#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 0.96 -4.22 1.20 4.05 -1.26 -0.56 115.26 115.43 1w1u n ASN 6 Ca 0.00 -0.48 -0.31 0.00 0.45 0.00 0.00 54.58 54.25 1w1u n ASN 6 Cb 0.00 1.04 -0.17 0.00 1.23 0.00 0.00 39.78 41.88 1w1u n ASN 6 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 177.26 173.74 1w1u s TYR 7 N -1.56 2.34 -0.12 1.20 5.04 -1.26 -4.25 117.35 118.74 1w1u s TYR 7 Ca 0.01 -0.81 -0.04 0.00 -2.44 0.00 0.00 57.07 53.79 1w1u s TYR 7 Cb 0.03 -1.56 0.06 0.00 0.35 0.00 0.00 41.96 40.84 1w1u s TYR 7 CO 0.17 -0.29 0.21 0.50 -1.34 0.00 0.00 175.55 174.79 1w1u s ARG 8 N 0.10 0.10 -1.02 4.97 3.52 -0.51 -5.03 118.95 121.07 1w1u s ARG 8 Ca -0.10 0.59 -0.18 0.00 -0.13 0.00 0.00 55.73 55.91 1w1u s ARG 8 Cb -0.15 -0.30 -0.09 0.00 -1.56 0.00 0.00 34.95 32.85 1w1u s ARG 8 CO 0.06 -0.34 2.06 -3.47 -0.81 0.00 0.00 175.30 172.79 1w1u n ASP 9 N 5.34 3.22 -4.06 -2.12 4.64 -1.26 -4.62 116.55 117.69 1w1u n ASP 9 Ca -0.05 -2.71 -0.09 0.00 -1.38 0.00 0.00 54.79 50.56 1w1u n ASP 9 Cb 0.50 -1.30 -0.09 0.00 -1.04 0.00 0.00 41.12 39.19 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 4.27 0.15 -0.24 5.18 -7.23 -1.26 -5.13 120.40 116.13 1w1u s VAL 10 Ca 0.53 -1.70 -0.05 0.00 -1.81 0.00 0.00 61.98 58.95 1w1u s VAL 10 Cb 0.14 -1.73 -0.01 0.00 0.56 0.00 0.00 36.38 35.35 1w1u s VAL 10 CO 0.04 -0.67 -0.01 -1.61 -0.31 0.00 0.00 175.10 172.55 1w1u s GLU 11 N -3.96 3.32 -0.11 4.82 2.02 -1.26 -4.71 118.70 118.82 1w1u s GLU 11 Ca 0.14 -0.68 -0.03 0.00 0.02 0.00 0.00 54.97 54.43 1w1u s GLU 11 Cb 0.07 -3.12 -0.03 0.00 0.10 0.00 0.00 34.13 31.14 1w1u s GLU 11 CO -0.05 -0.26 0.01 0.42 0.02 0.00 0.00 175.26 175.41 1w1u s ILE 12 N 1.49 4.41 -0.10 -1.63 -1.09 -1.26 -5.03 121.20 117.98 1w1u s ILE 12 Ca 0.05 -0.20 -0.10 0.00 -2.23 0.00 0.00 60.65 58.16 1w1u s ILE 12 Cb -0.15 -2.88 0.03 0.00 -1.58 0.00 0.00 42.46 37.88 1w1u s ILE 12 CO -0.01 0.58 0.29 0.00 -1.23 0.00 0.00 174.94 174.56 1w1u s ARG 13 N -0.62 0.36 0.26 2.79 1.70 -1.26 -3.13 118.95 119.04 1w1u s ARG 13 Ca 0.10 0.35 -0.30 0.00 -0.47 0.00 0.00 55.73 55.42 1w1u s ARG 13 Cb -0.12 0.17 -0.14 0.00 -0.57 0.00 0.00 34.95 34.29 1w1u s ARG 13 CO 0.02 -0.05 1.12 0.00 -1.08 0.00 0.00 175.30 175.32 1w1u n ALA 14 N 2.80 -0.06 -0.76 7.88 0.00 -1.26 -4.85 120.51 124.25 1w1u n ALA 14 Ca -0.14 0.41 -0.31 0.00 0.00 0.00 0.00 53.44 53.40 1w1u n ALA 14 Cb 0.58 -2.07 0.16 0.00 0.00 0.00 0.00 19.45 18.11 1w1u n ALA 14 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1w1u s PRO 15 N -1.13 1.13 0.47 0.00 0.02 -1.26 -5.00 135.00 129.22 1w1u s PRO 15 Ca 0.63 1.56 0.02 0.00 0.02 0.00 0.00 61.00 63.23 1w1u s PRO 15 Cb -0.72 -1.74 -0.02 0.00 0.02 0.00 0.00 34.50 32.04 1w1u s PRO 15 CO 0.57 -2.55 0.04 1.03 -0.33 0.00 0.00 177.00 175.76 1w1u s ARG 16 N -4.61 2.08 2.45 5.54 3.00 -1.26 -4.92 118.95 121.22 1w1u s ARG 16 Ca 0.67 -2.30 0.00 0.00 0.00 0.00 0.00 55.73 54.10 1w1u s ARG 16 Cb -0.23 -1.25 0.00 0.00 0.00 0.00 0.00 34.95 33.47 1w1u s ARG 16 CO 0.57 -0.37 0.00 0.41 0.00 0.00 0.00 175.30 175.92 1w1u n GLY 17 N -1.12 -0.26 0.36 -3.53 0.00 -0.93 -4.29 105.19 95.42 1w1u n GLY 17 Ca -0.14 -1.05 0.11 0.00 0.00 0.00 0.00 46.02 44.95 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 -1.68 1.64 -4.72 1.61 5.03 -1.26 -4.59 115.26 111.29 1w1u n ASN 18 Ca 0.00 -1.28 -0.42 0.00 0.87 0.00 0.00 54.58 53.75 1w1u n ASN 18 Cb 0.00 0.47 -0.03 0.00 -1.02 0.00 0.00 39.78 39.20 1w1u n ASN 18 CO 0.00 0.00 0.00 -0.75 -1.83 0.00 0.00 177.26 174.68 1w1u s LYS 19 N -2.57 4.42 -0.05 3.52 2.36 -1.26 -5.01 119.74 121.15 1w1u s LYS 19 Ca 0.18 1.91 -0.08 0.00 -2.55 0.00 0.00 55.97 55.42 1w1u s LYS 19 Cb 0.18 -3.27 -0.05 0.00 -1.05 0.00 0.00 37.83 33.64 1w1u s LYS 19 CO 0.61 -0.25 0.24 -0.51 1.55 0.00 0.00 175.35 176.99 1w1u s LEU 20 N 0.54 4.40 -0.23 5.43 1.43 -1.26 -4.91 118.68 124.08 1w1u s LEU 20 Ca 0.58 0.61 0.02 0.00 -1.03 0.00 0.00 54.13 54.31 1w1u s LEU 20 Cb -0.33 -2.40 -0.16 0.00 0.03 0.00 0.00 46.19 43.34 1w1u s LEU 20 CO 0.33 0.34 -0.20 0.41 0.23 0.00 0.00 176.35 177.46 1w1u n THR 21 N 1.63 1.34 -1.81 5.49 -1.04 -1.26 -4.98 114.28 113.67 1w1u n THR 21 Ca -0.16 -0.53 -0.24 0.00 -2.04 0.00 0.00 64.05 61.08 1w1u n THR 21 Cb 0.54 -1.30 0.17 0.00 -1.82 0.00 0.00 70.33 67.92 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 -3.16 -1.22 0.35 2.41 0.00 -1.26 -4.92 120.51 112.71 1w1u n ALA 22 Ca -0.41 -1.46 0.13 0.00 0.00 0.00 0.00 53.44 51.70 1w1u n ALA 22 Cb 0.95 -0.06 0.27 0.00 0.00 0.00 0.00 19.45 20.62 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 -2.92 0.00 1.57 -1.81 -3.47 116.57 109.93 1w1u h LYS 23 Ca -0.36 0.00 0.08 0.00 -1.87 0.00 0.00 60.65 58.50 1w1u h LYS 23 Cb 0.99 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.24 1w1u h LYS 23 CO 0.26 0.00 0.26 -1.54 -0.57 0.00 0.00 179.45 177.85 1w1u s SER 24 N -5.64 -0.27 0.44 0.86 1.04 -1.26 -5.04 113.70 103.83 1w1u s SER 24 Ca 0.08 -0.55 0.13 0.00 0.48 0.00 0.00 55.95 56.09 1w1u s SER 24 Cb 0.07 0.69 0.98 0.00 0.10 0.00 0.00 66.02 67.87 1w1u s SER 24 CO 0.64 -1.27 2.00 -0.50 0.98 0.00 0.00 173.24 175.08 1w1u h TRP 25 N 2.00 0.07 0.00 5.02 4.06 -1.97 0.18 115.95 125.31 1w1u h TRP 25 Ca -0.20 -0.01 -0.04 0.00 2.06 0.00 0.00 58.89 60.70 1w1u h TRP 25 Cb 1.25 -0.02 -0.01 0.00 -1.00 0.00 0.00 29.16 29.38 1w1u h TRP 25 CO 0.41 0.21 -0.21 -0.07 -3.56 0.00 0.00 178.44 175.22 1w1u h LEU 26 N 0.07 0.00 0.00 -4.49 3.38 -1.98 -0.83 115.31 111.45 1w1u h LEU 26 Ca 0.01 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 1w1u h LEU 26 Cb 0.28 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1w1u h LEU 26 CO 0.02 0.21 -1.95 0.35 0.09 0.00 0.00 178.44 177.16 1w1u n THR 27 N -3.82 0.10 0.07 0.22 -2.24 -0.82 -4.27 114.28 103.52 1w1u n THR 27 Ca -0.02 -0.49 -0.09 0.00 -2.27 0.00 0.00 64.05 61.19 1w1u n THR 27 Cb 0.31 -0.00 0.04 0.00 -2.10 0.00 0.00 70.33 68.57 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 0.33 0.37 -0.78 4.57 -0.39 -3.20 114.58 115.47 1w1u h GLU 28 Ca -0.04 -0.28 -0.02 0.00 -1.18 0.00 0.00 59.36 57.84 1w1u h GLU 28 Cb 1.02 0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.67 1w1u h GLU 28 CO 0.00 0.93 -0.18 0.00 -1.18 0.00 0.00 179.01 178.58 1w1u h ALA 29 N 0.99 -0.50 -0.03 2.92 0.00 -1.34 0.89 119.26 122.19 1w1u h ALA 29 Ca -0.03 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 1w1u h ALA 29 Cb 1.32 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 19.29 1w1u h ALA 29 CO 0.12 -0.77 -0.20 -1.00 0.00 0.00 0.00 179.25 177.40 1w1u h PRO 30 N -0.53 0.04 -0.44 0.00 0.13 -1.76 -0.20 132.00 129.25 1w1u h PRO 30 Ca -0.05 -0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 65.02 1w1u h PRO 30 Cb 0.40 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.51 1w1u h PRO 30 CO 0.08 0.25 0.07 1.25 -0.23 0.00 0.00 178.00 179.42 1w1u h LEU 31 N 0.04 0.70 -0.30 1.56 6.46 -1.45 0.16 115.31 122.48 1w1u h LEU 31 Ca 0.01 -0.26 -0.14 0.00 -0.12 0.00 0.00 57.88 57.37 1w1u h LEU 31 Cb 0.39 -0.18 -0.00 0.00 -0.73 0.00 0.00 40.66 40.13 1w1u h LEU 31 CO 0.03 0.78 -0.35 0.03 -0.62 0.00 0.00 178.44 178.31 1w1u h ARG 32 N 0.58 0.77 -0.37 1.25 3.08 -0.26 -2.89 114.38 116.55 1w1u h ARG 32 Ca 0.13 -0.43 -0.10 0.00 0.07 0.00 0.00 59.98 59.66 1w1u h ARG 32 Cb 0.38 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.44 1w1u h ARG 32 CO 0.01 1.05 -0.17 0.52 -1.07 0.00 0.00 179.97 180.31 1w1u h MET 33 N 0.53 0.69 -0.11 0.04 2.86 -0.98 0.26 114.93 118.23 1w1u h MET 33 Ca 0.04 -0.25 0.03 0.00 -2.06 0.00 0.00 59.70 57.47 1w1u h MET 33 Cb 0.93 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 32.51 1w1u h MET 33 CO 0.08 0.82 -0.09 1.25 1.06 0.00 0.00 176.91 180.04 1w1u h LEU 34 N 0.62 -0.28 -0.76 1.22 5.85 -0.93 0.17 115.31 121.19 1w1u h LEU 34 Ca 0.10 0.06 -0.07 0.00 0.84 0.00 0.00 57.88 58.81 1w1u h LEU 34 Cb 0.64 0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.78 1w1u h LEU 34 CO 0.04 -0.12 0.15 0.24 -0.34 0.00 0.00 178.44 178.41 1w1u h MET 35 N -0.11 1.09 -0.84 1.25 2.86 -1.27 -2.57 114.93 115.35 1w1u h MET 35 Ca 0.07 -0.26 0.01 0.00 -2.06 0.00 0.00 59.70 57.46 1w1u h MET 35 Cb 0.21 -0.14 -0.04 0.00 0.06 0.00 0.00 31.60 31.69 1w1u h MET 35 CO -0.17 0.97 0.55 -0.97 1.06 0.00 0.00 176.91 178.35 1w1u h ASN 36 N 1.03 0.96 0.00 1.22 -1.24 0.20 -0.01 115.58 117.73 1w1u h ASN 36 Ca 0.21 -0.03 0.00 0.00 0.71 0.00 0.00 56.30 57.20 1w1u h ASN 36 Cb 0.39 -0.24 0.00 0.00 0.73 0.00 0.00 38.32 39.20 1w1u h ASN 36 CO 0.01 0.70 0.05 0.78 -1.29 0.00 0.00 177.43 177.68 1w1u h ASN 37 N 1.13 0.00 -0.32 1.15 4.21 -0.26 -1.46 115.58 120.04 1w1u h ASN 37 Ca 0.31 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.82 1w1u h ASN 37 Cb -0.13 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.07 1w1u h ASN 37 CO -0.07 0.00 0.00 0.18 -1.29 0.00 0.00 177.43 176.25 1w1u n LEU 38 N -2.90 2.91 -4.76 1.61 4.77 -0.05 -4.08 117.00 114.50 1w1u n LEU 38 Ca -0.03 -2.05 -0.41 0.00 -0.03 0.00 0.00 56.01 53.49 1w1u n LEU 38 Cb 0.11 -0.23 -0.01 0.00 -2.33 0.00 0.00 43.42 40.96 1w1u n LEU 38 CO 0.17 0.71 1.19 -0.62 -1.33 0.00 0.00 177.39 177.51 1w1u s ASP 39 N -1.05 6.43 0.58 -1.43 3.68 -0.55 -4.21 116.67 120.12 1w1u s ASP 39 Ca 0.23 2.91 0.28 0.00 2.13 0.00 0.00 52.55 58.10 1w1u s ASP 39 Cb 0.12 -2.64 1.54 0.00 -1.45 0.00 0.00 42.92 40.49 1w1u s ASP 39 CO 0.14 -0.86 2.00 -0.65 0.13 0.00 0.00 175.17 175.93 1w1u h PRO 40 N 4.45 0.00 0.00 4.34 0.11 -1.90 0.30 132.00 139.31 1w1u h PRO 40 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1w1u h PRO 40 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1w1u h PRO 40 CO 0.75 0.00 -0.50 0.94 -0.21 0.00 0.00 178.00 178.99 1w1u n GLN 41 N -3.85 0.03 -0.06 1.05 7.27 -1.26 -4.56 117.38 115.99 1w1u n GLN 41 Ca 0.06 0.01 -0.10 0.00 0.07 0.00 0.00 57.00 57.03 1w1u n GLN 41 Cb 0.52 -1.52 -0.03 0.00 2.41 0.00 0.00 30.24 31.61 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 -1.56 1.25 -1.47 1.69 0.31 0.93 -4.58 118.33 114.91 1w1u n VAL 42 Ca 0.05 0.07 -0.31 0.00 -0.01 0.00 0.00 64.34 64.14 1w1u n VAL 42 Cb 0.35 -1.96 0.06 0.00 -0.91 0.00 0.00 33.84 31.38 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 -2.49 2.54 0.00 3.52 0.00 -0.40 -4.54 121.76 120.39 1w1u s ALA 43 Ca -0.21 0.15 0.04 0.00 0.00 0.00 0.00 51.96 51.94 1w1u s ALA 43 Cb 0.05 -3.21 -0.25 0.00 0.00 0.00 0.00 23.12 19.71 1w1u s ALA 43 CO 0.29 -1.40 0.85 0.93 0.00 0.00 0.00 175.76 176.43 1w1u h GLU 44 N -0.85 0.12 -0.37 0.00 4.39 -1.21 -3.42 114.58 113.24 1w1u h GLU 44 Ca -0.44 -0.21 -0.28 0.00 0.34 0.00 0.00 59.36 58.77 1w1u h GLU 44 Cb 1.22 0.08 -0.19 0.00 -0.10 0.00 0.00 28.75 29.75 1w1u h GLU 44 CO 0.55 0.90 -0.59 -1.71 -1.16 0.00 0.00 179.01 177.00 1w1u n ASN 45 N -3.31 -2.04 -0.01 1.42 5.15 -0.77 -5.03 115.26 110.68 1w1u n ASN 45 Ca -0.14 -3.40 0.13 0.00 -0.60 0.00 0.00 54.58 50.57 1w1u n ASN 45 Cb 1.02 1.43 0.56 0.00 -0.53 0.00 0.00 39.78 42.26 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 3.47 0.25 0.00 1.20 0.13 -1.78 -1.36 132.00 133.92 1w1u h PRO 46 Ca -0.08 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 65.03 1w1u h PRO 46 Cb 1.04 -0.06 -0.00 0.00 0.13 0.00 0.00 31.00 32.11 1w1u h PRO 46 CO 0.27 0.17 -0.02 0.87 -0.23 0.00 0.00 178.00 179.06 1w1u h LYS 47 N 0.26 0.00 -0.30 0.86 1.57 -1.84 0.26 116.57 117.38 1w1u h LYS 47 Ca 0.22 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.00 1w1u h LYS 47 Cb 0.53 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.84 1w1u h LYS 47 CO -0.05 0.02 0.00 0.39 -0.57 0.00 0.00 179.45 179.24 1w1u n GLU 48 N -3.32 3.16 -0.76 3.15 1.02 -0.76 -1.43 120.64 121.69 1w1u n GLU 48 Ca -0.02 -2.89 0.00 0.00 -0.02 0.00 0.00 57.16 54.22 1w1u n GLU 48 Cb 0.12 -1.90 0.00 0.00 -0.02 0.00 0.00 31.44 29.64 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 -0.38 0.81 -4.68 -4.62 4.77 0.90 -4.92 117.00 108.89 1w1u n LEU 49 Ca 0.22 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.78 1w1u n LEU 49 Cb 0.94 -1.60 -0.02 0.00 -2.33 0.00 0.00 43.42 40.41 1w1u n LEU 49 CO 0.18 -0.58 0.94 -0.69 -1.33 0.00 0.00 177.39 175.91 1w1u s VAL 50 N -1.41 4.47 -0.23 4.08 1.01 -0.58 -2.59 120.40 125.15 1w1u s VAL 50 Ca 0.00 1.77 -0.17 0.00 0.00 0.00 0.00 61.98 63.58 1w1u s VAL 50 Cb 0.00 -4.14 -0.14 0.00 0.00 0.00 0.00 36.38 32.10 1w1u s VAL 50 CO 0.00 -0.07 -0.09 0.52 0.00 0.00 0.00 175.10 175.46 1w1u n VAL 51 N 4.93 1.52 -3.98 2.92 0.31 0.76 -1.86 118.33 122.93 1w1u n VAL 51 Ca 0.11 -0.13 0.02 0.00 -0.01 0.00 0.00 64.34 64.33 1w1u n VAL 51 Cb 0.46 -2.04 0.01 0.00 -0.91 0.00 0.00 33.84 31.37 1w1u n VAL 51 CO 0.00 0.00 0.00 -0.72 -1.32 0.00 0.00 176.83 174.79 1w1u s TYR 52 N -2.45 0.03 -0.94 3.52 1.13 -1.21 -1.25 117.35 116.19 1w1u s TYR 52 Ca -0.31 -0.20 -0.08 0.00 -1.41 0.00 0.00 57.07 55.07 1w1u s TYR 52 Cb 0.09 0.58 -0.02 0.00 -1.10 0.00 0.00 41.96 41.52 1w1u s TYR 52 CO 0.50 -0.38 0.76 0.41 -2.51 0.00 0.00 175.55 174.33 1w1u n GLY 53 N -0.88 -1.16 7.00 5.49 0.00 -1.26 -2.04 105.19 112.34 1w1u n GLY 53 Ca 0.03 0.51 0.00 0.00 0.00 0.00 0.00 46.02 46.56 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 -1.62 2.44 2.49 -0.02 0.00 -1.26 -3.44 105.19 103.78 1w1u n GLY 54 Ca -0.09 -0.37 -0.34 0.00 0.00 0.00 0.00 46.02 45.21 1w1u n GLY 54 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1w1u n ILE 55 N 0.00 3.32 -2.37 -0.61 0.13 -1.26 -4.90 119.36 113.67 1w1u n ILE 55 Ca 0.00 -3.78 -0.43 0.00 -1.10 0.00 0.00 62.75 57.44 1w1u n ILE 55 Cb 0.00 -1.19 -0.02 0.00 -0.84 0.00 0.00 39.64 37.58 1w1u n ILE 55 CO 0.00 0.00 0.00 -0.83 2.80 0.00 0.00 176.55 178.52 1w1u s GLY 56 N -2.05 1.44 0.22 4.50 0.00 -0.87 -4.39 107.32 106.17 1w1u s GLY 56 Ca 0.57 0.27 0.09 0.00 0.00 0.00 0.00 44.72 45.65 1w1u s GLY 56 CO -0.15 2.63 -0.02 0.50 0.00 0.00 0.00 173.10 176.05 1w1u s ARG 57 N 4.05 2.28 0.20 2.90 0.52 0.60 -0.17 118.95 129.32 1w1u s ARG 57 Ca 0.58 -1.29 0.17 0.00 -0.52 0.00 0.00 55.73 54.67 1w1u s ARG 57 Cb -0.20 -2.22 -0.00 0.00 0.52 0.00 0.00 34.95 33.05 1w1u s ARG 57 CO 0.22 0.41 1.16 0.00 0.02 0.00 0.00 175.30 177.10 1w1u h ALA 58 N 2.34 0.67 -2.74 2.13 0.00 -1.62 -2.60 119.26 117.44 1w1u h ALA 58 Ca -0.46 -0.52 -0.05 0.00 0.00 0.00 0.00 54.91 53.88 1w1u h ALA 58 Cb 1.23 0.08 -0.13 0.00 0.00 0.00 0.00 17.79 18.96 1w1u h ALA 58 CO 0.58 0.61 -0.10 0.00 0.00 0.00 0.00 179.25 180.35 1w1u s ALA 59 N -3.02 -0.86 0.20 0.00 0.00 -1.26 -4.74 121.76 112.08 1w1u s ALA 59 Ca 0.01 -0.10 -0.09 0.00 0.00 0.00 0.00 51.96 51.77 1w1u s ALA 59 Cb 0.08 0.68 0.14 0.00 0.00 0.00 0.00 23.12 24.01 1w1u s ALA 59 CO 0.77 -0.63 1.78 -0.09 0.00 0.00 0.00 175.76 177.59 1w1u h ARG 60 N 2.40 1.09 -2.63 0.00 2.43 -1.50 -3.47 114.38 112.70 1w1u h ARG 60 Ca -0.34 -0.18 0.11 0.00 -0.81 0.00 0.00 59.98 58.76 1w1u h ARG 60 Cb 1.25 -0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 30.57 1w1u h ARG 60 CO 0.48 0.88 0.44 0.54 -1.51 0.00 0.00 179.97 180.79 1w1u s ASN 61 N -6.23 -0.08 0.40 -3.80 2.20 -1.26 -4.95 114.94 101.21 1w1u s ASN 61 Ca -0.13 -0.69 0.14 0.00 -0.94 0.00 0.00 52.86 51.24 1w1u s ASN 61 Cb 0.15 0.61 0.82 0.00 -2.00 0.00 0.00 41.25 40.82 1w1u s ASN 61 CO 0.82 -1.17 1.87 -0.50 -2.94 0.00 0.00 177.10 175.18 1w1u h TRP 62 N 2.00 0.00 -0.14 1.54 4.06 -1.15 -0.30 115.95 121.96 1w1u h TRP 62 Ca -0.27 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 60.67 1w1u h TRP 62 Cb 1.23 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.39 1w1u h TRP 62 CO 0.95 0.32 0.02 1.49 -3.56 0.00 0.00 178.44 177.66 1w1u h GLU 63 N 0.00 0.24 0.00 0.49 4.81 -1.98 -1.84 114.58 116.30 1w1u h GLU 63 Ca -0.00 -0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 59.11 1w1u h GLU 63 Cb 0.58 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.92 1w1u h GLU 63 CO 0.04 0.42 -0.25 0.00 -0.73 0.00 0.00 179.01 178.49 1w1u h TYR 65 N 0.00 0.09 -0.88 0.00 5.03 -0.73 -1.49 116.97 118.99 1w1u h TYR 65 Ca -0.00 -0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.28 1w1u h TYR 65 Cb 0.58 -0.02 -0.04 0.00 1.55 0.00 0.00 36.73 38.80 1w1u h TYR 65 CO 0.00 0.41 0.52 -0.44 -1.32 0.00 0.00 178.16 177.33 1w1u h ASP 66 N -0.25 1.07 -0.64 -2.11 3.32 -1.10 -1.63 116.42 115.08 1w1u h ASP 66 Ca 0.01 -0.07 -0.07 0.00 0.02 0.00 0.00 57.03 56.92 1w1u h ASP 66 Cb 0.37 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.63 1w1u h ASP 66 CO 0.00 0.83 0.14 0.50 -1.72 0.00 0.00 179.24 178.99 1w1u h LYS 67 N 1.22 1.06 -0.15 3.56 1.63 -1.35 0.13 116.57 122.66 1w1u h LYS 67 Ca 0.31 -0.26 -0.05 0.00 -0.85 0.00 0.00 60.65 59.81 1w1u h LYS 67 Cb -0.03 -0.14 -0.00 0.00 -0.60 0.00 0.00 32.23 31.46 1w1u h LYS 67 CO -0.06 0.95 -0.10 -0.84 -3.45 0.00 0.00 179.45 175.95 1w1u h ILE 68 N 1.00 1.33 -0.74 2.00 3.07 -0.92 0.34 117.51 123.60 1w1u h ILE 68 Ca 0.21 -1.20 0.08 0.00 1.55 0.00 0.00 64.86 65.49 1w1u h ILE 68 Cb 0.39 1.81 -0.06 0.00 -0.27 0.00 0.00 36.82 38.68 1w1u h ILE 68 CO 0.01 0.35 0.41 0.58 -1.05 0.00 0.00 178.15 178.45 1w1u h VAL 69 N -0.03 0.93 0.28 0.16 2.07 -1.10 0.40 116.25 118.95 1w1u h VAL 69 Ca 0.03 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.29 1w1u h VAL 69 Cb 0.60 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.52 1w1u h VAL 69 CO 0.03 0.13 -0.14 -0.08 0.02 0.00 0.00 177.57 177.53 1w1u h GLU 70 N 0.72 -0.36 -0.47 1.57 4.81 -0.61 -1.65 114.58 118.59 1w1u h GLU 70 Ca 0.35 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.59 1w1u h GLU 70 Cb 0.28 0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.72 1w1u h GLU 70 CO -0.22 -0.19 0.25 1.15 -0.73 0.00 0.00 179.01 179.26 1w1u h THR 71 N -0.45 1.17 -0.87 0.32 2.02 -0.32 -1.88 112.91 112.91 1w1u h THR 71 Ca -0.04 -0.45 0.12 0.00 0.77 0.00 0.00 66.41 66.81 1w1u h THR 71 Cb 0.34 0.61 -0.07 0.00 -1.74 0.00 0.00 68.15 67.30 1w1u h THR 71 CO 0.06 0.18 0.56 -0.07 0.37 0.00 0.00 175.52 176.63 1w1u h LEU 72 N 0.62 0.70 -1.40 2.58 4.07 -0.17 -0.12 115.31 121.59 1w1u h LEU 72 Ca 0.16 0.03 -0.04 0.00 0.08 0.00 0.00 57.88 58.11 1w1u h LEU 72 Cb 0.07 -0.11 -0.01 0.00 1.08 0.00 0.00 40.66 41.69 1w1u h LEU 72 CO -0.02 0.39 -0.06 0.74 -1.08 0.00 0.00 178.44 178.41 1w1u h THR 73 N 0.76 1.17 -0.00 0.22 2.02 -0.45 -3.13 112.91 113.49 1w1u h THR 73 Ca 0.42 -0.70 0.00 0.00 0.77 0.00 0.00 66.41 66.90 1w1u h THR 73 Cb 0.56 1.07 0.00 0.00 -1.74 0.00 0.00 68.15 68.05 1w1u h THR 73 CO -0.18 0.23 -0.61 -2.11 0.37 0.00 0.00 175.52 173.22 1w1u n ARG 74 N -4.30 1.65 -1.61 6.66 -4.01 -0.71 -3.56 116.66 110.78 1w1u n ARG 74 Ca 0.00 -0.32 -0.50 0.00 -1.04 0.00 0.00 57.85 55.99 1w1u n ARG 74 Cb 0.24 -1.28 -0.05 0.00 -3.04 0.00 0.00 32.46 28.32 1w1u n ARG 74 CO 0.00 0.00 0.00 -0.11 -3.04 0.00 0.00 177.63 174.48 1w1u n LEU 75 N -0.89 2.00 -4.94 2.89 7.94 -0.14 -4.93 117.00 118.92 1w1u n LEU 75 Ca 0.05 1.11 -0.28 0.00 -1.11 0.00 0.00 56.01 55.78 1w1u n LEU 75 Cb 0.29 -1.25 0.16 0.00 0.53 0.00 0.00 43.42 43.15 1w1u n LEU 75 CO 0.28 -0.88 0.80 -1.61 -1.11 0.00 0.00 177.39 174.87 1w1u s GLU 76 N 0.47 0.97 0.44 1.96 0.41 -1.26 -4.61 118.70 117.09 1w1u s GLU 76 Ca 0.82 -0.52 0.24 0.00 -0.41 0.00 0.00 54.97 55.10 1w1u s GLU 76 Cb -0.87 -1.96 0.89 0.00 -1.78 0.00 0.00 34.13 30.41 1w1u s GLU 76 CO 0.45 -2.14 1.81 0.38 -0.49 0.00 0.00 175.26 175.28 1w1u h ASP 77 N -1.35 0.00 -0.35 -0.19 3.04 -1.98 -3.05 116.42 112.53 1w1u h ASP 77 Ca -0.43 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.36 1w1u h ASP 77 Cb 1.25 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.54 1w1u h ASP 77 CO 0.41 0.21 0.00 -0.90 -2.04 0.00 0.00 179.24 176.92 1w1u n ASP 78 N -3.34 3.60 -4.69 4.15 5.75 -1.26 -3.54 116.55 117.21 1w1u n ASP 78 Ca 0.00 -2.49 -0.31 0.00 -0.01 0.00 0.00 54.79 51.98 1w1u n ASP 78 Cb 0.44 -0.41 -0.08 0.00 -1.03 0.00 0.00 41.12 40.03 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 -1.89 2.67 -0.14 0.11 2.02 -1.16 0.84 118.70 121.17 1w1u s GLU 79 Ca 0.35 -0.73 0.01 0.00 0.02 0.00 0.00 54.97 54.62 1w1u s GLU 79 Cb 0.24 -2.61 0.02 0.00 0.10 0.00 0.00 34.13 31.88 1w1u s GLU 79 CO 0.14 0.58 -0.15 0.99 0.02 0.00 0.00 175.26 176.84 1w1u s THR 80 N -1.23 1.59 0.05 3.63 2.01 0.24 -4.62 115.64 117.32 1w1u s THR 80 Ca 0.24 -0.66 -0.25 0.00 0.31 0.00 0.00 61.69 61.32 1w1u s THR 80 Cb -0.12 -1.48 -0.06 0.00 0.01 0.00 0.00 72.50 70.86 1w1u s THR 80 CO 0.15 0.46 0.76 -0.22 -0.69 0.00 0.00 174.62 175.09 1w1u s LEU 81 N 1.29 4.45 -0.21 4.42 2.96 0.16 -1.55 118.68 130.22 1w1u s LEU 81 Ca 0.01 1.45 -0.07 0.00 -0.22 0.00 0.00 54.13 55.29 1w1u s LEU 81 Cb -0.14 -3.22 -0.04 0.00 0.50 0.00 0.00 46.19 43.29 1w1u s LEU 81 CO -0.08 0.03 0.07 -0.76 -1.32 0.00 0.00 176.35 174.29 1w1u s LEU 82 N -0.11 3.69 -0.21 -0.68 1.43 0.15 -1.05 118.68 121.90 1w1u s LEU 82 Ca 0.38 -0.02 -0.03 0.00 -1.03 0.00 0.00 54.13 53.43 1w1u s LEU 82 Cb -0.21 -1.95 -0.00 0.00 0.03 0.00 0.00 46.19 44.06 1w1u s LEU 82 CO 0.23 0.10 -0.07 -0.69 0.23 0.00 0.00 176.35 176.15 1w1u s VAL 83 N 0.81 3.13 -0.31 -1.59 1.01 -0.14 -1.87 120.40 121.44 1w1u s VAL 83 Ca 0.04 -0.58 -0.04 0.00 0.00 0.00 0.00 61.98 61.40 1w1u s VAL 83 Cb -0.14 -2.41 0.04 0.00 0.00 0.00 0.00 36.38 33.87 1w1u s VAL 83 CO 0.02 0.44 0.03 -1.58 0.00 0.00 0.00 175.10 174.02 1w1u s GLN 84 N 1.44 2.60 -1.42 2.72 -0.44 0.15 -1.49 119.66 123.22 1w1u s GLN 84 Ca 0.06 -1.17 -0.04 0.00 -2.50 0.00 0.00 55.36 51.71 1w1u s GLN 84 Cb -0.14 -3.27 0.00 0.00 -1.64 0.00 0.00 33.01 27.97 1w1u s GLN 84 CO -0.05 -0.59 0.34 0.43 0.50 0.00 0.00 175.29 175.91 1w1u n SER 85 N 4.71 -0.51 -0.58 6.67 7.64 0.50 -0.96 113.62 131.10 1w1u n SER 85 Ca -0.13 -1.11 -0.07 0.00 1.01 0.00 0.00 58.87 58.57 1w1u n SER 85 Cb 0.45 -2.57 -0.02 0.00 -1.01 0.00 0.00 64.21 61.06 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 -2.15 0.68 3.02 0.23 0.00 -1.26 -4.13 105.19 101.58 1w1u n GLY 86 Ca -0.29 -0.71 -0.25 0.00 0.00 0.00 0.00 46.02 44.77 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 -3.05 1.75 -0.96 1.61 2.20 -0.13 -1.67 119.74 119.50 1w1u s LYS 87 Ca 0.00 -0.42 -0.24 0.00 -0.36 0.00 0.00 55.97 54.95 1w1u s LYS 87 Cb 0.00 -1.46 0.04 0.00 -1.51 0.00 0.00 37.83 34.91 1w1u s LYS 87 CO 0.00 0.01 1.43 -1.25 -0.36 0.00 0.00 175.35 175.18 1w1u s PRO 88 N 0.71 3.48 0.18 4.03 0.04 -1.26 0.30 135.00 142.48 1w1u s PRO 88 Ca -0.14 -0.91 0.20 0.00 0.04 0.00 0.00 61.00 60.19 1w1u s PRO 88 Cb -0.16 -5.11 -0.01 0.00 0.04 0.00 0.00 34.50 29.26 1w1u s PRO 88 CO 0.03 -2.22 1.05 -0.39 0.04 0.00 0.00 177.00 175.51 1w1u h VAL 89 N 6.65 0.28 -2.06 -0.36 -1.51 -1.73 -3.49 116.25 114.03 1w1u h VAL 89 Ca 0.10 -1.50 0.12 0.00 -1.23 0.00 0.00 66.70 64.19 1w1u h VAL 89 Cb 1.02 1.84 -0.17 0.00 -2.13 0.00 0.00 31.29 31.85 1w1u h VAL 89 CO 1.39 0.16 0.54 -0.83 -1.23 0.00 0.00 177.57 177.60 1w1u s GLY 90 N -4.52 -0.41 -0.08 5.19 0.00 -1.22 -5.02 107.32 101.25 1w1u s GLY 90 Ca -0.00 1.26 0.01 0.00 0.00 0.00 0.00 44.72 45.98 1w1u s GLY 90 CO 0.78 0.48 -0.09 0.14 0.00 0.00 0.00 173.10 174.42 1w1u s VAL 91 N -2.68 0.99 0.12 1.40 1.01 -1.26 0.33 120.40 120.31 1w1u s VAL 91 Ca 0.04 -0.33 0.06 0.00 0.00 0.00 0.00 61.98 61.76 1w1u s VAL 91 Cb -0.01 -0.97 -0.04 0.00 0.00 0.00 0.00 36.38 35.37 1w1u s VAL 91 CO -0.07 0.34 -0.15 -0.36 0.00 0.00 0.00 175.10 174.87 1w1u s PHE 92 N 1.21 1.44 0.04 5.22 0.40 -0.59 -4.93 117.98 120.77 1w1u s PHE 92 Ca -0.05 -0.53 -0.30 0.00 -0.60 0.00 0.00 56.93 55.45 1w1u s PHE 92 Cb -0.14 -0.76 -0.05 0.00 0.51 0.00 0.00 43.02 42.59 1w1u s PHE 92 CO -0.02 0.16 1.08 0.15 0.70 0.00 0.00 175.22 177.29 1w1u s LYS 93 N -2.56 4.51 0.00 0.44 3.01 -1.26 -0.59 119.74 123.29 1w1u s LYS 93 Ca 0.08 1.59 0.00 0.00 -1.01 0.00 0.00 55.97 56.64 1w1u s LYS 93 Cb -0.06 -3.40 0.00 0.00 -1.01 0.00 0.00 37.83 33.37 1w1u s LYS 93 CO 0.03 -0.13 0.00 2.41 0.51 0.00 0.00 175.35 178.18 1w1u n THR 94 N 3.79 0.00 -3.49 2.17 -1.04 0.25 -4.92 114.28 111.03 1w1u n THR 94 Ca 0.07 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.96 1w1u n THR 94 Cb 0.49 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.96 1w1u n THR 94 CO 0.00 0.00 0.00 -1.38 -0.64 0.00 0.00 175.07 173.05 1w1u s HIS 95 N 2.79 -0.45 0.20 -1.42 -3.43 -1.23 -4.88 115.29 106.86 1w1u s HIS 95 Ca 0.00 0.27 0.30 0.00 -0.80 0.00 0.00 55.06 54.83 1w1u s HIS 95 Cb 0.00 0.45 1.64 0.00 -1.43 0.00 0.00 32.58 33.24 1w1u s HIS 95 CO 0.00 -0.78 1.91 0.66 -2.00 0.00 0.00 174.74 174.53 1w1u h SER 96 N 2.22 0.00 -0.68 7.38 4.64 -1.87 -1.16 113.55 124.08 1w1u h SER 96 Ca -0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 1w1u h SER 96 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1w1u h SER 96 CO 0.41 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.96 1w1u n ASN 97 N -2.59 3.98 -4.83 4.97 3.02 -1.26 -4.91 115.26 113.65 1w1u n ASN 97 Ca -0.02 -2.12 -0.22 0.00 -0.03 0.00 0.00 54.58 52.20 1w1u n ASN 97 Cb 0.10 -0.50 -0.04 0.00 -0.61 0.00 0.00 39.78 38.73 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 -1.28 3.86 0.57 5.41 0.00 -0.44 -3.98 121.76 125.90 1w1u s ALA 98 Ca 0.48 -1.83 -0.20 0.00 0.00 0.00 0.00 51.96 50.41 1w1u s ALA 98 Cb 0.26 -0.95 -0.04 0.00 0.00 0.00 0.00 23.12 22.39 1w1u s ALA 98 CO 0.30 -0.11 1.21 -2.14 0.00 0.00 0.00 175.76 175.02 1w1u s PRO 99 N -4.02 3.13 0.22 0.00 0.02 -1.22 -4.88 135.00 128.26 1w1u s PRO 99 Ca 0.44 1.84 0.13 0.00 0.02 0.00 0.00 61.00 63.43 1w1u s PRO 99 Cb -0.03 -2.03 -0.02 0.00 0.02 0.00 0.00 34.50 32.44 1w1u s PRO 99 CO 0.26 -1.08 1.35 0.00 -0.33 0.00 0.00 177.00 177.20 1w1u h ARG 100 N 1.13 0.00 -3.88 5.54 2.47 -0.67 -3.42 114.38 115.55 1w1u h ARG 100 Ca -0.50 0.00 -0.32 0.00 -1.26 0.00 0.00 59.98 57.90 1w1u h ARG 100 Cb 1.29 0.00 -0.31 0.00 -1.65 0.00 0.00 29.97 29.29 1w1u h ARG 100 CO 0.56 0.59 -0.74 0.08 0.56 0.00 0.00 179.97 181.02 1w1u s VAL 101 N -2.90 0.21 -0.18 2.04 1.01 -1.21 0.39 120.40 119.77 1w1u s VAL 101 Ca 0.03 -0.02 -0.01 0.00 0.00 0.00 0.00 61.98 61.98 1w1u s VAL 101 Cb 0.08 -0.25 -0.00 0.00 0.00 0.00 0.00 36.38 36.21 1w1u s VAL 101 CO 0.77 0.11 -0.12 -0.76 0.00 0.00 0.00 175.10 175.10 1w1u s LEU 102 N 0.53 2.58 -0.12 3.92 1.02 -0.21 -2.31 118.68 124.09 1w1u s LEU 102 Ca -0.05 -0.46 0.02 0.00 0.02 0.00 0.00 54.13 53.66 1w1u s LEU 102 Cb -0.08 -1.61 -0.00 0.00 0.02 0.00 0.00 46.19 44.51 1w1u s LEU 102 CO -0.01 0.05 -0.19 -0.63 0.02 0.00 0.00 176.35 175.58 1w1u s ILE 103 N 1.05 2.46 -0.22 -0.59 1.01 0.82 -0.97 121.20 124.77 1w1u s ILE 103 Ca -0.00 -0.87 -0.02 0.00 0.00 0.00 0.00 60.65 59.75 1w1u s ILE 103 Cb -0.15 -1.99 0.07 0.00 0.01 0.00 0.00 42.46 40.40 1w1u s ILE 103 CO -0.03 0.54 0.03 0.00 0.00 0.00 0.00 174.94 175.49 1w1u s ALA 104 N 0.42 1.20 -0.04 9.38 0.00 -0.56 -0.04 121.76 132.13 1w1u s ALA 104 Ca -0.14 -0.93 0.06 0.00 0.00 0.00 0.00 51.96 50.95 1w1u s ALA 104 Cb -0.17 -1.28 -0.01 0.00 0.00 0.00 0.00 23.12 21.66 1w1u s ALA 104 CO 0.06 -1.26 -0.24 -0.80 0.00 0.00 0.00 175.76 173.53 1w1u s ASN 105 N 1.77 2.86 0.00 0.00 0.01 -0.90 -0.37 114.94 118.30 1w1u s ASN 105 Ca 0.00 -0.46 0.00 0.00 -0.71 0.00 0.00 52.86 51.69 1w1u s ASN 105 Cb -0.17 -0.59 0.00 0.00 0.41 0.00 0.00 41.25 40.89 1w1u s ASN 105 CO -0.11 0.25 0.00 -1.20 -1.51 0.00 0.00 177.10 174.54 1w1u n SER 106 N 2.78 -2.99 -4.69 -1.22 7.64 -1.22 -2.50 113.62 111.42 1w1u n SER 106 Ca -0.17 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.29 1w1u n SER 106 Cb 0.52 -2.03 -0.03 0.00 -1.01 0.00 0.00 64.21 61.66 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 -2.15 6.77 -0.00 6.43 0.01 -1.26 -4.55 114.94 120.20 1w1u s ASN 107 Ca 0.00 2.25 0.04 0.00 -0.71 0.00 0.00 52.86 54.44 1w1u s ASN 107 Cb 0.00 -2.56 -0.01 0.00 0.41 0.00 0.00 41.25 39.08 1w1u s ASN 107 CO 0.00 -0.76 -0.12 -0.76 -1.51 0.00 0.00 177.10 173.95 1w1u s LEU 108 N 2.29 2.05 0.09 0.60 1.43 -1.26 -5.07 118.68 118.81 1w1u s LEU 108 Ca 0.67 -0.26 -0.34 0.00 -1.03 0.00 0.00 54.13 53.17 1w1u s LEU 108 Cb -0.35 -0.60 -0.13 0.00 0.03 0.00 0.00 46.19 45.14 1w1u s LEU 108 CO 0.29 0.12 1.65 0.52 0.23 0.00 0.00 176.35 179.16 1w1u n VAL 109 N 2.62 0.16 -0.16 -1.59 0.31 -1.26 -4.55 118.33 113.85 1w1u n VAL 109 Ca -0.15 -0.03 -0.02 0.00 -0.01 0.00 0.00 64.34 64.13 1w1u n VAL 109 Cb 0.56 -1.60 -0.01 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 4.26 -0.13 0.18 5.55 -0.02 -1.26 0.32 135.00 143.89 1w1u n PRO 110 Ca 0.19 0.60 0.11 0.00 -2.02 0.00 0.00 63.50 62.38 1w1u n PRO 110 Cb 0.29 -0.89 0.60 0.00 -0.02 0.00 0.00 33.50 33.48 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 -0.03 6.00 2.76 -2.04 -0.86 115.15 120.99 1w1u h HIS 111 Ca 0.10 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.27 1w1u h HIS 111 Cb 0.20 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.16 1w1u h HIS 111 CO -0.37 0.00 0.00 0.91 -1.30 0.00 0.00 177.93 177.17 1w1u n TRP 112 N -2.29 0.04 -2.60 5.26 8.01 0.15 -4.91 117.44 121.10 1w1u n TRP 112 Ca -0.01 -0.55 -0.43 0.00 -1.31 0.00 0.00 57.50 55.19 1w1u n TRP 112 Cb 0.08 -0.06 0.00 0.00 -2.01 0.00 0.00 31.31 29.32 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 -0.52 3.73 -2.85 6.99 0.00 -0.33 -4.63 120.51 122.91 1w1u n ALA 113 Ca 0.03 -3.93 -0.10 0.00 0.00 0.00 0.00 53.44 49.44 1w1u n ALA 113 Cb 0.30 -3.50 -0.06 0.00 0.00 0.00 0.00 19.45 16.19 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 3.89 -0.09 0.32 0.00 2.20 -1.26 -3.06 114.94 116.95 1w1u s ASN 114 Ca 0.52 -0.40 0.01 0.00 -0.94 0.00 0.00 52.86 52.05 1w1u s ASN 114 Cb 0.03 0.40 0.56 0.00 -2.00 0.00 0.00 41.25 40.25 1w1u s ASN 114 CO 0.06 -0.76 1.97 -0.50 -2.94 0.00 0.00 177.10 174.93 1w1u h TRP 115 N 2.68 0.93 -0.04 1.54 -0.00 -1.89 -1.46 115.95 117.70 1w1u h TRP 115 Ca -0.33 0.02 0.03 0.00 -0.00 0.00 0.00 58.89 58.61 1w1u h TRP 115 Cb 1.22 -0.31 -0.04 0.00 -0.00 0.00 0.00 29.16 30.04 1w1u h TRP 115 CO 0.39 0.56 -0.16 0.93 -0.00 0.00 0.00 178.44 180.16 1w1u h GLU 116 N 0.97 -0.23 -0.23 0.49 3.07 -1.97 0.46 114.58 117.15 1w1u h GLU 116 Ca 0.30 0.02 -0.14 0.00 -0.50 0.00 0.00 59.36 59.03 1w1u h GLU 116 Cb -0.01 0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 27.94 1w1u h GLU 116 CO -0.08 -0.15 -0.45 1.25 -1.40 0.00 0.00 179.01 178.18 1w1u h HIS 117 N -0.24 0.70 -0.53 4.33 2.76 -1.76 -2.52 115.15 117.89 1w1u h HIS 117 Ca 0.06 -0.22 0.03 0.00 -2.20 0.00 0.00 60.37 58.04 1w1u h HIS 117 Cb 0.33 -0.14 -0.04 0.00 1.55 0.00 0.00 27.41 29.10 1w1u h HIS 117 CO -0.23 0.93 0.31 0.35 -1.30 0.00 0.00 177.93 177.99 1w1u h PHE 118 N 0.47 0.58 -0.84 5.26 3.04 -0.73 -1.74 116.94 122.98 1w1u h PHE 118 Ca 0.03 0.02 -0.03 0.00 3.98 0.00 0.00 57.97 61.97 1w1u h PHE 118 Cb 0.97 -0.18 -0.04 0.00 2.56 0.00 0.00 35.95 39.26 1w1u h PHE 118 CO 0.04 0.32 0.39 -0.91 -2.02 0.00 0.00 178.31 176.14 1w1u h ASN 119 N 0.61 1.11 -0.29 0.41 2.35 0.12 0.17 115.58 120.06 1w1u h ASN 119 Ca 0.22 -0.14 0.02 0.00 -0.55 0.00 0.00 56.30 55.84 1w1u h ASN 119 Cb 0.04 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.10 1w1u h ASN 119 CO -0.10 0.94 0.15 -0.08 -1.65 0.00 0.00 177.43 176.69 1w1u h GLU 120 N 1.20 0.31 -0.73 0.81 4.81 -1.05 0.47 114.58 120.39 1w1u h GLU 120 Ca 0.29 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.44 1w1u h GLU 120 Cb 0.13 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.41 1w1u h GLU 120 CO -0.03 0.21 0.25 -0.07 -0.73 0.00 0.00 179.01 178.63 1w1u h LEU 121 N 0.32 1.06 -0.67 1.64 3.38 -0.86 -2.41 115.31 117.77 1w1u h LEU 121 Ca 0.12 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 1w1u h LEU 121 Cb 0.02 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.46 1w1u h LEU 121 CO -0.07 0.97 0.32 -0.78 0.09 0.00 0.00 178.44 178.98 1w1u h ASP 122 N 1.08 0.87 -0.94 -0.43 1.82 -0.10 0.45 116.42 119.17 1w1u h ASP 122 Ca 0.24 -0.13 -0.00 0.00 -0.39 0.00 0.00 57.03 56.74 1w1u h ASP 122 Cb 0.28 -0.22 -0.05 0.00 0.68 0.00 0.00 39.33 40.02 1w1u h ASP 122 CO -0.01 0.76 0.57 0.00 -1.61 0.00 0.00 179.24 178.95 1w1u h ALA 123 N 1.15 1.20 0.00 -0.78 0.00 -0.66 0.19 119.26 120.36 1w1u h ALA 123 Ca 0.23 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1w1u h ALA 123 Cb 0.12 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 17.53 1w1u h ALA 123 CO -0.03 0.65 0.00 1.63 0.00 0.00 0.00 179.25 181.50 1w1u n LYS 124 N -4.36 0.97 -2.13 0.00 5.02 -0.88 -4.82 118.16 111.95 1w1u n LYS 124 Ca 0.11 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.23 1w1u n LYS 124 Cb 0.06 -1.23 -0.02 0.00 -0.02 0.00 0.00 35.03 33.82 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 0.26 0.11 0.69 0.72 0.00 0.06 -4.92 105.19 102.10 1w1u n GLY 125 Ca 0.00 -0.22 0.06 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.22 3.05 -4.04 0.99 4.32 0.15 -4.99 117.00 114.25 1w1u n LEU 126 Ca -0.19 -2.07 -0.10 0.00 -0.02 0.00 0.00 56.01 53.63 1w1u n LEU 126 Cb 0.62 -0.27 -0.08 0.00 -1.62 0.00 0.00 43.42 42.08 1w1u n LEU 126 CO 0.23 0.74 -0.04 0.00 -1.22 0.00 0.00 177.39 177.09 1w1u s ALA 127 N -1.13 0.29 -0.28 -1.18 0.00 -1.23 -4.79 121.76 113.44 1w1u s ALA 127 Ca 0.26 -1.13 -0.17 0.00 0.00 0.00 0.00 51.96 50.91 1w1u s ALA 127 Cb 0.14 1.04 0.10 0.00 0.00 0.00 0.00 23.12 24.41 1w1u s ALA 127 CO 0.16 -0.67 0.80 1.41 0.00 0.00 0.00 175.76 177.45 1w1u s MET 128 N -4.03 0.61 -0.24 0.00 1.75 -1.26 -4.77 119.30 111.36 1w1u s MET 128 Ca 0.24 1.00 -0.19 0.00 -1.25 0.00 0.00 55.69 55.50 1w1u s MET 128 Cb 0.04 0.15 -0.03 0.00 2.84 0.00 0.00 34.83 37.83 1w1u s MET 128 CO 0.05 -0.12 0.55 -0.47 -0.65 0.00 0.00 175.02 174.39 1w1u s TYR 129 N 1.35 3.31 -2.52 4.11 5.04 -1.26 -3.43 117.35 123.94 1w1u s TYR 129 Ca -0.08 0.74 0.23 0.00 -2.44 0.00 0.00 57.07 55.52 1w1u s TYR 129 Cb -0.05 -2.74 0.56 0.00 0.35 0.00 0.00 41.96 40.09 1w1u s TYR 129 CO -0.16 -0.24 1.47 0.41 -1.34 0.00 0.00 175.55 175.69 1w1u n GLY 130 N 4.16 0.90 7.00 8.97 0.00 -1.26 -0.29 105.19 124.67 1w1u n GLY 130 Ca -0.03 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.40 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 0.92 0.00 -0.04 1.61 1.13 -1.26 -1.42 117.38 118.32 1w1u n GLN 131 Ca 0.17 0.00 -0.07 0.00 -1.94 0.00 0.00 57.00 55.16 1w1u n GLN 131 Cb 0.48 0.00 -0.02 0.00 0.11 0.00 0.00 30.24 30.81 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 0.32 -0.07 -1.09 2.81 -1.26 -4.21 117.12 127.62 1w1u n MET 132 Ca 0.00 0.13 0.08 0.00 -1.81 0.00 0.00 57.70 56.10 1w1u n MET 132 Cb 0.00 -1.06 0.11 0.00 -0.71 0.00 0.00 33.22 31.55 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 -4.02 0.28 0.13 2.03 -2.24 -1.26 -4.24 114.28 104.97 1w1u n THR 133 Ca -0.12 -0.64 -0.12 0.00 -2.27 0.00 0.00 64.05 60.90 1w1u n THR 133 Cb 0.38 1.09 -0.07 0.00 -2.10 0.00 0.00 70.33 69.63 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 2.98 -0.39 -0.00 6.98 0.00 -1.81 -2.77 119.26 124.24 1w1u h ALA 134 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1w1u h ALA 134 Cb 0.69 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1w1u h ALA 134 CO 0.00 -0.46 -0.04 0.41 0.00 0.00 0.00 179.25 179.16 1w1u n GLY 135 N 0.16 -0.93 0.64 0.00 0.00 -0.51 -3.37 105.19 101.18 1w1u n GLY 135 Ca -0.08 -0.24 0.07 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.91 2.58 -3.58 1.61 3.41 -1.23 -4.93 113.62 110.56 1w1u n SER 136 Ca 0.18 -1.77 -0.28 0.00 -0.26 0.00 0.00 58.87 56.75 1w1u n SER 136 Cb 0.22 -0.13 0.05 0.00 -0.26 0.00 0.00 64.21 64.09 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 0.72 -2.04 -2.12 7.33 8.01 -1.06 -4.91 117.44 123.37 1w1u n TRP 137 Ca 0.11 0.54 -0.04 0.00 -1.31 0.00 0.00 57.50 56.80 1w1u n TRP 137 Cb 0.39 -3.59 -0.04 0.00 -2.01 0.00 0.00 31.31 26.05 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 -3.96 0.00 -3.15 -0.99 0.13 -1.14 -4.62 119.36 105.64 1w1u n ILE 138 Ca -0.09 -0.23 -0.39 0.00 -1.10 0.00 0.00 62.75 60.94 1w1u n ILE 138 Cb 0.60 0.59 -0.05 0.00 -0.84 0.00 0.00 39.64 39.93 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 0.00 3.68 -0.24 9.51 5.04 -1.24 -4.82 117.35 129.28 1w1u s TYR 139 Ca 0.08 1.25 0.12 0.00 -2.44 0.00 0.00 57.07 56.08 1w1u s TYR 139 Cb 0.09 -2.67 0.45 0.00 0.35 0.00 0.00 41.96 40.18 1w1u s TYR 139 CO -0.04 0.30 1.19 0.44 -1.34 0.00 0.00 175.55 176.10 1w1u n ILE 140 N 2.88 2.05 -4.09 3.14 -5.35 -1.26 -4.63 119.36 112.10 1w1u n ILE 140 Ca -0.05 -3.48 0.00 0.00 -0.27 0.00 0.00 62.75 58.94 1w1u n ILE 140 Cb 0.51 -0.36 0.00 0.00 -1.74 0.00 0.00 39.64 38.05 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 -0.71 -1.24 0.29 3.28 0.00 -1.26 -3.84 105.19 101.71 1w1u n GLY 141 Ca 0.28 -1.26 0.17 0.00 0.00 0.00 0.00 46.02 45.21 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 0.37 0.00 0.21 1.61 0.02 -1.87 -2.59 113.55 111.30 1w1u h SER 142 Ca 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 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 0.05 -0.06 -0.61 -1.14 0.00 0.00 176.83 175.06 1w1u h GLN 143 N 0.00 0.00 -0.95 3.45 4.15 -1.90 -2.67 115.11 117.19 1w1u h GLN 143 Ca -0.00 0.00 0.08 0.00 0.77 0.00 0.00 58.65 59.50 1w1u h GLN 143 Cb 0.22 0.00 -0.07 0.00 0.21 0.00 0.00 27.48 27.84 1w1u h GLN 143 CO 0.01 0.06 0.60 0.78 -1.93 0.00 0.00 178.83 178.35 1w1u h GLY 144 N 0.48 1.46 0.00 2.39 0.00 -1.63 -3.22 103.07 102.55 1w1u h GLY 144 Ca -0.00 -0.43 -0.02 0.00 0.00 0.00 0.00 47.33 46.88 1w1u h GLY 144 CO 0.01 0.26 -1.87 4.51 0.00 0.00 0.00 176.54 179.45 1w1u n ILE 145 N -4.58 0.09 -0.24 2.60 3.06 -1.13 -4.72 119.36 114.43 1w1u n ILE 145 Ca 0.15 -0.44 0.03 0.00 -2.50 0.00 0.00 62.75 59.99 1w1u n ILE 145 Cb 0.22 0.03 0.13 0.00 0.54 0.00 0.00 39.64 40.56 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 0.38 -0.39 9.51 3.04 -1.48 0.23 116.25 127.54 1w1u h VAL 146 Ca -0.03 -0.03 -0.06 0.00 -1.01 0.00 0.00 66.70 65.57 1w1u h VAL 146 Cb 0.93 0.28 -0.02 0.00 -2.01 0.00 0.00 31.29 30.48 1w1u h VAL 146 CO 0.00 0.02 0.00 -0.61 -1.01 0.00 0.00 177.57 175.97 1w1u h GLN 147 N 0.09 0.61 -0.56 4.17 4.15 -1.85 0.30 115.11 122.02 1w1u h GLN 147 Ca 0.37 -0.14 -0.09 0.00 0.77 0.00 0.00 58.65 59.56 1w1u h GLN 147 Cb 0.62 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 28.21 1w1u h GLN 147 CO -0.63 0.63 0.01 0.78 -1.93 0.00 0.00 178.83 177.68 1w1u h GLY 148 N 0.89 1.07 1.49 2.39 0.00 -1.33 0.49 103.07 108.08 1w1u h GLY 148 Ca 0.12 -0.78 -0.13 0.00 0.00 0.00 0.00 47.33 46.54 1w1u h GLY 148 CO 0.01 0.72 -0.38 -0.84 0.00 0.00 0.00 176.54 176.05 1w1u h THR 149 N 0.88 1.30 0.03 4.70 2.02 -0.73 -1.61 112.91 119.50 1w1u h THR 149 Ca 0.16 -1.53 -0.00 0.00 0.77 0.00 0.00 66.41 65.81 1w1u h THR 149 Cb 0.54 1.52 0.00 0.00 -1.74 0.00 0.00 68.15 68.47 1w1u h THR 149 CO 0.03 0.48 -0.01 0.22 0.37 0.00 0.00 175.52 176.61 1w1u h TYR 150 N 0.47 -0.04 -0.69 3.16 3.20 0.18 -2.13 116.97 121.12 1w1u h TYR 150 Ca 0.04 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.94 1w1u h TYR 150 Cb 0.87 0.01 -0.04 0.00 1.54 0.00 0.00 36.73 39.12 1w1u h TYR 150 CO 0.03 0.13 0.46 0.93 -1.64 0.00 0.00 178.16 178.07 1w1u h GLU 151 N -0.19 0.85 -0.33 1.82 4.39 0.14 0.22 114.58 121.48 1w1u h GLU 151 Ca -0.00 -0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.63 1w1u h GLU 151 Cb 0.18 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.62 1w1u h GLU 151 CO 0.01 0.56 0.13 1.15 -1.16 0.00 0.00 179.01 179.70 1w1u h THR 152 N 0.88 1.18 -0.25 1.13 2.02 -1.06 -0.97 112.91 115.84 1w1u h THR 152 Ca 0.27 -0.56 -0.04 0.00 0.77 0.00 0.00 66.41 66.85 1w1u h THR 152 Cb -0.01 0.94 -0.01 0.00 -1.74 0.00 0.00 68.15 67.33 1w1u h THR 152 CO -0.07 0.20 0.01 -0.26 0.37 0.00 0.00 175.52 175.77 1w1u h PHE 153 N 0.39 0.48 -0.29 3.16 0.04 -0.80 -0.57 116.94 119.34 1w1u h PHE 153 Ca 0.11 -0.08 0.05 0.00 2.80 0.00 0.00 57.97 60.85 1w1u h PHE 153 Cb 0.18 -0.13 -0.05 0.00 2.20 0.00 0.00 35.95 38.16 1w1u h PHE 153 CO -0.00 0.59 -0.01 0.28 -0.60 0.00 0.00 178.31 178.57 1w1u h VAL 154 N 0.23 0.78 -0.65 -0.55 2.07 -0.87 0.75 116.25 118.01 1w1u h VAL 154 Ca 0.07 -0.03 -0.04 0.00 0.82 0.00 0.00 66.70 67.52 1w1u h VAL 154 Cb 0.40 0.69 -0.03 0.00 -1.52 0.00 0.00 31.29 30.83 1w1u h VAL 154 CO 0.01 0.01 0.23 -0.08 0.02 0.00 0.00 177.57 177.76 1w1u h GLU 155 N 0.08 0.98 -0.40 1.57 4.57 -1.09 -0.27 114.58 120.02 1w1u h GLU 155 Ca 0.14 -0.20 -0.03 0.00 -1.18 0.00 0.00 59.36 58.09 1w1u h GLU 155 Cb 0.19 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 28.61 1w1u h GLU 155 CO -0.24 0.85 0.11 0.00 -1.18 0.00 0.00 179.01 178.54 1w1u h ALA 156 N 1.09 1.43 -0.44 2.92 0.00 -0.67 0.19 119.26 123.79 1w1u h ALA 156 Ca 0.21 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 54.84 1w1u h ALA 156 Cb 0.25 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1w1u h ALA 156 CO -0.01 0.42 -0.22 0.78 0.00 0.00 0.00 179.25 180.21 1w1u h GLY 157 N 0.80 1.01 1.41 0.00 0.00 -0.12 0.85 103.07 107.02 1w1u h GLY 157 Ca 0.14 -0.91 -0.09 0.00 0.00 0.00 0.00 47.33 46.46 1w1u h GLY 157 CO -0.00 0.83 -0.13 3.21 0.00 0.00 0.00 176.54 180.45 1w1u h ARG 158 N 0.76 0.70 -0.05 4.80 3.08 -0.43 0.21 114.38 123.45 1w1u h ARG 158 Ca 0.10 -0.23 -0.15 0.00 0.07 0.00 0.00 59.98 59.76 1w1u h ARG 158 Cb 0.80 -0.06 0.01 0.00 0.08 0.00 0.00 29.97 30.80 1w1u h ARG 158 CO 0.07 0.80 -0.56 1.96 -1.07 0.00 0.00 179.97 181.17 1w1u h GLN 159 N 0.64 0.46 0.00 0.04 4.20 -0.81 -3.37 115.11 116.27 1w1u h GLN 159 Ca 0.11 -0.44 -0.28 0.00 0.06 0.00 0.00 58.65 58.10 1w1u h GLN 159 Cb 0.58 0.11 -0.05 0.00 0.30 0.00 0.00 27.48 28.42 1w1u h GLN 159 CO 0.04 1.08 -2.13 0.72 -0.67 0.00 0.00 178.83 177.86 1w1u n HIS 160 N -4.22 0.00 -1.53 2.96 8.25 0.28 -4.74 115.22 116.22 1w1u n HIS 160 Ca -0.09 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.43 1w1u n HIS 160 Cb 0.64 -0.80 0.20 0.00 1.12 0.00 0.00 29.99 31.15 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 -2.58 0.00 0.00 4.41 4.01 0.60 -4.97 117.16 118.63 1w1u n TYR 161 Ca -0.25 -1.42 0.00 0.00 -0.16 0.00 0.00 57.90 56.07 1w1u n TYR 161 Cb 1.00 -0.23 0.00 0.00 -0.31 0.00 0.00 39.34 39.80 1w1u n TYR 161 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1w1u n GLY 162 N -1.15 2.79 0.00 2.72 0.00 -1.06 -4.45 105.19 104.04 1w1u n GLY 162 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 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 -1.99 2.73 0.06 -0.02 0.00 -0.43 -4.85 105.19 100.69 1w1u n GLY 163 Ca 0.00 -0.54 0.12 0.00 0.00 0.00 0.00 46.02 45.60 1w1u n GLY 163 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1w1u n SER 164 N 0.00 0.69 0.00 1.61 2.88 -1.26 -3.83 113.62 113.71 1w1u n SER 164 Ca 0.00 0.06 0.00 0.00 -1.33 0.00 0.00 58.87 57.60 1w1u n SER 164 Cb 0.00 0.39 0.00 0.00 -0.75 0.00 0.00 64.21 63.85 1w1u n SER 164 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1w1u n LEU 165 N -2.16 0.52 -4.68 2.46 4.77 -1.26 -4.50 117.00 112.15 1w1u n LEU 165 Ca 0.02 0.00 -0.46 0.00 -0.03 0.00 0.00 56.01 55.55 1w1u n LEU 165 Cb 0.46 -1.33 -0.04 0.00 -2.33 0.00 0.00 43.42 40.18 1w1u n LEU 165 CO 0.38 -0.45 1.33 1.17 -1.33 0.00 0.00 177.39 178.49 1w1u n LYS 166 N -1.22 2.33 -1.00 3.23 3.00 -1.25 -1.43 118.16 121.80 1w1u n LYS 166 Ca 0.00 0.84 -0.00 0.00 -0.00 0.00 0.00 58.31 59.15 1w1u n LYS 166 Cb 0.19 -2.66 -0.00 0.00 0.00 0.00 0.00 35.03 32.56 1w1u n LYS 166 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1w1u n GLY 167 N 3.84 0.48 3.75 3.14 0.00 -1.26 -5.00 105.19 110.13 1w1u n GLY 167 Ca 0.18 -0.05 -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 -0.15 2.46 0.01 1.61 -0.14 -0.52 -4.74 119.74 118.27 1w1u s LYS 168 Ca 0.00 -1.44 -0.01 0.00 -1.36 0.00 0.00 55.97 53.15 1w1u s LYS 168 Cb 0.00 -2.25 -0.01 0.00 -1.68 0.00 0.00 37.83 33.89 1w1u s LYS 168 CO 0.00 0.17 0.01 1.67 -0.76 0.00 0.00 175.35 176.44 1w1u s TRP 169 N -2.37 0.15 -0.06 3.18 1.48 -1.26 -1.15 118.94 118.92 1w1u s TRP 169 Ca 0.37 -0.31 -0.04 0.00 -1.06 0.00 0.00 56.10 55.06 1w1u s TRP 169 Cb -0.04 -0.11 -0.04 0.00 -1.16 0.00 0.00 33.47 32.12 1w1u s TRP 169 CO 0.23 -0.15 0.11 0.08 -4.06 0.00 0.00 176.95 173.16 1w1u s VAL 170 N -1.03 5.12 -0.15 -0.66 1.01 -0.14 -1.18 120.40 123.37 1w1u s VAL 170 Ca -0.11 -0.09 0.01 0.00 0.00 0.00 0.00 61.98 61.79 1w1u s VAL 170 Cb -0.07 -3.28 0.00 0.00 0.00 0.00 0.00 36.38 33.03 1w1u s VAL 170 CO -0.00 0.49 -0.18 -0.22 0.00 0.00 0.00 175.10 175.19 1w1u s LEU 171 N -1.38 2.34 0.00 3.92 2.96 0.36 -1.45 118.68 125.44 1w1u s LEU 171 Ca 0.19 -0.52 -0.07 0.00 -0.22 0.00 0.00 54.13 53.52 1w1u s LEU 171 Cb -0.12 -1.52 0.03 0.00 0.50 0.00 0.00 46.19 45.08 1w1u s LEU 171 CO 0.09 0.08 0.41 1.07 -1.32 0.00 0.00 176.35 176.69 1w1u n THR 172 N 4.06 0.00 -3.84 3.68 5.66 -0.87 -1.88 114.28 121.09 1w1u n THR 172 Ca -0.19 -0.68 -0.09 0.00 -3.05 0.00 0.00 64.05 60.04 1w1u n THR 172 Cb 0.52 0.58 -0.07 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 -1.77 -0.28 0.00 1.79 0.00 -1.26 -1.77 121.76 118.47 1w1u s ALA 173 Ca 0.11 -0.59 0.00 0.00 0.00 0.00 0.00 51.96 51.48 1w1u s ALA 173 Cb -0.02 0.58 0.00 0.00 0.00 0.00 0.00 23.12 23.68 1w1u s ALA 173 CO 0.08 -0.55 0.00 0.41 0.00 0.00 0.00 175.76 175.70 1w1u n GLY 174 N -0.11 -0.03 2.63 0.00 0.00 0.42 -1.00 105.19 107.10 1w1u n GLY 174 Ca -0.14 -0.80 -0.31 0.00 0.00 0.00 0.00 46.02 44.77 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 5.46 0.00 0.99 4.77 -1.26 -3.82 117.00 123.14 1w1u n LEU 175 Ca 0.00 -5.18 0.00 0.00 -0.03 0.00 0.00 56.01 50.80 1w1u n LEU 175 Cb 0.00 -0.64 0.00 0.00 -2.33 0.00 0.00 43.42 40.45 1w1u n LEU 175 CO 0.00 2.13 0.00 0.61 -1.33 0.00 0.00 177.39 178.80 1w1u n GLY 176 N -0.46 0.84 0.23 -0.72 0.00 -1.26 -4.47 105.19 99.35 1w1u n GLY 176 Ca 0.42 -1.77 -0.14 0.00 0.00 0.00 0.00 46.02 44.53 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 -0.46 0.83 -0.02 0.00 -1.94 0.15 103.07 101.62 1w1u h GLY 177 Ca 0.00 0.21 -0.35 0.00 0.00 0.00 0.00 47.33 47.19 1w1u h GLY 177 CO 0.00 -0.19 -1.83 -0.33 0.00 0.00 0.00 176.54 174.19 1w1u h MET 178 N -0.45 0.27 0.00 4.80 2.86 -1.92 -3.34 114.93 117.15 1w1u h MET 178 Ca -0.02 -0.46 -0.04 0.00 -2.06 0.00 0.00 59.70 57.11 1w1u h MET 178 Cb 0.39 0.17 -0.01 0.00 0.06 0.00 0.00 31.60 32.21 1w1u h MET 178 CO 0.01 1.15 -0.19 0.78 1.06 0.00 0.00 176.91 179.72 1w1u h GLY 179 N 1.33 0.00 2.00 8.32 0.00 -1.76 -2.33 103.07 110.63 1w1u h GLY 179 Ca -0.36 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.97 1w1u h GLY 179 CO 0.12 0.00 0.00 -1.33 0.00 0.00 0.00 176.54 175.33 1w1u h GLY 180 N 0.60 0.00 2.00 4.60 0.00 -0.79 -0.85 103.07 108.63 1w1u h GLY 180 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1w1u h GLY 180 CO 0.02 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.56 1w1u h ALA 181 N 2.01 1.00 0.29 3.60 0.00 -1.61 -3.36 119.26 121.20 1w1u h ALA 181 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1w1u h ALA 181 Cb 0.05 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 1w1u h ALA 181 CO 0.00 0.00 -0.36 1.96 0.00 0.00 0.00 179.25 180.85 1w1u h GLN 182 N 0.00 -0.67 -0.47 0.00 4.20 -1.31 0.15 115.11 117.02 1w1u h GLN 182 Ca 0.00 0.05 0.09 0.00 0.06 0.00 0.00 58.65 58.85 1w1u h GLN 182 Cb 0.92 0.15 -0.08 0.00 0.30 0.00 0.00 27.48 28.77 1w1u h GLN 182 CO 0.00 -0.45 -0.06 -1.00 -0.67 0.00 0.00 178.83 176.65 1w1u h PRO 183 N -0.70 0.05 -0.59 1.46 0.13 -1.76 0.25 132.00 130.84 1w1u h PRO 183 Ca -0.01 -0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.05 1w1u h PRO 183 Cb 0.65 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.75 1w1u h PRO 183 CO -0.11 0.03 0.13 1.25 -0.23 0.00 0.00 178.00 179.08 1w1u h LEU 184 N 0.05 0.92 -0.45 1.56 5.85 -1.09 -1.43 115.31 120.72 1w1u h LEU 184 Ca 0.23 -0.24 0.04 0.00 0.84 0.00 0.00 57.88 58.75 1w1u h LEU 184 Cb 0.35 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.10 1w1u h LEU 184 CO -0.44 0.92 0.22 0.00 -0.34 0.00 0.00 178.44 178.81 1w1u h ALA 185 N 1.03 0.57 0.12 1.25 0.00 -0.38 0.15 119.26 121.99 1w1u h ALA 185 Ca 0.18 0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.13 1w1u h ALA 185 Cb 0.38 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1w1u h ALA 185 CO 0.01 -0.13 -0.23 0.00 0.00 0.00 0.00 179.25 178.89 1w1u h ALA 186 N 1.25 -0.39 -0.39 0.00 0.00 -0.67 -0.53 119.26 118.53 1w1u h ALA 186 Ca 0.20 -0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.15 1w1u h ALA 186 Cb 0.11 0.36 -0.07 0.00 0.00 0.00 0.00 17.79 18.19 1w1u h ALA 186 CO -0.14 -0.76 -0.10 1.15 0.00 0.00 0.00 179.25 179.40 1w1u h THR 187 N -0.43 0.61 0.00 0.00 2.02 -0.61 0.18 112.91 114.69 1w1u h THR 187 Ca 0.03 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.19 1w1u h THR 187 Cb 0.45 0.61 -0.00 0.00 -1.74 0.00 0.00 68.15 67.47 1w1u h THR 187 CO -0.13 0.00 -0.07 -0.07 0.37 0.00 0.00 175.52 175.63 1w1u h LEU 188 N -0.00 0.00 -0.15 2.58 3.38 -0.36 0.12 115.31 120.89 1w1u h LEU 188 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1w1u h LEU 188 Cb 0.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1w1u h LEU 188 CO -0.40 0.07 -0.23 0.00 0.09 0.00 0.00 178.44 177.97 1w1u n ALA 189 N -2.25 2.96 -0.24 1.53 0.00 -0.07 -4.94 120.51 117.51 1w1u n ALA 189 Ca -0.02 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.14 1w1u n ALA 189 Cb 0.18 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.37 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 1.40 0.85 3.66 0.00 0.00 0.43 -4.56 105.19 106.97 1w1u n GLY 190 Ca 0.10 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.05 3.20 0.62 4.61 0.00 -0.65 -3.95 121.76 123.54 1w1u s ALA 191 Ca 0.00 -1.55 -0.03 0.00 0.00 0.00 0.00 51.96 50.37 1w1u s ALA 191 Cb 0.00 -0.88 0.04 0.00 0.00 0.00 0.00 23.12 22.28 1w1u s ALA 191 CO 0.00 0.33 0.90 0.00 0.00 0.00 0.00 175.76 176.98 1w1u s SER 193 N -4.44 -0.68 -0.25 0.00 1.04 -1.02 -0.97 113.70 107.38 1w1u s SER 193 Ca 0.58 0.91 -0.02 0.00 0.48 0.00 0.00 55.95 57.89 1w1u s SER 193 Cb -0.11 0.78 0.02 0.00 0.10 0.00 0.00 66.02 66.82 1w1u s SER 193 CO 0.42 -0.51 -0.05 -0.22 0.98 0.00 0.00 173.24 173.86 1w1u s LEU 194 N -0.78 3.17 -0.30 2.42 2.96 -0.53 0.99 118.68 126.62 1w1u s LEU 194 Ca -0.08 -0.77 0.01 0.00 -0.22 0.00 0.00 54.13 53.06 1w1u s LEU 194 Cb -0.01 -1.69 0.07 0.00 0.50 0.00 0.00 46.19 45.05 1w1u s LEU 194 CO 0.08 -0.11 -0.01 0.20 -1.32 0.00 0.00 176.35 175.18 1w1u s ASN 195 N 1.37 4.75 -0.03 3.68 0.01 0.13 -2.06 114.94 122.79 1w1u s ASN 195 Ca 0.01 -1.54 -0.20 0.00 -0.71 0.00 0.00 52.86 50.42 1w1u s ASN 195 Cb -0.16 -1.65 -0.05 0.00 0.41 0.00 0.00 41.25 39.80 1w1u s ASN 195 CO -0.04 -0.28 0.58 -0.51 -1.51 0.00 0.00 177.10 175.34 1w1u s ILE 196 N 1.13 4.97 -0.03 0.60 -1.16 -0.73 -1.67 121.20 124.32 1w1u s ILE 196 Ca -0.03 1.20 -0.00 0.00 -0.51 0.00 0.00 60.65 61.31 1w1u s ILE 196 Cb -0.20 -3.92 0.03 0.00 0.61 0.00 0.00 42.46 38.99 1w1u s ILE 196 CO -0.04 0.39 0.04 -0.70 -2.81 0.00 0.00 174.94 171.83 1w1u s GLU 197 N 0.01 -0.02 0.41 3.50 2.56 -0.90 -0.44 118.70 123.82 1w1u s GLU 197 Ca 0.31 0.21 0.24 0.00 0.00 0.00 0.00 54.97 55.73 1w1u s GLU 197 Cb -0.18 -0.23 0.51 0.00 2.00 0.00 0.00 34.13 36.23 1w1u s GLU 197 CO 0.16 -0.17 1.67 0.66 -0.56 0.00 0.00 175.26 177.02 1w1u h SER 198 N 7.26 0.00 -3.64 -1.70 4.64 -1.66 -1.57 113.55 116.88 1w1u h SER 198 Ca -0.45 0.00 -0.65 0.00 -0.47 0.00 0.00 61.79 60.21 1w1u h SER 198 Cb 1.12 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 62.99 1w1u h SER 198 CO 0.47 0.00 -0.61 -1.10 -0.87 0.00 0.00 176.83 174.72 1w1u s GLN 199 N -3.23 3.57 0.36 4.77 -0.21 -1.26 -4.67 119.66 118.99 1w1u s GLN 199 Ca 0.07 -0.54 0.04 0.00 0.02 0.00 0.00 55.36 54.95 1w1u s GLN 199 Cb 0.07 -3.36 0.69 0.00 1.00 0.00 0.00 33.01 31.40 1w1u s GLN 199 CO 0.64 -0.24 2.00 0.37 -2.12 0.00 0.00 175.29 175.94 1w1u h GLN 200 N 8.25 0.77 -0.19 2.91 5.75 -2.00 -1.93 115.11 128.67 1w1u h GLN 200 Ca -0.37 -0.05 -0.02 0.00 -0.15 0.00 0.00 58.65 58.06 1w1u h GLN 200 Cb 1.17 -0.17 -0.01 0.00 1.07 0.00 0.00 27.48 29.53 1w1u h GLN 200 CO 0.58 0.51 0.02 0.66 -2.65 0.00 0.00 178.83 177.95 1w1u h SER 201 N 0.80 0.24 -0.17 -0.69 4.64 -1.99 -0.53 113.55 115.85 1w1u h SER 201 Ca 0.26 -0.03 -0.22 0.00 -0.47 0.00 0.00 61.79 61.33 1w1u h SER 201 Cb 0.04 -0.06 0.01 0.00 -0.31 0.00 0.00 62.40 62.07 1w1u h SER 201 CO -0.07 0.28 -0.76 0.03 -0.87 0.00 0.00 176.83 175.45 1w1u h ARG 202 N 0.27 0.81 -0.57 4.77 2.47 -1.67 -1.44 114.38 119.03 1w1u h ARG 202 Ca 0.07 -0.64 -0.01 0.00 -1.26 0.00 0.00 59.98 58.13 1w1u h ARG 202 Cb 0.16 0.13 -0.03 0.00 -1.65 0.00 0.00 29.97 28.58 1w1u h ARG 202 CO 0.00 1.25 0.32 0.82 0.56 0.00 0.00 179.97 182.92 1w1u h ILE 203 N 0.56 1.17 -0.15 2.04 2.04 -1.06 -1.25 117.51 120.86 1w1u h ILE 203 Ca -0.05 -0.41 -0.14 0.00 1.00 0.00 0.00 64.86 65.27 1w1u h ILE 203 Cb 1.38 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.85 1w1u h ILE 203 CO 0.16 0.18 -0.49 0.44 0.00 0.00 0.00 178.15 178.44 1w1u h ASP 204 N 0.78 0.43 -0.12 1.72 3.32 -0.91 -2.03 116.42 119.61 1w1u h ASP 204 Ca 0.20 -0.21 -0.01 0.00 0.02 0.00 0.00 57.03 57.03 1w1u h ASP 204 Cb 0.01 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 39.43 1w1u h ASP 204 CO -0.03 0.85 0.03 0.15 -1.72 0.00 0.00 179.24 178.51 1w1u h PHE 205 N 0.32 0.21 -0.47 4.55 3.04 -0.15 -0.52 116.94 123.92 1w1u h PHE 205 Ca 0.02 -0.03 -0.05 0.00 3.98 0.00 0.00 57.97 61.89 1w1u h PHE 205 Cb 0.98 -0.06 -0.02 0.00 2.56 0.00 0.00 35.95 39.41 1w1u h PHE 205 CO 0.03 0.37 0.09 0.00 -2.02 0.00 0.00 178.31 176.78 1w1u h ARG 206 N -0.01 0.73 -0.15 1.11 -0.00 -1.30 -1.43 114.38 113.33 1w1u h ARG 206 Ca 0.04 -0.15 -0.02 0.00 -0.50 0.00 0.00 59.98 59.35 1w1u h ARG 206 Cb 0.27 -0.11 -0.01 0.00 0.00 0.00 0.00 29.97 30.12 1w1u h ARG 206 CO 0.00 0.68 0.01 -0.07 0.00 0.00 0.00 179.97 180.59 1w1u h LEU 207 N 0.70 0.25 -1.35 3.04 3.38 -1.19 0.24 115.31 120.37 1w1u h LEU 207 Ca 0.15 -0.29 -0.05 0.00 0.09 0.00 0.00 57.88 57.79 1w1u h LEU 207 Cb 0.29 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1w1u h LEU 207 CO 0.00 0.48 -0.05 -0.33 0.09 0.00 0.00 178.44 178.63 1w1u h GLU 208 N 0.01 0.37 -0.10 1.13 5.08 -0.89 -2.23 114.58 117.94 1w1u h GLU 208 Ca 0.04 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1w1u h GLU 208 Cb 0.35 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1w1u h GLU 208 CO 0.01 0.44 0.00 0.25 -1.00 0.00 0.00 179.01 178.70 1w1u n THR 209 N -4.29 0.13 -1.77 1.13 -2.24 -0.56 -4.94 114.28 101.74 1w1u n THR 209 Ca 0.00 -0.29 -0.11 0.00 -2.27 0.00 0.00 64.05 61.38 1w1u n THR 209 Cb 0.24 0.35 -0.03 0.00 -2.10 0.00 0.00 70.33 68.80 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 0.18 -0.86 0.07 -0.78 1.74 -0.67 -4.47 116.66 111.88 1w1u n ARG 210 Ca 0.17 0.73 0.12 0.00 -0.77 0.00 0.00 57.85 58.10 1w1u n ARG 210 Cb 0.32 -4.79 0.06 0.00 -1.02 0.00 0.00 32.46 27.03 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 -3.33 0.69 -4.25 -1.55 4.01 0.75 -4.86 117.16 108.62 1w1u n TYR 211 Ca -0.13 0.20 -0.17 0.00 -0.16 0.00 0.00 57.90 57.64 1w1u n TYR 211 Cb 0.49 -0.76 -0.14 0.00 -0.31 0.00 0.00 39.34 38.62 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 -3.27 0.71 -0.16 -0.72 0.11 -1.17 -1.36 120.40 114.55 1w1u s VAL 212 Ca 0.03 -0.65 -0.23 0.00 -2.93 0.00 0.00 61.98 58.20 1w1u s VAL 212 Cb 0.12 -0.65 -0.20 0.00 -1.53 0.00 0.00 36.38 34.12 1w1u s VAL 212 CO 0.77 0.01 0.46 0.44 -3.33 0.00 0.00 175.10 173.45 1w1u h ASP 213 N 5.39 0.00 -5.39 3.54 3.32 -1.85 -3.40 116.42 118.02 1w1u h ASP 213 Ca -0.33 -0.68 -0.14 0.00 0.02 0.00 0.00 57.03 55.90 1w1u h ASP 213 Cb 1.19 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.62 1w1u h ASP 213 CO 0.46 1.09 -0.31 -1.83 -1.72 0.00 0.00 179.24 176.93 1w1u s GLU 214 N -2.20 1.44 -0.16 3.56 -1.05 -0.97 -5.04 118.70 114.28 1w1u s GLU 214 Ca -0.20 -1.42 0.01 0.00 -0.15 0.00 0.00 54.97 53.21 1w1u s GLU 214 Cb 0.00 0.39 0.02 0.00 -0.44 0.00 0.00 34.13 34.11 1w1u s GLU 214 CO 0.56 -0.55 -0.17 -1.14 0.95 0.00 0.00 175.26 174.90 1w1u s GLN 215 N -4.02 2.66 0.97 -4.83 0.74 -1.26 0.21 119.66 114.13 1w1u s GLN 215 Ca 0.29 -0.70 -0.12 0.00 0.05 0.00 0.00 55.36 54.88 1w1u s GLN 215 Cb 0.02 -2.32 0.17 0.00 1.10 0.00 0.00 33.01 31.99 1w1u s GLN 215 CO 0.11 -0.19 1.09 0.00 -0.55 0.00 0.00 175.29 175.75 1w1u s ALA 216 N 1.29 1.11 -1.20 1.58 0.00 -0.36 -4.92 121.76 119.26 1w1u s ALA 216 Ca 0.03 -0.29 0.21 0.00 0.00 0.00 0.00 51.96 51.91 1w1u s ALA 216 Cb -0.13 -3.13 -0.18 0.00 0.00 0.00 0.00 23.12 19.67 1w1u s ALA 216 CO -0.10 -2.71 0.94 0.25 0.00 0.00 0.00 175.76 174.14 1w1u n THR 217 N -4.10 0.00 -3.94 0.00 -2.24 -1.26 -4.75 114.28 97.99 1w1u n THR 217 Ca 0.06 -0.05 0.05 0.00 -2.27 0.00 0.00 64.05 61.83 1w1u n THR 217 Cb 0.57 1.05 0.01 0.00 -2.10 0.00 0.00 70.33 69.85 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 -2.90 -0.00 0.12 3.42 1.47 -1.26 -4.99 116.67 112.53 1w1u s ASP 218 Ca 0.10 -0.01 -0.24 0.00 1.18 0.00 0.00 52.55 53.58 1w1u s ASP 218 Cb 0.16 0.01 -0.07 0.00 -0.34 0.00 0.00 42.92 42.68 1w1u s ASP 218 CO 0.81 -0.01 1.67 0.25 0.68 0.00 0.00 175.17 178.56 1w1u h LEU 219 N 2.00 -0.51 -0.58 2.11 5.85 -1.95 0.27 115.31 122.50 1w1u h LEU 219 Ca -0.22 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.57 1w1u h LEU 219 Cb 1.18 0.21 -0.03 0.00 0.37 0.00 0.00 40.66 42.39 1w1u h LEU 219 CO 0.29 -0.24 0.38 0.44 -0.34 0.00 0.00 178.44 178.97 1w1u h ASP 220 N -0.29 0.67 -0.61 1.25 3.32 -1.98 0.29 116.42 119.07 1w1u h ASP 220 Ca 0.05 -0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.04 1w1u h ASP 220 Cb 0.36 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.71 1w1u h ASP 220 CO -0.16 0.49 0.26 -0.78 -1.72 0.00 0.00 179.24 177.33 1w1u h ASP 221 N 0.79 0.86 -0.18 6.45 3.58 -1.86 0.14 116.42 126.20 1w1u h ASP 221 Ca 0.21 -0.12 -0.03 0.00 0.42 0.00 0.00 57.03 57.51 1w1u h ASP 221 Cb -0.08 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 40.74 1w1u h ASP 221 CO -0.05 0.77 -0.01 0.00 -2.88 0.00 0.00 179.24 177.08 1w1u h ALA 222 N 1.35 0.24 -0.11 -0.78 0.00 0.42 -1.52 119.26 118.86 1w1u h ALA 222 Ca 0.22 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1w1u h ALA 222 Cb 0.18 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1w1u h ALA 222 CO -0.02 -0.04 -0.12 -0.07 0.00 0.00 0.00 179.25 178.99 1w1u h LEU 223 N 0.06 0.16 -0.59 0.00 3.38 -0.07 0.41 115.31 118.66 1w1u h LEU 223 Ca 0.05 -0.03 -0.14 0.00 0.09 0.00 0.00 57.88 57.86 1w1u h LEU 223 Cb 0.40 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 1w1u h LEU 223 CO 0.01 0.30 -0.34 0.58 0.09 0.00 0.00 178.44 179.09 1w1u h VAL 224 N 0.16 1.28 -0.28 1.22 2.07 -0.45 -1.52 116.25 118.74 1w1u h VAL 224 Ca 0.03 -1.49 -0.18 0.00 0.82 0.00 0.00 66.70 65.88 1w1u h VAL 224 Cb 0.33 1.38 0.00 0.00 -1.52 0.00 0.00 31.29 31.48 1w1u h VAL 224 CO 0.02 0.49 -0.54 0.03 0.02 0.00 0.00 177.57 177.59 1w1u h ARG 225 N 0.64 0.85 -0.02 1.57 3.08 -0.27 -1.93 114.38 118.30 1w1u h ARG 225 Ca 0.07 -0.55 -0.00 0.00 0.07 0.00 0.00 59.98 59.57 1w1u h ARG 225 Cb 0.87 0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.99 1w1u h ARG 225 CO 0.08 1.18 0.01 0.82 -1.07 0.00 0.00 179.97 180.99 1w1u h ILE 226 N 0.63 1.08 -0.62 2.04 1.08 -0.90 -0.83 117.51 119.99 1w1u h ILE 226 Ca 0.01 -0.24 0.07 0.00 -0.39 0.00 0.00 64.86 64.31 1w1u h ILE 226 Cb 1.15 1.20 -0.06 0.00 -3.07 0.00 0.00 36.82 36.04 1w1u h ILE 226 CO 0.12 0.07 0.31 0.00 -0.69 0.00 0.00 178.15 177.95 1w1u h ALA 227 N 0.91 0.82 0.41 1.87 0.00 -1.27 0.65 119.26 122.65 1w1u h ALA 227 Ca 0.01 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1w1u h ALA 227 Cb 0.10 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1w1u h ALA 227 CO -0.00 -0.06 -0.20 -0.22 0.00 0.00 0.00 179.25 178.77 1w1u h LYS 228 N 0.56 -0.54 -0.53 0.00 3.64 -1.13 -2.58 116.57 116.00 1w1u h LYS 228 Ca 0.29 0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.64 1w1u h LYS 228 Cb 0.25 0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.17 1w1u h LYS 228 CO -0.22 -0.23 0.05 1.88 -2.27 0.00 0.00 179.45 178.66 1w1u h TYR 229 N -0.88 0.90 -0.26 1.91 0.05 -1.10 -2.59 116.97 114.99 1w1u h TYR 229 Ca -0.06 -0.12 -0.01 0.00 0.05 0.00 0.00 58.73 58.59 1w1u h TYR 229 Cb 0.56 -0.25 -0.01 0.00 1.01 0.00 0.00 36.73 38.03 1w1u h TYR 229 CO 0.02 0.80 0.11 0.00 -1.05 0.00 0.00 178.16 178.03 1w1u h THR 230 N 0.80 1.17 -0.24 -2.88 1.03 -0.93 -1.37 112.91 110.49 1w1u h THR 230 Ca 0.16 -0.52 -0.02 0.00 -0.01 0.00 0.00 66.41 66.02 1w1u h THR 230 Cb 0.41 1.03 -0.01 0.00 -1.07 0.00 0.00 68.15 68.50 1w1u h THR 230 CO 0.01 0.18 0.04 0.00 -0.01 0.00 0.00 175.52 175.74 1w1u h ALA 231 N 0.95 1.63 -0.16 0.00 0.00 -1.36 -2.46 119.26 117.87 1w1u h ALA 231 Ca 0.09 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1w1u h ALA 231 Cb 0.18 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1w1u h ALA 231 CO -0.01 0.29 0.00 0.39 0.00 0.00 0.00 179.25 179.92 1w1u n GLU 232 N -4.38 1.51 -2.09 0.00 1.02 -0.99 -4.92 120.64 110.79 1w1u n GLU 232 Ca 0.01 -0.78 -0.16 0.00 -0.02 0.00 0.00 57.16 56.21 1w1u n GLU 232 Cb 0.17 -1.30 -0.02 0.00 -0.02 0.00 0.00 31.44 30.26 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 0.97 0.18 3.95 0.62 0.00 -0.92 -5.01 105.19 104.97 1w1u n GLY 233 Ca 0.13 -0.23 -0.24 0.00 0.00 0.00 0.00 46.02 45.68 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 -4.43 2.92 -0.54 1.61 3.01 -0.55 -4.70 119.74 117.05 1w1u s LYS 234 Ca 0.00 -0.40 0.04 0.00 -1.01 0.00 0.00 55.97 54.61 1w1u s LYS 234 Cb 0.00 -2.46 0.17 0.00 -1.01 0.00 0.00 37.83 34.53 1w1u s LYS 234 CO 0.00 -0.49 0.41 0.00 0.51 0.00 0.00 175.35 175.78 1w1u s ALA 235 N -2.73 2.42 -0.00 5.17 0.00 -1.26 -4.42 121.76 120.93 1w1u s ALA 235 Ca 0.52 -3.04 0.07 0.00 0.00 0.00 0.00 51.96 49.51 1w1u s ALA 235 Cb -0.10 -1.83 -0.02 0.00 0.00 0.00 0.00 23.12 21.16 1w1u s ALA 235 CO 0.40 -2.03 -0.23 -1.50 0.00 0.00 0.00 175.76 172.41 1w1u s ILE 236 N -0.58 1.80 -0.04 0.00 2.07 -1.26 -4.74 121.20 118.45 1w1u s ILE 236 Ca 0.29 -1.03 -0.13 0.00 -1.41 0.00 0.00 60.65 58.38 1w1u s ILE 236 Cb 0.00 -1.51 -0.05 0.00 0.13 0.00 0.00 42.46 41.04 1w1u s ILE 236 CO -0.19 0.45 0.33 -0.94 -1.91 0.00 0.00 174.94 172.69 1w1u s SER 237 N -0.68 6.68 -0.08 4.50 1.04 -1.26 -2.42 113.70 121.47 1w1u s SER 237 Ca 0.09 0.81 0.05 0.00 0.48 0.00 0.00 55.95 57.37 1w1u s SER 237 Cb -0.09 -2.20 -0.01 0.00 0.10 0.00 0.00 66.02 63.82 1w1u s SER 237 CO -0.00 0.34 -0.23 -0.63 0.98 0.00 0.00 173.24 173.69 1w1u s ILE 238 N -0.98 2.22 0.00 -1.02 -1.09 0.28 -2.30 121.20 118.31 1w1u s ILE 238 Ca 0.21 -0.99 -0.01 0.00 -2.23 0.00 0.00 60.65 57.63 1w1u s ILE 238 Cb -0.15 -1.84 -0.04 0.00 -1.58 0.00 0.00 42.46 38.85 1w1u s ILE 238 CO 0.10 0.56 0.15 0.00 -1.23 0.00 0.00 174.94 174.53 1w1u s ALA 239 N 0.03 3.83 -0.18 9.38 0.00 0.13 0.22 121.76 135.17 1w1u s ALA 239 Ca -0.09 -0.82 -0.05 0.00 0.00 0.00 0.00 51.96 51.01 1w1u s ALA 239 Cb -0.15 -1.76 0.07 0.00 0.00 0.00 0.00 23.12 21.27 1w1u s ALA 239 CO 0.05 0.74 0.11 -1.17 0.00 0.00 0.00 175.76 175.49 1w1u s LEU 240 N -1.96 0.27 0.01 0.00 2.96 -0.67 -1.23 118.68 118.07 1w1u s LEU 240 Ca 0.27 -0.56 -0.30 0.00 -0.22 0.00 0.00 54.13 53.32 1w1u s LEU 240 Cb -0.12 -0.15 -0.08 0.00 0.50 0.00 0.00 46.19 46.34 1w1u s LEU 240 CO 0.18 -0.35 1.91 -2.28 -1.32 0.00 0.00 176.35 174.50 1w1u s HIS 241 N 2.17 1.41 -2.57 5.38 5.65 -1.26 -2.11 115.29 123.96 1w1u s HIS 241 Ca 0.03 -0.30 0.00 0.00 0.25 0.00 0.00 55.06 55.04 1w1u s HIS 241 Cb -0.16 -4.17 0.00 0.00 -1.18 0.00 0.00 32.58 27.07 1w1u s HIS 241 CO -0.10 -5.18 0.00 0.41 -0.65 0.00 0.00 174.74 169.22 1w1u n GLY 242 N 4.51 -1.52 3.27 1.59 0.00 -0.59 -4.91 105.19 107.55 1w1u n GLY 242 Ca 0.20 -1.06 -0.35 0.00 0.00 0.00 0.00 46.02 44.81 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 -2.90 4.17 0.41 1.61 3.84 -1.26 -1.85 114.94 118.95 1w1u s ASN 243 Ca 0.00 -0.49 0.12 0.00 0.21 0.00 0.00 52.86 52.70 1w1u s ASN 243 Cb 0.00 -1.70 0.96 0.00 -0.55 0.00 0.00 41.25 39.96 1w1u s ASN 243 CO 0.00 -0.04 1.93 0.00 -2.79 0.00 0.00 177.10 176.21 1w1u h ALA 244 N 8.08 1.97 0.00 1.71 0.00 -1.93 0.85 119.26 129.94 1w1u h ALA 244 Ca -0.41 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.50 1w1u h ALA 244 Cb 1.15 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 1w1u h ALA 244 CO 0.61 -0.15 -0.01 0.00 0.00 0.00 0.00 179.25 179.70 1w1u h ALA 245 N 1.64 1.09 0.00 0.00 0.00 -1.91 -0.27 119.26 119.81 1w1u h ALA 245 Ca 0.35 -0.01 -0.43 0.00 0.00 0.00 0.00 54.91 54.83 1w1u h ALA 245 Cb 0.65 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.37 1w1u h ALA 245 CO -0.12 0.01 -2.50 0.39 0.00 0.00 0.00 179.25 177.03 1w1u n GLU 246 N -3.22 0.61 0.00 0.00 1.02 0.11 -4.37 120.64 114.78 1w1u n GLU 246 Ca -0.02 0.21 -0.12 0.00 -0.02 0.00 0.00 57.16 57.20 1w1u n GLU 246 Cb 0.11 -1.49 -0.07 0.00 -0.02 0.00 0.00 31.44 29.97 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 -0.53 1.14 0.01 -3.67 1.08 -0.81 -2.47 117.51 112.27 1w1u h ILE 247 Ca -0.64 -0.42 0.00 0.00 -0.39 0.00 0.00 64.86 63.42 1w1u h ILE 247 Cb 1.74 1.32 -0.00 0.00 -3.07 0.00 0.00 36.82 36.80 1w1u h ILE 247 CO -0.27 0.12 -0.01 -0.07 -0.69 0.00 0.00 178.15 177.22 1w1u h LEU 248 N -0.07 -0.04 -1.39 1.44 3.38 -1.30 -0.23 115.31 117.10 1w1u h LEU 248 Ca 0.02 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.07 1w1u h LEU 248 Cb 0.17 0.01 -0.05 0.00 0.09 0.00 0.00 40.66 40.88 1w1u h LEU 248 CO -0.00 -0.02 0.49 -0.65 0.09 0.00 0.00 178.44 178.34 1w1u h PRO 249 N -0.03 0.70 0.03 1.13 0.11 -1.74 -0.85 132.00 131.35 1w1u h PRO 249 Ca 0.00 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.07 1w1u h PRO 249 Cb 0.03 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 30.98 1w1u h PRO 249 CO -0.01 0.46 -0.01 1.49 -0.21 0.00 0.00 178.00 179.72 1w1u h GLU 250 N 0.72 -0.03 -0.91 1.05 4.57 -0.94 -2.22 114.58 116.82 1w1u h GLU 250 Ca 0.33 0.00 0.04 0.00 -1.18 0.00 0.00 59.36 58.55 1w1u h GLU 250 Cb 0.34 0.01 -0.06 0.00 -0.16 0.00 0.00 28.75 28.88 1w1u h GLU 250 CO -0.11 0.21 0.58 -0.07 -1.18 0.00 0.00 179.01 178.44 1w1u h LEU 251 N -0.28 0.96 -0.38 1.64 3.38 -0.43 0.31 115.31 120.51 1w1u h LEU 251 Ca -0.00 -0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.01 1w1u h LEU 251 Cb 0.26 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.76 1w1u h LEU 251 CO 0.01 0.65 0.13 0.58 0.09 0.00 0.00 178.44 179.90 1w1u h VAL 252 N 1.11 0.89 0.00 1.22 2.07 -1.08 -1.41 116.25 119.06 1w1u h VAL 252 Ca 0.37 -0.10 -0.05 0.00 0.82 0.00 0.00 66.70 67.74 1w1u h VAL 252 Cb 0.05 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 30.39 1w1u h VAL 252 CO -0.13 0.05 -0.22 0.11 0.02 0.00 0.00 177.57 177.40 1w1u h LYS 253 N 0.29 0.00 0.00 1.57 1.57 -0.61 -2.04 116.57 117.35 1w1u h LYS 253 Ca 0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 1w1u h LYS 253 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.46 1w1u h LYS 253 CO -0.17 0.22 -0.00 0.54 -0.57 0.00 0.00 179.45 179.46 1w1u n ARG 254 N -4.25 0.04 -0.84 3.15 1.74 -0.02 -4.89 116.66 111.59 1w1u n ARG 254 Ca -0.02 0.03 0.00 0.00 -0.77 0.00 0.00 57.85 57.09 1w1u n ARG 254 Cb 0.28 -1.55 0.00 0.00 -1.02 0.00 0.00 32.46 30.17 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 1.47 0.53 3.77 -0.13 0.00 -0.77 -5.02 105.19 105.04 1w1u n GLY 255 Ca 0.07 -0.44 -0.39 0.00 0.00 0.00 0.00 46.02 45.25 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 -2.00 2.93 -0.33 1.61 1.01 -0.60 -5.01 120.40 118.01 1w1u s VAL 256 Ca 0.00 0.83 -0.00 0.00 0.00 0.00 0.00 61.98 62.81 1w1u s VAL 256 Cb 0.00 -3.49 0.10 0.00 0.00 0.00 0.00 36.38 33.00 1w1u s VAL 256 CO 0.00 0.12 0.11 -0.60 0.00 0.00 0.00 175.10 174.73 1w1u s ARG 257 N -2.16 0.84 1.05 2.72 3.52 -1.26 -4.67 118.95 118.99 1w1u s ARG 257 Ca 0.55 -1.25 -0.14 0.00 -0.13 0.00 0.00 55.73 54.76 1w1u s ARG 257 Cb -0.34 -2.13 0.21 0.00 -1.56 0.00 0.00 34.95 31.13 1w1u s ARG 257 CO 0.44 -1.00 1.11 -2.14 -0.81 0.00 0.00 175.30 172.90 1w1u s PRO 258 N 1.41 0.04 -0.00 5.12 0.02 -1.26 -4.96 135.00 135.38 1w1u s PRO 258 Ca 0.11 0.30 0.21 0.00 0.02 0.00 0.00 61.00 61.63 1w1u s PRO 258 Cb -0.18 -1.71 -0.23 0.00 0.02 0.00 0.00 34.50 32.40 1w1u s PRO 258 CO -0.21 -2.94 0.88 -0.25 -0.33 0.00 0.00 177.00 174.15 1w1u n ASP 259 N -4.28 0.97 -3.64 2.53 8.00 -0.32 -4.86 116.55 114.95 1w1u n ASP 259 Ca 0.07 -0.98 -0.08 0.00 0.71 0.00 0.00 54.79 54.51 1w1u n ASP 259 Cb 0.58 1.01 -0.07 0.00 -0.02 0.00 0.00 41.12 42.62 1w1u n ASP 259 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 1w1u s MET 260 N -2.97 0.69 -0.03 -1.24 1.75 -1.16 -4.15 119.30 112.19 1w1u s MET 260 Ca 0.08 1.09 0.04 0.00 -1.25 0.00 0.00 55.69 55.65 1w1u s MET 260 Cb 0.16 0.19 -0.01 0.00 2.84 0.00 0.00 34.83 38.01 1w1u s MET 260 CO 0.86 -0.13 -0.16 0.08 -0.65 0.00 0.00 175.02 175.02 1w1u s VAL 261 N 1.29 1.28 0.00 10.11 1.01 -0.51 -0.48 120.40 133.09 1w1u s VAL 261 Ca -0.07 -0.66 0.00 0.00 0.00 0.00 0.00 61.98 61.24 1w1u s VAL 261 Cb -0.05 -1.09 0.00 0.00 0.00 0.00 0.00 36.38 35.24 1w1u s VAL 261 CO -0.15 0.37 0.00 1.07 0.00 0.00 0.00 175.10 176.39 1w1u n THR 262 N 2.94 0.00 -3.57 3.92 5.66 -0.79 -2.10 114.28 120.34 1w1u n THR 262 Ca -0.16 0.00 -0.14 0.00 -3.05 0.00 0.00 64.05 60.70 1w1u n THR 262 Cb 0.54 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.26 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 0.31 -0.55 -0.28 1.09 3.68 -1.26 -4.26 116.67 115.41 1w1u s ASP 263 Ca 0.00 0.74 0.21 0.00 2.13 0.00 0.00 52.55 55.64 1w1u s ASP 263 Cb 0.00 0.65 0.49 0.00 -1.45 0.00 0.00 42.92 42.61 1w1u s ASP 263 CO 0.00 -0.40 1.17 1.67 0.13 0.00 0.00 175.17 177.74 1w1u n GLN 264 N 1.31 1.64 -1.75 4.34 7.27 -0.17 -3.99 117.38 126.03 1w1u n GLN 264 Ca -0.14 -3.15 -0.29 0.00 0.07 0.00 0.00 57.00 53.48 1w1u n GLN 264 Cb 0.57 -1.28 0.10 0.00 2.41 0.00 0.00 30.24 32.03 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 -3.17 2.36 -0.53 1.69 -4.23 -1.21 -4.50 115.64 106.05 1w1u s THR 265 Ca 0.24 0.12 -0.05 0.00 -1.18 0.00 0.00 61.69 60.82 1w1u s THR 265 Cb 0.35 -3.01 -0.04 0.00 1.34 0.00 0.00 72.50 71.13 1w1u s THR 265 CO -0.05 -0.15 3.00 -1.20 -0.54 0.00 0.00 174.62 175.67 1w1u n SER 266 N -3.42 6.50 0.22 3.99 7.64 -1.00 -4.61 113.62 122.94 1w1u n SER 266 Ca 0.07 -2.93 0.15 0.00 1.01 0.00 0.00 58.87 57.18 1w1u n SER 266 Cb 0.59 -1.33 0.80 0.00 -1.01 0.00 0.00 64.21 63.26 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 3.38 1.00 0.00 -0.43 0.00 -1.72 -2.59 119.26 118.90 1w1u h ALA 267 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.32 1w1u h ALA 267 Cb 0.87 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1w1u h ALA 267 CO 0.83 0.00 0.00 1.12 0.00 0.00 0.00 179.25 181.20 1w1u h HIS 268 N 0.00 0.00 -2.65 0.00 2.07 -1.48 -3.33 115.15 109.76 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 0.00 0.00 -0.39 0.00 2.57 0.00 0.00 27.41 29.59 1w1u h HIS 268 CO 0.00 0.00 -0.84 0.34 -3.07 0.00 0.00 177.93 174.36 1w1u s ASP 269 N -5.11 2.73 0.32 3.10 3.68 -0.97 -4.48 116.67 115.93 1w1u s ASP 269 Ca -0.02 -2.95 0.08 0.00 2.13 0.00 0.00 52.55 51.80 1w1u s ASP 269 Cb 0.10 -0.75 0.92 0.00 -1.45 0.00 0.00 42.92 41.74 1w1u s ASP 269 CO 0.43 -0.20 1.63 -0.65 0.13 0.00 0.00 175.17 176.51 1w1u h PRO 270 N 6.08 0.17 -0.23 4.34 0.11 -1.78 0.22 132.00 140.90 1w1u h PRO 270 Ca 0.15 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 66.14 1w1u h PRO 270 Cb 0.90 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.96 1w1u h PRO 270 CO 0.43 0.11 -0.32 1.25 -0.21 0.00 0.00 178.00 179.26 1w1u h LEU 271 N 0.17 0.50 0.00 2.35 5.85 -1.90 -3.36 115.31 118.92 1w1u h LEU 271 Ca 0.66 -0.19 -0.13 0.00 0.84 0.00 0.00 57.88 59.05 1w1u h LEU 271 Cb 1.46 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 42.33 1w1u h LEU 271 CO -0.71 0.80 -1.49 0.59 -0.34 0.00 0.00 178.44 177.29 1w1u n ASN 272 N -4.08 3.24 -0.74 1.25 3.02 -0.60 -4.85 115.26 112.51 1w1u n ASN 272 Ca -0.01 -0.00 0.06 0.00 -0.03 0.00 0.00 54.58 54.60 1w1u n ASN 272 Cb 0.45 0.60 0.18 0.00 -0.61 0.00 0.00 39.78 40.40 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 2.60 2.85 2.64 7.41 0.00 0.68 -4.94 105.19 116.43 1w1u n GLY 273 Ca -0.12 -0.47 -0.27 0.00 0.00 0.00 0.00 46.02 45.16 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 -1.16 0.42 -0.13 1.61 5.04 -1.25 -2.38 117.35 119.49 1w1u s TYR 274 Ca 0.27 -0.49 -0.29 0.00 -2.44 0.00 0.00 57.07 54.12 1w1u s TYR 274 Cb 0.15 -0.79 -0.03 0.00 0.35 0.00 0.00 41.96 41.64 1w1u s TYR 274 CO 0.17 -0.55 1.43 -1.17 -1.34 0.00 0.00 175.55 174.08 1w1u s LEU 275 N 2.06 4.21 0.56 6.97 2.96 -1.26 -4.67 118.68 129.51 1w1u s LEU 275 Ca 0.02 1.88 -0.20 0.00 -0.22 0.00 0.00 54.13 55.60 1w1u s LEU 275 Cb -0.16 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 42.95 1w1u s LEU 275 CO -0.10 -0.85 1.25 -2.84 -1.32 0.00 0.00 176.35 172.49 1w1u s PRO 276 N 3.77 3.13 0.08 0.98 0.02 -1.26 -4.90 135.00 136.82 1w1u s PRO 276 Ca 0.62 1.96 -0.34 0.00 0.02 0.00 0.00 61.00 63.27 1w1u s PRO 276 Cb -0.26 -2.11 -0.13 0.00 0.02 0.00 0.00 34.50 32.02 1w1u s PRO 276 CO 0.21 -1.11 1.70 0.00 -0.33 0.00 0.00 177.00 177.46 1w1u n ALA 277 N -1.24 1.28 -0.25 -1.55 0.00 -1.26 -1.81 120.51 115.67 1w1u n ALA 277 Ca 0.12 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.94 1w1u n ALA 277 Cb 0.48 -2.42 0.00 0.00 0.00 0.00 0.00 19.45 17.51 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 3.79 1.22 3.88 0.00 0.00 -1.26 -5.05 105.19 107.77 1w1u n GLY 278 Ca 0.19 0.00 -0.32 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 -2.79 3.49 0.15 1.61 0.52 -0.75 -5.09 118.94 116.08 1w1u s TRP 279 Ca 0.00 0.72 -0.07 0.00 0.02 0.00 0.00 56.10 56.77 1w1u s TRP 279 Cb 0.00 -2.13 -0.06 0.00 -1.15 0.00 0.00 33.47 30.13 1w1u s TRP 279 CO 0.00 0.40 0.43 0.95 0.02 0.00 0.00 176.95 178.75 1w1u s THR 280 N -1.65 5.09 0.53 2.01 -4.23 -1.26 -4.87 115.64 111.27 1w1u s THR 280 Ca 0.41 0.23 0.23 0.00 -1.18 0.00 0.00 61.69 61.38 1w1u s THR 280 Cb -0.12 -3.63 0.36 0.00 1.34 0.00 0.00 72.50 70.45 1w1u s THR 280 CO 0.22 0.06 2.04 -0.25 -0.54 0.00 0.00 174.62 176.15 1w1u h TRP 281 N 2.91 0.00 0.14 3.99 2.91 -1.98 -0.90 115.95 123.02 1w1u h TRP 281 Ca -0.47 0.00 -0.01 0.00 1.13 0.00 0.00 58.89 59.55 1w1u h TRP 281 Cb 1.17 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.82 1w1u h TRP 281 CO 0.62 0.00 -0.07 0.93 -1.03 0.00 0.00 178.44 178.90 1w1u h GLU 282 N 0.00 -0.18 -0.27 2.65 3.07 -2.00 -1.72 114.58 116.13 1w1u h GLU 282 Ca 0.17 0.01 -0.07 0.00 -0.50 0.00 0.00 59.36 58.97 1w1u h GLU 282 Cb 0.70 0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 28.64 1w1u h GLU 282 CO -0.00 -0.07 -0.13 1.96 -1.40 0.00 0.00 179.01 179.36 1w1u h GLN 283 N -0.23 0.46 0.66 2.33 4.20 -1.68 -2.65 115.11 118.21 1w1u h GLN 283 Ca -0.02 -0.13 -0.03 0.00 0.06 0.00 0.00 58.65 58.53 1w1u h GLN 283 Cb 0.18 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 27.91 1w1u h GLN 283 CO 0.03 0.59 -0.39 -0.92 -0.67 0.00 0.00 178.83 177.47 1w1u h TYR 284 N 0.43 -1.04 0.00 2.96 -0.00 -0.83 -0.94 116.97 117.54 1w1u h TYR 284 Ca 0.08 -0.01 0.00 0.00 -0.00 0.00 0.00 58.73 58.80 1w1u h TYR 284 Cb 0.49 0.37 0.00 0.00 -0.00 0.00 0.00 36.73 37.58 1w1u h TYR 284 CO 0.01 -0.60 0.00 0.00 -0.00 0.00 0.00 178.16 177.57 1w1u h ARG 285 N -0.99 0.00 0.01 1.82 3.08 -1.29 -1.10 114.38 115.90 1w1u h ARG 285 Ca -0.08 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 1w1u h ARG 285 Cb 0.80 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.85 1w1u h ARG 285 CO 0.10 0.00 -0.04 -0.44 -1.07 0.00 0.00 179.97 178.52 1w1u h ASP 286 N 0.00 0.02 0.65 7.04 3.32 -1.32 -3.30 116.42 122.84 1w1u h ASP 286 Ca 0.00 -0.98 -0.01 0.00 0.02 0.00 0.00 57.03 56.05 1w1u h ASP 286 Cb 0.49 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 40.04 1w1u h ASP 286 CO 0.00 1.00 -0.07 0.03 -1.72 0.00 0.00 179.24 178.48 1w1u h ARG 287 N -0.96 0.00 -0.94 3.56 3.08 -1.06 -3.00 114.38 115.07 1w1u h ARG 287 Ca -0.01 0.00 0.13 0.00 0.07 0.00 0.00 59.98 60.18 1w1u h ARG 287 Cb 1.01 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 30.98 1w1u h ARG 287 CO 0.01 0.07 0.56 0.00 -1.07 0.00 0.00 179.97 179.53 1w1u h ALA 288 N 1.93 1.43 -0.02 0.04 0.00 -1.27 0.83 119.26 122.19 1w1u h ALA 288 Ca -0.00 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1w1u h ALA 288 Cb 0.42 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1w1u h ALA 288 CO 0.01 0.08 -0.26 0.00 0.00 0.00 0.00 179.25 179.08 1w1u n GLN 289 N -4.72 1.52 -0.10 0.00 10.64 -1.14 -3.00 117.38 120.59 1w1u n GLN 289 Ca 0.18 -1.19 -0.17 0.00 -1.83 0.00 0.00 57.00 54.00 1w1u n GLN 289 Cb 0.40 -1.48 -0.08 0.00 -0.86 0.00 0.00 30.24 28.23 1w1u n GLN 289 CO 0.00 0.00 0.00 2.41 -1.83 0.00 0.00 177.06 177.64 1w1u n THR 290 N 0.30 1.49 -2.99 -0.39 -1.04 -0.44 -4.71 114.28 106.51 1w1u n THR 290 Ca 0.12 0.01 -0.19 0.00 -2.04 0.00 0.00 64.05 61.95 1w1u n THR 290 Cb 0.48 -2.15 -0.02 0.00 -1.82 0.00 0.00 70.33 66.81 1w1u n THR 290 CO 0.00 0.00 0.00 -1.84 -0.64 0.00 0.00 175.07 172.59 1w1u n GLU 291 N -4.47 1.74 -0.29 -2.82 0.28 0.16 -4.98 120.64 110.26 1w1u n GLU 291 Ca -0.26 -3.81 0.03 0.00 -0.16 0.00 0.00 57.16 52.96 1w1u n GLU 291 Cb 0.57 -1.80 0.10 0.00 1.43 0.00 0.00 31.44 31.74 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 2.96 -0.00 -0.89 3.44 0.13 -1.54 0.27 132.00 136.37 1w1u h PRO 292 Ca 0.09 0.00 0.08 0.00 -0.87 0.00 0.00 66.00 65.30 1w1u h PRO 292 Cb 0.89 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.95 1w1u h PRO 292 CO 0.61 -0.00 0.58 0.00 -0.23 0.00 0.00 178.00 178.95 1w1u h ALA 293 N 1.81 1.58 -0.23 -0.56 0.00 -1.92 0.93 119.26 120.87 1w1u h ALA 293 Ca 0.40 -0.01 -0.19 0.00 0.00 0.00 0.00 54.91 55.10 1w1u h ALA 293 Cb 0.61 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1w1u h ALA 293 CO -0.85 0.27 -0.61 0.00 0.00 0.00 0.00 179.25 178.06 1w1u h ALA 294 N 1.53 0.39 -0.76 0.00 0.00 -0.94 -2.41 119.26 117.07 1w1u h ALA 294 Ca 0.40 -0.54 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 1w1u h ALA 294 Cb 0.30 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1w1u h ALA 294 CO -0.16 0.64 0.26 0.28 0.00 0.00 0.00 179.25 180.28 1w1u h VAL 295 N 0.58 1.26 -0.84 0.00 2.07 -0.12 0.52 116.25 119.72 1w1u h VAL 295 Ca -0.01 -0.88 -0.03 0.00 0.82 0.00 0.00 66.70 66.60 1w1u h VAL 295 Cb 1.22 0.40 -0.04 0.00 -1.52 0.00 0.00 31.29 31.35 1w1u h VAL 295 CO 0.13 0.35 0.41 0.58 0.02 0.00 0.00 177.57 179.06 1w1u h VAL 296 N 1.12 1.26 -0.08 2.57 2.07 -0.79 0.53 116.25 122.93 1w1u h VAL 296 Ca 0.25 -0.72 -0.00 0.00 0.82 0.00 0.00 66.70 67.05 1w1u h VAL 296 Cb 0.28 0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 30.22 1w1u h VAL 296 CO -0.01 0.31 0.04 0.11 0.02 0.00 0.00 177.57 178.04 1w1u h LYS 297 N 1.20 0.12 0.07 1.57 1.57 -0.83 -1.77 116.57 118.49 1w1u h LYS 297 Ca 0.29 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 59.05 1w1u h LYS 297 Cb 0.11 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.40 1w1u h LYS 297 CO -0.04 0.18 -0.03 0.00 -0.57 0.00 0.00 179.45 178.99 1w1u h ALA 298 N 0.93 -0.09 -0.49 3.86 0.00 -0.57 -1.78 119.26 121.12 1w1u h ALA 298 Ca 0.03 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.97 1w1u h ALA 298 Cb 0.10 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.87 1w1u h ALA 298 CO -0.00 -0.54 0.21 0.00 0.00 0.00 0.00 179.25 178.91 1w1u h ALA 299 N 0.83 0.61 -0.02 0.00 0.00 -0.82 -2.11 119.26 117.75 1w1u h ALA 299 Ca -0.01 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1w1u h ALA 299 Cb 0.08 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1w1u h ALA 299 CO 0.02 -0.17 -0.38 0.87 0.00 0.00 0.00 179.25 179.58 1w1u h LYS 300 N 0.41 0.03 -0.19 0.00 1.57 -1.21 -1.71 116.57 115.47 1w1u h LYS 300 Ca 0.23 -0.01 -0.11 0.00 -1.87 0.00 0.00 60.65 58.88 1w1u h LYS 300 Cb 0.20 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 1w1u h LYS 300 CO -0.20 0.41 -0.37 1.96 -0.57 0.00 0.00 179.45 180.68 1w1u h GLN 301 N 0.03 0.41 -0.18 3.15 4.20 -0.76 -2.25 115.11 119.71 1w1u h GLN 301 Ca 0.00 -0.19 -0.18 0.00 0.06 0.00 0.00 58.65 58.35 1w1u h GLN 301 Cb 0.69 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.46 1w1u h GLN 301 CO 0.05 0.72 -0.61 0.77 -0.67 0.00 0.00 178.83 179.10 1w1u h SER 302 N 0.34 0.68 -0.69 1.46 0.02 -0.87 -3.03 113.55 111.46 1w1u h SER 302 Ca 0.04 -0.39 0.00 0.00 -0.84 0.00 0.00 61.79 60.60 1w1u h SER 302 Cb 0.82 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 63.12 1w1u h SER 302 CO 0.07 1.13 0.45 0.24 -1.14 0.00 0.00 176.83 177.57 1w1u h MET 303 N 0.45 0.92 0.19 3.45 2.86 -0.97 -1.07 114.93 120.76 1w1u h MET 303 Ca -0.01 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.57 1w1u h MET 303 Cb 1.18 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 32.62 1w1u h MET 303 CO 0.12 0.62 -0.17 0.00 1.06 0.00 0.00 176.91 178.54 1w1u h ALA 304 N 1.55 -0.36 -0.82 6.32 0.00 -1.30 0.25 119.26 124.89 1w1u h ALA 304 Ca 0.25 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 1w1u h ALA 304 Cb -0.09 0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 1w1u h ALA 304 CO -0.05 -0.73 0.50 0.28 0.00 0.00 0.00 179.25 179.26 1w1u h VAL 305 N -0.39 1.22 0.04 0.00 2.07 -1.42 0.14 116.25 117.91 1w1u h VAL 305 Ca -0.00 -0.48 -0.00 0.00 0.82 0.00 0.00 66.70 67.04 1w1u h VAL 305 Cb 0.36 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.19 1w1u h VAL 305 CO -0.03 0.23 -0.02 -0.74 0.02 0.00 0.00 177.57 177.03 1w1u h HIS 306 N 1.13 -0.05 -0.72 1.57 6.17 -0.80 -1.63 115.15 120.82 1w1u h HIS 306 Ca 0.30 -0.00 -0.03 0.00 0.71 0.00 0.00 60.37 61.34 1w1u h HIS 306 Cb -0.06 0.02 -0.03 0.00 2.52 0.00 0.00 27.41 29.85 1w1u h HIS 306 CO 0.00 0.16 0.31 0.28 0.71 0.00 0.00 177.93 179.40 1w1u h VAL 307 N -0.25 1.24 -0.89 5.26 2.07 -0.19 -1.79 116.25 121.69 1w1u h VAL 307 Ca -0.01 -0.71 0.01 0.00 0.82 0.00 0.00 66.70 66.81 1w1u h VAL 307 Cb 0.23 0.35 -0.04 0.00 -1.52 0.00 0.00 31.29 30.31 1w1u h VAL 307 CO 0.01 0.29 0.58 -0.61 0.02 0.00 0.00 177.57 177.86 1w1u h GLN 308 N 1.04 1.19 -0.82 1.57 5.75 -0.80 0.30 115.11 123.33 1w1u h GLN 308 Ca 0.25 -0.08 -0.02 0.00 -0.15 0.00 0.00 58.65 58.64 1w1u h GLN 308 Cb 0.16 -0.26 -0.04 0.00 1.07 0.00 0.00 27.48 28.41 1w1u h GLN 308 CO -0.03 0.80 0.42 0.00 -2.65 0.00 0.00 178.83 177.37 1w1u h ALA 309 N 1.32 1.05 -0.71 3.38 0.00 -0.73 0.47 119.26 124.03 1w1u h ALA 309 Ca 0.33 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 55.03 1w1u h ALA 309 Cb -0.12 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.32 1w1u h ALA 309 CO -0.07 0.58 0.17 0.52 0.00 0.00 0.00 179.25 180.46 1w1u h MET 310 N 1.15 1.14 -0.52 0.00 2.86 -0.39 -1.65 114.93 117.51 1w1u h MET 310 Ca 0.28 -0.27 -0.05 0.00 -2.06 0.00 0.00 59.70 57.60 1w1u h MET 310 Cb 0.07 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.56 1w1u h MET 310 CO -0.04 1.00 0.12 -0.07 1.06 0.00 0.00 176.91 178.98 1w1u h LEU 311 N 1.07 0.74 -0.60 1.22 3.38 0.27 -2.36 115.31 119.04 1w1u h LEU 311 Ca 0.22 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 58.00 1w1u h LEU 311 Cb 0.37 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 1w1u h LEU 311 CO 0.00 0.74 0.12 0.44 0.09 0.00 0.00 178.44 179.83 1w1u h ASP 312 N 0.77 0.93 -0.67 -0.43 3.32 -0.40 -1.72 116.42 118.23 1w1u h ASP 312 Ca 0.17 -0.25 -0.02 0.00 0.02 0.00 0.00 57.03 56.95 1w1u h ASP 312 Cb 0.29 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.56 1w1u h ASP 312 CO -0.00 0.94 0.34 -0.26 -1.72 0.00 0.00 179.24 178.53 1w1u h PHE 313 N 0.89 0.94 -0.47 4.55 0.04 -1.02 -2.21 116.94 119.65 1w1u h PHE 313 Ca 0.19 -0.04 -0.03 0.00 2.80 0.00 0.00 57.97 60.89 1w1u h PHE 313 Cb 0.39 -0.30 -0.02 0.00 2.20 0.00 0.00 35.95 38.22 1w1u h PHE 313 CO 0.03 0.69 0.17 0.37 -0.60 0.00 0.00 178.31 178.97 1w1u h GLN 314 N 0.92 0.68 0.00 1.51 4.15 -1.13 -0.32 115.11 120.92 1w1u h GLN 314 Ca 0.23 -0.10 -0.02 0.00 0.77 0.00 0.00 58.65 59.53 1w1u h GLN 314 Cb 0.09 -0.12 -0.00 0.00 0.21 0.00 0.00 27.48 27.66 1w1u h GLN 314 CO -0.03 0.58 -0.10 0.87 -1.93 0.00 0.00 178.83 178.21 1w1u h LYS 315 N 0.67 0.00 -0.01 1.69 1.57 -0.71 -0.25 116.57 119.53 1w1u h LYS 315 Ca 0.16 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 1w1u h LYS 315 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.47 1w1u h LYS 315 CO -0.01 0.10 -0.01 1.04 -0.57 0.00 0.00 179.45 180.00 1w1u n GLN 316 N -3.73 1.31 -0.23 3.15 1.13 -0.20 -4.89 117.38 113.92 1w1u n GLN 316 Ca -0.02 -0.49 0.00 0.00 -1.94 0.00 0.00 57.00 54.54 1w1u n GLN 316 Cb 0.21 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.07 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 1.11 0.76 3.65 1.08 0.00 -0.10 -5.05 105.19 106.64 1w1u n GLY 317 Ca 0.21 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.80 1w1u n GLY 317 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1w1u s VAL 318 N -2.21 4.65 -0.08 1.61 1.01 -0.80 -4.97 120.40 119.61 1w1u s VAL 318 Ca 0.00 1.94 -0.35 0.00 0.00 0.00 0.00 61.98 63.57 1w1u s VAL 318 Cb 0.00 -4.33 -0.13 0.00 0.00 0.00 0.00 36.38 31.92 1w1u s VAL 318 CO 0.00 -0.25 1.80 -2.65 0.00 0.00 0.00 175.10 174.00 1w1u n PRO 319 N 6.44 1.95 -4.49 2.72 -0.02 -1.26 -3.90 135.00 136.44 1w1u n PRO 319 Ca 0.12 0.71 -0.21 0.00 -2.02 0.00 0.00 63.50 62.10 1w1u n PRO 319 Cb 0.46 -2.51 -0.15 0.00 -0.02 0.00 0.00 33.50 31.28 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 3.41 0.91 -0.00 3.45 2.01 -1.26 -1.43 115.64 122.73 1w1u s THR 320 Ca 0.92 -0.45 -0.17 0.00 0.31 0.00 0.00 61.69 62.30 1w1u s THR 320 Cb -0.77 -0.79 0.03 0.00 0.01 0.00 0.00 72.50 70.98 1w1u s THR 320 CO 0.52 0.27 0.36 0.72 -0.69 0.00 0.00 174.62 175.81 1w1u s PHE 321 N 0.02 -0.23 -0.07 4.92 -0.71 -0.89 -4.17 117.98 116.84 1w1u s PHE 321 Ca -0.01 0.32 -0.27 0.00 -1.04 0.00 0.00 56.93 55.93 1w1u s PHE 321 Cb -0.08 0.15 -0.02 0.00 -1.21 0.00 0.00 43.02 41.86 1w1u s PHE 321 CO 0.00 -0.45 0.89 0.34 -1.34 0.00 0.00 175.22 174.66 1w1u s ASP 322 N -1.50 7.16 -0.51 1.98 3.68 0.34 -4.32 116.67 123.51 1w1u s ASP 322 Ca -0.11 1.42 0.02 0.00 2.13 0.00 0.00 52.55 56.00 1w1u s ASP 322 Cb -0.03 -2.50 0.57 0.00 -1.45 0.00 0.00 42.92 39.50 1w1u s ASP 322 CO 0.03 -0.29 1.94 0.00 0.13 0.00 0.00 175.17 176.97 1w1u n TYR 323 N 4.39 3.00 -1.29 -5.34 -0.00 -1.26 -0.99 117.16 115.67 1w1u n TYR 323 Ca 0.05 -2.21 0.00 0.00 -0.00 0.00 0.00 57.90 55.74 1w1u n TYR 323 Cb 0.50 -1.10 0.00 0.00 -0.00 0.00 0.00 39.34 38.74 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 -0.98 0.59 0.52 2.98 0.00 -1.26 -4.97 105.19 102.07 1w1u n GLY 324 Ca 0.58 -0.80 0.05 0.00 0.00 0.00 0.00 46.02 45.86 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 1.64 2.86 -1.92 1.61 6.94 -1.26 -3.82 115.26 121.30 1w1u n ASN 325 Ca 0.00 -2.23 -0.19 0.00 -0.02 0.00 0.00 54.58 52.14 1w1u n ASN 325 Cb 0.23 -0.25 -0.05 0.00 -2.36 0.00 0.00 39.78 37.36 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 0.03 -5.28 -0.13 0.53 5.15 -1.26 -1.39 115.26 112.91 1w1u n ASN 326 Ca 0.11 0.28 -0.04 0.00 -0.60 0.00 0.00 54.58 54.33 1w1u n ASN 326 Cb 0.48 -4.57 0.15 0.00 -0.53 0.00 0.00 39.78 35.31 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 1.24 -0.44 -1.44 2.10 -1.94 -2.80 117.51 114.23 1w1u h ILE 327 Ca -0.42 -0.97 0.00 0.00 1.08 0.00 0.00 64.86 64.55 1w1u h ILE 327 Cb 1.29 0.81 -0.02 0.00 -1.09 0.00 0.00 36.82 37.81 1w1u h ILE 327 CO 0.56 0.35 0.29 0.03 -1.08 0.00 0.00 178.15 178.30 1w1u h ARG 328 N 0.78 0.59 -0.59 2.19 3.08 -1.90 -1.10 114.38 117.42 1w1u h ARG 328 Ca 0.16 -0.04 0.05 0.00 0.07 0.00 0.00 59.98 60.22 1w1u h ARG 328 Cb 0.42 -0.13 -0.05 0.00 0.08 0.00 0.00 29.97 30.29 1w1u h ARG 328 CO 0.01 0.40 0.32 0.37 -1.07 0.00 0.00 179.97 180.00 1w1u h GLN 329 N 0.60 0.58 -0.75 0.04 5.75 -1.88 0.40 115.11 119.86 1w1u h GLN 329 Ca 0.16 -0.04 -0.04 0.00 -0.15 0.00 0.00 58.65 58.59 1w1u h GLN 329 Cb -0.05 -0.13 -0.03 0.00 1.07 0.00 0.00 27.48 28.33 1w1u h GLN 329 CO -0.03 0.39 0.31 0.52 -2.65 0.00 0.00 178.83 177.37 1w1u h MET 330 N 0.60 1.11 -0.41 1.69 2.86 -1.22 -0.91 114.93 118.65 1w1u h MET 330 Ca 0.26 -0.19 -0.15 0.00 -2.06 0.00 0.00 59.70 57.56 1w1u h MET 330 Cb 0.16 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 31.62 1w1u h MET 330 CO -0.17 0.90 -0.34 0.00 1.06 0.00 0.00 176.91 178.36 1w1u h ALA 331 N 1.16 0.60 -0.52 6.32 0.00 -0.39 -2.39 119.26 124.03 1w1u h ALA 331 Ca 0.25 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 1w1u h ALA 331 Cb 0.19 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1w1u h ALA 331 CO -0.02 0.68 0.27 -0.22 0.00 0.00 0.00 179.25 179.96 1w1u h LYS 332 N 0.80 0.74 0.00 0.00 3.64 0.08 -0.36 116.57 121.47 1w1u h LYS 332 Ca 0.07 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1w1u h LYS 332 Cb 0.94 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.62 1w1u h LYS 332 CO 0.09 0.59 0.00 0.93 -2.27 0.00 0.00 179.45 178.79 1w1u h GLU 333 N 0.70 0.00 -0.65 1.90 5.08 -1.08 -2.22 114.58 118.31 1w1u h GLU 333 Ca 0.18 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.46 1w1u h GLU 333 Cb 0.08 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.28 1w1u h GLU 333 CO -0.03 0.00 0.11 -1.91 -1.00 0.00 0.00 179.01 176.18 1w1u n GLU 334 N -2.76 4.48 -0.13 2.33 4.07 -0.30 -4.89 120.64 123.43 1w1u n GLU 334 Ca -0.01 -3.12 0.00 0.00 -0.06 0.00 0.00 57.16 53.97 1w1u n GLU 334 Cb 0.17 -2.26 0.00 0.00 -0.06 0.00 0.00 31.44 29.29 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 0.34 0.56 3.03 8.31 0.00 -0.84 -4.98 105.19 111.61 1w1u n GLY 335 Ca 0.33 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.92 1w1u n GLY 335 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1w1u n VAL 336 N -2.00 4.44 -0.32 1.61 0.31 -0.30 -4.85 118.33 117.22 1w1u n VAL 336 Ca 0.00 -4.67 0.24 0.00 -0.01 0.00 0.00 64.34 59.89 1w1u n VAL 336 Cb 0.00 -2.36 0.46 0.00 -0.91 0.00 0.00 33.84 31.03 1w1u n VAL 336 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1w1u h ALA 337 N 6.05 1.83 -0.49 3.52 0.00 -1.84 0.12 119.26 128.45 1w1u h ALA 337 Ca 0.35 0.24 -0.04 0.00 0.00 0.00 0.00 54.91 55.46 1w1u h ALA 337 Cb 0.69 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 1w1u h ALA 337 CO 1.49 -0.68 0.04 0.27 0.00 0.00 0.00 179.25 180.38 1w1u n ASN 338 N -5.19 4.73 0.11 0.00 6.94 -1.26 -4.52 115.26 116.05 1w1u n ASN 338 Ca 0.31 -2.80 0.20 0.00 -0.02 0.00 0.00 54.58 52.27 1w1u n ASN 338 Cb 1.01 -0.66 0.74 0.00 -2.36 0.00 0.00 39.78 38.50 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 3.42 2.07 -0.61 -2.53 0.00 -1.08 -0.35 119.26 120.18 1w1u h ALA 339 Ca 0.04 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.73 1w1u h ALA 339 Cb 1.77 0.03 -0.13 0.00 0.00 0.00 0.00 17.79 19.46 1w1u h ALA 339 CO 0.44 -0.67 0.27 1.19 0.00 0.00 0.00 179.25 180.49 1w1u n PHE 340 N -3.61 1.97 0.42 0.00 3.01 -1.26 -4.26 117.46 113.74 1w1u n PHE 340 Ca 0.07 -1.07 0.13 0.00 1.01 0.00 0.00 57.45 57.59 1w1u n PHE 340 Cb 0.63 -0.61 0.43 0.00 -0.01 0.00 0.00 39.48 39.92 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 1.77 0.00 -3.97 4.37 3.45 -1.43 -3.41 116.42 117.20 1w1u h ASP 341 Ca 0.26 0.00 -0.69 0.00 0.43 0.00 0.00 57.03 57.04 1w1u h ASP 341 Cb 2.05 0.00 -0.26 0.00 -0.56 0.00 0.00 39.33 40.56 1w1u h ASP 341 CO 0.62 0.00 -0.80 0.72 -1.57 0.00 0.00 179.24 178.21 1w1u s PHE 342 N -3.28 2.63 0.81 4.55 -0.71 -1.26 -5.13 117.98 115.60 1w1u s PHE 342 Ca 0.07 -0.38 -0.12 0.00 -1.04 0.00 0.00 56.93 55.46 1w1u s PHE 342 Cb 0.09 -1.65 0.08 0.00 -1.21 0.00 0.00 43.02 40.33 1w1u s PHE 342 CO 0.55 0.02 1.10 -1.25 -1.34 0.00 0.00 175.22 174.30 1w1u s PRO 343 N -0.42 1.96 0.58 1.99 0.04 -1.26 -4.65 135.00 133.24 1w1u s PRO 343 Ca 0.05 0.64 -0.14 0.00 0.04 0.00 0.00 61.00 61.59 1w1u s PRO 343 Cb -0.12 -1.90 -0.05 0.00 0.04 0.00 0.00 34.50 32.47 1w1u s PRO 343 CO 0.02 -1.71 1.02 0.20 0.04 0.00 0.00 177.00 176.57 1w1u s GLY 344 N -3.86 1.90 0.48 0.56 0.00 -1.26 -0.50 107.32 104.64 1w1u s GLY 344 Ca 0.61 0.12 0.20 0.00 0.00 0.00 0.00 44.72 45.66 1w1u s GLY 344 CO 0.54 0.41 2.04 0.27 0.00 0.00 0.00 173.10 176.36 1w1u h PHE 345 N 0.25 0.00 0.01 1.90 -5.15 -1.41 -3.09 116.94 109.45 1w1u h PHE 345 Ca -0.46 0.00 -0.05 0.00 -0.20 0.00 0.00 57.97 57.27 1w1u h PHE 345 Cb 1.20 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.37 1w1u h PHE 345 CO 0.63 0.15 -0.19 -0.24 -2.00 0.00 0.00 178.31 176.67 1w1u h VAL 346 N 0.00 1.61 0.00 0.88 3.04 -1.87 -0.15 116.25 119.76 1w1u h VAL 346 Ca -0.00 -2.05 -0.05 0.00 -1.01 0.00 0.00 66.70 63.58 1w1u h VAL 346 Cb 0.31 2.95 -0.01 0.00 -2.01 0.00 0.00 31.29 32.54 1w1u h VAL 346 CO 0.02 0.55 -0.25 1.55 -1.01 0.00 0.00 177.57 178.43 1w1u h PRO 347 N -0.65 0.00 0.20 4.17 0.13 -1.79 0.79 132.00 134.86 1w1u h PRO 347 Ca -0.03 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.77 1w1u h PRO 347 Cb 1.01 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.16 1w1u h PRO 347 CO 0.04 0.25 -1.55 0.00 -0.23 0.00 0.00 178.00 176.51 1w1u h ALA 348 N 1.75 0.02 0.00 -0.56 0.00 -1.61 -3.44 119.26 115.42 1w1u h ALA 348 Ca -0.00 -0.98 0.00 0.00 0.00 0.00 0.00 54.91 53.92 1w1u h ALA 348 Cb 0.49 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1w1u h ALA 348 CO 0.03 0.88 -0.59 0.66 0.00 0.00 0.00 179.25 180.23 1w1u n TYR 349 N -3.62 0.00 -0.04 0.00 4.01 -0.11 -4.95 117.16 112.45 1w1u n TYR 349 Ca -0.18 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.57 1w1u n TYR 349 Cb 1.08 0.00 -0.16 0.00 -0.31 0.00 0.00 39.34 39.96 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 -1.63 0.70 -0.30 -0.72 2.08 -0.55 -4.62 119.36 114.31 1w1u n ILE 350 Ca 0.00 -0.67 0.14 0.00 0.56 0.00 0.00 62.75 62.78 1w1u n ILE 350 Cb 0.30 -0.26 0.31 0.00 -0.75 0.00 0.00 39.64 39.24 1w1u n ILE 350 CO 0.00 0.00 0.00 -0.09 0.56 0.00 0.00 176.55 177.02 1w1u h ARG 351 N 0.00 0.19 -0.66 0.38 2.43 0.28 0.17 114.38 117.17 1w1u h ARG 351 Ca -0.25 -0.01 0.15 0.00 -0.81 0.00 0.00 59.98 59.06 1w1u h ARG 351 Cb 1.59 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 31.06 1w1u h ARG 351 CO 0.02 0.12 0.45 -1.35 -1.51 0.00 0.00 179.97 177.70 1w1u h PRO 352 N 0.19 0.23 -0.29 0.20 0.11 -1.83 0.10 132.00 130.71 1w1u h PRO 352 Ca 0.58 -0.01 -0.17 0.00 0.11 0.00 0.00 66.00 66.50 1w1u h PRO 352 Cb 1.19 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 1w1u h PRO 352 CO -0.68 0.15 -0.49 -0.07 -0.21 0.00 0.00 178.00 176.71 1w1u h LEU 353 N 0.24 0.88 -1.10 2.35 3.38 -0.97 -2.96 115.31 117.13 1w1u h LEU 353 Ca 0.32 -0.44 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 1w1u h LEU 353 Cb 0.91 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 1w1u h LEU 353 CO -0.07 1.22 -0.01 -0.26 0.09 0.00 0.00 178.44 179.41 1w1u h PHE 354 N 0.63 0.65 0.00 1.13 0.04 -0.70 -1.26 116.94 117.43 1w1u h PHE 354 Ca 0.03 -0.08 0.00 0.00 2.80 0.00 0.00 57.97 60.72 1w1u h PHE 354 Cb 1.07 -0.18 0.00 0.00 2.20 0.00 0.00 35.95 39.04 1w1u h PHE 354 CO 0.06 0.63 0.03 0.00 -0.60 0.00 0.00 178.31 178.44 1w1u n ARG 356 N -2.75 2.93 -0.99 0.00 1.74 -0.91 -3.86 116.66 112.82 1w1u n ARG 356 Ca -0.02 -2.31 0.00 0.00 -0.77 0.00 0.00 57.85 54.75 1w1u n ARG 356 Cb 0.09 -1.43 0.00 0.00 -1.02 0.00 0.00 32.46 30.10 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 0.67 0.50 3.75 -0.13 0.00 0.11 -1.94 105.19 108.16 1w1u n GLY 357 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.13 3.65 0.05 1.61 1.01 -0.53 -3.89 120.40 120.17 1w1u s VAL 358 Ca 0.00 1.58 -0.19 0.00 0.00 0.00 0.00 61.98 63.37 1w1u s VAL 358 Cb 0.00 -4.01 0.06 0.00 0.00 0.00 0.00 36.38 32.44 1w1u s VAL 358 CO 0.00 0.34 0.87 0.61 0.00 0.00 0.00 175.10 176.92 1w1u n GLY 359 N 1.50 0.52 2.54 4.51 0.00 -1.22 -3.89 105.19 109.15 1w1u n GLY 359 Ca 0.00 -1.04 -0.04 0.00 0.00 0.00 0.00 46.02 44.95 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 -0.62 0.45 -1.91 1.61 -0.04 -1.26 -3.91 135.00 129.32 1w1u n PRO 360 Ca 0.01 -0.35 -0.41 0.00 -0.04 0.00 0.00 63.50 62.71 1w1u n PRO 360 Cb 0.43 -1.74 -0.01 0.00 -0.04 0.00 0.00 33.50 32.14 1w1u n PRO 360 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1w1u s PHE 361 N 3.14 2.77 0.26 0.54 5.36 -1.26 -3.65 117.98 125.14 1w1u s PHE 361 Ca 0.12 1.19 -0.21 0.00 -0.96 0.00 0.00 56.93 57.07 1w1u s PHE 361 Cb 0.05 -3.91 0.03 0.00 -0.34 0.00 0.00 43.02 38.84 1w1u s PHE 361 CO -0.00 -2.71 0.69 -0.98 -1.46 0.00 0.00 175.22 170.76 1w1u s ARG 362 N -1.69 1.71 0.06 10.12 1.70 -0.93 -0.76 118.95 129.15 1w1u s ARG 362 Ca 0.53 -0.92 -0.13 0.00 -0.47 0.00 0.00 55.73 54.74 1w1u s ARG 362 Cb -0.44 0.60 0.02 0.00 -0.57 0.00 0.00 34.95 34.56 1w1u s ARG 362 CO 0.57 -0.78 0.28 1.67 -1.08 0.00 0.00 175.30 175.97 1w1u s TRP 363 N -3.90 -0.05 0.04 5.89 -2.14 -0.86 -0.46 118.94 117.46 1w1u s TRP 363 Ca 0.10 -0.18 0.05 0.00 2.66 0.00 0.00 56.10 58.73 1w1u s TRP 363 Cb -0.05 0.08 -0.02 0.00 -3.10 0.00 0.00 33.47 30.37 1w1u s TRP 363 CO 0.04 -0.53 -0.14 0.00 -2.66 0.00 0.00 176.95 173.66 1w1u s ALA 364 N -3.01 1.13 -0.47 2.67 0.00 -0.22 -1.43 121.76 120.42 1w1u s ALA 364 Ca -0.02 -0.84 -0.19 0.00 0.00 0.00 0.00 51.96 50.92 1w1u s ALA 364 Cb 0.01 -0.16 0.04 0.00 0.00 0.00 0.00 23.12 23.01 1w1u s ALA 364 CO -0.06 0.20 0.56 0.00 0.00 0.00 0.00 175.76 176.45 1w1u s ALA 365 N -0.92 3.41 0.62 0.00 0.00 -0.50 -1.46 121.76 122.91 1w1u s ALA 365 Ca 0.01 -1.64 0.35 0.00 0.00 0.00 0.00 51.96 50.67 1w1u s ALA 365 Cb -0.08 -3.24 2.01 0.00 0.00 0.00 0.00 23.12 21.81 1w1u s ALA 365 CO 0.01 -1.84 2.27 -0.07 0.00 0.00 0.00 175.76 176.14 1w1u h LEU 366 N 9.44 0.00 -1.07 0.00 3.38 -1.81 -1.57 115.31 123.68 1w1u h LEU 366 Ca -0.27 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.68 1w1u h LEU 366 Cb 1.10 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.82 1w1u h LEU 366 CO 0.90 0.00 0.39 0.77 0.09 0.00 0.00 178.44 180.59 1w1u h SER 367 N 0.00 0.93 0.00 -0.43 4.64 -1.81 -3.39 113.55 113.49 1w1u h SER 367 Ca 0.01 -0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 1w1u h SER 367 Cb 0.07 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 61.92 1w1u h SER 367 CO -0.00 0.76 0.00 0.61 -0.87 0.00 0.00 176.83 177.33 1w1u n GLY 368 N -1.15 0.64 3.69 -0.77 0.00 -0.59 -2.20 105.19 104.81 1w1u n GLY 368 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.74 4.28 0.26 1.61 2.02 -1.26 -4.53 118.70 120.34 1w1u s GLU 369 Ca 0.00 0.48 -0.04 0.00 0.02 0.00 0.00 54.97 55.42 1w1u s GLU 369 Cb 0.00 -3.50 0.32 0.00 0.10 0.00 0.00 34.13 31.05 1w1u s GLU 369 CO 0.00 -0.01 1.90 0.00 0.02 0.00 0.00 175.26 177.18 1w1u h ALA 370 N 7.09 1.27 -0.00 5.21 0.00 -1.96 -1.93 119.26 128.93 1w1u h ALA 370 Ca -0.37 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1w1u h ALA 370 Cb 1.17 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 1w1u h ALA 370 CO 0.75 0.61 0.04 1.49 0.00 0.00 0.00 179.25 182.15 1w1u h GLU 371 N 1.18 0.00 -0.33 0.00 4.81 -1.98 0.41 114.58 118.67 1w1u h GLU 371 Ca 0.30 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 59.45 1w1u h GLU 371 Cb -0.02 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 1w1u h GLU 371 CO -0.05 0.00 -0.13 -0.44 -0.73 0.00 0.00 179.01 177.65 1w1u h ASP 372 N 0.00 0.68 -0.38 1.04 3.32 -1.73 -0.96 116.42 118.39 1w1u h ASP 372 Ca 0.00 -0.39 -0.15 0.00 0.02 0.00 0.00 57.03 56.51 1w1u h ASP 372 Cb 0.09 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 1w1u h ASP 372 CO -0.00 0.92 -0.34 0.40 -1.72 0.00 0.00 179.24 178.50 1w1u h ILE 373 N 0.44 1.27 -0.94 0.35 5.03 -1.06 -2.12 117.51 120.49 1w1u h ILE 373 Ca 0.08 -1.52 0.04 0.00 -0.12 0.00 0.00 64.86 63.34 1w1u h ILE 373 Cb 0.65 1.33 -0.06 0.00 -3.03 0.00 0.00 36.82 35.71 1w1u h ILE 373 CO 0.04 0.51 0.60 1.88 -0.68 0.00 0.00 178.15 180.51 1w1u h TYR 374 N 0.77 1.13 -0.49 1.37 0.05 -1.22 0.58 116.97 119.15 1w1u h TYR 374 Ca 0.07 0.03 -0.07 0.00 0.05 0.00 0.00 58.73 58.81 1w1u h TYR 374 Cb 0.93 -0.37 -0.02 0.00 1.01 0.00 0.00 36.73 38.27 1w1u h TYR 374 CO 0.06 0.63 0.00 0.87 -1.05 0.00 0.00 178.16 178.67 1w1u h LYS 375 N 1.15 0.81 -0.13 4.88 1.57 -0.93 -1.25 116.57 122.67 1w1u h LYS 375 Ca 0.38 -0.22 -0.16 0.00 -1.87 0.00 0.00 60.65 58.78 1w1u h LYS 375 Cb 0.05 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 1w1u h LYS 375 CO -0.14 0.82 -0.59 1.79 -0.57 0.00 0.00 179.45 180.76 1w1u h THR 376 N 0.76 1.35 -0.47 -0.16 1.35 -0.41 -0.93 112.91 114.40 1w1u h THR 376 Ca 0.15 -1.90 0.03 0.00 -0.55 0.00 0.00 66.41 64.13 1w1u h THR 376 Cb 0.46 1.90 -0.03 0.00 -1.73 0.00 0.00 68.15 68.74 1w1u h THR 376 CO 0.02 0.58 0.26 0.44 -0.25 0.00 0.00 175.52 176.57 1w1u h ASP 377 N 0.32 0.41 -0.60 5.36 3.32 0.64 0.11 116.42 125.98 1w1u h ASP 377 Ca -0.00 0.01 -0.09 0.00 0.02 0.00 0.00 57.03 56.96 1w1u h ASP 377 Cb 1.12 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.58 1w1u h ASP 377 CO 0.10 0.29 0.01 0.00 -1.72 0.00 0.00 179.24 177.93 1w1u h ALA 378 N 1.22 0.86 -0.43 3.45 0.00 -1.12 -2.69 119.26 120.56 1w1u h ALA 378 Ca 0.19 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1w1u h ALA 378 Cb 0.05 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1w1u h ALA 378 CO -0.10 0.67 0.20 -0.22 0.00 0.00 0.00 179.25 179.79 1w1u h LYS 379 N 0.97 0.63 -0.24 0.00 1.63 -0.48 -2.32 116.57 116.77 1w1u h LYS 379 Ca 0.17 -0.10 0.04 0.00 -0.85 0.00 0.00 60.65 59.92 1w1u h LYS 379 Cb 0.54 -0.11 -0.04 0.00 -0.60 0.00 0.00 32.23 32.02 1w1u h LYS 379 CO 0.03 0.56 -0.02 0.28 -3.45 0.00 0.00 179.45 176.85 1w1u h VAL 380 N 0.56 0.81 -0.79 2.00 2.07 -0.62 -0.51 116.25 119.76 1w1u h VAL 380 Ca 0.15 -0.02 0.05 0.00 0.82 0.00 0.00 66.70 67.70 1w1u h VAL 380 Cb 0.15 0.76 -0.05 0.00 -1.52 0.00 0.00 31.29 30.62 1w1u h VAL 380 CO -0.02 0.01 0.52 0.11 0.02 0.00 0.00 177.57 178.21 1w1u h LYS 381 N 0.05 0.89 -0.54 1.57 1.57 -1.35 0.17 116.57 118.92 1w1u h LYS 381 Ca 0.11 -0.05 -0.07 0.00 -1.87 0.00 0.00 60.65 58.77 1w1u h LYS 381 Cb 0.15 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 1w1u h LYS 381 CO -0.21 0.59 0.08 1.49 -0.57 0.00 0.00 179.45 180.83 1w1u h GLU 382 N 0.92 0.89 0.00 3.15 4.81 -0.71 -1.93 114.58 121.71 1w1u h GLU 382 Ca 0.33 -0.25 -0.01 0.00 -0.13 0.00 0.00 59.36 59.31 1w1u h GLU 382 Cb 0.14 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.42 1w1u h GLU 382 CO -0.11 0.88 -0.12 -0.07 -0.73 0.00 0.00 179.01 178.85 1w1u h LEU 383 N 0.78 0.00 -5.87 1.64 3.38 -0.32 -3.33 115.31 111.59 1w1u h LEU 383 Ca 0.16 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.57 1w1u h LEU 383 Cb 0.42 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 40.76 1w1u h LEU 383 CO 0.01 0.04 -0.86 -0.38 0.09 0.00 0.00 178.44 177.33 1w1u n ILE 384 N -3.07 1.26 0.33 1.22 5.41 0.51 -4.94 119.36 120.07 1w1u n ILE 384 Ca 0.03 -4.89 0.15 0.00 1.00 0.00 0.00 62.75 59.04 1w1u n ILE 384 Cb 0.55 -1.47 0.62 0.00 -0.71 0.00 0.00 39.64 38.63 1w1u n ILE 384 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 176.55 178.10 1w1u h PRO 385 N 3.55 0.00 -0.83 0.38 0.13 -1.47 -3.28 132.00 130.49 1w1u h PRO 385 Ca 0.13 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.67 1w1u h PRO 385 Cb 0.74 0.00 -0.38 0.00 0.13 0.00 0.00 31.00 31.49 1w1u h PRO 385 CO 0.67 0.00 -0.24 -0.25 -0.23 0.00 0.00 178.00 177.95 1w1u n ASP 386 N -2.63 5.82 -3.58 1.44 8.00 -1.26 -4.80 116.55 119.53 1w1u n ASP 386 Ca 0.01 -3.76 -0.28 0.00 0.71 0.00 0.00 54.79 51.47 1w1u n ASP 386 Cb 0.24 -0.56 -0.11 0.00 -0.02 0.00 0.00 41.12 40.67 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 -2.99 2.76 0.34 -2.24 -1.08 -1.24 -4.98 116.67 107.25 1w1u s ASP 387 Ca 0.56 -3.15 0.06 0.00 -0.52 0.00 0.00 52.55 49.50 1w1u s ASP 387 Cb 0.44 -0.84 0.74 0.00 -1.46 0.00 0.00 42.92 41.80 1w1u s ASP 387 CO 0.02 -0.17 1.90 0.00 0.52 0.00 0.00 175.17 177.44 1w1u h ALA 388 N 5.84 1.73 -0.64 3.66 0.00 -1.90 -0.04 119.26 127.91 1w1u h ALA 388 Ca 0.18 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1w1u h ALA 388 Cb 0.88 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 1w1u h ALA 388 CO 0.47 0.08 0.40 1.25 0.00 0.00 0.00 179.25 181.46 1w1u h HIS 389 N 0.78 0.82 0.27 0.00 -0.00 -1.98 0.20 115.15 115.25 1w1u h HIS 389 Ca 0.40 0.01 -0.01 0.00 -0.00 0.00 0.00 60.37 60.77 1w1u h HIS 389 Cb 0.50 -0.27 0.00 0.00 -0.00 0.00 0.00 27.41 27.63 1w1u h HIS 389 CO -0.00 0.54 -0.14 1.25 -0.00 0.00 0.00 177.93 179.58 1w1u h LEU 390 N 0.87 -0.33 -0.45 0.26 7.12 -1.45 -0.85 115.31 120.48 1w1u h LEU 390 Ca 0.23 0.01 0.02 0.00 0.13 0.00 0.00 57.88 58.28 1w1u h LEU 390 Cb -0.06 0.09 -0.03 0.00 -0.53 0.00 0.00 40.66 40.12 1w1u h LEU 390 CO -0.05 -0.23 0.25 0.45 -0.13 0.00 0.00 178.44 178.74 1w1u h HIS 391 N -0.38 0.48 -0.44 1.25 3.86 -0.94 -1.04 115.15 117.95 1w1u h HIS 391 Ca -0.04 0.02 0.05 0.00 -1.16 0.00 0.00 60.37 59.24 1w1u h HIS 391 Cb 0.30 -0.15 -0.02 0.00 1.06 0.00 0.00 27.41 28.59 1w1u h HIS 391 CO -0.06 0.27 0.29 -0.09 0.86 0.00 0.00 177.93 179.20 1w1u h ARG 392 N 0.51 0.36 -0.19 2.45 2.43 -0.42 0.08 114.38 119.61 1w1u h ARG 392 Ca 0.18 -0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.25 1w1u h ARG 392 Cb 0.03 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.50 1w1u h ARG 392 CO -0.09 0.24 -0.18 2.35 -1.51 0.00 0.00 179.97 180.78 1w1u h TRP 393 N 0.37 0.54 -0.95 2.20 2.91 0.10 -1.69 115.95 119.43 1w1u h TRP 393 Ca 0.19 -0.16 -0.01 0.00 1.13 0.00 0.00 58.89 60.04 1w1u h TRP 393 Cb 0.27 -0.12 -0.05 0.00 -0.51 0.00 0.00 29.16 28.76 1w1u h TRP 393 CO -0.00 0.81 0.56 -0.07 -1.03 0.00 0.00 178.44 178.71 1w1u h LEU 394 N 0.12 1.14 -0.40 0.65 3.38 -0.36 0.03 115.31 119.87 1w1u h LEU 394 Ca 0.03 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 1w1u h LEU 394 Cb 0.72 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 1w1u h LEU 394 CO 0.04 0.88 0.07 0.44 0.09 0.00 0.00 178.44 179.97 1w1u h ASP 395 N 1.31 0.62 -0.21 -0.43 3.32 -0.96 -1.19 116.42 118.88 1w1u h ASP 395 Ca 0.34 -0.25 -0.08 0.00 0.02 0.00 0.00 57.03 57.05 1w1u h ASP 395 Cb -0.04 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.32 1w1u h ASP 395 CO -0.06 0.71 -0.13 0.24 -1.72 0.00 0.00 179.24 178.28 1w1u h MET 396 N 0.50 0.61 -0.14 3.56 2.86 -1.00 -0.63 114.93 120.69 1w1u h MET 396 Ca 0.12 -0.19 -0.02 0.00 -2.06 0.00 0.00 59.70 57.54 1w1u h MET 396 Cb 0.35 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 31.95 1w1u h MET 396 CO 0.01 0.73 -0.01 0.00 1.06 0.00 0.00 176.91 178.69 1w1u h ALA 397 N 1.30 0.19 -1.00 6.32 0.00 -0.76 0.77 119.26 126.08 1w1u h ALA 397 Ca 0.10 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 54.84 1w1u h ALA 397 Cb 0.55 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.23 1w1u h ALA 397 CO 0.03 -0.10 0.66 -0.09 0.00 0.00 0.00 179.25 179.75 1w1u h ARG 398 N -0.03 1.24 0.06 0.00 9.65 -1.09 1.00 114.38 125.21 1w1u h ARG 398 Ca 0.04 -0.07 -0.00 0.00 -1.10 0.00 0.00 59.98 58.84 1w1u h ARG 398 Cb 0.39 -0.28 0.00 0.00 -1.39 0.00 0.00 29.97 28.69 1w1u h ARG 398 CO 0.01 0.82 -0.03 0.93 2.80 0.00 0.00 179.97 184.50 1w1u h GLU 399 N 1.28 -0.08 0.00 0.20 5.08 -0.82 -3.41 114.58 116.83 1w1u h GLU 399 Ca 0.40 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.76 1w1u h GLU 399 Cb -0.01 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1w1u h GLU 399 CO -0.12 0.49 -0.94 0.54 -1.00 0.00 0.00 179.01 177.98 1w1u n ARG 400 N -4.82 2.03 -3.27 2.33 5.12 0.26 -4.94 116.66 113.37 1w1u n ARG 400 Ca -0.08 -0.04 -0.43 0.00 -1.93 0.00 0.00 57.85 55.37 1w1u n ARG 400 Cb 0.30 -1.15 -0.08 0.00 -1.16 0.00 0.00 32.46 30.37 1w1u n ARG 400 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1w1u s ILE 401 N -2.41 5.03 0.13 0.55 -1.09 0.34 -4.91 121.20 118.84 1w1u s ILE 401 Ca 0.01 -0.16 -0.27 0.00 -2.23 0.00 0.00 60.65 58.00 1w1u s ILE 401 Cb 0.09 -4.05 -0.07 0.00 -1.58 0.00 0.00 42.46 36.85 1w1u s ILE 401 CO 0.50 -0.42 0.84 -0.55 -1.23 0.00 0.00 174.94 174.08 1w1u s SER 402 N 1.84 7.40 0.53 3.58 0.15 -1.26 -4.70 113.70 121.23 1w1u s SER 402 Ca 0.15 1.66 -0.21 0.00 0.70 0.00 0.00 55.95 58.25 1w1u s SER 402 Cb -0.16 -2.53 -0.05 0.00 -1.71 0.00 0.00 66.02 61.57 1w1u s SER 402 CO 0.15 0.08 1.22 -0.36 1.20 0.00 0.00 173.24 175.52 1w1u s PHE 403 N -0.55 2.57 -0.11 3.44 0.08 -1.26 -4.96 117.98 117.18 1w1u s PHE 403 Ca 0.40 1.49 0.00 0.00 0.12 0.00 0.00 56.93 58.94 1w1u s PHE 403 Cb -0.23 -3.50 0.02 0.00 -0.57 0.00 0.00 43.02 38.75 1w1u s PHE 403 CO 0.27 -2.05 -0.10 -0.65 -0.10 0.00 0.00 175.22 172.60 1w1u s GLN 404 N -3.00 1.71 6.22 0.44 -0.21 -1.26 -5.04 119.66 118.52 1w1u s GLN 404 Ca 0.71 -0.34 0.00 0.00 0.02 0.00 0.00 55.36 55.75 1w1u s GLN 404 Cb -0.31 -1.67 0.00 0.00 1.00 0.00 0.00 33.01 32.02 1w1u s GLN 404 CO 0.36 -0.22 0.00 0.41 -2.12 0.00 0.00 175.29 173.72 1w1u n GLY 405 N 4.76 2.54 3.73 3.09 0.00 -1.26 -4.60 105.19 113.45 1w1u n GLY 405 Ca -0.15 -0.41 -0.42 0.00 0.00 0.00 0.00 46.02 45.05 1w1u n GLY 405 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1w1u s LEU 406 N 0.00 4.39 0.07 0.99 1.43 -1.26 -4.90 118.68 119.40 1w1u s LEU 406 Ca 0.00 2.54 -0.35 0.00 -1.03 0.00 0.00 54.13 55.28 1w1u s LEU 406 Cb 0.00 -3.61 -0.15 0.00 0.03 0.00 0.00 46.19 42.46 1w1u s LEU 406 CO 0.00 -0.67 1.55 -2.65 0.23 0.00 0.00 176.35 174.81 1w1u n PRO 407 N 2.96 1.75 -4.19 1.29 -0.02 -1.26 -4.80 135.00 130.73 1w1u n PRO 407 Ca 0.09 0.63 -0.12 0.00 -2.02 0.00 0.00 63.50 62.08 1w1u n PRO 407 Cb 0.41 -2.37 -0.10 0.00 -0.02 0.00 0.00 33.50 31.42 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 1.34 1.11 -0.07 3.55 0.00 -1.26 -1.41 121.76 125.02 1w1u s ALA 408 Ca 0.84 -1.64 -0.04 0.00 0.00 0.00 0.00 51.96 51.12 1w1u s ALA 408 Cb -0.80 1.19 0.03 0.00 0.00 0.00 0.00 23.12 23.54 1w1u s ALA 408 CO 0.44 -0.54 0.18 0.50 0.00 0.00 0.00 175.76 176.34 1w1u s ARG 409 N -4.11 0.16 -0.15 0.00 6.06 -0.52 -4.99 118.95 115.40 1w1u s ARG 409 Ca 0.34 0.36 -0.08 0.00 -2.50 0.00 0.00 55.73 53.85 1w1u s ARG 409 Cb 0.07 -0.07 -0.04 0.00 0.06 0.00 0.00 34.95 34.97 1w1u s ARG 409 CO 0.09 -0.12 0.12 -1.50 -2.50 0.00 0.00 175.30 171.39 1w1u s ILE 410 N 0.82 5.36 -0.28 4.11 1.10 -1.26 -2.03 121.20 129.01 1w1u s ILE 410 Ca -0.06 0.16 0.01 0.00 -0.51 0.00 0.00 60.65 60.25 1w1u s ILE 410 Cb -0.08 -3.37 0.17 0.00 0.15 0.00 0.00 42.46 39.34 1w1u s ILE 410 CO -0.04 0.55 0.51 0.00 -2.11 0.00 0.00 174.94 173.84 1w1u s TRP 412 N 2.71 2.02 0.06 0.00 0.52 -1.26 -4.00 118.94 118.99 1w1u s TRP 412 Ca 0.14 0.65 -0.04 0.00 0.02 0.00 0.00 56.10 56.86 1w1u s TRP 412 Cb -0.13 -4.21 -0.02 0.00 -1.15 0.00 0.00 33.47 27.96 1w1u s TRP 412 CO -0.23 -2.46 0.07 0.14 0.02 0.00 0.00 176.95 174.48 1w1u s VAL 413 N 6.68 0.17 0.00 4.03 -7.23 -1.25 -4.85 120.40 117.95 1w1u s VAL 413 Ca 0.69 -1.43 0.00 0.00 -1.81 0.00 0.00 61.98 59.43 1w1u s VAL 413 Cb -0.17 -1.29 0.00 0.00 0.56 0.00 0.00 36.38 35.48 1w1u s VAL 413 CO 0.31 -0.79 0.00 0.61 -0.31 0.00 0.00 175.10 174.91 1w1u n GLY 414 N 0.24 5.11 3.65 2.32 0.00 -1.26 -3.38 105.19 111.87 1w1u n GLY 414 Ca -0.16 -1.69 -0.52 0.00 0.00 0.00 0.00 46.02 43.65 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 2.41 0.00 0.99 0.00 -0.82 -2.49 117.00 117.09 1w1u n LEU 415 Ca 0.00 1.08 0.00 0.00 0.00 0.00 0.00 56.01 57.09 1w1u n LEU 415 Cb 0.00 -1.25 0.00 0.00 0.00 0.00 0.00 43.42 42.17 1w1u n LEU 415 CO 0.00 -0.58 0.00 0.61 0.00 0.00 0.00 177.39 177.42 1w1u n GLY 416 N 3.41 2.40 0.23 -3.96 0.00 -1.26 -4.78 105.19 101.24 1w1u n GLY 416 Ca 0.21 -0.67 -0.03 0.00 0.00 0.00 0.00 46.02 45.52 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 0.47 -0.49 0.99 3.38 -1.90 -3.10 115.31 114.66 1w1u h LEU 417 Ca 0.00 -0.16 0.08 0.00 0.09 0.00 0.00 57.88 57.89 1w1u h LEU 417 Cb 0.00 -0.13 -0.07 0.00 0.09 0.00 0.00 40.66 40.56 1w1u h LEU 417 CO 0.00 0.73 0.12 0.03 0.09 0.00 0.00 178.44 179.41 1w1u h ARG 418 N 0.41 0.26 0.00 1.13 3.08 -1.77 0.38 114.38 117.87 1w1u h ARG 418 Ca 0.06 -0.02 -0.08 0.00 0.07 0.00 0.00 59.98 60.02 1w1u h ARG 418 Cb 0.68 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.66 1w1u h ARG 418 CO 0.05 0.17 -0.37 0.00 -1.07 0.00 0.00 179.97 178.76 1w1u h ALA 419 N 1.37 1.11 -0.22 0.04 0.00 -1.67 -0.51 119.26 119.37 1w1u h ALA 419 Ca 0.25 -0.33 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 1w1u h ALA 419 Cb 0.31 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1w1u h ALA 419 CO -0.30 0.46 -0.12 -0.22 0.00 0.00 0.00 179.25 179.07 1w1u h LYS 420 N 0.00 0.47 -0.25 0.00 3.64 -1.10 -1.82 116.57 117.52 1w1u h LYS 420 Ca -0.00 -0.21 -0.04 0.00 -1.27 0.00 0.00 60.65 59.12 1w1u h LYS 420 Cb 0.80 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.60 1w1u h LYS 420 CO 0.05 0.76 0.00 -0.07 -2.27 0.00 0.00 179.45 177.92 1w1u h LEU 421 N 0.18 0.42 -0.89 5.20 4.07 -0.78 -2.38 115.31 121.13 1w1u h LEU 421 Ca 0.05 -0.31 -0.03 0.00 0.08 0.00 0.00 57.88 57.68 1w1u h LEU 421 Cb 0.62 -0.11 -0.04 0.00 1.08 0.00 0.00 40.66 42.21 1w1u h LEU 421 CO 0.04 0.63 0.44 1.23 -1.08 0.00 0.00 178.44 179.69 1w1u h GLY 422 N 0.21 1.32 1.28 0.83 0.00 -1.08 -0.91 103.07 104.71 1w1u h GLY 422 Ca 0.07 -0.63 -0.17 0.00 0.00 0.00 0.00 47.33 46.60 1w1u h GLY 422 CO 0.01 0.60 -0.52 1.41 0.00 0.00 0.00 176.54 178.05 1w1u h LEU 423 N 1.22 0.84 -0.09 3.11 3.38 -1.34 -2.14 115.31 120.29 1w1u h LEU 423 Ca 0.30 -0.44 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 1w1u h LEU 423 Cb 0.08 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.59 1w1u h LEU 423 CO -0.04 1.20 0.04 0.00 0.09 0.00 0.00 178.44 179.73 1w1u h ALA 424 N 0.82 0.12 -0.86 1.53 0.00 -1.15 -1.45 119.26 118.28 1w1u h ALA 424 Ca 0.02 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 1w1u h ALA 424 Cb 1.10 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.81 1w1u h ALA 424 CO 0.11 -0.30 0.53 0.74 0.00 0.00 0.00 179.25 180.33 1w1u h PHE 425 N 0.01 1.11 -0.77 0.00 0.04 -1.18 -0.51 116.94 115.64 1w1u h PHE 425 Ca 0.03 0.01 -0.02 0.00 2.80 0.00 0.00 57.97 60.78 1w1u h PHE 425 Cb 0.15 -0.37 -0.04 0.00 2.20 0.00 0.00 35.95 37.90 1w1u h PHE 425 CO -0.02 0.73 0.38 -0.97 -0.60 0.00 0.00 178.31 177.83 1w1u h ASN 426 N 1.17 0.99 0.78 2.17 -1.24 -1.14 -1.34 115.58 116.98 1w1u h ASN 426 Ca 0.31 -0.12 -0.04 0.00 0.71 0.00 0.00 56.30 57.16 1w1u h ASN 426 Cb -0.08 -0.25 -0.01 0.00 0.73 0.00 0.00 38.32 38.72 1w1u h ASN 426 CO -0.06 0.84 -0.18 -0.08 -1.29 0.00 0.00 177.43 176.66 1w1u h GLU 427 N 1.08 0.00 0.00 6.67 4.22 -0.22 -1.50 114.58 124.82 1w1u h GLU 427 Ca 0.27 0.00 -0.16 0.00 0.08 0.00 0.00 59.36 59.55 1w1u h GLU 427 Cb 0.10 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 1w1u h GLU 427 CO -0.04 0.18 -0.75 0.52 -2.18 0.00 0.00 179.01 176.75 1w1u h MET 428 N 0.00 0.00 -0.08 1.92 2.86 -0.20 -2.05 114.93 117.38 1w1u h MET 428 Ca -0.00 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.49 1w1u h MET 428 Cb 0.62 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.29 1w1u h MET 428 CO 0.02 0.75 -0.53 0.28 1.06 0.00 0.00 176.91 178.49 1w1u h VAL 429 N 0.00 1.37 -0.46 -2.22 2.07 -0.83 0.41 116.25 116.59 1w1u h VAL 429 Ca -0.01 -1.88 -0.00 0.00 0.82 0.00 0.00 66.70 65.63 1w1u h VAL 429 Cb 1.51 2.27 -0.02 0.00 -1.52 0.00 0.00 31.29 33.53 1w1u h VAL 429 CO 0.10 0.56 0.28 -0.09 0.02 0.00 0.00 177.57 178.44 1w1u h ARG 430 N 0.09 0.62 0.00 1.57 2.43 -1.27 -2.71 114.38 115.11 1w1u h ARG 430 Ca -0.04 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.07 1w1u h ARG 430 Cb 1.19 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.61 1w1u h ARG 430 CO 0.11 0.45 0.00 -1.13 -1.51 0.00 0.00 179.97 177.89 1w1u n SER 431 N -4.73 0.43 0.00 -3.80 3.41 -0.78 -4.91 113.62 103.24 1w1u n SER 431 Ca 0.02 0.55 0.00 0.00 -0.26 0.00 0.00 58.87 59.18 1w1u n SER 431 Cb 0.05 -0.66 0.00 0.00 -0.26 0.00 0.00 64.21 63.33 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 1.08 0.72 0.30 5.00 0.00 -0.88 -4.91 105.19 106.50 1w1u n GLY 432 Ca 0.05 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.11 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 4.18 0.51 -5.37 1.61 4.81 -1.24 -3.38 114.58 115.69 1w1u h GLU 433 Ca 0.00 -0.03 -0.62 0.00 -0.13 0.00 0.00 59.36 58.57 1w1u h GLU 433 Cb 0.00 -0.11 -0.14 0.00 0.63 0.00 0.00 28.75 29.12 1w1u h GLU 433 CO 0.00 0.35 -0.55 -0.51 -0.73 0.00 0.00 179.01 177.57 1w1u s LEU 434 N -9.45 3.92 0.13 1.64 1.43 -0.41 -4.98 118.68 110.95 1w1u s LEU 434 Ca -0.08 0.15 -0.30 0.00 -1.03 0.00 0.00 54.13 52.87 1w1u s LEU 434 Cb 0.17 -1.98 -0.06 0.00 0.03 0.00 0.00 46.19 44.35 1w1u s LEU 434 CO 0.73 0.22 1.57 0.28 0.23 0.00 0.00 176.35 179.38 1w1u h SER 435 N 6.38 -1.43 -4.13 2.29 0.02 -1.90 -3.43 113.55 111.35 1w1u h SER 435 Ca -0.40 0.19 -0.46 0.00 -0.84 0.00 0.00 61.79 60.27 1w1u h SER 435 Cb 1.17 0.58 -0.14 0.00 0.14 0.00 0.00 62.40 64.16 1w1u h SER 435 CO 0.69 -0.43 -0.55 0.00 -1.14 0.00 0.00 176.83 175.40 1w1u s ALA 436 N -5.84 2.27 0.80 3.77 0.00 -1.26 -4.96 121.76 116.54 1w1u s ALA 436 Ca -0.15 -1.66 -0.13 0.00 0.00 0.00 0.00 51.96 50.02 1w1u s ALA 436 Cb 0.09 0.99 0.08 0.00 0.00 0.00 0.00 23.12 24.28 1w1u s ALA 436 CO 0.64 -0.44 1.17 -2.14 0.00 0.00 0.00 175.76 174.99 1w1u s PRO 437 N -3.79 1.76 0.13 0.00 0.02 -1.26 -4.75 135.00 127.11 1w1u s PRO 437 Ca 0.33 1.63 0.10 0.00 0.02 0.00 0.00 61.00 63.08 1w1u s PRO 437 Cb 0.05 -1.80 -0.04 0.00 0.02 0.00 0.00 34.50 32.72 1w1u s PRO 437 CO 0.17 -2.09 -0.25 0.14 -0.33 0.00 0.00 177.00 174.63 1w1u s VAL 438 N -2.31 2.14 -0.10 3.83 -7.23 -1.14 -2.68 120.40 112.91 1w1u s VAL 438 Ca 0.70 -1.74 -0.05 0.00 -1.81 0.00 0.00 61.98 59.08 1w1u s VAL 438 Cb -0.26 -1.91 -0.04 0.00 0.56 0.00 0.00 36.38 34.73 1w1u s VAL 438 CO 0.51 0.03 0.10 0.68 -0.31 0.00 0.00 175.10 176.11 1w1u s VAL 439 N -1.16 5.15 -0.18 1.32 -7.23 -0.53 -1.29 120.40 116.47 1w1u s VAL 439 Ca 0.13 0.04 -0.02 0.00 -1.81 0.00 0.00 61.98 60.32 1w1u s VAL 439 Cb -0.10 -3.24 -0.01 0.00 0.56 0.00 0.00 36.38 33.59 1w1u s VAL 439 CO 0.06 0.59 -0.09 -0.63 -0.31 0.00 0.00 175.10 174.71 1w1u s ILE 440 N -1.02 3.15 0.00 -0.62 1.09 -0.17 -1.06 121.20 122.57 1w1u s ILE 440 Ca 0.16 -0.59 0.00 0.00 -1.10 0.00 0.00 60.65 59.11 1w1u s ILE 440 Cb -0.12 -2.38 0.00 0.00 -1.06 0.00 0.00 42.46 38.90 1w1u s ILE 440 CO 0.05 0.48 0.00 0.61 -0.10 0.00 0.00 174.94 175.98 1w1u n GLY 441 N 4.22 5.27 0.00 6.18 0.00 0.39 -1.02 105.19 120.22 1w1u n GLY 441 Ca -0.18 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 44.84 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 -1.03 -2.14 1.61 1.85 -1.26 -2.19 116.66 113.50 1w1u n ARG 442 Ca 0.00 0.00 -0.27 0.00 -1.00 0.00 0.00 57.85 56.58 1w1u n ARG 442 Cb 0.00 0.00 0.11 0.00 -1.05 0.00 0.00 32.46 31.52 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 4.22 0.06 2.89 2.15 -1.24 -4.78 116.67 119.97 1w1u s ASP 443 Ca 0.00 0.33 0.27 0.00 0.43 0.00 0.00 52.55 53.58 1w1u s ASP 443 Cb 0.00 -0.74 0.89 0.00 -0.30 0.00 0.00 42.92 42.77 1w1u s ASP 443 CO 0.00 -2.01 1.72 1.41 -0.17 0.00 0.00 175.17 176.12 1w1u n HIS 444 N -3.21 0.26 -2.61 -5.34 8.25 -1.26 -4.52 115.22 106.80 1w1u n HIS 444 Ca 0.11 0.08 -0.43 0.00 -0.26 0.00 0.00 57.72 57.22 1w1u n HIS 444 Cb 0.60 -0.56 -0.02 0.00 1.12 0.00 0.00 29.99 31.13 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 -3.47 3.60 0.17 2.41 0.20 -1.26 -4.17 118.68 116.17 1w1u s LEU 445 Ca 0.12 0.30 -0.24 0.00 0.69 0.00 0.00 54.13 55.00 1w1u s LEU 445 Cb 0.17 -3.38 0.06 0.00 -0.43 0.00 0.00 46.19 42.60 1w1u s LEU 445 CO 0.60 -1.32 0.92 -0.62 -0.29 0.00 0.00 176.35 175.64 1w1u s ASP 446 N 2.63 -0.19 0.21 3.68 2.15 -1.26 -4.35 116.67 119.54 1w1u s ASP 446 Ca 0.45 -0.43 -0.10 0.00 0.43 0.00 0.00 52.55 52.90 1w1u s ASP 446 Cb -0.07 0.53 0.29 0.00 -0.30 0.00 0.00 42.92 43.36 1w1u s ASP 446 CO 0.29 -0.98 1.70 0.77 -0.17 0.00 0.00 175.17 176.78 1w1u h SER 447 N 2.00 -0.05 -0.03 -0.34 4.64 -1.85 -3.24 113.55 114.68 1w1u h SER 447 Ca -0.23 0.12 -0.00 0.00 -0.47 0.00 0.00 61.79 61.20 1w1u h SER 447 Cb 1.23 0.17 -0.00 0.00 -0.31 0.00 0.00 62.40 63.50 1w1u h SER 447 CO 0.25 -0.02 -0.10 0.61 -0.87 0.00 0.00 176.83 176.71 1w1u n GLY 448 N -1.32 4.88 0.20 -0.77 0.00 -1.26 -4.56 105.19 102.36 1w1u n GLY 448 Ca 0.09 -1.17 0.05 0.00 0.00 0.00 0.00 46.02 44.99 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 -1.30 2.45 -3.67 1.61 3.41 -1.22 -4.05 113.62 110.85 1w1u n SER 449 Ca 0.17 -2.51 -0.14 0.00 -0.26 0.00 0.00 58.87 56.13 1w1u n SER 449 Cb 0.68 -0.24 -0.08 0.00 -0.26 0.00 0.00 64.21 64.30 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 -1.89 0.01 -0.11 -3.33 0.11 -1.26 -0.35 120.40 113.58 1w1u s VAL 450 Ca 0.19 -0.04 0.01 0.00 -2.93 0.00 0.00 61.98 59.21 1w1u s VAL 450 Cb 0.15 -0.80 0.02 0.00 -1.53 0.00 0.00 36.38 34.22 1w1u s VAL 450 CO 0.04 -0.02 -0.14 -0.44 -3.33 0.00 0.00 175.10 171.20 1w1u s SER 451 N -0.06 2.40 -0.39 3.54 0.01 -0.78 -4.71 113.70 113.72 1w1u s SER 451 Ca -0.03 -0.42 0.05 0.00 1.31 0.00 0.00 55.95 56.87 1w1u s SER 451 Cb -0.04 -1.06 0.18 0.00 0.21 0.00 0.00 66.02 65.32 1w1u s SER 451 CO 0.02 -0.01 0.68 -0.55 0.41 0.00 0.00 173.24 173.80 1w1u s SER 452 N 1.10 -1.38 0.56 2.44 0.15 -1.26 -2.39 113.70 112.92 1w1u s SER 452 Ca -0.05 -0.62 0.34 0.00 0.70 0.00 0.00 55.95 56.32 1w1u s SER 452 Cb -0.14 1.78 1.47 0.00 -1.71 0.00 0.00 66.02 67.41 1w1u s SER 452 CO -0.03 -0.16 1.78 -0.65 1.20 0.00 0.00 173.24 175.37 1w1u h PRO 453 N 6.89 0.00 -0.64 5.44 0.11 -1.75 0.43 132.00 142.48 1w1u h PRO 453 Ca 0.03 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.14 1w1u h PRO 453 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1w1u h PRO 453 CO 0.08 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 177.96 1w1u n ASN 454 N -3.96 3.73 0.00 -2.05 3.02 -1.26 -3.63 115.26 111.12 1w1u n ASN 454 Ca 0.21 -2.00 0.00 0.00 -0.03 0.00 0.00 54.58 52.76 1w1u n ASN 454 Cb 1.12 -0.43 0.00 0.00 -0.61 0.00 0.00 39.78 39.87 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 1.56 0.00 -0.18 5.41 0.00 0.14 -4.73 120.51 122.72 1w1u n ALA 455 Ca 0.23 0.00 0.22 0.00 0.00 0.00 0.00 53.44 53.89 1w1u n ALA 455 Cb 0.60 0.00 0.61 0.00 0.00 0.00 0.00 19.45 20.66 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 0.20 -0.35 0.00 3.07 -1.89 -1.68 114.58 113.94 1w1u h GLU 456 Ca 0.00 -0.01 -0.19 0.00 -0.50 0.00 0.00 59.36 58.66 1w1u h GLU 456 Cb 0.00 -0.05 -0.12 0.00 -0.84 0.00 0.00 28.75 27.75 1w1u h GLU 456 CO 0.00 0.13 -0.14 0.25 -1.40 0.00 0.00 179.01 177.86 1w1u n THR 457 N -4.41 2.55 -2.38 1.13 -2.24 -0.83 -4.84 114.28 103.26 1w1u n THR 457 Ca 0.17 -2.88 -0.42 0.00 -2.27 0.00 0.00 64.05 58.65 1w1u n THR 457 Cb 0.77 -0.36 -0.03 0.00 -2.10 0.00 0.00 70.33 68.60 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 -3.28 4.43 -1.34 -0.78 2.12 -0.63 -3.68 118.70 115.53 1w1u s GLU 458 Ca 0.45 1.83 -0.05 0.00 0.36 0.00 0.00 54.97 57.55 1w1u s GLU 458 Cb 0.41 -3.32 0.02 0.00 0.26 0.00 0.00 34.13 31.50 1w1u s GLU 458 CO -0.01 -0.25 0.99 0.00 -0.54 0.00 0.00 175.26 175.44 1w1u n ALA 459 N 3.69 -1.67 -1.76 6.30 0.00 -1.26 -4.50 120.51 121.31 1w1u n ALA 459 Ca 0.08 0.10 -0.40 0.00 0.00 0.00 0.00 53.44 53.23 1w1u n ALA 459 Cb 0.45 -3.64 0.02 0.00 0.00 0.00 0.00 19.45 16.29 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 -6.03 3.62 0.66 0.00 -1.94 -1.24 -4.85 119.30 109.51 1w1u s MET 460 Ca 0.30 2.40 0.42 0.00 -1.71 0.00 0.00 55.69 57.11 1w1u s MET 460 Cb -0.14 -2.61 2.34 0.00 2.01 0.00 0.00 34.83 36.43 1w1u s MET 460 CO 0.77 -0.87 2.35 0.07 -0.01 0.00 0.00 175.02 177.33 1w1u h ARG 461 N 2.22 0.00 -0.17 2.03 0.11 -1.92 -1.72 114.38 114.93 1w1u h ARG 461 Ca -0.51 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.57 1w1u h ARG 461 Cb 1.27 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.35 1w1u h ARG 461 CO 0.61 0.00 0.00 -0.40 0.10 0.00 0.00 179.97 180.28 1w1u n ASP 462 N -3.17 2.95 0.00 0.08 5.75 -1.26 -4.95 116.55 115.94 1w1u n ASP 462 Ca -0.03 -1.89 0.00 0.00 -0.01 0.00 0.00 54.79 52.86 1w1u n ASP 462 Cb 0.09 -0.10 0.00 0.00 -1.03 0.00 0.00 41.12 40.08 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 1.21 0.42 0.73 6.12 0.00 -0.65 -4.94 105.19 108.09 1w1u n GLY 463 Ca 0.14 -0.76 0.02 0.00 0.00 0.00 0.00 46.02 45.43 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 1.37 1.95 -0.26 1.61 3.41 -1.26 -4.65 113.62 115.79 1w1u n SER 464 Ca 0.00 -2.18 -0.07 0.00 -0.26 0.00 0.00 58.87 56.36 1w1u n SER 464 Cb 0.00 -0.42 -0.06 0.00 -0.26 0.00 0.00 64.21 63.47 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 0.16 -0.65 0.00 4.04 9.92 -1.26 -1.41 116.55 127.35 1w1u n ASP 465 Ca 0.08 1.15 0.11 0.00 -0.53 0.00 0.00 54.79 55.60 1w1u n ASP 465 Cb 0.41 -0.17 0.59 0.00 -0.64 0.00 0.00 41.12 41.31 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 -3.42 2.20 -2.02 2.24 0.00 -1.26 -4.28 120.51 113.97 1w1u n ALA 466 Ca 0.01 -0.12 -0.43 0.00 0.00 0.00 0.00 53.44 52.91 1w1u n ALA 466 Cb 0.16 -1.36 -0.03 0.00 0.00 0.00 0.00 19.45 18.22 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 -2.42 3.55 -1.07 0.00 1.01 -0.50 -4.85 120.40 116.11 1w1u s VAL 467 Ca 0.25 0.59 0.17 0.00 0.00 0.00 0.00 61.98 62.99 1w1u s VAL 467 Cb 0.15 -3.62 0.59 0.00 0.00 0.00 0.00 36.38 33.50 1w1u s VAL 467 CO 0.32 -0.31 1.50 -1.54 0.00 0.00 0.00 175.10 175.07 1w1u n SER 468 N 9.24 4.10 -0.23 3.32 3.41 -1.26 -4.47 113.62 127.74 1w1u n SER 468 Ca 0.21 -2.35 -0.07 0.00 -0.26 0.00 0.00 58.87 56.40 1w1u n SER 468 Cb 0.46 -0.48 0.04 0.00 -0.26 0.00 0.00 64.21 63.96 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 3.32 0.83 -0.23 4.04 3.32 -2.00 -3.28 116.42 122.43 1w1u h ASP 469 Ca 0.00 -0.14 0.05 0.00 0.02 0.00 0.00 57.03 56.96 1w1u h ASP 469 Cb 1.21 -0.21 -0.07 0.00 0.22 0.00 0.00 39.33 40.48 1w1u h ASP 469 CO 0.14 0.73 -0.48 -0.50 -1.72 0.00 0.00 179.24 177.41 1w1u h TRP 470 N 0.87 -1.42 -0.30 4.55 4.06 -1.92 -0.35 115.95 121.44 1w1u h TRP 470 Ca 0.22 0.06 -0.02 0.00 2.06 0.00 0.00 58.89 61.21 1w1u h TRP 470 Cb 0.13 0.65 -0.02 0.00 -1.00 0.00 0.00 29.16 28.92 1w1u h TRP 470 CO 0.00 -0.50 0.09 -1.00 -3.56 0.00 0.00 178.44 173.47 1w1u h PRO 471 N -0.48 0.42 -0.53 0.49 0.13 -1.70 0.45 132.00 130.78 1w1u h PRO 471 Ca 0.07 -0.06 -0.09 0.00 -0.87 0.00 0.00 66.00 65.06 1w1u h PRO 471 Cb 0.64 -0.08 -0.02 0.00 0.13 0.00 0.00 31.00 31.67 1w1u h PRO 471 CO -0.48 0.38 -0.02 -0.07 -0.23 0.00 0.00 178.00 177.58 1w1u h LEU 472 N 0.42 0.89 -0.63 1.56 3.38 -1.44 -1.47 115.31 118.02 1w1u h LEU 472 Ca 0.10 -0.24 -0.13 0.00 0.09 0.00 0.00 57.88 57.70 1w1u h LEU 472 Cb 0.14 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1w1u h LEU 472 CO -0.01 0.97 -0.31 -0.07 0.09 0.00 0.00 178.44 179.11 1w1u h LEU 473 N 0.84 0.76 -0.37 1.67 3.38 -0.11 -1.63 115.31 119.86 1w1u h LEU 473 Ca 0.15 -0.31 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 1w1u h LEU 473 Cb 0.53 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 1w1u h LEU 473 CO 0.03 1.02 0.22 -1.13 0.09 0.00 0.00 178.44 178.66 1w1u h ASN 474 N 0.62 0.45 -0.47 -0.43 -0.73 -0.56 0.14 115.58 114.60 1w1u h ASN 474 Ca 0.07 -0.06 -0.04 0.00 1.87 0.00 0.00 56.30 58.13 1w1u h ASN 474 Cb 0.84 -0.11 -0.02 0.00 0.27 0.00 0.00 38.32 39.29 1w1u h ASN 474 CO 0.07 0.38 0.13 0.00 -0.37 0.00 0.00 177.43 177.65 1w1u h ALA 475 N 1.09 0.62 -0.43 1.57 0.00 -1.18 0.88 119.26 121.81 1w1u h ALA 475 Ca 0.13 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1w1u h ALA 475 Cb 0.02 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1w1u h ALA 475 CO -0.02 0.29 0.27 -0.07 0.00 0.00 0.00 179.25 179.72 1w1u h LEU 476 N 0.63 0.51 -0.65 0.00 4.07 -1.00 -1.32 115.31 117.55 1w1u h LEU 476 Ca 0.15 -0.04 -0.12 0.00 0.08 0.00 0.00 57.88 57.95 1w1u h LEU 476 Cb 0.30 -0.13 -0.01 0.00 1.08 0.00 0.00 40.66 41.90 1w1u h LEU 476 CO -0.00 0.40 -0.22 0.25 -1.08 0.00 0.00 178.44 177.79 1w1u h LEU 477 N 0.57 0.84 -1.28 1.67 5.85 -0.52 -1.32 115.31 121.13 1w1u h LEU 477 Ca 0.16 -0.30 -0.04 0.00 0.84 0.00 0.00 57.88 58.53 1w1u h LEU 477 Cb -0.03 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.75 1w1u h LEU 477 CO -0.03 1.03 0.06 0.78 -0.34 0.00 0.00 178.44 179.94 1w1u h ASN 478 N 0.72 0.51 -0.32 1.25 2.35 -0.55 0.16 115.58 119.69 1w1u h ASN 478 Ca 0.10 -0.08 -0.08 0.00 -0.55 0.00 0.00 56.30 55.69 1w1u h ASN 478 Cb 0.74 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.97 1w1u h ASN 478 CO 0.06 0.53 -0.12 0.74 -1.65 0.00 0.00 177.43 176.99 1w1u h THR 479 N 0.53 1.29 -0.29 2.81 2.02 -0.89 -2.25 112.91 116.14 1w1u h THR 479 Ca 0.12 -1.21 -0.10 0.00 0.77 0.00 0.00 66.41 66.00 1w1u h THR 479 Cb 0.25 1.39 -0.01 0.00 -1.74 0.00 0.00 68.15 68.04 1w1u h THR 479 CO 0.00 0.39 -0.24 0.00 0.37 0.00 0.00 175.52 176.05 1w1u h ALA 480 N 0.78 1.06 0.00 6.16 0.00 -0.61 -3.19 119.26 123.46 1w1u h ALA 480 Ca 0.08 -0.35 -0.18 0.00 0.00 0.00 0.00 54.91 54.46 1w1u h ALA 480 Cb 0.64 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 1w1u h ALA 480 CO 0.04 0.57 -0.84 0.78 0.00 0.00 0.00 179.25 179.81 1w1u h GLY 481 N 1.01 0.00 0.00 0.00 0.00 -0.63 -3.48 103.07 99.96 1w1u h GLY 481 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.40 1w1u h GLY 481 CO 0.05 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.20 1w1u n GLY 482 N 0.89 1.72 3.70 4.60 0.00 -0.92 -4.58 105.19 110.60 1w1u n GLY 482 Ca -0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 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 -1.78 1.82 0.06 4.61 0.00 -0.89 -4.78 121.76 120.79 1w1u s ALA 483 Ca 0.00 0.83 -0.16 0.00 0.00 0.00 0.00 51.96 52.63 1w1u s ALA 483 Cb 0.00 -3.49 -0.22 0.00 0.00 0.00 0.00 23.12 19.41 1w1u s ALA 483 CO 0.00 -2.32 1.18 1.15 0.00 0.00 0.00 175.76 175.78 1w1u h THR 484 N -0.95 1.32 -3.30 0.00 2.02 -0.83 -3.22 112.91 107.96 1w1u h THR 484 Ca -0.46 -2.14 -0.22 0.00 0.77 0.00 0.00 66.41 64.37 1w1u h THR 484 Cb 1.29 2.37 -0.29 0.00 -1.74 0.00 0.00 68.15 69.78 1w1u h THR 484 CO 0.46 0.65 -0.57 -1.66 0.37 0.00 0.00 175.52 174.77 1w1u s TRP 485 N -3.37 -0.17 -0.00 3.16 -2.14 -0.91 0.01 118.94 115.52 1w1u s TRP 485 Ca -0.11 0.46 0.08 0.00 2.66 0.00 0.00 56.10 59.19 1w1u s TRP 485 Cb 0.06 -0.01 -0.02 0.00 -3.10 0.00 0.00 33.47 30.39 1w1u s TRP 485 CO 0.89 -0.13 -0.25 0.08 -2.66 0.00 0.00 176.95 174.87 1w1u s VAL 486 N 0.70 2.02 0.04 -0.66 1.01 -0.98 -1.88 120.40 120.66 1w1u s VAL 486 Ca -0.05 -1.17 0.02 0.00 0.00 0.00 0.00 61.98 60.78 1w1u s VAL 486 Cb -0.07 -1.70 -0.02 0.00 0.00 0.00 0.00 36.38 34.59 1w1u s VAL 486 CO -0.03 0.50 -0.07 -0.94 0.00 0.00 0.00 175.10 174.56 1w1u s SER 487 N -0.78 0.75 -0.16 3.32 1.04 -0.92 -0.12 113.70 116.83 1w1u s SER 487 Ca 0.10 -0.56 -0.01 0.00 0.48 0.00 0.00 55.95 55.96 1w1u s SER 487 Cb -0.10 0.05 0.04 0.00 0.10 0.00 0.00 66.02 66.12 1w1u s SER 487 CO -0.00 -0.24 -0.03 -0.76 0.98 0.00 0.00 173.24 173.20 1w1u s LEU 488 N -1.63 1.37 0.32 2.42 1.43 0.94 -0.65 118.68 122.89 1w1u s LEU 488 Ca -0.10 -0.61 0.10 0.00 -1.03 0.00 0.00 54.13 52.48 1w1u s LEU 488 Cb -0.09 -0.78 -0.06 0.00 0.03 0.00 0.00 46.19 45.30 1w1u s LEU 488 CO -0.00 -0.21 -0.05 -1.00 0.23 0.00 0.00 176.35 175.31 1w1u s HIS 489 N 1.73 2.48 -0.04 0.29 3.76 0.28 -2.13 115.29 121.67 1w1u s HIS 489 Ca 0.01 -0.42 0.04 0.00 -0.15 0.00 0.00 55.06 54.54 1w1u s HIS 489 Cb -0.15 -1.35 -0.00 0.00 1.11 0.00 0.00 32.58 32.18 1w1u s HIS 489 CO -0.07 0.56 -0.14 -1.58 -0.85 0.00 0.00 174.74 172.66 1w1u s HIS 490 N -2.52 1.41 -0.38 1.40 2.46 -1.04 -1.47 115.29 115.15 1w1u s HIS 490 Ca 0.33 -0.39 0.00 0.00 0.47 0.00 0.00 55.06 55.47 1w1u s HIS 490 Cb -0.01 -0.97 0.00 0.00 -0.13 0.00 0.00 32.58 31.47 1w1u s HIS 490 CO 0.18 -0.14 0.00 0.41 -2.47 0.00 0.00 174.74 172.72 1w1u n GLY 491 N 3.22 0.66 3.79 1.59 0.00 0.13 -4.76 105.19 109.81 1w1u n GLY 491 Ca -0.18 -0.87 -0.34 0.00 0.00 0.00 0.00 46.02 44.63 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 -2.92 2.44 0.00 -0.02 0.00 -1.26 -0.86 107.32 104.70 1w1u s GLY 492 Ca 0.00 0.63 0.00 0.00 0.00 0.00 0.00 44.72 45.35 1w1u s GLY 492 CO 0.00 0.97 0.00 0.61 0.00 0.00 0.00 173.10 174.68 1w1u n GLY 493 N -0.28 0.86 0.29 0.20 0.00 -1.26 -3.88 105.19 101.12 1w1u n GLY 493 Ca 0.10 -0.01 0.13 0.00 0.00 0.00 0.00 46.02 46.24 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 0.00 0.00 1.61 0.24 -1.25 -4.41 118.33 114.52 1w1u n VAL 494 Ca 0.00 -0.15 0.00 0.00 -2.04 0.00 0.00 64.34 62.15 1w1u n VAL 494 Cb 0.00 0.53 0.00 0.00 -1.47 0.00 0.00 33.84 32.90 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 1.35 -0.71 3.63 7.63 0.00 -0.04 -4.67 105.19 112.37 1w1u n GLY 495 Ca 0.12 -1.70 -0.62 0.00 0.00 0.00 0.00 46.02 43.82 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 -0.80 0.19 -0.01 1.61 0.00 -1.26 -2.06 117.12 114.80 1w1u n MET 496 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 57.70 57.77 1w1u n MET 496 Cb 0.00 -1.60 0.00 0.00 0.00 0.00 0.00 33.22 31.62 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 2.81 1.86 0.40 3.03 0.00 -1.17 -4.60 105.19 107.52 1w1u n GLY 497 Ca 0.25 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.31 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 0.09 -3.48 1.61 3.72 -0.87 -5.05 117.46 111.48 1w1u n PHE 498 Ca 0.00 -0.12 -0.13 0.00 -0.05 0.00 0.00 57.45 57.15 1w1u n PHE 498 Cb 0.00 -0.01 -0.03 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 -0.81 -0.55 -0.06 4.37 1.04 -1.26 -4.27 113.70 112.16 1w1u s SER 499 Ca 0.12 0.25 -0.04 0.00 0.48 0.00 0.00 55.95 56.77 1w1u s SER 499 Cb 0.08 0.53 0.03 0.00 0.10 0.00 0.00 66.02 66.76 1w1u s SER 499 CO 0.12 -0.76 0.14 -1.10 0.98 0.00 0.00 173.24 172.62 1w1u s GLN 500 N -2.67 0.12 0.12 4.02 -0.21 -1.00 -0.70 119.66 119.34 1w1u s GLN 500 Ca -0.02 0.30 -0.21 0.00 0.02 0.00 0.00 55.36 55.45 1w1u s GLN 500 Cb -0.01 -0.08 0.06 0.00 1.00 0.00 0.00 33.01 33.98 1w1u s GLN 500 CO -0.04 -0.11 0.52 -3.38 -2.12 0.00 0.00 175.29 170.16 1w1u s HIS 501 N 0.75 -0.42 0.36 0.91 -3.43 -0.54 -1.87 115.29 111.05 1w1u s HIS 501 Ca -0.06 0.25 0.08 0.00 -0.80 0.00 0.00 55.06 54.53 1w1u s HIS 501 Cb -0.07 0.42 -0.05 0.00 -1.43 0.00 0.00 32.58 31.44 1w1u s HIS 501 CO -0.04 -0.75 0.12 -1.54 -2.00 0.00 0.00 174.74 170.53 1w1u s SER 502 N -2.55 4.49 0.11 7.38 1.04 0.53 -0.56 113.70 124.14 1w1u s SER 502 Ca -0.00 -0.90 -0.02 0.00 0.48 0.00 0.00 55.95 55.51 1w1u s SER 502 Cb -0.00 -0.62 -0.04 0.00 0.10 0.00 0.00 66.02 65.46 1w1u s SER 502 CO -0.10 -0.34 0.04 -0.83 0.98 0.00 0.00 173.24 173.00 1w1u s GLY 503 N -3.83 0.78 0.04 7.32 0.00 0.17 -4.43 107.32 107.37 1w1u s GLY 503 Ca 0.38 -1.34 -0.23 0.00 0.00 0.00 0.00 44.72 43.53 1w1u s GLY 503 CO 0.22 -1.31 0.53 -3.16 0.00 0.00 0.00 173.10 169.38 1w1u s MET 504 N -4.00 1.03 -0.16 2.90 0.23 -1.26 -2.16 119.30 115.88 1w1u s MET 504 Ca 0.18 -0.18 -0.12 0.00 -1.03 0.00 0.00 55.69 54.54 1w1u s MET 504 Cb 0.07 0.47 0.05 0.00 -1.53 0.00 0.00 34.83 33.89 1w1u s MET 504 CO -0.02 -0.36 0.41 0.08 -2.03 0.00 0.00 175.02 173.10 1w1u s VAL 505 N -2.29 -0.01 -0.03 5.16 1.01 -0.79 -4.02 120.40 119.43 1w1u s VAL 505 Ca -0.06 0.04 0.03 0.00 0.00 0.00 0.00 61.98 61.99 1w1u s VAL 505 Cb -0.01 -0.59 0.00 0.00 0.00 0.00 0.00 36.38 35.78 1w1u s VAL 505 CO -0.00 0.02 -0.11 -0.51 0.00 0.00 0.00 175.10 174.50 1w1u s ILE 506 N 0.76 0.93 0.07 2.22 2.07 -0.19 -0.08 121.20 126.99 1w1u s ILE 506 Ca -0.04 -0.44 -0.20 0.00 -1.41 0.00 0.00 60.65 58.56 1w1u s ILE 506 Cb -0.05 -0.83 -0.07 0.00 0.13 0.00 0.00 42.46 41.64 1w1u s ILE 506 CO -0.06 0.29 0.60 -0.69 -1.91 0.00 0.00 174.94 173.17 1w1u s VAL 507 N 0.20 4.72 -0.57 4.00 1.01 -1.26 -1.00 120.40 127.49 1w1u s VAL 507 Ca -0.04 1.28 -0.07 0.00 0.00 0.00 0.00 61.98 63.16 1w1u s VAL 507 Cb -0.10 -3.93 0.15 0.00 0.00 0.00 0.00 36.38 32.50 1w1u s VAL 507 CO 0.01 0.53 0.42 0.00 0.00 0.00 0.00 175.10 176.06 1w1u n ASP 509 N 4.19 4.99 0.00 0.00 5.68 -1.26 -2.89 116.55 127.27 1w1u n ASP 509 Ca 0.02 -2.60 0.00 0.00 -0.50 0.00 0.00 54.79 51.71 1w1u n ASP 509 Cb 0.41 -0.60 0.00 0.00 -1.14 0.00 0.00 41.12 39.78 1w1u n ASP 509 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1w1u n GLY 510 N 0.91 1.98 3.82 6.12 0.00 -1.24 -4.71 105.19 112.08 1w1u n GLY 510 Ca 0.26 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.95 1w1u n GLY 510 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1w1u s THR 511 N -3.41 4.31 0.23 2.61 2.01 -1.26 -4.46 115.64 115.67 1w1u s THR 511 Ca 0.00 1.35 -0.01 0.00 0.31 0.00 0.00 61.69 63.34 1w1u s THR 511 Cb 0.00 -3.59 0.02 0.00 0.01 0.00 0.00 72.50 68.93 1w1u s THR 511 CO 0.00 -0.40 1.63 0.44 -0.69 0.00 0.00 174.62 175.60 1w1u h ASP 512 N 1.58 0.61 -0.50 3.53 3.32 -1.98 0.36 116.42 123.33 1w1u h ASP 512 Ca -0.49 -0.25 -0.01 0.00 0.02 0.00 0.00 57.03 56.31 1w1u h ASP 512 Cb 1.19 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 40.55 1w1u h ASP 512 CO 0.61 0.90 0.27 -0.33 -1.72 0.00 0.00 179.24 178.96 1w1u h GLU 513 N 0.49 0.71 -0.54 3.56 3.07 -2.00 -0.88 114.58 118.99 1w1u h GLU 513 Ca 0.05 -0.09 -0.03 0.00 -0.50 0.00 0.00 59.36 58.79 1w1u h GLU 513 Cb 0.82 -0.14 -0.03 0.00 -0.84 0.00 0.00 28.75 28.57 1w1u h GLU 513 CO 0.07 0.56 0.20 0.00 -1.40 0.00 0.00 179.01 178.44 1w1u h ALA 514 N 1.11 1.34 0.16 3.43 0.00 -1.85 -2.54 119.26 120.91 1w1u h ALA 514 Ca 0.18 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1w1u h ALA 514 Cb 0.07 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1w1u h ALA 514 CO -0.03 0.49 -0.14 0.00 0.00 0.00 0.00 179.25 179.57 1w1u h ALA 515 N 1.45 -0.29 -0.11 0.00 0.00 0.36 0.96 119.26 121.63 1w1u h ALA 515 Ca 0.18 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1w1u h ALA 515 Cb 0.18 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1w1u h ALA 515 CO -0.01 -0.68 -0.07 1.05 0.00 0.00 0.00 179.25 179.53 1w1u h GLU 516 N -0.32 0.16 -0.04 0.00 4.11 -1.05 -1.73 114.58 115.71 1w1u h GLU 516 Ca 0.00 -0.03 -0.20 0.00 0.07 0.00 0.00 59.36 59.20 1w1u h GLU 516 Cb 0.30 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 1w1u h GLU 516 CO -0.03 0.25 -0.83 0.00 0.07 0.00 0.00 179.01 178.47 1w1u h ARG 517 N 0.16 0.40 -0.14 1.06 3.08 -1.03 -3.14 114.38 114.77 1w1u h ARG 517 Ca 0.04 -0.38 -0.01 0.00 0.07 0.00 0.00 59.98 59.70 1w1u h ARG 517 Cb 0.24 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 1w1u h ARG 517 CO 0.01 1.03 0.06 0.82 -1.07 0.00 0.00 179.97 180.83 1w1u h ILE 518 N 0.25 1.13 -0.57 2.04 1.08 0.00 -1.12 117.51 120.32 1w1u h ILE 518 Ca -0.05 -0.37 0.08 0.00 -0.39 0.00 0.00 64.86 64.13 1w1u h ILE 518 Cb 1.43 1.12 -0.06 0.00 -3.07 0.00 0.00 36.82 36.25 1w1u h ILE 518 CO 0.14 0.12 0.22 0.00 -0.69 0.00 0.00 178.15 177.94 1w1u h ALA 519 N 0.93 0.72 0.25 1.87 0.00 -1.40 -0.47 119.26 121.17 1w1u h ALA 519 Ca 0.05 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1w1u h ALA 519 Cb 0.13 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1w1u h ALA 519 CO -0.01 -0.18 -0.12 0.00 0.00 0.00 0.00 179.25 178.95 1w1u h ARG 520 N 0.42 -0.33 -0.44 0.00 3.08 -1.48 -3.08 114.38 112.54 1w1u h ARG 520 Ca 0.28 0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.35 1w1u h ARG 520 Cb 0.31 0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.41 1w1u h ARG 520 CO -0.27 -0.22 0.25 -0.39 -1.07 0.00 0.00 179.97 178.28 1w1u h VAL 521 N -0.50 1.13 0.00 2.04 -1.51 -1.22 0.28 116.25 116.48 1w1u h VAL 521 Ca -0.03 -0.31 0.00 0.00 -1.23 0.00 0.00 66.70 65.12 1w1u h VAL 521 Cb 0.26 0.52 0.00 0.00 -2.13 0.00 0.00 31.29 29.94 1w1u h VAL 521 CO 0.06 0.14 0.00 0.18 -1.23 0.00 0.00 177.57 176.72 1w1u n LEU 522 N -4.44 0.00 -0.10 4.19 4.77 -0.19 -1.07 117.00 120.16 1w1u n LEU 522 Ca 0.03 0.47 -0.18 0.00 -0.03 0.00 0.00 56.01 56.31 1w1u n LEU 522 Cb 0.09 -0.47 -0.07 0.00 -2.33 0.00 0.00 43.42 40.64 1w1u n LEU 522 CO 0.36 -0.05 -0.80 0.41 -1.33 0.00 0.00 177.39 175.97 1w1u n THR 523 N -1.47 1.50 -0.01 -5.08 -1.04 -0.57 -3.92 114.28 103.68 1w1u n THR 523 Ca 0.07 -0.04 -0.10 0.00 -2.04 0.00 0.00 64.05 61.94 1w1u n THR 523 Cb 0.29 -2.14 -0.04 0.00 -1.82 0.00 0.00 70.33 66.62 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 -1.00 -0.15 -0.03 8.00 2.35 -0.47 0.02 115.58 124.30 1w1u h ASN 524 Ca -0.30 0.04 0.02 0.00 -0.55 0.00 0.00 56.30 55.51 1w1u h ASN 524 Cb 1.16 0.09 -0.05 0.00 0.05 0.00 0.00 38.32 39.57 1w1u h ASN 524 CO -0.18 -0.05 -0.45 -0.78 -1.65 0.00 0.00 177.43 174.31 1w1u h ASP 525 N -0.01 -1.42 0.85 5.81 -0.00 -1.33 0.75 116.42 121.07 1w1u h ASP 525 Ca 0.07 0.16 -0.01 0.00 -0.00 0.00 0.00 57.03 57.25 1w1u h ASP 525 Cb 0.11 0.54 -0.00 0.00 -0.00 0.00 0.00 39.33 39.98 1w1u h ASP 525 CO -0.15 -0.43 -0.05 1.55 -0.00 0.00 0.00 179.24 180.16 1w1u h PRO 526 N -0.55 0.00 -0.58 0.28 0.13 -1.76 -2.90 132.00 126.63 1w1u h PRO 526 Ca 0.01 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.10 1w1u h PRO 526 Cb 0.60 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.70 1w1u h PRO 526 CO -0.32 0.05 0.17 0.78 -0.23 0.00 0.00 178.00 178.45 1w1u h GLY 527 N 1.75 0.93 2.00 1.56 0.00 0.11 -1.75 103.07 107.67 1w1u h GLY 527 Ca -0.00 -0.52 -0.06 0.00 0.00 0.00 0.00 47.33 46.75 1w1u h GLY 527 CO 0.01 0.49 -0.28 -0.91 0.00 0.00 0.00 176.54 175.84 1w1u h THR 528 N 0.85 0.80 -0.14 4.70 1.35 -0.75 -0.67 112.91 119.04 1w1u h THR 528 Ca 0.19 -1.16 -0.08 0.00 -0.55 0.00 0.00 66.41 64.80 1w1u h THR 528 Cb 0.25 1.72 -0.00 0.00 -1.73 0.00 0.00 68.15 68.39 1w1u h THR 528 CO -0.01 0.28 -0.23 1.23 -0.25 0.00 0.00 175.52 176.54 1w1u h GLY 529 N 1.62 0.45 1.32 5.82 0.00 -1.38 0.13 103.07 111.02 1w1u h GLY 529 Ca -0.00 -0.51 -0.10 0.00 0.00 0.00 0.00 47.33 46.72 1w1u h GLY 529 CO 0.04 0.46 -0.14 -2.08 0.00 0.00 0.00 176.54 174.82 1w1u h VAL 530 N 0.02 1.26 0.21 4.60 2.07 -1.24 -2.22 116.25 120.95 1w1u h VAL 530 Ca 0.01 -1.22 -0.01 0.00 0.82 0.00 0.00 66.70 66.30 1w1u h VAL 530 Cb 0.80 1.08 0.00 0.00 -1.52 0.00 0.00 31.29 31.65 1w1u h VAL 530 CO 0.05 0.41 -0.10 -0.03 0.02 0.00 0.00 177.57 177.93 1w1u h MET 531 N 0.71 -0.27 -0.82 1.57 -1.53 -1.04 0.51 114.93 114.07 1w1u h MET 531 Ca 0.11 0.02 0.08 0.00 -3.44 0.00 0.00 59.70 56.48 1w1u h MET 531 Cb 0.63 0.06 -0.07 0.00 -0.55 0.00 0.00 31.60 31.67 1w1u h MET 531 CO 0.04 -0.11 0.48 -0.09 0.14 0.00 0.00 176.91 177.37 1w1u h ARG 532 N -0.36 0.81 0.00 0.39 1.12 -0.53 0.22 114.38 116.03 1w1u h ARG 532 Ca -0.03 -0.05 -0.10 0.00 -1.11 0.00 0.00 59.98 58.69 1w1u h ARG 532 Cb 0.28 -0.18 -0.01 0.00 -0.01 0.00 0.00 29.97 30.04 1w1u h ARG 532 CO 0.05 0.53 -0.47 0.45 -3.11 0.00 0.00 179.97 177.42 1w1u h HIS 533 N 0.83 0.00 -0.19 2.20 3.86 -1.31 -2.73 115.15 117.81 1w1u h HIS 533 Ca 0.39 0.00 -0.21 0.00 -1.16 0.00 0.00 60.37 59.39 1w1u h HIS 533 Cb 0.30 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.78 1w1u h HIS 533 CO -0.05 0.47 -0.70 0.00 0.86 0.00 0.00 177.93 178.52 1w1u h ALA 534 N 1.53 0.41 -0.39 2.45 0.00 0.05 -2.10 119.26 121.20 1w1u h ALA 534 Ca -0.00 -0.57 -0.02 0.00 0.00 0.00 0.00 54.91 54.31 1w1u h ALA 534 Cb 1.30 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 1w1u h ALA 534 CO 0.06 0.69 0.14 0.22 0.00 0.00 0.00 179.25 180.37 1w1u h ASP 535 N 0.55 0.50 0.86 0.00 1.82 -0.52 0.22 116.42 119.84 1w1u h ASP 535 Ca -0.03 -0.05 0.00 0.00 -0.39 0.00 0.00 57.03 56.56 1w1u h ASP 535 Cb 1.31 -0.13 0.00 0.00 0.68 0.00 0.00 39.33 41.19 1w1u h ASP 535 CO 0.14 0.47 0.00 0.00 -1.61 0.00 0.00 179.24 178.24 1w1u n ALA 536 N -2.47 1.98 0.00 -0.78 0.00 -1.04 -4.91 120.51 113.29 1w1u n ALA 536 Ca 0.03 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1w1u n ALA 536 Cb 0.15 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.23 1w1u n ALA 536 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1w1u n GLY 537 N 0.70 0.57 3.64 0.00 0.00 0.07 -4.26 105.19 105.91 1w1u n GLY 537 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 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 1.77 0.34 1.61 2.02 -0.82 -4.89 117.35 115.39 1w1u s TYR 538 Ca 0.00 0.19 0.04 0.00 -0.37 0.00 0.00 57.07 56.93 1w1u s TYR 538 Cb 0.00 -4.01 0.67 0.00 -0.40 0.00 0.00 41.96 38.22 1w1u s TYR 538 CO 0.00 -3.99 1.94 -0.44 -1.57 0.00 0.00 175.55 171.50 1w1u h ASP 539 N 10.71 0.75 -0.90 2.29 3.32 -1.94 -1.49 116.42 129.16 1w1u h ASP 539 Ca -0.40 0.00 0.02 0.00 0.02 0.00 0.00 57.03 56.67 1w1u h ASP 539 Cb 1.19 -0.16 -0.05 0.00 0.22 0.00 0.00 39.33 40.54 1w1u h ASP 539 CO 0.97 0.48 0.59 0.16 -1.72 0.00 0.00 179.24 179.72 1w1u h ILE 540 N 0.85 1.21 -0.20 0.35 -2.65 -1.93 -0.15 117.51 114.98 1w1u h ILE 540 Ca 0.34 -0.41 -0.07 0.00 1.03 0.00 0.00 64.86 65.75 1w1u h ILE 540 Cb 0.23 -0.09 -0.00 0.00 -2.05 0.00 0.00 36.82 34.90 1w1u h ILE 540 CO -0.12 0.22 -0.14 0.00 0.03 0.00 0.00 178.15 178.14 1w1u h ALA 541 N 1.34 0.29 -0.29 0.16 0.00 -1.44 -1.69 119.26 117.63 1w1u h ALA 541 Ca 0.34 -0.32 0.05 0.00 0.00 0.00 0.00 54.91 54.98 1w1u h ALA 541 Cb -0.10 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.57 1w1u h ALA 541 CO -0.08 0.17 -0.01 0.82 0.00 0.00 0.00 179.25 180.14 1w1u h ILE 542 N 0.14 0.78 -0.15 0.00 1.08 -0.96 0.53 117.51 118.93 1w1u h ILE 542 Ca 0.04 -0.03 0.02 0.00 -0.39 0.00 0.00 64.86 64.50 1w1u h ILE 542 Cb 0.65 0.69 -0.02 0.00 -3.07 0.00 0.00 36.82 35.08 1w1u h ILE 542 CO 0.04 0.01 0.03 0.44 -0.69 0.00 0.00 178.15 177.98 1w1u h ASP 543 N 0.07 0.01 -0.77 1.72 3.32 -0.96 -1.47 116.42 118.33 1w1u h ASP 543 Ca 0.14 0.02 0.09 0.00 0.02 0.00 0.00 57.03 57.30 1w1u h ASP 543 Cb 0.19 0.03 -0.07 0.00 0.22 0.00 0.00 39.33 39.70 1w1u h ASP 543 CO -0.25 0.03 0.43 0.00 -1.72 0.00 0.00 179.24 177.73 1w1u h ALA 545 N 1.43 0.30 -0.35 0.00 0.00 -0.29 -0.79 119.26 119.56 1w1u h ALA 545 Ca 0.37 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.32 1w1u h ALA 545 Cb 0.33 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1w1u h ALA 545 CO -0.24 -0.35 0.18 0.87 0.00 0.00 0.00 179.25 179.71 1w1u h LYS 546 N 0.16 0.50 -0.65 0.00 1.57 -0.32 0.01 116.57 117.85 1w1u h LYS 546 Ca 0.14 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1w1u h LYS 546 Cb 0.14 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.33 1w1u h LYS 546 CO -0.18 0.43 0.39 0.93 -0.57 0.00 0.00 179.45 180.45 1w1u h GLU 547 N 0.43 0.88 -0.00 3.15 5.08 -0.71 -2.60 114.58 120.81 1w1u h GLU 547 Ca 0.12 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1w1u h GLU 547 Cb 0.09 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.16 1w1u h GLU 547 CO -0.02 0.63 -0.01 1.04 -1.00 0.00 0.00 179.01 179.65 1w1u n GLN 548 N -4.58 1.14 -2.95 2.33 1.13 -0.33 -4.93 117.38 109.19 1w1u n GLN 548 Ca 0.05 -0.28 -0.17 0.00 -1.94 0.00 0.00 57.00 54.65 1w1u n GLN 548 Cb 0.06 -1.49 0.04 0.00 0.11 0.00 0.00 30.24 28.95 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 1.08 -0.23 3.77 1.08 0.00 -0.46 -4.98 105.19 105.45 1w1u n GLY 549 Ca 0.22 -0.06 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 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 -5.36 3.87 -0.87 0.99 1.43 -0.14 -4.97 118.68 113.64 1w1u s LEU 550 Ca 0.28 2.21 -0.13 0.00 -1.03 0.00 0.00 54.13 55.46 1w1u s LEU 550 Cb -0.12 -4.43 0.23 0.00 0.03 0.00 0.00 46.19 41.89 1w1u s LEU 550 CO 0.35 -1.05 0.82 -0.62 0.23 0.00 0.00 176.35 176.07 1w1u s ASP 551 N -1.61 6.80 -0.59 2.29 -1.08 -1.26 -4.84 116.67 116.38 1w1u s ASP 551 Ca 0.68 -2.88 -0.05 0.00 -0.52 0.00 0.00 52.55 49.79 1w1u s ASP 551 Cb -0.25 -2.19 0.15 0.00 -1.46 0.00 0.00 42.92 39.17 1w1u s ASP 551 CO 0.30 -0.51 0.42 -0.76 0.52 0.00 0.00 175.17 175.13 1w1u s LEU 552 N -0.12 5.45 0.08 -1.34 1.43 -1.26 -5.00 118.68 117.91 1w1u s LEU 552 Ca 0.20 -2.58 -0.16 0.00 -1.03 0.00 0.00 54.13 50.57 1w1u s LEU 552 Cb -0.10 -1.90 -0.04 0.00 0.03 0.00 0.00 46.19 44.18 1w1u s LEU 552 CO -0.09 -0.46 0.90 -2.65 0.23 0.00 0.00 176.35 174.29 1w1u n PRO 553 N 3.91 -0.23 0.00 1.29 -0.02 -1.26 0.13 135.00 138.82 1w1u n PRO 553 Ca 0.05 0.89 0.08 0.00 -2.02 0.00 0.00 63.50 62.49 1w1u n PRO 553 Cb 0.40 -1.31 0.45 0.00 -0.02 0.00 0.00 33.50 33.02 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 -4.40 0.67 0.00 -0.52 2.81 -1.26 -5.31 117.12 109.11 1w1u n MET 554 Ca 0.01 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.90 1w1u n MET 554 Cb 0.13 -1.36 0.00 0.00 -0.71 0.00 0.00 33.22 31.29 1w1u n MET 554 CO 0.00 0.00 0.00 1.51 1.51 0.00 0.00 175.97 178.99