -0.37 -0.61 0.02 0.00 0.00 177.57 176.97 1w1u h GLN 308 N 0.09 0.00 -0.20 1.57 5.75 -0.89 0.15 115.11 121.60 1w1u h GLN 308 Ca 0.01 0.00 -0.17 0.00 -0.15 0.00 0.00 58.65 58.34 1w1u h GLN 308 Cb 0.54 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.10 1w1u h GLN 308 CO 0.04 0.37 -0.55 0.00 -2.65 0.00 0.00 178.83 176.04 1w1u h ALA 309 N 1.63 0.33 -0.80 3.38 0.00 -0.43 -1.89 119.26 121.47 1w1u h ALA 309 Ca -0.00 -0.51 -0.03 0.00 0.00 0.00 0.00 54.91 54.36 1w1u h ALA 309 Cb 0.67 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 1w1u h ALA 309 CO 0.05 0.54 0.36 0.52 0.00 0.00 0.00 179.25 180.73 1w1u h MET 310 N 0.43 1.16 -0.46 0.00 2.86 -0.51 -1.23 114.93 117.17 1w1u h MET 310 Ca -0.01 -0.18 -0.09 0.00 -2.06 0.00 0.00 59.70 57.36 1w1u h MET 310 Cb 1.17 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 32.61 1w1u h MET 310 CO 0.12 0.90 -0.09 -0.07 1.06 0.00 0.00 176.91 178.83 1w1u h LEU 311 N 1.14 0.80 -0.62 1.22 3.38 -0.64 -1.69 115.31 118.91 1w1u h LEU 311 Ca 0.27 -0.24 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 1w1u h LEU 311 Cb 0.14 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1w1u h LEU 311 CO -0.03 0.92 0.08 0.44 0.09 0.00 0.00 178.44 179.95 1w1u h ASP 312 N 0.74 1.00 -0.74 -0.43 3.32 -0.79 0.17 116.42 119.69 1w1u h ASP 312 Ca 0.13 -0.27 -0.02 0.00 0.02 0.00 0.00 57.03 56.89 1w1u h ASP 312 Cb 0.58 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.83 1w1u h ASP 312 CO 0.04 1.02 0.38 -0.26 -1.72 0.00 0.00 179.24 178.70 1w1u h PHE 313 N 0.95 1.03 -0.71 4.55 0.04 -0.96 -1.76 116.94 120.08 1w1u h PHE 313 Ca 0.19 -0.04 -0.06 0.00 2.80 0.00 0.00 57.97 60.86 1w1u h PHE 313 Cb 0.45 -0.33 -0.03 0.00 2.20 0.00 0.00 35.95 38.25 1w1u h PHE 313 CO 0.03 0.74 0.20 0.37 -0.60 0.00 0.00 178.31 179.05 1w1u h GLN 314 N 1.02 1.10 -0.08 1.51 4.15 -0.76 -1.34 115.11 120.71 1w1u h GLN 314 Ca 0.26 -0.24 0.02 0.00 0.77 0.00 0.00 58.65 59.46 1w1u h GLN 314 Cb 0.07 -0.16 -0.00 0.00 0.21 0.00 0.00 27.48 27.60 1w1u h GLN 314 CO -0.04 0.95 0.07 0.87 -1.93 0.00 0.00 178.83 178.75 1w1u h LYS 315 N 1.06 0.00 -0.00 1.69 1.57 0.15 0.49 116.57 121.53 1w1u h LYS 315 Ca 0.23 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 1w1u h LYS 315 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.63 1w1u h LYS 315 CO -0.00 0.00 -0.01 1.04 -0.57 0.00 0.00 179.45 179.91 1w1u n GLN 316 N -4.19 0.65 -0.24 3.15 1.13 -0.55 -4.89 117.38 112.44 1w1u n GLN 316 Ca -0.01 -0.02 0.00 0.00 -1.94 0.00 0.00 57.00 55.03 1w1u n GLN 316 Cb 0.18 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.03 1w1u n GLN 316 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1w1u n GLY 317 N 1.19 0.73 3.70 1.08 0.00 0.17 -5.06 105.19 107.00 1w1u n GLY 317 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1w1u n GLY 317 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1w1u s VAL 318 N -2.28 4.81 0.10 1.61 -7.23 -0.93 -4.96 120.40 111.51 1w1u s VAL 318 Ca 0.00 2.03 -0.33 0.00 -1.81 0.00 0.00 61.98 61.87 1w1u s VAL 318 Cb 0.00 -4.30 -0.13 0.00 0.56 0.00 0.00 36.38 32.51 1w1u s VAL 318 CO 0.00 0.11 1.70 -2.65 -0.31 0.00 0.00 175.10 173.95 1w1u n PRO 319 N 4.25 2.30 -4.38 4.82 -0.02 -1.26 -4.10 135.00 136.62 1w1u n PRO 319 Ca 0.07 0.84 -0.19 0.00 -2.02 0.00 0.00 63.50 62.19 1w1u n PRO 319 Cb 0.50 -2.65 -0.15 0.00 -0.02 0.00 0.00 33.50 31.18 1w1u n PRO 319 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1w1u s THR 320 N 2.00 0.73 0.02 3.45 2.01 -1.26 -1.03 115.64 121.56 1w1u s THR 320 Ca 0.82 -0.38 -0.17 0.00 0.31 0.00 0.00 61.69 62.28 1w1u s THR 320 Cb -0.64 -0.63 0.03 0.00 0.01 0.00 0.00 72.50 71.27 1w1u s THR 320 CO 0.41 0.22 0.37 0.72 -0.69 0.00 0.00 174.62 175.64 1w1u s PHE 321 N -0.09 -0.22 -0.10 4.92 -0.71 -0.81 -4.19 117.98 116.78 1w1u s PHE 321 Ca 0.02 0.24 -0.23 0.00 -1.04 0.00 0.00 56.93 55.91 1w1u s PHE 321 Cb -0.05 0.16 -0.03 0.00 -1.21 0.00 0.00 43.02 41.89 1w1u s PHE 321 CO -0.00 -0.50 0.69 0.34 -1.34 0.00 0.00 175.22 174.42 1w1u s ASP 322 N -1.73 6.92 -0.63 1.98 3.68 0.79 -4.20 116.67 123.48 1w1u s ASP 322 Ca -0.08 1.12 -0.00 0.00 2.13 0.00 0.00 52.55 55.71 1w1u s ASP 322 Cb -0.02 -2.40 0.43 0.00 -1.45 0.00 0.00 42.92 39.48 1w1u s ASP 322 CO 0.01 -0.17 1.88 0.00 0.13 0.00 0.00 175.17 177.02 1w1u n TYR 323 N 4.14 3.13 -1.60 -5.34 -0.00 -1.26 -1.25 117.16 114.98 1w1u n TYR 323 Ca -0.01 -2.81 -0.03 0.00 -0.00 0.00 0.00 57.90 55.05 1w1u n TYR 323 Cb 0.51 -1.20 -0.01 0.00 -0.00 0.00 0.00 39.34 38.64 1w1u n TYR 323 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1w1u n GLY 324 N -0.81 0.42 0.67 2.98 0.00 -1.26 -4.94 105.19 102.24 1w1u n GLY 324 Ca 0.58 -0.84 0.06 0.00 0.00 0.00 0.00 46.02 45.82 1w1u n GLY 324 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1w1u n ASN 325 N 1.44 2.81 -1.95 1.61 6.94 -1.26 -3.95 115.26 120.90 1w1u n ASN 325 Ca -0.03 -1.89 -0.20 0.00 -0.02 0.00 0.00 54.58 52.44 1w1u n ASN 325 Cb 0.33 -0.20 -0.04 0.00 -2.36 0.00 0.00 39.78 37.51 1w1u n ASN 325 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 1w1u n ASN 326 N 0.66 -5.57 0.13 0.53 5.15 -1.26 -0.92 115.26 113.98 1w1u n ASN 326 Ca 0.12 0.20 -0.00 0.00 -0.60 0.00 0.00 54.58 54.29 1w1u n ASN 326 Cb 0.42 -4.69 0.26 0.00 -0.53 0.00 0.00 39.78 35.23 1w1u n ASN 326 CO 0.00 0.00 0.00 -0.29 1.40 0.00 0.00 177.26 178.37 1w1u h ILE 327 N 0.00 1.32 -0.29 -1.44 2.10 -1.94 -2.74 117.51 114.52 1w1u h ILE 327 Ca -0.45 -1.56 -0.01 0.00 1.08 0.00 0.00 64.86 63.92 1w1u h ILE 327 Cb 1.33 1.78 -0.01 0.00 -1.09 0.00 0.00 36.82 38.83 1w1u h ILE 327 CO 0.58 0.46 0.14 0.03 -1.08 0.00 0.00 178.15 178.27 1w1u h ARG 328 N 0.09 0.42 -0.74 2.19 3.08 -1.90 -0.49 114.38 117.04 1w1u h ARG 328 Ca 0.01 -0.06 0.05 0.00 0.07 0.00 0.00 59.98 60.05 1w1u h ARG 328 Cb 0.82 -0.08 -0.05 0.00 0.08 0.00 0.00 29.97 30.74 1w1u h ARG 328 CO 0.06 0.40 0.44 0.37 -1.07 0.00 0.00 179.97 180.17 1w1u h GLN 329 N 0.34 0.79 0.08 0.04 5.75 -1.90 0.44 115.11 120.64 1w1u h GLN 329 Ca 0.10 -0.05 -0.00 0.00 -0.15 0.00 0.00 58.65 58.55 1w1u h GLN 329 Cb 0.12 -0.18 0.00 0.00 1.07 0.00 0.00 27.48 28.49 1w1u h GLN 329 CO -0.01 0.52 -0.04 0.52 -2.65 0.00 0.00 178.83 177.17 1w1u h MET 330 N 0.81 -0.10 -0.50 1.69 2.86 -1.18 -0.90 114.93 117.61 1w1u h MET 330 Ca 0.32 0.01 0.07 0.00 -2.06 0.00 0.00 59.70 58.04 1w1u h MET 330 Cb 0.15 0.02 -0.06 0.00 0.06 0.00 0.00 31.60 31.77 1w1u h MET 330 CO -0.17 0.12 0.15 0.00 1.06 0.00 0.00 176.91 178.08 1w1u h ALA 331 N 0.60 0.60 -0.67 6.32 0.00 -0.50 -1.72 119.26 123.89 1w1u h ALA 331 Ca -0.01 0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.01 1w1u h ALA 331 Cb 0.26 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 1w1u h ALA 331 CO 0.02 -0.25 0.41 -0.22 0.00 0.00 0.00 179.25 179.21 1w1u h LYS 332 N 0.31 0.77 0.00 0.00 3.64 0.07 -0.08 116.57 121.28 1w1u h LYS 332 Ca 0.25 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 1w1u h LYS 332 Cb 0.29 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 1w1u h LYS 332 CO -0.28 0.51 0.00 0.93 -2.27 0.00 0.00 179.45 178.35 1w1u h GLU 333 N 0.80 0.00 -0.69 1.90 5.08 -0.41 -2.30 114.58 118.96 1w1u h GLU 333 Ca 0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.63 1w1u h GLU 333 Cb 0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1w1u h GLU 333 CO -0.11 0.00 0.00 -1.91 -1.00 0.00 0.00 179.01 175.99 1w1u n GLU 334 N -2.39 3.33 0.00 2.33 4.07 -0.10 -4.94 120.64 122.95 1w1u n GLU 334 Ca 0.02 -2.76 0.00 0.00 -0.06 0.00 0.00 57.16 54.36 1w1u n GLU 334 Cb 0.23 -1.77 0.00 0.00 -0.06 0.00 0.00 31.44 29.84 1w1u n GLU 334 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1w1u n GLY 335 N 1.34 2.34 3.57 8.31 0.00 -0.87 -5.00 105.19 114.89 1w1u n GLY 335 Ca 0.25 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.87 1w1u n GLY 335 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1w1u s VAL 336 N -2.14 3.95 0.33 1.61 1.01 -0.89 -4.84 120.40 119.44 1w1u s VAL 336 Ca 0.00 -1.13 0.05 0.00 0.00 0.00 0.00 61.98 60.89 1w1u s VAL 336 Cb 0.00 -5.04 0.30 0.00 0.00 0.00 0.00 36.38 31.64 1w1u s VAL 336 CO 0.00 -1.89 1.91 0.00 0.00 0.00 0.00 175.10 175.12 1w1u h ALA 337 N 9.13 1.66 -0.50 5.51 0.00 -1.87 -1.56 119.26 131.63 1w1u h ALA 337 Ca 0.28 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.05 1w1u h ALA 337 Cb 0.96 -0.20 -0.08 0.00 0.00 0.00 0.00 17.79 18.47 1w1u h ALA 337 CO 1.42 0.18 0.16 0.27 0.00 0.00 0.00 179.25 181.29 1w1u n ASN 338 N -4.51 4.00 -0.33 0.00 6.94 -1.26 -4.52 115.26 115.58 1w1u n ASN 338 Ca 0.14 -2.80 0.20 0.00 -0.02 0.00 0.00 54.58 52.10 1w1u n ASN 338 Cb 0.28 -0.67 0.46 0.00 -2.36 0.00 0.00 39.78 37.49 1w1u n ASN 338 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1w1u h ALA 339 N 2.65 2.07 -0.34 -2.53 0.00 -1.61 0.42 119.26 119.92 1w1u h ALA 339 Ca 0.15 0.08 -0.10 0.00 0.00 0.00 0.00 54.91 55.04 1w1u h ALA 339 Cb 1.79 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 19.53 1w1u h ALA 339 CO 0.49 -0.48 0.13 1.19 0.00 0.00 0.00 179.25 180.58 1w1u n PHE 340 N -4.69 1.11 0.23 0.00 3.01 -1.26 -4.09 117.46 111.76 1w1u n PHE 340 Ca 0.25 -0.67 0.12 0.00 1.01 0.00 0.00 57.45 58.16 1w1u n PHE 340 Cb 0.80 -0.41 0.44 0.00 -0.01 0.00 0.00 39.48 40.31 1w1u n PHE 340 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 1w1u h ASP 341 N 1.16 0.00 -3.19 4.37 3.45 -1.27 -3.42 116.42 117.52 1w1u h ASP 341 Ca 0.13 0.00 -0.65 0.00 0.43 0.00 0.00 57.03 56.94 1w1u h ASP 341 Cb 1.46 0.00 -0.10 0.00 -0.56 0.00 0.00 39.33 40.12 1w1u h ASP 341 CO 0.34 0.16 -0.60 0.72 -1.57 0.00 0.00 179.24 178.28 1w1u s PHE 342 N -3.53 3.20 0.72 4.55 -0.71 -1.26 -5.12 117.98 115.83 1w1u s PHE 342 Ca 0.02 0.13 -0.07 0.00 -1.04 0.00 0.00 56.93 55.97 1w1u s PHE 342 Cb 0.09 -1.67 0.07 0.00 -1.21 0.00 0.00 43.02 40.30 1w1u s PHE 342 CO 0.62 0.52 1.03 -1.25 -1.34 0.00 0.00 175.22 174.81 1w1u s PRO 343 N -1.97 2.09 0.48 1.99 0.04 -1.26 -4.74 135.00 131.63 1w1u s PRO 343 Ca 0.25 -0.29 -0.12 0.00 0.04 0.00 0.00 61.00 60.88 1w1u s PRO 343 Cb -0.12 -2.15 -0.06 0.00 0.04 0.00 0.00 34.50 32.20 1w1u s PRO 343 CO 0.16 -1.32 0.88 0.20 0.04 0.00 0.00 177.00 176.96 1w1u s GLY 344 N -4.55 1.91 0.55 0.56 0.00 -1.26 -0.15 107.32 104.38 1w1u s GLY 344 Ca 0.61 -0.08 0.29 0.00 0.00 0.00 0.00 44.72 45.54 1w1u s GLY 344 CO 0.45 0.14 2.13 0.27 0.00 0.00 0.00 173.10 176.10 1w1u h PHE 345 N 0.85 0.00 0.00 1.90 -5.15 -1.52 -2.66 116.94 110.36 1w1u h PHE 345 Ca -0.47 0.00 -0.00 0.00 -0.20 0.00 0.00 57.97 57.30 1w1u h PHE 345 Cb 1.19 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.36 1w1u h PHE 345 CO 0.62 0.08 -0.00 0.28 -2.00 0.00 0.00 178.31 177.29 1w1u h VAL 346 N 0.00 1.01 -0.02 0.88 2.07 -1.87 0.11 116.25 118.43 1w1u h VAL 346 Ca -0.00 -1.75 -0.04 0.00 0.82 0.00 0.00 66.70 65.73 1w1u h VAL 346 Cb 0.25 1.91 -0.01 0.00 -1.52 0.00 0.00 31.29 31.92 1w1u h VAL 346 CO 0.01 0.34 -0.16 1.55 0.02 0.00 0.00 177.57 179.34 1w1u h PRO 347 N -1.00 0.04 0.06 1.57 0.13 -1.80 0.25 132.00 131.25 1w1u h PRO 347 Ca -0.00 -0.01 -0.22 0.00 -0.87 0.00 0.00 66.00 64.90 1w1u h PRO 347 Cb 0.56 -0.01 0.02 0.00 0.13 0.00 0.00 31.00 31.71 1w1u h PRO 347 CO 0.00 0.19 -0.89 0.00 -0.23 0.00 0.00 178.00 177.08 1w1u h ALA 348 N 1.81 0.03 0.00 -0.56 0.00 -1.56 -3.44 119.26 115.54 1w1u h ALA 348 Ca 0.01 -0.67 0.00 0.00 0.00 0.00 0.00 54.91 54.25 1w1u h ALA 348 Cb 0.30 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1w1u h ALA 348 CO 0.02 0.50 -0.46 0.66 0.00 0.00 0.00 179.25 179.97 1w1u n TYR 349 N -4.03 0.00 0.16 0.00 4.01 0.34 -4.94 117.16 112.70 1w1u n TYR 349 Ca -0.12 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.72 1w1u n TYR 349 Cb 0.82 0.00 -0.16 0.00 -0.31 0.00 0.00 39.34 39.69 1w1u n TYR 349 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 1w1u n ILE 350 N -1.35 0.00 -0.32 -0.72 5.41 -0.85 -4.61 119.36 116.92 1w1u n ILE 350 Ca 0.00 -0.40 0.18 0.00 1.00 0.00 0.00 62.75 63.53 1w1u n ILE 350 Cb 0.23 0.19 0.37 0.00 -0.71 0.00 0.00 39.64 39.72 1w1u n ILE 350 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 176.55 176.46 1w1u h ARG 351 N 0.00 0.29 -0.74 0.38 2.43 -0.78 0.85 114.38 116.81 1w1u h ARG 351 Ca 0.00 -0.02 0.15 0.00 -0.81 0.00 0.00 59.98 59.31 1w1u h ARG 351 Cb 0.88 -0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 30.32 1w1u h ARG 351 CO 0.00 0.19 0.50 -1.35 -1.51 0.00 0.00 179.97 177.80 1w1u h PRO 352 N 0.30 0.35 -0.29 0.20 0.11 -1.85 -0.58 132.00 130.25 1w1u h PRO 352 Ca 0.63 -0.02 -0.14 0.00 0.11 0.00 0.00 66.00 66.58 1w1u h PRO 352 Cb 1.33 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.36 1w1u h PRO 352 CO -0.61 0.23 -0.35 -0.07 -0.21 0.00 0.00 178.00 176.99 1w1u h LEU 353 N 0.36 0.82 -1.87 2.35 3.38 -1.15 -3.01 115.31 116.20 1w1u h LEU 353 Ca 0.36 -0.49 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 1w1u h LEU 353 Cb 0.90 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 1w1u h LEU 353 CO -0.11 1.15 -0.10 -0.26 0.09 0.00 0.00 178.44 179.20 1w1u h PHE 354 N 0.51 0.00 0.00 1.13 0.04 -1.04 -0.75 116.94 116.83 1w1u h PHE 354 Ca 0.04 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.81 1w1u h PHE 354 Cb 0.94 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.09 1w1u h PHE 354 CO 0.07 0.10 0.00 0.00 -0.60 0.00 0.00 178.31 177.89 1w1u n ARG 356 N -3.07 3.29 -1.00 0.00 1.74 -0.65 -3.67 116.66 113.30 1w1u n ARG 356 Ca -0.01 -2.70 -0.00 0.00 -0.77 0.00 0.00 57.85 54.37 1w1u n ARG 356 Cb 0.23 -1.76 -0.00 0.00 -1.02 0.00 0.00 32.46 29.90 1w1u n ARG 356 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1w1u n GLY 357 N 0.19 0.30 3.72 -0.13 0.00 -0.52 -2.12 105.19 106.63 1w1u n GLY 357 Ca 0.21 -0.01 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 1w1u n GLY 357 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1w1u s VAL 358 N -1.58 4.25 0.09 1.61 1.01 -0.38 -3.94 120.40 121.46 1w1u s VAL 358 Ca 0.00 1.76 -0.07 0.00 0.00 0.00 0.00 61.98 63.67 1w1u s VAL 358 Cb 0.00 -4.13 0.02 0.00 0.00 0.00 0.00 36.38 32.28 1w1u s VAL 358 CO 0.00 0.22 0.34 0.61 0.00 0.00 0.00 175.10 176.26 1w1u n GLY 359 N 2.57 1.24 2.53 4.51 0.00 -1.20 -3.66 105.19 111.18 1w1u n GLY 359 Ca 0.05 -1.03 -0.15 0.00 0.00 0.00 0.00 46.02 44.89 1w1u n GLY 359 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1w1u n PRO 360 N -0.23 1.52 -1.76 1.61 -0.04 -1.26 -3.69 135.00 131.16 1w1u n PRO 360 Ca -0.02 -1.04 -0.42 0.00 -0.04 0.00 0.00 63.50 61.99 1w1u n PRO 360 Cb 0.21 -2.17 -0.01 0.00 -0.04 0.00 0.00 33.50 31.49 1w1u n PRO 360 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1w1u n PHE 361 N 3.79 2.85 -3.74 0.54 7.35 -1.26 -3.55 117.46 123.44 1w1u n PHE 361 Ca 0.32 0.40 -0.10 0.00 -0.76 0.00 0.00 57.45 57.32 1w1u n PHE 361 Cb 0.23 -2.54 -0.05 0.00 0.35 0.00 0.00 39.48 37.47 1w1u n PHE 361 CO 0.00 0.00 0.00 -0.98 -0.76 0.00 0.00 176.76 175.02 1w1u s ARG 362 N -1.58 1.15 0.06 -4.13 1.70 -0.65 -1.60 118.95 113.90 1w1u s ARG 362 Ca 0.57 -0.86 -0.14 0.00 -0.47 0.00 0.00 55.73 54.83 1w1u s ARG 362 Cb -0.50 0.46 0.02 0.00 -0.57 0.00 0.00 34.95 34.36 1w1u s ARG 362 CO 0.59 -0.45 0.32 1.67 -1.08 0.00 0.00 175.30 176.34 1w1u s TRP 363 N -3.86 -0.11 0.03 5.89 -2.14 -0.90 0.09 118.94 117.95 1w1u s TRP 363 Ca 0.07 -0.07 0.03 0.00 2.66 0.00 0.00 56.10 58.80 1w1u s TRP 363 Cb 0.02 0.11 -0.02 0.00 -3.10 0.00 0.00 33.47 30.48 1w1u s TRP 363 CO -0.07 -0.54 -0.10 0.00 -2.66 0.00 0.00 176.95 173.58 1w1u s ALA 364 N -2.83 0.79 -0.43 2.67 0.00 -0.48 -0.71 121.76 120.77 1w1u s ALA 364 Ca -0.03 -0.69 -0.21 0.00 0.00 0.00 0.00 51.96 51.03 1w1u s ALA 364 Cb 0.00 -0.08 0.02 0.00 0.00 0.00 0.00 23.12 23.07 1w1u s ALA 364 CO -0.05 0.10 0.64 0.00 0.00 0.00 0.00 175.76 176.46 1w1u s ALA 365 N -0.92 3.35 0.51 0.00 0.00 -0.61 -1.72 121.76 122.37 1w1u s ALA 365 Ca -0.03 -1.18 0.31 0.00 0.00 0.00 0.00 51.96 51.06 1w1u s ALA 365 Cb -0.08 -3.29 1.76 0.00 0.00 0.00 0.00 23.12 21.51 1w1u s ALA 365 CO 0.01 -1.75 2.19 -0.07 0.00 0.00 0.00 175.76 176.13 1w1u h LEU 366 N 9.68 0.00 -1.44 0.00 3.38 -1.77 -1.98 115.31 123.18 1w1u h LEU 366 Ca -0.25 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.66 1w1u h LEU 366 Cb 1.10 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 1w1u h LEU 366 CO 0.89 0.05 -0.28 0.77 0.09 0.00 0.00 178.44 179.95 1w1u h SER 367 N 0.00 0.00 0.00 -0.43 4.64 -1.81 -3.39 113.55 112.56 1w1u h SER 367 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1w1u h SER 367 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 1w1u h SER 367 CO 0.01 0.28 0.00 0.61 -0.87 0.00 0.00 176.83 176.86 1w1u n GLY 368 N -0.64 0.74 3.69 -0.77 0.00 -0.75 -1.88 105.19 105.58 1w1u n GLY 368 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 1w1u n GLY 368 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1w1u s GLU 369 N -0.52 4.41 0.32 1.61 0.41 -1.26 -4.51 118.70 119.17 1w1u s GLU 369 Ca 0.00 1.32 0.02 0.00 -0.41 0.00 0.00 54.97 55.89 1w1u s GLU 369 Cb 0.00 -3.54 0.55 0.00 -1.78 0.00 0.00 34.13 29.36 1w1u s GLU 369 CO 0.00 -0.29 1.90 0.00 -0.49 0.00 0.00 175.26 176.38 1w1u h ALA 370 N 7.11 1.38 0.00 5.21 0.00 -1.96 -2.33 119.26 128.67 1w1u h ALA 370 Ca -0.32 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.43 1w1u h ALA 370 Cb 1.15 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 1w1u h ALA 370 CO 0.84 0.46 -0.09 0.93 0.00 0.00 0.00 179.25 181.39 1w1u h GLU 371 N 0.71 0.00 -0.38 0.00 4.39 -1.99 -2.32 114.58 114.99 1w1u h GLU 371 Ca 0.17 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.82 1w1u h GLU 371 Cb 0.18 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.82 1w1u h GLU 371 CO -0.01 0.09 0.05 -0.44 -1.16 0.00 0.00 179.01 177.54 1w1u h ASP 372 N 0.00 0.61 -0.36 1.42 3.32 -1.80 -1.33 116.42 118.29 1w1u h ASP 372 Ca -0.00 -0.27 -0.08 0.00 0.02 0.00 0.00 57.03 56.70 1w1u h ASP 372 Cb 0.37 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 1w1u h ASP 372 CO 0.01 0.73 -0.10 0.40 -1.72 0.00 0.00 179.24 178.56 1w1u h ILE 373 N 0.48 1.28 -0.99 0.35 1.08 -1.52 -2.25 117.51 115.93 1w1u h ILE 373 Ca 0.11 -1.18 0.05 0.00 -0.39 0.00 0.00 64.86 63.45 1w1u h ILE 373 Cb 0.38 1.29 -0.06 0.00 -3.07 0.00 0.00 36.82 35.37 1w1u h ILE 373 CO 0.01 0.39 0.65 1.88 -0.69 0.00 0.00 178.15 180.39 1w1u h TYR 374 N 0.50 1.21 -0.77 1.37 0.05 -1.34 0.21 116.97 118.20 1w1u h TYR 374 Ca 0.09 0.03 -0.04 0.00 0.05 0.00 0.00 58.73 58.87 1w1u h TYR 374 Cb 0.61 -0.40 -0.03 0.00 1.01 0.00 0.00 36.73 37.92 1w1u h TYR 374 CO 0.05 0.67 0.34 0.87 -1.05 0.00 0.00 178.16 179.05 1w1u h LYS 375 N 1.23 1.13 -0.54 4.88 1.57 -1.05 -1.05 116.57 122.73 1w1u h LYS 375 Ca 0.41 -0.18 -0.11 0.00 -1.87 0.00 0.00 60.65 58.90 1w1u h LYS 375 Cb 0.06 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.15 1w1u h LYS 375 CO -0.14 0.90 -0.08 1.79 -0.57 0.00 0.00 179.45 181.35 1w1u h THR 376 N 1.10 1.27 -0.24 -0.16 1.35 -0.60 -1.12 112.91 114.50 1w1u h THR 376 Ca 0.26 -1.22 0.05 0.00 -0.55 0.00 0.00 66.41 64.96 1w1u h THR 376 Cb 0.16 0.93 -0.05 0.00 -1.73 0.00 0.00 68.15 67.46 1w1u h THR 376 CO -0.03 0.43 -0.10 0.44 -0.25 0.00 0.00 175.52 176.02 1w1u h ASP 377 N 0.89 -0.33 -0.58 5.36 3.32 0.00 0.36 116.42 125.44 1w1u h ASP 377 Ca 0.15 0.09 0.03 0.00 0.02 0.00 0.00 57.03 57.31 1w1u h ASP 377 Cb 0.63 0.19 -0.04 0.00 0.22 0.00 0.00 39.33 40.33 1w1u h ASP 377 CO 0.04 -0.13 0.35 0.00 -1.72 0.00 0.00 179.24 177.79 1w1u h ALA 378 N 1.16 0.75 -0.84 3.45 0.00 -0.86 -2.18 119.26 120.74 1w1u h ALA 378 Ca 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1w1u h ALA 378 Cb 0.25 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1w1u h ALA 378 CO -0.28 0.08 0.54 -0.22 0.00 0.00 0.00 179.25 179.36 1w1u h LYS 379 N 0.69 1.12 -0.50 0.00 1.63 -0.46 -1.80 116.57 117.25 1w1u h LYS 379 Ca 0.23 -0.08 -0.02 0.00 -0.85 0.00 0.00 60.65 59.93 1w1u h LYS 379 Cb 0.03 -0.25 -0.02 0.00 -0.60 0.00 0.00 32.23 31.39 1w1u h LYS 379 CO -0.10 0.76 0.22 0.28 -3.45 0.00 0.00 179.45 177.16 1w1u h VAL 380 N 1.15 1.20 -0.62 2.00 2.07 -0.43 0.10 116.25 121.73 1w1u h VAL 380 Ca 0.31 -0.61 0.02 0.00 0.82 0.00 0.00 66.70 67.24 1w1u h VAL 380 Cb -0.09 0.68 -0.03 0.00 -1.52 0.00 0.00 31.29 30.32 1w1u h VAL 380 CO -0.06 0.23 0.41 0.11 0.02 0.00 0.00 177.57 178.28 1w1u h LYS 381 N 0.66 0.74 -0.14 1.57 1.57 -1.07 0.14 116.57 120.05 1w1u h LYS 381 Ca 0.17 -0.04 -0.15 0.00 -1.87 0.00 0.00 60.65 58.75 1w1u h LYS 381 Cb 0.16 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 1w1u h LYS 381 CO -0.02 0.49 -0.57 1.49 -0.57 0.00 0.00 179.45 180.27 1w1u h GLU 382 N 0.76 0.42 0.00 3.15 4.81 -0.66 -2.76 114.58 120.31 1w1u h GLU 382 Ca 0.24 -0.28 -0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1w1u h GLU 382 Cb 0.02 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.43 1w1u h GLU 382 CO -0.06 0.88 -0.28 -0.07 -0.73 0.00 0.00 179.01 178.75 1w1u h LEU 383 N 0.32 0.00 -5.90 1.64 3.38 0.42 -3.34 115.31 111.83 1w1u h LEU 383 Ca 0.00 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.41 1w1u h LEU 383 Cb 1.10 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 41.44 1w1u h LEU 383 CO 0.10 0.01 -0.85 -0.38 0.09 0.00 0.00 178.44 177.41 1w1u n ILE 384 N -2.99 1.26 0.30 1.22 2.08 0.35 -4.96 119.36 116.62 1w1u n ILE 384 Ca 0.03 -4.87 0.17 0.00 0.56 0.00 0.00 62.75 58.64 1w1u n ILE 384 Cb 0.54 -1.56 0.97 0.00 -0.75 0.00 0.00 39.64 38.84 1w1u n ILE 384 CO 0.00 0.00 0.00 1.55 0.56 0.00 0.00 176.55 178.66 1w1u h PRO 385 N 3.63 0.00 -0.83 0.38 0.13 -1.63 -3.28 132.00 130.41 1w1u h PRO 385 Ca 0.13 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.68 1w1u h PRO 385 Cb 0.74 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.47 1w1u h PRO 385 CO 0.67 0.02 -0.43 -0.25 -0.23 0.00 0.00 178.00 177.78 1w1u n ASP 386 N -3.55 5.56 -3.79 1.44 8.00 -1.26 -4.85 116.55 118.10 1w1u n ASP 386 Ca -0.03 -3.76 -0.30 0.00 0.71 0.00 0.00 54.79 51.42 1w1u n ASP 386 Cb 0.11 -0.49 -0.14 0.00 -0.02 0.00 0.00 41.12 40.59 1w1u n ASP 386 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1w1u s ASP 387 N -3.19 3.93 0.41 -2.24 -1.08 -1.24 -4.97 116.67 108.29 1w1u s ASP 387 Ca 0.54 -2.55 0.09 0.00 -0.52 0.00 0.00 52.55 50.11 1w1u s ASP 387 Cb 0.43 -1.19 0.88 0.00 -1.46 0.00 0.00 42.92 41.58 1w1u s ASP 387 CO 0.02 -0.29 2.02 0.00 0.52 0.00 0.00 175.17 177.45 1w1u h ALA 388 N 6.92 1.67 -0.47 3.66 0.00 -1.91 -1.02 119.26 128.11 1w1u h ALA 388 Ca -0.04 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1w1u h ALA 388 Cb 0.94 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 1w1u h ALA 388 CO 0.53 0.26 0.14 1.25 0.00 0.00 0.00 179.25 181.44 1w1u h HIS 389 N 0.39 0.76 -0.29 0.00 -0.00 -1.99 -0.94 115.15 113.08 1w1u h HIS 389 Ca 0.10 -0.08 -0.09 0.00 -0.00 0.00 0.00 60.37 60.30 1w1u h HIS 389 Cb 0.09 -0.22 -0.01 0.00 -0.00 0.00 0.00 27.41 27.27 1w1u h HIS 389 CO 0.00 0.67 -0.18 1.25 -0.00 0.00 0.00 177.93 179.68 1w1u h LEU 390 N 0.63 0.67 -0.86 0.26 6.46 -1.85 -1.21 115.31 119.40 1w1u h LEU 390 Ca 0.15 -0.43 -0.03 0.00 -0.12 0.00 0.00 57.88 57.45 1w1u h LEU 390 Cb 0.27 -0.18 -0.04 0.00 -0.73 0.00 0.00 40.66 39.98 1w1u h LEU 390 CO -0.00 0.95 0.41 0.45 -0.62 0.00 0.00 178.44 179.62 1w1u h HIS 391 N 0.38 1.23 -0.22 1.25 3.86 -1.11 -1.02 115.15 119.52 1w1u h HIS 391 Ca 0.06 -0.06 -0.07 0.00 -1.16 0.00 0.00 60.37 59.14 1w1u h HIS 391 Cb 0.72 -0.38 -0.01 0.00 1.06 0.00 0.00 27.41 28.79 1w1u h HIS 391 CO 0.06 0.89 -0.18 -0.09 0.86 0.00 0.00 177.93 179.47 1w1u h ARG 392 N 1.22 0.38 -0.36 2.45 2.43 -1.02 -0.85 114.38 118.62 1w1u h ARG 392 Ca 0.29 -0.12 -0.13 0.00 -0.81 0.00 0.00 59.98 59.22 1w1u h ARG 392 Cb 0.12 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 1w1u h ARG 392 CO -0.04 0.56 -0.28 2.35 -1.51 0.00 0.00 179.97 181.05 1w1u h TRP 393 N 0.35 0.98 -0.74 2.20 2.91 -0.48 -0.60 115.95 120.57 1w1u h TRP 393 Ca 0.06 -0.27 -0.06 0.00 1.13 0.00 0.00 58.89 59.75 1w1u h TRP 393 Cb 0.53 -0.21 -0.03 0.00 -0.51 0.00 0.00 29.16 28.93 1w1u h TRP 393 CO 0.01 1.05 0.24 -0.07 -1.03 0.00 0.00 178.44 178.65 1w1u h LEU 394 N 0.62 1.06 -0.03 0.65 3.38 -0.87 0.40 115.31 120.52 1w1u h LEU 394 Ca 0.07 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 1w1u h LEU 394 Cb 0.85 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.32 1w1u h LEU 394 CO 0.07 0.98 0.02 0.44 0.09 0.00 0.00 178.44 180.04 1w1u h ASP 395 N 1.09 0.04 -0.86 -0.43 3.32 -0.97 -1.01 116.42 117.60 1w1u h ASP 395 Ca 0.24 -0.09 0.01 0.00 0.02 0.00 0.00 57.03 57.20 1w1u h ASP 395 Cb 0.29 -0.01 -0.04 0.00 0.22 0.00 0.00 39.33 39.79 1w1u h ASP 395 CO -0.01 0.12 0.56 0.24 -1.72 0.00 0.00 179.24 178.43 1w1u h MET 396 N -0.05 1.14 -0.34 3.56 2.86 -0.84 0.42 114.93 121.68 1w1u h MET 396 Ca 0.01 -0.08 -0.03 0.00 -2.06 0.00 0.00 59.70 57.54 1w1u h MET 396 Cb 0.09 -0.25 -0.01 0.00 0.06 0.00 0.00 31.60 31.49 1w1u h MET 396 CO -0.00 0.76 0.08 0.00 1.06 0.00 0.00 176.91 178.81 1w1u h ALA 397 N 1.45 0.45 -0.69 6.32 0.00 -0.67 0.46 119.26 126.58 1w1u h ALA 397 Ca 0.31 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1w1u h ALA 397 Cb -0.11 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 1w1u h ALA 397 CO -0.07 0.12 0.38 -0.09 0.00 0.00 0.00 179.25 179.60 1w1u h ARG 398 N 0.40 0.96 0.00 0.00 9.65 -0.62 0.13 114.38 124.90 1w1u h ARG 398 Ca 0.11 -0.11 -0.05 0.00 -1.10 0.00 0.00 59.98 58.83 1w1u h ARG 398 Cb 0.31 -0.19 -0.01 0.00 -1.39 0.00 0.00 29.97 28.69 1w1u h ARG 398 CO 0.00 0.72 -0.71 0.93 2.80 0.00 0.00 179.97 183.71 1w1u h GLU 399 N 0.94 0.00 0.00 0.20 5.08 -0.77 -3.41 114.58 116.62 1w1u h GLU 399 Ca 0.24 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.60 1w1u h GLU 399 Cb 0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1w1u h GLU 399 CO -0.04 0.13 0.00 -2.13 -1.00 0.00 0.00 179.01 175.97 1w1u n ARG 400 N -2.92 2.16 -3.76 2.33 3.00 0.16 -5.00 116.66 112.63 1w1u n ARG 400 Ca -0.00 -0.10 -0.37 0.00 -0.00 0.00 0.00 57.85 57.37 1w1u n ARG 400 Cb 0.62 -0.45 -0.13 0.00 0.00 0.00 0.00 32.46 32.51 1w1u n ARG 400 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 1w1u s ILE 401 N -0.34 3.94 0.05 5.15 1.09 0.45 -4.96 121.20 126.58 1w1u s ILE 401 Ca 0.00 -0.76 -0.18 0.00 -1.10 0.00 0.00 60.65 58.61 1w1u s ILE 401 Cb 0.00 -3.06 -0.06 0.00 -1.06 0.00 0.00 42.46 38.27 1w1u s ILE 401 CO 0.00 0.04 0.53 -0.44 -0.10 0.00 0.00 174.94 174.97 1w1u s SER 402 N 1.49 7.00 0.58 3.58 0.01 -1.26 -4.72 113.70 120.37 1w1u s SER 402 Ca 0.02 1.18 -0.20 0.00 1.31 0.00 0.00 55.95 58.26 1w1u s SER 402 Cb -0.18 -2.33 -0.04 0.00 0.21 0.00 0.00 66.02 63.69 1w1u s SER 402 CO 0.02 0.27 1.29 -0.36 0.41 0.00 0.00 173.24 174.88 1w1u s PHE 403 N -1.02 2.28 -0.18 2.43 0.08 -1.26 -5.00 117.98 115.31 1w1u s PHE 403 Ca 0.28 1.45 -0.00 0.00 0.12 0.00 0.00 56.93 58.78 1w1u s PHE 403 Cb -0.19 -3.68 0.04 0.00 -0.57 0.00 0.00 43.02 38.63 1w1u s PHE 403 CO 0.17 -2.68 -0.07 -0.65 -0.10 0.00 0.00 175.22 171.89 1w1u s GLN 404 N -3.13 1.65 5.20 0.44 -0.21 -1.26 -5.03 119.66 117.31 1w1u s GLN 404 Ca 0.76 -0.62 0.00 0.00 0.02 0.00 0.00 55.36 55.52 1w1u s GLN 404 Cb -0.37 -2.14 0.00 0.00 1.00 0.00 0.00 33.01 31.50 1w1u s GLN 404 CO 0.41 -0.43 0.00 0.41 -2.12 0.00 0.00 175.29 173.57 1w1u n GLY 405 N 4.81 1.99 3.70 3.09 0.00 -1.26 -4.64 105.19 112.88 1w1u n GLY 405 Ca -0.13 -0.57 -0.43 0.00 0.00 0.00 0.00 46.02 44.89 1w1u n GLY 405 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1w1u n LEU 406 N 0.00 3.79 -4.65 0.99 4.77 -1.26 -4.88 117.00 115.75 1w1u n LEU 406 Ca 0.00 1.05 -0.43 0.00 -0.03 0.00 0.00 56.01 56.60 1w1u n LEU 406 Cb 0.00 -1.53 -0.01 0.00 -2.33 0.00 0.00 43.42 39.55 1w1u n LEU 406 CO 0.00 0.07 0.75 -2.65 -1.33 0.00 0.00 177.39 174.23 1w1u n PRO 407 N 4.19 1.76 -3.66 3.23 -0.02 -1.26 -4.81 135.00 134.44 1w1u n PRO 407 Ca 0.17 0.62 -0.11 0.00 -2.02 0.00 0.00 63.50 62.16 1w1u n PRO 407 Cb 0.34 -2.14 -0.05 0.00 -0.02 0.00 0.00 33.50 31.62 1w1u n PRO 407 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1w1u s ALA 408 N -1.12 -0.88 -0.03 3.55 0.00 -1.26 -1.58 121.76 120.44 1w1u s ALA 408 Ca 0.58 -0.04 0.03 0.00 0.00 0.00 0.00 51.96 52.53 1w1u s ALA 408 Cb -0.60 0.61 -0.00 0.00 0.00 0.00 0.00 23.12 23.13 1w1u s ALA 408 CO 0.60 -0.60 -0.11 0.50 0.00 0.00 0.00 175.76 176.15 1w1u s ARG 409 N -3.57 1.13 -0.20 0.00 6.06 0.11 -4.98 118.95 117.50 1w1u s ARG 409 Ca 0.02 -0.39 -0.09 0.00 -2.50 0.00 0.00 55.73 52.77 1w1u s ARG 409 Cb 0.02 -1.04 -0.05 0.00 0.06 0.00 0.00 34.95 33.94 1w1u s ARG 409 CO -0.10 0.16 0.11 -1.50 -2.50 0.00 0.00 175.30 171.47 1w1u s ILE 410 N 0.09 5.12 -0.28 4.11 1.10 -1.26 -2.11 121.20 127.96 1w1u s ILE 410 Ca -0.02 0.09 0.01 0.00 -0.51 0.00 0.00 60.65 60.21 1w1u s ILE 410 Cb -0.09 -3.34 0.15 0.00 0.15 0.00 0.00 42.46 39.34 1w1u s ILE 410 CO 0.01 0.43 0.39 0.00 -2.11 0.00 0.00 174.94 173.66 1w1u s TRP 412 N 2.53 1.93 0.08 0.00 0.52 -1.26 -4.14 118.94 118.61 1w1u s TRP 412 Ca 0.10 0.26 -0.12 0.00 0.02 0.00 0.00 56.10 56.37 1w1u s TRP 412 Cb -0.13 -3.95 0.01 0.00 -1.15 0.00 0.00 33.47 28.25 1w1u s TRP 412 CO -0.27 -3.73 0.26 0.14 0.02 0.00 0.00 176.95 173.37 1w1u s VAL 413 N 4.55 0.11 0.00 4.03 -7.23 -1.24 -4.88 120.40 115.73 1w1u s VAL 413 Ca 0.75 -0.90 0.00 0.00 -1.81 0.00 0.00 61.98 60.02 1w1u s VAL 413 Cb -0.32 -1.17 0.00 0.00 0.56 0.00 0.00 36.38 35.45 1w1u s VAL 413 CO 0.30 -0.50 0.00 0.61 -0.31 0.00 0.00 175.10 175.20 1w1u n GLY 414 N 0.11 5.27 3.68 2.32 0.00 -1.26 -3.26 105.19 112.04 1w1u n GLY 414 Ca -0.16 -1.85 -0.47 0.00 0.00 0.00 0.00 46.02 43.53 1w1u n GLY 414 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1w1u n LEU 415 N 0.00 3.35 0.00 0.99 0.00 -0.90 -2.29 117.00 118.16 1w1u n LEU 415 Ca 0.00 1.01 0.00 0.00 0.00 0.00 0.00 56.01 57.02 1w1u n LEU 415 Cb 0.00 -1.40 0.00 0.00 0.00 0.00 0.00 43.42 42.02 1w1u n LEU 415 CO 0.00 -0.13 0.00 0.61 0.00 0.00 0.00 177.39 177.87 1w1u n GLY 416 N 4.04 2.56 0.17 -3.96 0.00 -1.26 -4.79 105.19 101.94 1w1u n GLY 416 Ca 0.20 -0.72 -0.02 0.00 0.00 0.00 0.00 46.02 45.48 1w1u n GLY 416 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1w1u h LEU 417 N 0.00 0.16 -0.28 0.99 3.38 -1.91 -3.01 115.31 114.66 1w1u h LEU 417 Ca 0.00 -0.08 0.04 0.00 0.09 0.00 0.00 57.88 57.93 1w1u h LEU 417 Cb 0.00 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 40.66 1w1u h LEU 417 CO 0.00 0.67 0.03 0.03 0.09 0.00 0.00 178.44 179.26 1w1u h ARG 418 N 0.12 0.12 -0.26 1.13 3.08 -1.73 0.32 114.38 117.16 1w1u h ARG 418 Ca 0.00 -0.01 -0.11 0.00 0.07 0.00 0.00 59.98 59.93 1w1u h ARG 418 Cb 0.98 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.99 1w1u h ARG 418 CO 0.08 0.08 -0.30 0.00 -1.07 0.00 0.00 179.97 178.75 1w1u h ALA 419 N 1.22 1.00 -0.44 0.04 0.00 -1.65 -0.58 119.26 118.85 1w1u h ALA 419 Ca 0.13 -0.38 -0.00 0.00 0.00 0.00 0.00 54.91 54.65 1w1u h ALA 419 Cb 0.15 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1w1u h ALA 419 CO -0.19 0.60 0.26 -0.22 0.00 0.00 0.00 179.25 179.69 1w1u h LYS 420 N 0.45 0.60 -0.39 0.00 3.64 -1.22 -0.82 116.57 118.83 1w1u h LYS 420 Ca 0.06 -0.06 -0.07 0.00 -1.27 0.00 0.00 60.65 59.30 1w1u h LYS 420 Cb 0.76 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.44 1w1u h LYS 420 CO 0.06 0.46 -0.04 -0.07 -2.27 0.00 0.00 179.45 177.59 1w1u h LEU 421 N 0.58 0.71 0.03 5.20 4.07 -0.78 -2.38 115.31 122.74 1w1u h LEU 421 Ca 0.16 -0.33 -0.00 0.00 0.08 0.00 0.00 57.88 57.78 1w1u h LEU 421 Cb 0.02 -0.19 0.00 0.00 1.08 0.00 0.00 40.66 41.57 1w1u h LEU 421 CO -0.03 0.87 -0.02 1.23 -1.08 0.00 0.00 178.44 179.42 1w1u h GLY 422 N 0.54 -0.05 1.01 0.83 0.00 -0.78 0.19 103.07 104.81 1w1u h GLY 422 Ca 0.11 0.02 0.01 0.00 0.00 0.00 0.00 47.33 47.46 1w1u h GLY 422 CO 0.03 -0.02 0.42 1.41 0.00 0.00 0.00 176.54 178.38 1w1u h LEU 423 N -0.05 0.74 -0.48 3.11 3.38 -1.20 -0.66 115.31 120.15 1w1u h LEU 423 Ca -0.00 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 57.96 1w1u h LEU 423 Cb 0.03 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 1w1u h LEU 423 CO 0.01 0.54 0.29 0.00 0.09 0.00 0.00 178.44 179.36 1w1u h ALA 424 N 1.23 0.62 -0.72 1.53 0.00 -1.09 -0.73 119.26 120.10 1w1u h ALA 424 Ca 0.23 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 1w1u h ALA 424 Cb -0.09 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 1w1u h ALA 424 CO -0.05 -0.02 0.31 0.74 0.00 0.00 0.00 179.25 180.23 1w1u h PHE 425 N 0.57 1.06 -0.42 0.00 0.04 -0.05 -1.65 116.94 116.50 1w1u h PHE 425 Ca 0.19 -0.06 -0.05 0.00 2.80 0.00 0.00 57.97 60.85 1w1u h PHE 425 Cb 0.02 -0.32 -0.02 0.00 2.20 0.00 0.00 35.95 37.82 1w1u h PHE 425 CO -0.07 0.79 0.05 -0.97 -0.60 0.00 0.00 178.31 177.51 1w1u h ASN 426 N 1.04 0.61 0.47 2.17 -1.24 -0.51 -1.90 115.58 116.21 1w1u h ASN 426 Ca 0.25 -0.11 -0.07 0.00 0.71 0.00 0.00 56.30 57.07 1w1u h ASN 426 Cb 0.16 -0.16 -0.01 0.00 0.73 0.00 0.00 38.32 39.04 1w1u h ASN 426 CO -0.03 0.65 -0.35 -0.08 -1.29 0.00 0.00 177.43 176.33 1w1u h GLU 427 N 0.62 0.00 0.01 6.67 4.22 -0.25 -2.08 114.58 123.77 1w1u h GLU 427 Ca 0.13 0.00 -0.20 0.00 0.08 0.00 0.00 59.36 59.38 1w1u h GLU 427 Cb 0.32 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 1w1u h GLU 427 CO 0.01 0.35 -0.93 0.52 -2.18 0.00 0.00 179.01 176.77 1w1u h MET 428 N 0.00 0.02 -0.14 1.92 2.86 -0.65 -2.21 114.93 116.73 1w1u h MET 428 Ca -0.00 -0.03 -0.10 0.00 -2.06 0.00 0.00 59.70 57.50 1w1u h MET 428 Cb 0.68 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.35 1w1u h MET 428 CO 0.05 0.93 -0.31 0.28 1.06 0.00 0.00 176.91 178.92 1w1u h VAL 429 N 0.01 1.37 0.18 -2.22 2.07 -1.20 0.90 116.25 117.35 1w1u h VAL 429 Ca -0.02 -1.58 -0.00 0.00 0.82 0.00 0.00 66.70 65.92 1w1u h VAL 429 Cb 1.63 2.03 -0.01 0.00 -1.52 0.00 0.00 31.29 33.42 1w1u h VAL 429 CO 0.12 0.47 -0.13 -0.09 0.02 0.00 0.00 177.57 177.97 1w1u h ARG 430 N 0.07 -0.30 0.00 1.57 2.43 -1.37 -2.41 114.38 114.36 1w1u h ARG 430 Ca 0.00 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 1w1u h ARG 430 Cb 0.91 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.53 1w1u h ARG 430 CO 0.07 -0.20 0.00 -1.13 -1.51 0.00 0.00 179.97 177.20 1w1u n SER 431 N -5.25 0.44 0.00 -3.80 3.41 -0.83 -4.85 113.62 102.74 1w1u n SER 431 Ca -0.08 0.63 0.00 0.00 -0.26 0.00 0.00 58.87 59.16 1w1u n SER 431 Cb 0.17 -0.72 0.00 0.00 -0.26 0.00 0.00 64.21 63.40 1w1u n SER 431 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1w1u n GLY 432 N -0.44 0.76 0.11 5.00 0.00 -0.91 -4.94 105.19 104.77 1w1u n GLY 432 Ca 0.01 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.94 1w1u n GLY 432 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1w1u h GLU 433 N 4.07 0.20 -6.09 1.61 4.81 -1.16 -3.37 114.58 114.65 1w1u h GLU 433 Ca 0.00 -0.01 -0.56 0.00 -0.13 0.00 0.00 59.36 58.65 1w1u h GLU 433 Cb 0.00 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.28 1w1u h GLU 433 CO 0.00 0.13 0.01 -0.51 -0.73 0.00 0.00 179.01 177.92 1w1u s LEU 434 N -10.24 4.41 0.45 1.64 1.43 -0.07 -4.96 118.68 111.33 1w1u s LEU 434 Ca -0.13 1.19 0.19 0.00 -1.03 0.00 0.00 54.13 54.34 1w1u s LEU 434 Cb 0.09 -2.96 1.06 0.00 0.03 0.00 0.00 46.19 44.41 1w1u s LEU 434 CO 0.69 0.07 1.96 0.77 0.23 0.00 0.00 176.35 180.07 1w1u h SER 435 N 5.76 0.00 -5.23 2.29 4.64 -1.89 -3.42 113.55 115.71 1w1u h SER 435 Ca -0.45 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 60.80 1w1u h SER 435 Cb 1.20 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.18 1w1u h SER 435 CO 0.70 0.22 -0.18 0.00 -0.87 0.00 0.00 176.83 176.70 1w1u s ALA 436 N -4.29 -0.23 0.62 5.18 0.00 -1.26 -4.88 121.76 116.89 1w1u s ALA 436 Ca -0.03 -0.79 -0.18 0.00 0.00 0.00 0.00 51.96 50.96 1w1u s ALA 436 Cb 0.14 0.97 -0.04 0.00 0.00 0.00 0.00 23.12 24.19 1w1u s ALA 436 CO 0.66 -0.76 1.00 -2.30 0.00 0.00 0.00 175.76 174.37 1w1u n PRO 437 N -0.31 0.89 -4.40 0.00 -0.02 -1.26 -4.72 135.00 125.18 1w1u n PRO 437 Ca -0.05 0.35 -0.28 0.00 -2.02 0.00 0.00 63.50 61.50 1w1u n PRO 437 Cb 0.63 -2.22 -0.12 0.00 -0.02 0.00 0.00 33.50 31.77 1w1u n PRO 437 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1w1u s VAL 438 N -1.51 2.39 -0.12 -1.45 -7.23 -1.11 -2.45 120.40 108.92 1w1u s VAL 438 Ca 0.77 -1.87 -0.01 0.00 -1.81 0.00 0.00 61.98 59.06 1w1u s VAL 438 Cb -0.41 -2.11 -0.02 0.00 0.56 0.00 0.00 36.38 34.40 1w1u s VAL 438 CO 0.46 -0.02 -0.07 0.68 -0.31 0.00 0.00 175.10 175.83 1w1u s VAL 439 N -1.40 3.58 -0.13 1.32 -7.23 -0.70 -0.77 120.40 115.08 1w1u s VAL 439 Ca 0.18 -0.48 -0.04 0.00 -1.81 0.00 0.00 61.98 59.83 1w1u s VAL 439 Cb -0.09 -2.52 -0.03 0.00 0.56 0.00 0.00 36.38 34.29 1w1u s VAL 439 CO 0.09 0.53 0.02 -0.63 -0.31 0.00 0.00 175.10 174.79 1w1u s ILE 440 N 0.05 4.40 0.00 -0.62 1.09 -0.19 -1.38 121.20 124.55 1w1u s ILE 440 Ca -0.02 -0.19 0.00 0.00 -1.10 0.00 0.00 60.65 59.34 1w1u s ILE 440 Cb -0.14 -2.91 0.00 0.00 -1.06 0.00 0.00 42.46 38.35 1w1u s ILE 440 CO 0.03 0.54 0.00 0.61 -0.10 0.00 0.00 174.94 176.02 1w1u n GLY 441 N 2.85 4.11 0.00 6.18 0.00 0.11 -0.53 105.19 117.92 1w1u n GLY 441 Ca -0.18 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.15 1w1u n GLY 441 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1w1u n ARG 442 N 0.00 -0.67 -1.92 1.61 1.85 -1.26 -1.63 116.66 114.64 1w1u n ARG 442 Ca 0.00 0.00 -0.29 0.00 -1.00 0.00 0.00 57.85 56.56 1w1u n ARG 442 Cb 0.00 0.00 0.12 0.00 -1.05 0.00 0.00 32.46 31.53 1w1u n ARG 442 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 1w1u s ASP 443 N 0.00 4.04 0.10 2.89 -1.08 -1.23 -4.78 116.67 116.61 1w1u s ASP 443 Ca 0.00 0.59 0.27 0.00 -0.52 0.00 0.00 52.55 52.90 1w1u s ASP 443 Cb 0.00 -0.93 1.00 0.00 -1.46 0.00 0.00 42.92 41.53 1w1u s ASP 443 CO 0.00 -2.18 1.83 1.41 0.52 0.00 0.00 175.17 176.75 1w1u n HIS 444 N -3.46 0.46 -2.54 -5.34 8.25 -1.26 -4.48 115.22 106.85 1w1u n HIS 444 Ca 0.10 0.13 -0.43 0.00 -0.26 0.00 0.00 57.72 57.27 1w1u n HIS 444 Cb 0.60 -0.71 -0.02 0.00 1.12 0.00 0.00 29.99 30.98 1w1u n HIS 444 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 1w1u s LEU 445 N -3.77 3.64 0.01 2.41 0.20 -1.26 -4.15 118.68 115.76 1w1u s LEU 445 Ca 0.12 0.58 -0.29 0.00 0.69 0.00 0.00 54.13 55.24 1w1u s LEU 445 Cb 0.16 -3.55 0.10 0.00 -0.43 0.00 0.00 46.19 42.47 1w1u s LEU 445 CO 0.57 -1.28 0.94 -0.62 -0.29 0.00 0.00 176.35 175.67 1w1u s ASP 446 N 2.77 -0.30 0.25 3.68 2.15 -1.26 -4.29 116.67 119.67 1w1u s ASP 446 Ca 0.51 -0.08 -0.08 0.00 0.43 0.00 0.00 52.55 53.33 1w1u s ASP 446 Cb -0.09 0.38 0.42 0.00 -0.30 0.00 0.00 42.92 43.33 1w1u s ASP 446 CO 0.31 -0.64 1.62 0.77 -0.17 0.00 0.00 175.17 177.07 1w1u h SER 447 N 2.00 -0.47 0.00 -0.34 4.64 -1.84 -3.04 113.55 114.50 1w1u h SER 447 Ca -0.22 0.21 -0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1w1u h SER 447 Cb 1.23 0.39 -0.00 0.00 -0.31 0.00 0.00 62.40 63.71 1w1u h SER 447 CO 0.29 -0.21 -0.23 0.61 -0.87 0.00 0.00 176.83 176.42 1w1u n GLY 448 N -1.45 4.91 0.26 -0.77 0.00 -1.26 -4.58 105.19 102.30 1w1u n GLY 448 Ca 0.13 -1.20 0.02 0.00 0.00 0.00 0.00 46.02 44.98 1w1u n GLY 448 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1w1u n SER 449 N -1.27 2.38 -3.76 1.61 3.41 -1.15 -4.22 113.62 110.62 1w1u n SER 449 Ca 0.17 -2.00 -0.13 0.00 -0.26 0.00 0.00 58.87 56.65 1w1u n SER 449 Cb 0.67 -0.10 -0.11 0.00 -0.26 0.00 0.00 64.21 64.41 1w1u n SER 449 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1w1u s VAL 450 N -1.00 0.00 -0.20 -3.33 0.11 -1.26 -0.46 120.40 114.26 1w1u s VAL 450 Ca 0.10 -0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.15 1w1u s VAL 450 Cb 0.05 -0.47 0.05 0.00 -1.53 0.00 0.00 36.38 34.48 1w1u s VAL 450 CO 0.07 -0.00 -0.07 -0.44 -3.33 0.00 0.00 175.10 171.32 1w1u s SER 451 N 0.16 3.41 -0.31 3.54 0.01 -0.14 -4.73 113.70 115.64 1w1u s SER 451 Ca -0.00 -0.93 0.04 0.00 1.31 0.00 0.00 55.95 56.36 1w1u s SER 451 Cb -0.02 -1.12 0.17 0.00 0.21 0.00 0.00 66.02 65.26 1w1u s SER 451 CO 0.00 -0.19 0.48 -0.55 0.41 0.00 0.00 173.24 173.39 1w1u s SER 452 N 1.46 -0.29 0.55 2.44 0.15 -1.26 -1.79 113.70 114.96 1w1u s SER 452 Ca -0.02 -0.40 0.26 0.00 0.70 0.00 0.00 55.95 56.48 1w1u s SER 452 Cb -0.17 1.40 1.45 0.00 -1.71 0.00 0.00 66.02 66.98 1w1u s SER 452 CO -0.07 -0.31 2.01 -0.65 1.20 0.00 0.00 173.24 175.42 1w1u h PRO 453 N 7.87 0.00 -0.52 5.44 0.11 -1.72 -0.42 132.00 142.75 1w1u h PRO 453 Ca -0.04 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.07 1w1u h PRO 453 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1w1u h PRO 453 CO 0.21 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.09 1w1u n ASN 454 N -4.20 3.43 0.00 -2.05 3.02 -1.26 -3.45 115.26 110.74 1w1u n ASN 454 Ca 0.08 -1.98 0.00 0.00 -0.03 0.00 0.00 54.58 52.65 1w1u n ASN 454 Cb 0.54 -0.34 0.00 0.00 -0.61 0.00 0.00 39.78 39.37 1w1u n ASN 454 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1w1u n ALA 455 N 1.41 0.00 -0.25 5.41 0.00 -0.70 -4.71 120.51 121.68 1w1u n ALA 455 Ca 0.21 0.00 0.21 0.00 0.00 0.00 0.00 53.44 53.86 1w1u n ALA 455 Cb 0.57 0.00 0.54 0.00 0.00 0.00 0.00 19.45 20.56 1w1u n ALA 455 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1w1u h GLU 456 N 0.00 0.35 -0.33 0.00 3.07 -1.90 -2.16 114.58 113.61 1w1u h GLU 456 Ca 0.00 -0.02 -0.15 0.00 -0.50 0.00 0.00 59.36 58.69 1w1u h GLU 456 Cb 0.00 -0.08 -0.09 0.00 -0.84 0.00 0.00 28.75 27.74 1w1u h GLU 456 CO 0.00 0.23 -0.05 0.25 -1.40 0.00 0.00 179.01 178.04 1w1u n THR 457 N -4.50 2.49 -2.11 1.13 -2.24 -0.25 -4.80 114.28 104.00 1w1u n THR 457 Ca 0.20 -2.55 -0.41 0.00 -2.27 0.00 0.00 64.05 59.01 1w1u n THR 457 Cb 0.75 -0.31 -0.03 0.00 -2.10 0.00 0.00 70.33 68.65 1w1u n THR 457 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1w1u s GLU 458 N -3.16 4.33 -1.14 -0.78 2.12 -0.81 -3.75 118.70 115.51 1w1u s GLU 458 Ca 0.44 2.18 -0.22 0.00 0.36 0.00 0.00 54.97 57.73 1w1u s GLU 458 Cb 0.39 -3.15 -0.00 0.00 0.26 0.00 0.00 34.13 31.63 1w1u s GLU 458 CO 0.02 -0.33 0.79 0.00 -0.54 0.00 0.00 175.26 175.20 1w1u n ALA 459 N 2.38 -2.56 -1.76 6.30 0.00 -1.26 -4.54 120.51 119.06 1w1u n ALA 459 Ca 0.06 -0.27 -0.40 0.00 0.00 0.00 0.00 53.44 52.83 1w1u n ALA 459 Cb 0.41 -4.00 -0.04 0.00 0.00 0.00 0.00 19.45 15.83 1w1u n ALA 459 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1w1u s MET 460 N -6.10 4.53 0.55 0.00 -1.94 -1.25 -4.90 119.30 110.20 1w1u s MET 460 Ca 0.48 1.80 0.27 0.00 -1.71 0.00 0.00 55.69 56.53 1w1u s MET 460 Cb -0.18 -3.08 1.47 0.00 2.01 0.00 0.00 34.83 35.05 1w1u s MET 460 CO 0.87 0.12 1.98 0.07 -0.01 0.00 0.00 175.02 178.05 1w1u h ARG 461 N 3.57 0.00 -0.02 2.03 0.11 -1.92 0.02 114.38 118.18 1w1u h ARG 461 Ca -0.47 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.61 1w1u h ARG 461 Cb 1.21 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.29 1w1u h ARG 461 CO 0.66 0.00 -0.13 -0.40 0.10 0.00 0.00 179.97 180.20 1w1u n ASP 462 N -4.11 1.88 0.00 0.08 5.75 -1.26 -4.94 116.55 113.95 1w1u n ASP 462 Ca 0.09 -1.51 0.00 0.00 -0.01 0.00 0.00 54.79 53.36 1w1u n ASP 462 Cb 0.61 0.10 0.00 0.00 -1.03 0.00 0.00 41.12 40.80 1w1u n ASP 462 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1w1u n GLY 463 N 1.30 0.57 0.03 6.12 0.00 -0.01 -4.94 105.19 108.26 1w1u n GLY 463 Ca 0.15 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1w1u n GLY 463 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1w1u n SER 464 N 0.53 0.07 -0.21 1.61 3.41 -1.26 -4.57 113.62 113.20 1w1u n SER 464 Ca 0.00 -1.89 -0.02 0.00 -0.26 0.00 0.00 58.87 56.70 1w1u n SER 464 Cb 0.00 -0.03 -0.00 0.00 -0.26 0.00 0.00 64.21 63.92 1w1u n SER 464 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1w1u n ASP 465 N -0.46 -0.41 -0.00 4.04 9.92 -1.26 -0.74 116.55 127.64 1w1u n ASP 465 Ca 0.00 0.93 0.14 0.00 -0.53 0.00 0.00 54.79 55.33 1w1u n ASP 465 Cb 0.02 -0.18 0.62 0.00 -0.64 0.00 0.00 41.12 40.93 1w1u n ASP 465 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1w1u n ALA 466 N -3.69 2.42 -1.81 2.24 0.00 -1.26 -4.15 120.51 114.27 1w1u n ALA 466 Ca 0.04 -0.12 -0.42 0.00 0.00 0.00 0.00 53.44 52.93 1w1u n ALA 466 Cb 0.19 -1.45 -0.03 0.00 0.00 0.00 0.00 19.45 18.16 1w1u n ALA 466 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1w1u s VAL 467 N -2.93 3.25 -1.14 0.00 1.01 0.08 -4.86 120.40 115.82 1w1u s VAL 467 Ca 0.16 0.30 0.13 0.00 0.00 0.00 0.00 61.98 62.57 1w1u s VAL 467 Cb 0.19 -3.23 0.37 0.00 0.00 0.00 0.00 36.38 33.71 1w1u s VAL 467 CO 0.53 -0.07 1.31 -1.54 0.00 0.00 0.00 175.10 175.33 1w1u n SER 468 N 8.45 3.12 -0.33 3.32 3.41 -1.26 -4.56 113.62 125.78 1w1u n SER 468 Ca 0.21 -1.99 0.02 0.00 -0.26 0.00 0.00 58.87 56.85 1w1u n SER 468 Cb 0.43 -0.28 0.20 0.00 -0.26 0.00 0.00 64.21 64.30 1w1u n SER 468 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1w1u h ASP 469 N 2.48 0.99 0.02 4.04 3.32 -2.00 -3.21 116.42 122.06 1w1u h ASP 469 Ca 0.00 -0.00 0.03 0.00 0.02 0.00 0.00 57.03 57.08 1w1u h ASP 469 Cb 0.78 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 40.07 1w1u h ASP 469 CO 0.00 0.66 -0.28 -0.50 -1.72 0.00 0.00 179.24 177.40 1w1u h TRP 470 N 1.14 -0.76 -0.43 4.55 4.06 -1.93 -1.20 115.95 121.37 1w1u h TRP 470 Ca 0.38 0.02 -0.01 0.00 2.06 0.00 0.00 58.89 61.35 1w1u h TRP 470 Cb 0.08 0.33 -0.02 0.00 -1.00 0.00 0.00 29.16 28.55 1w1u h TRP 470 CO -0.00 -0.38 0.24 -1.00 -3.56 0.00 0.00 178.44 173.75 1w1u h PRO 471 N -0.44 0.58 -0.47 0.49 0.13 -1.73 0.09 132.00 130.66 1w1u h PRO 471 Ca 0.06 -0.05 -0.04 0.00 -0.87 0.00 0.00 66.00 65.10 1w1u h PRO 471 Cb 0.51 -0.12 -0.02 0.00 0.13 0.00 0.00 31.00 31.50 1w1u h PRO 471 CO -0.23 0.43 0.15 -0.07 -0.23 0.00 0.00 178.00 178.04 1w1u h LEU 472 N 0.59 0.69 -0.86 1.56 4.07 -1.51 -2.26 115.31 117.59 1w1u h LEU 472 Ca 0.16 -0.21 -0.09 0.00 0.08 0.00 0.00 57.88 57.82 1w1u h LEU 472 Cb 0.00 -0.18 -0.02 0.00 1.08 0.00 0.00 40.66 41.55 1w1u h LEU 472 CO -0.03 0.71 -0.13 -0.07 -1.08 0.00 0.00 178.44 177.85 1w1u h LEU 473 N 0.63 0.70 -0.76 1.67 3.38 -0.49 -2.03 115.31 118.41 1w1u h LEU 473 Ca 0.15 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 1w1u h LEU 473 Cb 0.27 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.80 1w1u h LEU 473 CO -0.00 0.85 0.43 -1.13 0.09 0.00 0.00 178.44 178.68 1w1u h ASN 474 N 0.64 0.93 -0.35 -0.43 -0.73 -0.74 0.30 115.58 115.21 1w1u h ASN 474 Ca 0.11 -0.08 -0.09 0.00 1.87 0.00 0.00 56.30 58.11 1w1u h ASN 474 Cb 0.58 -0.24 -0.01 0.00 0.27 0.00 0.00 38.32 38.93 1w1u h ASN 474 CO 0.04 0.75 -0.12 0.00 -0.37 0.00 0.00 177.43 177.72 1w1u h ALA 475 N 1.22 0.49 -0.46 1.57 0.00 -1.23 0.78 119.26 121.63 1w1u h ALA 475 Ca 0.27 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1w1u h ALA 475 Cb 0.01 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1w1u h ALA 475 CO -0.05 0.37 0.21 -0.07 0.00 0.00 0.00 179.25 179.71 1w1u h LEU 476 N 0.49 0.61 -0.52 0.00 4.07 -1.09 -0.94 115.31 117.94 1w1u h LEU 476 Ca 0.09 -0.14 -0.09 0.00 0.08 0.00 0.00 57.88 57.81 1w1u h LEU 476 Cb 0.64 -0.16 -0.02 0.00 1.08 0.00 0.00 40.66 42.20 1w1u h LEU 476 CO 0.04 0.59 -0.03 0.25 -1.08 0.00 0.00 178.44 178.20 1w1u h LEU 477 N 0.60 0.93 -1.23 1.67 5.85 -0.27 -1.53 115.31 121.32 1w1u h LEU 477 Ca 0.16 -0.32 -0.02 0.00 0.84 0.00 0.00 57.88 58.54 1w1u h LEU 477 Cb 0.14 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.89 1w1u h LEU 477 CO -0.02 1.03 0.31 0.78 -0.34 0.00 0.00 178.44 180.20 1w1u h ASN 478 N 0.81 0.75 -0.40 1.25 2.35 -0.65 0.25 115.58 119.94 1w1u h ASN 478 Ca 0.14 -0.06 -0.10 0.00 -0.55 0.00 0.00 56.30 55.73 1w1u h ASN 478 Cb 0.57 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.74 1w1u h ASN 478 CO 0.03 0.62 -0.13 0.74 -1.65 0.00 0.00 177.43 177.05 1w1u h THR 479 N 0.84 1.28 -0.25 2.81 2.02 -0.90 -1.39 112.91 117.32 1w1u h THR 479 Ca 0.21 -1.23 -0.13 0.00 0.77 0.00 0.00 66.41 66.03 1w1u h THR 479 Cb 0.06 1.24 -0.01 0.00 -1.74 0.00 0.00 68.15 67.70 1w1u h THR 479 CO -0.03 0.41 -0.40 0.00 0.37 0.00 0.00 175.52 175.87 1w1u h ALA 480 N 0.83 0.84 0.00 6.16 0.00 -0.72 -3.15 119.26 123.23 1w1u h ALA 480 Ca 0.10 -0.44 -0.12 0.00 0.00 0.00 0.00 54.91 54.45 1w1u h ALA 480 Cb 0.66 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1w1u h ALA 480 CO 0.05 0.64 -0.56 0.78 0.00 0.00 0.00 179.25 180.16 1w1u h GLY 481 N 1.04 0.00 0.00 0.00 0.00 -0.41 -3.48 103.07 100.22 1w1u h GLY 481 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.37 1w1u h GLY 481 CO 0.08 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.23 1w1u n GLY 482 N 0.54 1.84 3.76 4.60 0.00 -0.61 -4.61 105.19 110.72 1w1u n GLY 482 Ca -0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1w1u n GLY 482 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1w1u s ALA 483 N -2.00 2.26 0.16 4.61 0.00 -0.70 -4.83 121.76 121.26 1w1u s ALA 483 Ca 0.00 0.39 -0.04 0.00 0.00 0.00 0.00 51.96 52.31 1w1u s ALA 483 Cb 0.00 -3.30 0.02 0.00 0.00 0.00 0.00 23.12 19.84 1w1u s ALA 483 CO 0.00 -1.71 1.42 1.15 0.00 0.00 0.00 175.76 176.62 1w1u h THR 484 N -0.83 1.35 -2.81 0.00 2.02 -0.92 -3.26 112.91 108.46 1w1u h THR 484 Ca -0.44 -2.06 -0.14 0.00 0.77 0.00 0.00 66.41 64.54 1w1u h THR 484 Cb 1.24 2.03 -0.26 0.00 -1.74 0.00 0.00 68.15 69.42 1w1u h THR 484 CO 0.51 0.63 -0.34 -1.66 0.37 0.00 0.00 175.52 175.03 1w1u s TRP 485 N -3.70 -0.47 0.11 3.16 -2.14 -0.96 -0.42 118.94 114.52 1w1u s TRP 485 Ca -0.07 1.06 0.10 0.00 2.66 0.00 0.00 56.10 59.85 1w1u s TRP 485 Cb 0.10 0.17 -0.04 0.00 -3.10 0.00 0.00 33.47 30.61 1w1u s TRP 485 CO 0.85 -0.26 -0.24 0.08 -2.66 0.00 0.00 176.95 174.72 1w1u s VAL 486 N 0.92 2.39 0.04 -0.66 1.01 -0.88 -2.07 120.40 121.15 1w1u s VAL 486 Ca -0.06 -1.61 -0.02 0.00 0.00 0.00 0.00 61.98 60.30 1w1u s VAL 486 Cb -0.07 -2.05 -0.03 0.00 0.00 0.00 0.00 36.38 34.24 1w1u s VAL 486 CO -0.07 0.16 0.00 -0.94 0.00 0.00 0.00 175.10 174.25 1w1u s SER 487 N -1.90 0.33 -0.19 3.32 1.04 -0.57 -0.74 113.70 114.99 1w1u s SER 487 Ca 0.14 -0.72 -0.02 0.00 0.48 0.00 0.00 55.95 55.83 1w1u s SER 487 Cb -0.10 0.18 0.06 0.00 0.10 0.00 0.00 66.02 66.25 1w1u s SER 487 CO 0.06 -0.48 0.01 -0.76 0.98 0.00 0.00 173.24 173.05 1w1u s LEU 488 N -2.25 1.41 0.31 2.42 1.43 0.77 -1.13 118.68 121.63 1w1u s LEU 488 Ca -0.03 -0.81 0.09 0.00 -1.03 0.00 0.00 54.13 52.35 1w1u s LEU 488 Cb -0.00 -0.71 -0.05 0.00 0.03 0.00 0.00 46.19 45.46 1w1u s LEU 488 CO -0.06 -0.27 0.03 -1.00 0.23 0.00 0.00 176.35 175.28 1w1u s HIS 489 N 1.77 2.64 -0.03 0.29 3.76 -0.10 -1.75 115.29 121.88 1w1u s HIS 489 Ca -0.01 -0.33 0.03 0.00 -0.15 0.00 0.00 55.06 54.60 1w1u s HIS 489 Cb -0.17 -1.39 0.00 0.00 1.11 0.00 0.00 32.58 32.13 1w1u s HIS 489 CO -0.07 0.51 -0.11 -1.58 -0.85 0.00 0.00 174.74 172.63 1w1u s HIS 490 N -2.41 1.15 0.00 1.40 2.46 -1.02 -1.97 115.29 114.90 1w1u s HIS 490 Ca 0.34 -0.30 0.00 0.00 0.47 0.00 0.00 55.06 55.57 1w1u s HIS 490 Cb -0.04 -0.80 0.00 0.00 -0.13 0.00 0.00 32.58 31.61 1w1u s HIS 490 CO 0.20 -0.11 0.00 0.41 -2.47 0.00 0.00 174.74 172.77 1w1u n GLY 491 N 3.24 0.46 3.77 1.59 0.00 -0.01 -4.78 105.19 109.46 1w1u n GLY 491 Ca -0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.44 1w1u n GLY 491 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1w1u s GLY 492 N -2.00 2.95 0.00 -0.02 0.00 -1.26 -0.67 107.32 106.33 1w1u s GLY 492 Ca 0.00 1.24 0.00 0.00 0.00 0.00 0.00 44.72 45.96 1w1u s GLY 492 CO 0.00 1.84 0.00 0.61 0.00 0.00 0.00 173.10 175.55 1w1u n GLY 493 N 0.71 1.97 0.87 0.20 0.00 -1.26 -4.33 105.19 103.36 1w1u n GLY 493 Ca 0.02 -0.17 0.11 0.00 0.00 0.00 0.00 46.02 45.98 1w1u n GLY 493 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1w1u n VAL 494 N 0.00 0.01 0.00 1.61 0.24 -1.25 -4.28 118.33 114.65 1w1u n VAL 494 Ca 0.00 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.80 1w1u n VAL 494 Cb 0.00 1.45 0.00 0.00 -1.47 0.00 0.00 33.84 33.82 1w1u n VAL 494 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1w1u n GLY 495 N 1.23 -0.13 3.56 7.63 0.00 0.16 -4.65 105.19 112.98 1w1u n GLY 495 Ca 0.13 -1.76 -0.53 0.00 0.00 0.00 0.00 46.02 43.86 1w1u n GLY 495 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1w1u n MET 496 N -0.01 0.81 0.00 1.61 0.00 -1.26 -2.37 117.12 115.91 1w1u n MET 496 Ca 0.00 0.29 0.00 0.00 0.00 0.00 0.00 57.70 57.99 1w1u n MET 496 Cb 0.00 -1.86 0.00 0.00 0.00 0.00 0.00 33.22 31.36 1w1u n MET 496 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1w1u n GLY 497 N 2.16 3.14 0.79 3.03 0.00 -1.21 -4.67 105.19 108.43 1w1u n GLY 497 Ca 0.18 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.29 1w1u n GLY 497 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1w1u n PHE 498 N -2.00 0.25 -3.48 1.61 3.72 -1.00 -5.02 117.46 111.55 1w1u n PHE 498 Ca 0.00 -0.18 -0.14 0.00 -0.05 0.00 0.00 57.45 57.08 1w1u n PHE 498 Cb 0.00 -0.01 -0.04 0.00 -0.94 0.00 0.00 39.48 38.50 1w1u n PHE 498 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1w1u s SER 499 N -1.27 -0.57 -0.05 4.37 1.04 -1.26 -4.10 113.70 111.85 1w1u s SER 499 Ca 0.26 0.33 -0.02 0.00 0.48 0.00 0.00 55.95 56.99 1w1u s SER 499 Cb 0.16 0.53 0.03 0.00 0.10 0.00 0.00 66.02 66.84 1w1u s SER 499 CO 0.22 -0.74 0.12 -1.10 0.98 0.00 0.00 173.24 172.73 1w1u s GLN 500 N -2.41 0.07 0.19 4.02 -0.21 -0.74 -0.83 119.66 119.74 1w1u s GLN 500 Ca -0.04 0.31 -0.16 0.00 0.02 0.00 0.00 55.36 55.49 1w1u s GLN 500 Cb -0.01 -0.17 0.02 0.00 1.00 0.00 0.00 33.01 33.86 1w1u s GLN 500 CO -0.02 -0.15 0.49 -3.38 -2.12 0.00 0.00 175.29 170.11 1w1u s HIS 501 N 1.03 -0.07 0.23 0.91 -3.43 -0.83 -0.96 115.29 112.17 1w1u s HIS 501 Ca -0.08 -0.27 0.09 0.00 -0.80 0.00 0.00 55.06 53.99 1w1u s HIS 501 Cb -0.11 0.34 -0.05 0.00 -1.43 0.00 0.00 32.58 31.33 1w1u s HIS 501 CO -0.05 -0.88 -0.15 -1.54 -2.00 0.00 0.00 174.74 170.13 1w1u s SER 502 N -2.88 2.86 0.17 7.38 1.04 0.39 -0.92 113.70 121.74 1w1u s SER 502 Ca 0.10 -1.05 0.04 0.00 0.48 0.00 0.00 55.95 55.52 1w1u s SER 502 Cb -0.00 -0.18 -0.05 0.00 0.10 0.00 0.00 66.02 65.89 1w1u s SER 502 CO -0.03 -0.14 -0.08 -0.83 0.98 0.00 0.00 173.24 173.14 1w1u s GLY 503 N -3.38 1.20 -0.15 7.32 0.00 -0.29 -4.46 107.32 107.56 1w1u s GLY 503 Ca 0.25 -1.57 -0.24 0.00 0.00 0.00 0.00 44.72 43.17 1w1u s GLY 503 CO 0.10 -1.61 0.61 -3.16 0.00 0.00 0.00 173.10 169.03 1w1u s MET 504 N -3.78 0.83 -0.05 2.90 0.23 -1.26 -1.51 119.30 116.67 1w1u s MET 504 Ca 0.20 0.55 -0.03 0.00 -1.03 0.00 0.00 55.69 55.38 1w1u s MET 504 Cb 0.03 0.40 0.02 0.00 -1.53 0.00 0.00 34.83 33.75 1w1u s MET 504 CO 0.03 -0.18 0.11 0.08 -2.03 0.00 0.00 175.02 173.03 1w1u s VAL 505 N -0.36 -0.02 -0.03 5.16 1.01 -0.88 -3.99 120.40 121.29 1w1u s VAL 505 Ca -0.05 0.07 0.03 0.00 0.00 0.00 0.00 61.98 62.03 1w1u s VAL 505 Cb -0.03 -0.18 0.00 0.00 0.00 0.00 0.00 36.38 36.18 1w1u s VAL 505 CO 0.04 0.03 -0.10 -0.51 0.00 0.00 0.00 175.10 174.57 1w1u s ILE 506 N 0.48 0.85 -0.04 2.22 2.07 0.31 -0.18 121.20 126.91 1w1u s ILE 506 Ca -0.04 -0.38 -0.24 0.00 -1.41 0.00 0.00 60.65 58.58 1w1u s ILE 506 Cb -0.05 -0.76 -0.04 0.00 0.13 0.00 0.00 42.46 41.74 1w1u s ILE 506 CO -0.02 0.27 0.74 -0.69 -1.91 0.00 0.00 174.94 173.33 1w1u s VAL 507 N 0.26 4.97 -0.59 4.00 1.01 -1.26 -1.02 120.40 127.77 1w1u s VAL 507 Ca -0.05 1.54 -0.11 0.00 0.00 0.00 0.00 61.98 63.36 1w1u s VAL 507 Cb -0.10 -4.08 0.15 0.00 0.00 0.00 0.00 36.38 32.35 1w1u s VAL 507 CO 0.01 0.27 0.50 0.00 0.00 0.00 0.00 175.10 175.87 1w1u n ASP 509 N 4.59 4.50 0.00 0.00 3.85 -1.26 -2.74 116.55 125.49 1w1u n ASP 509 Ca -0.02 -2.39 0.00 0.00 -0.71 0.00 0.00 54.79 51.67 1w1u n ASP 509 Cb 0.42 -0.54 0.00 0.00 -1.35 0.00 0.00 41.12 39.64 1w1u n ASP 509 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1w1u n GLY 510 N 1.06 2.17 3.87 6.12 0.00 -1.25 -4.72 105.19 112.44 1w1u n GLY 510 Ca 0.24 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.95 1w1u n GLY 510 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1w1u s THR 511 N -3.19 4.69 0.24 2.61 -4.23 -1.26 -4.45 115.64 110.05 1w1u s THR 511 Ca 0.00 0.88 -0.02 0.00 -1.18 0.00 0.00 61.69 61.37 1w1u s THR 511 Cb 0.00 -3.86 0.05 0.00 1.34 0.00 0.00 72.50 70.03 1w1u s THR 511 CO 0.00 -1.14 1.67 0.44 -0.54 0.00 0.00 174.62 175.05 1w1u h ASP 512 N -0.33 0.67 -0.55 3.99 3.32 -1.99 -2.34 116.42 119.20 1w1u h ASP 512 Ca -0.44 -0.23 0.03 0.00 0.02 0.00 0.00 57.03 56.40 1w1u h ASP 512 Cb 1.19 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 40.52 1w1u h ASP 512 CO 0.62 0.88 0.33 -0.33 -1.72 0.00 0.00 179.24 179.02 1w1u h GLU 513 N 0.59 0.62 -0.23 3.56 3.07 -2.00 -1.33 114.58 118.86 1w1u h GLU 513 Ca 0.08 -0.04 -0.00 0.00 -0.50 0.00 0.00 59.36 58.90 1w1u h GLU 513 Cb 0.70 -0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 28.46 1w1u h GLU 513 CO 0.05 0.41 0.12 0.00 -1.40 0.00 0.00 179.01 178.20 1w1u h ALA 514 N 1.25 0.29 -0.79 3.43 0.00 -1.86 -2.07 119.26 119.51 1w1u h ALA 514 Ca 0.22 -0.06 0.11 0.00 0.00 0.00 0.00 54.91 55.18 1w1u h ALA 514 Cb 0.03 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.68 1w1u h ALA 514 CO -0.10 -0.18 0.52 0.00 0.00 0.00 0.00 179.25 179.48 1w1u h ALA 515 N 1.01 1.83 -0.31 0.00 0.00 -0.96 0.49 119.26 121.32 1w1u h ALA 515 Ca 0.08 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1w1u h ALA 515 Cb 0.06 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1w1u h ALA 515 CO -0.01 -0.01 -0.09 1.49 0.00 0.00 0.00 179.25 180.62 1w1u h GLU 516 N 0.66 0.61 -0.32 0.00 4.57 -0.71 -1.46 114.58 117.92 1w1u h GLU 516 Ca 0.37 -0.24 -0.11 0.00 -1.18 0.00 0.00 59.36 58.20 1w1u h GLU 516 Cb 0.55 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.10 1w1u h GLU 516 CO -0.14 0.81 -0.25 0.00 -1.18 0.00 0.00 179.01 178.24 1w1u h ARG 517 N 0.37 0.73 -0.71 1.92 3.08 -0.59 -3.21 114.38 115.97 1w1u h ARG 517 Ca 0.08 -0.36 0.04 0.00 0.07 0.00 0.00 59.98 59.80 1w1u h ARG 517 Cb 0.59 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.60 1w1u h ARG 517 CO 0.03 0.98 0.44 0.82 -1.07 0.00 0.00 179.97 181.17 1w1u h ILE 518 N 0.50 1.07 -0.97 2.04 2.04 0.01 -1.33 117.51 120.86 1w1u h ILE 518 Ca 0.06 -0.29 0.03 0.00 1.00 0.00 0.00 64.86 65.66 1w1u h ILE 518 Cb 0.81 0.16 -0.05 0.00 -0.74 0.00 0.00 36.82 36.99 1w1u h ILE 518 CO 0.07 0.15 0.64 0.00 0.00 0.00 0.00 178.15 179.01 1w1u h ALA 519 N 1.32 1.27 0.13 1.87 0.00 -1.27 -2.22 119.26 120.36 1w1u h ALA 519 Ca 0.29 -0.05 -0.28 0.00 0.00 0.00 0.00 54.91 54.87 1w1u h ALA 519 Cb 0.06 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.49 1w1u h ALA 519 CO -0.12 0.55 -1.42 0.07 0.00 0.00 0.00 179.25 178.33 1w1u h ARG 520 N 1.26 0.28 -0.07 0.00 0.11 -1.54 -3.27 114.38 111.15 1w1u h ARG 520 Ca 0.38 -0.48 -0.08 0.00 0.10 0.00 0.00 59.98 59.89 1w1u h ARG 520 Cb -0.05 0.18 -0.01 0.00 1.11 0.00 0.00 29.97 31.20 1w1u h ARG 520 CO -0.11 1.23 -0.33 -0.39 0.10 0.00 0.00 179.97 180.47 1w1u h VAL 521 N -0.23 1.26 -0.00 0.08 -1.51 -1.27 0.31 116.25 114.89 1w1u h VAL 521 Ca -0.30 -1.26 0.00 0.00 -1.23 0.00 0.00 66.70 63.91 1w1u h VAL 521 Cb 1.82 1.58 0.00 0.00 -2.13 0.00 0.00 31.29 32.56 1w1u h VAL 521 CO 0.09 0.37 -0.09 0.18 -1.23 0.00 0.00 177.57 176.90 1w1u n LEU 522 N -4.11 0.33 -0.12 4.19 4.77 -0.84 -0.68 117.00 120.55 1w1u n LEU 522 Ca -0.01 0.09 -0.25 0.00 -0.03 0.00 0.00 56.01 55.80 1w1u n LEU 522 Cb 0.40 -0.22 -0.11 0.00 -2.33 0.00 0.00 43.42 41.17 1w1u n LEU 522 CO 0.40 0.06 -1.21 0.41 -1.33 0.00 0.00 177.39 175.72 1w1u n THR 523 N -1.07 1.54 -0.10 -5.08 -1.04 -0.92 -3.78 114.28 103.84 1w1u n THR 523 Ca 0.14 -0.39 -0.11 0.00 -2.04 0.00 0.00 64.05 61.65 1w1u n THR 523 Cb 0.27 -1.79 -0.04 0.00 -1.82 0.00 0.00 70.33 66.95 1w1u n THR 523 CO 0.00 0.00 0.00 0.78 -0.64 0.00 0.00 175.07 175.21 1w1u h ASN 524 N -0.69 0.53 0.30 8.00 2.35 -0.36 -1.36 115.58 124.36 1w1u h ASN 524 Ca -0.59 -0.35 0.00 0.00 -0.55 0.00 0.00 56.30 54.81 1w1u h ASN 524 Cb 1.66 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 39.85 1w1u h ASN 524 CO -0.27 0.76 -0.45 -0.78 -1.65 0.00 0.00 177.43 175.03 1w1u h ASP 525 N 0.30 -1.28 0.91 5.81 -0.00 -1.13 0.12 116.42 121.14 1w1u h ASP 525 Ca 0.07 0.12 -0.06 0.00 -0.00 0.00 0.00 57.03 57.17 1w1u h ASP 525 Cb 0.51 0.45 -0.01 0.00 -0.00 0.00 0.00 39.33 40.28 1w1u h ASP 525 CO 0.02 -0.56 -0.29 1.55 -0.00 0.00 0.00 179.24 179.96 1w1u h PRO 526 N -0.81 0.00 -0.95 0.28 0.13 -1.77 -3.14 132.00 125.73 1w1u h PRO 526 Ca -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 1w1u h PRO 526 Cb 0.76 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.84 1w1u h PRO 526 CO -0.15 0.29 0.60 0.78 -0.23 0.00 0.00 178.00 179.29 1w1u h GLY 527 N 2.10 1.36 2.00 1.56 0.00 -0.11 -0.83 103.07 109.15 1w1u h GLY 527 Ca -0.00 -0.54 -0.03 0.00 0.00 0.00 0.00 47.33 46.75 1w1u h GLY 527 CO 0.04 0.52 -0.17 -0.91 0.00 0.00 0.00 176.54 176.03 1w1u h THR 528 N 1.30 1.07 0.02 4.70 1.35 -0.77 0.30 112.91 120.88 1w1u h THR 528 Ca 0.35 -0.57 -0.00 0.00 -0.55 0.00 0.00 66.41 65.63 1w1u h THR 528 Cb -0.10 1.31 0.00 0.00 -1.73 0.00 0.00 68.15 67.63 1w1u h THR 528 CO -0.07 0.16 -0.01 1.23 -0.25 0.00 0.00 175.52 176.58 1w1u h GLY 529 N 0.53 -0.03 0.92 5.82 0.00 -1.26 0.32 103.07 109.38 1w1u h GLY 529 Ca -0.00 0.01 0.02 0.00 0.00 0.00 0.00 47.33 47.35 1w1u h GLY 529 CO 0.02 -0.01 0.24 -2.08 0.00 0.00 0.00 176.54 174.72 1w1u h VAL 530 N -0.51 1.05 -0.29 4.60 2.07 -1.07 -1.20 116.25 120.91 1w1u h VAL 530 Ca -0.00 -0.17 0.06 0.00 0.82 0.00 0.00 66.70 67.41 1w1u h VAL 530 Cb 0.49 0.51 -0.06 0.00 -1.52 0.00 0.00 31.29 30.72 1w1u h VAL 530 CO 0.00 0.09 -0.08 -0.03 0.02 0.00 0.00 177.57 177.57 1w1u h MET 531 N 0.50 -0.02 -0.33 1.57 -1.53 -0.31 0.17 114.93 114.98 1w1u h MET 531 Ca 0.16 0.00 -0.01 0.00 -3.44 0.00 0.00 59.70 56.41 1w1u h MET 531 Cb -0.01 0.00 -0.02 0.00 -0.55 0.00 0.00 31.60 31.03 1w1u h MET 531 CO -0.07 -0.01 0.16 -0.09 0.14 0.00 0.00 176.91 177.05 1w1u h ARG 532 N -0.02 0.44 0.00 0.39 1.12 0.27 -0.62 114.38 115.97 1w1u h ARG 532 Ca 0.14 -0.04 -0.14 0.00 -1.11 0.00 0.00 59.98 58.83 1w1u h ARG 532 Cb 0.23 -0.09 -0.02 0.00 -0.01 0.00 0.00 29.97 30.07 1w1u h ARG 532 CO -0.30 0.34 -1.05 0.45 -3.11 0.00 0.00 179.97 176.30 1w1u h HIS 533 N 0.45 0.00 -0.23 2.20 3.86 -0.74 -3.10 115.15 117.59 1w1u h HIS 533 Ca 0.12 0.00 -0.16 0.00 -1.16 0.00 0.00 60.37 59.17 1w1u h HIS 533 Cb 0.04 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.50 1w1u h HIS 533 CO 0.00 0.54 -0.50 0.00 0.86 0.00 0.00 177.93 178.83 1w1u h ALA 534 N 1.46 0.69 -0.44 2.45 0.00 -0.50 -2.10 119.26 120.81 1w1u h ALA 534 Ca -0.09 -0.49 -0.04 0.00 0.00 0.00 0.00 54.91 54.29 1w1u h ALA 534 Cb 1.50 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.17 1w1u h ALA 534 CO 0.05 0.68 0.12 0.22 0.00 0.00 0.00 179.25 180.32 1w1u h ASP 535 N 0.50 0.61 1.01 0.00 1.82 -1.17 -1.20 116.42 117.99 1w1u h ASP 535 Ca 0.02 -0.09 0.00 0.00 -0.39 0.00 0.00 57.03 56.57 1w1u h ASP 535 Cb 1.05 -0.16 0.00 0.00 0.68 0.00 0.00 39.33 40.90 1w1u h ASP 535 CO 0.10 0.60 0.00 0.00 -1.61 0.00 0.00 179.24 178.33 1w1u h ALA 536 N 1.49 1.00 0.00 -0.78 0.00 -1.40 -3.47 119.26 116.10 1w1u h ALA 536 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1w1u h ALA 536 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1w1u h ALA 536 CO -0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 1w1u n GLY 537 N 0.26 1.01 3.65 0.00 0.00 -0.45 -4.21 105.19 105.45 1w1u n GLY 537 Ca 0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 1w1u n GLY 537 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1w1u s TYR 538 N -2.00 2.45 0.29 1.61 2.02 -0.82 -4.90 117.35 115.99 1w1u s TYR 538 Ca 0.00 0.67 -0.00 0.00 -0.37 0.00 0.00 57.07 57.37 1w1u s TYR 538 Cb 0.00 -3.74 0.49 0.00 -0.40 0.00 0.00 41.96 38.31 1w1u s TYR 538 CO 0.00 -2.57 1.89 -0.44 -1.57 0.00 0.00 175.55 172.87 1w1u h ASP 539 N 9.08 0.96 -0.57 2.29 3.32 -1.94 -1.03 116.42 128.54 1w1u h ASP 539 Ca -0.31 0.01 0.03 0.00 0.02 0.00 0.00 57.03 56.78 1w1u h ASP 539 Cb 1.13 -0.19 -0.04 0.00 0.22 0.00 0.00 39.33 40.45 1w1u h ASP 539 CO 0.97 0.60 0.33 0.40 -1.72 0.00 0.00 179.24 179.83 1w1u h ILE 540 N 1.08 1.04 -0.48 0.35 2.04 -1.92 0.45 117.51 120.08 1w1u h ILE 540 Ca 0.42 -0.22 -0.12 0.00 1.00 0.00 0.00 64.86 65.93 1w1u h ILE 540 Cb 0.22 0.33 -0.01 0.00 -0.74 0.00 0.00 36.82 36.62 1w1u h ILE 540 CO -0.17 0.12 -0.19 0.00 0.00 0.00 0.00 178.15 177.91 1w1u h ALA 541 N 1.26 0.76 -0.54 1.87 0.00 -1.44 -0.52 119.26 120.65 1w1u h ALA 541 Ca 0.23 -0.38 -0.11 0.00 0.00 0.00 0.00 54.91 54.65 1w1u h ALA 541 Cb 0.05 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1w1u h ALA 541 CO -0.11 0.66 -0.10 0.82 0.00 0.00 0.00 179.25 180.52 1w1u h ILE 542 N 0.83 1.27 -0.22 0.00 2.04 -0.86 0.60 117.51 121.17 1w1u h ILE 542 Ca 0.11 -1.25 -0.03 0.00 1.00 0.00 0.00 64.86 64.69 1w1u h ILE 542 Cb 0.75 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 37.77 1w1u h ILE 542 CO 0.06 0.44 0.01 0.44 0.00 0.00 0.00 178.15 179.10 1w1u h ASP 543 N 0.90 0.38 -0.72 1.72 3.32 -0.79 -1.89 116.42 119.34 1w1u h ASP 543 Ca 0.14 -0.30 0.01 0.00 0.02 0.00 0.00 57.03 56.90 1w1u h ASP 543 Cb 0.66 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 40.07 1w1u h ASP 543 CO 0.05 0.58 0.48 0.00 -1.72 0.00 0.00 179.24 178.63 1w1u h ALA 545 N 1.27 0.62 -0.14 0.00 0.00 -0.72 -1.15 119.26 119.14 1w1u h ALA 545 Ca 0.27 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 1w1u h ALA 545 Cb -0.10 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1w1u h ALA 545 CO -0.06 -0.13 0.02 0.87 0.00 0.00 0.00 179.25 179.95 1w1u h LYS 546 N 0.46 0.23 -0.81 0.00 1.79 -0.82 0.94 116.57 118.36 1w1u h LYS 546 Ca 0.22 -0.06 -0.00 0.00 -2.18 0.00 0.00 60.65 58.62 1w1u h LYS 546 Cb 0.15 -0.03 -0.04 0.00 -1.58 0.00 0.00 32.23 30.74 1w1u h LYS 546 CO -0.17 0.43 0.50 0.93 -1.08 0.00 0.00 179.45 180.05 1w1u h GLU 547 N 0.01 1.09 -0.00 3.15 5.08 -0.88 -1.42 114.58 121.60 1w1u h GLU 547 Ca 0.04 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1w1u h GLU 547 Cb 0.31 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.33 1w1u h GLU 547 CO 0.00 0.76 -0.11 1.04 -1.00 0.00 0.00 179.01 179.70 1w1u n GLN 548 N -4.38 0.22 -2.60 2.33 1.13 -0.46 -4.95 117.38 108.67 1w1u n GLN 548 Ca 0.09 -0.05 -0.08 0.00 -1.94 0.00 0.00 57.00 55.01 1w1u n GLN 548 Cb 0.06 -1.50 0.02 0.00 0.11 0.00 0.00 30.24 28.92 1w1u n GLN 548 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1w1u n GLY 549 N 1.42 0.26 3.77 1.08 0.00 -0.54 -5.01 105.19 106.18 1w1u n GLY 549 Ca 0.10 -0.43 -0.37 0.00 0.00 0.00 0.00 46.02 45.32 1w1u n GLY 549 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1w1u s LEU 550 N -2.89 4.00 -1.06 0.99 1.43 0.22 -4.96 118.68 116.42 1w1u s LEU 550 Ca 0.13 2.22 -0.13 0.00 -1.03 0.00 0.00 54.13 55.32 1w1u s LEU 550 Cb -0.06 -4.28 0.21 0.00 0.03 0.00 0.00 46.19 42.10 1w1u s LEU 550 CO 0.16 -0.86 1.14 -0.62 0.23 0.00 0.00 176.35 176.40 1w1u s ASP 551 N -1.47 7.04 -0.77 2.29 -1.08 -1.26 -4.83 116.67 116.58 1w1u s ASP 551 Ca 0.64 -3.01 -0.12 0.00 -0.52 0.00 0.00 52.55 49.53 1w1u s ASP 551 Cb -0.26 -2.29 0.20 0.00 -1.46 0.00 0.00 42.92 39.11 1w1u s ASP 551 CO 0.32 -0.59 0.69 -0.76 0.52 0.00 0.00 175.17 175.35 1w1u s LEU 552 N 0.42 6.43 0.15 -1.34 1.43 -1.26 -4.96 118.68 119.55 1w1u s LEU 552 Ca 0.32 -2.69 -0.04 0.00 -1.03 0.00 0.00 54.13 50.70 1w1u s LEU 552 Cb -0.07 -2.14 0.26 0.00 0.03 0.00 0.00 46.19 44.27 1w1u s LEU 552 CO -0.06 -0.54 0.82 -2.65 0.23 0.00 0.00 176.35 174.15 1w1u n PRO 553 N 3.93 -0.05 -2.09 1.29 -0.02 -1.26 -4.50 135.00 132.30 1w1u n PRO 553 Ca 0.11 0.82 -0.25 0.00 -2.02 0.00 0.00 63.50 62.17 1w1u n PRO 553 Cb 0.45 -1.23 0.15 0.00 -0.02 0.00 0.00 33.50 32.85 1w1u n PRO 553 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 1w1u n MET 554 N -4.83 -0.67 0.00 -0.52 2.81 -1.26 -5.31 117.12 107.33 1w1u n MET 554 Ca 0.09 -2.22 0.00 0.00 -1.81 0.00 0.00 57.70 53.76 1w1u n MET 554 Cb 0.28 -0.96 0.00 0.00 -0.71 0.00 0.00 33.22 31.82 1w1u n MET 554 CO 0.00 0.00 0.00 1.51 1.51 0.00 0.00 175.97 178.99