#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i2x s LYS 4 N 0.00 2.34 0.17 0.00 2.47 -0.78 -5.03 119.74 118.91 2i2x s LYS 4 Ca 0.00 -1.47 -0.16 0.00 -1.56 0.00 0.00 55.97 52.77 2i2x s LYS 4 Cb 0.00 -3.46 -0.07 0.00 -1.46 0.00 0.00 37.83 32.83 2i2x s LYS 4 CO 0.00 -0.84 0.61 1.03 0.16 0.00 0.00 175.35 176.31 2i2x s ARG 5 N 1.27 4.07 0.06 4.03 0.52 -1.26 -4.53 118.95 123.11 2i2x s ARG 5 Ca 0.01 0.62 -0.30 0.00 -0.52 0.00 0.00 55.73 55.54 2i2x s ARG 5 Cb -0.21 -2.91 -0.05 0.00 0.52 0.00 0.00 34.95 32.30 2i2x s ARG 5 CO -0.01 0.45 0.98 0.71 0.02 0.00 0.00 175.30 177.45 2i2x s TYR 6 N -1.48 3.74 0.00 -0.53 2.02 -1.26 -4.92 117.35 114.91 2i2x s TYR 6 Ca 0.39 1.75 0.00 0.00 -0.37 0.00 0.00 57.07 58.84 2i2x s TYR 6 Cb -0.16 -3.09 0.00 0.00 -0.40 0.00 0.00 41.96 38.31 2i2x s TYR 6 CO 0.20 0.07 0.64 0.25 -1.57 0.00 0.00 175.55 175.14 2i2x n THR 7 N 3.28 0.37 -3.97 -0.71 -2.24 -1.26 -4.11 114.28 105.64 2i2x n THR 7 Ca 0.04 -0.60 -0.09 0.00 -2.27 0.00 0.00 64.05 61.12 2i2x n THR 7 Cb 0.50 0.91 -0.06 0.00 -2.10 0.00 0.00 70.33 69.58 2i2x n THR 7 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2i2x s SER 8 N -0.37 -0.06 -0.04 3.42 1.04 -1.26 -4.61 113.70 111.81 2i2x s SER 8 Ca 0.00 -0.89 -0.16 0.00 0.48 0.00 0.00 55.95 55.39 2i2x s SER 8 Cb 0.00 0.52 -0.05 0.00 0.10 0.00 0.00 66.02 66.59 2i2x s SER 8 CO 0.00 -1.03 0.42 -0.04 0.98 0.00 0.00 173.24 173.57 2i2x s MET 9 N -3.99 4.07 0.34 4.02 1.00 -1.26 -4.88 119.30 118.59 2i2x s MET 9 Ca 0.20 0.40 0.08 0.00 0.00 0.00 0.00 55.69 56.38 2i2x s MET 9 Cb 0.01 -3.30 0.62 0.00 0.00 0.00 0.00 34.83 32.16 2i2x s MET 9 CO 0.05 0.51 1.80 0.00 0.00 0.00 0.00 175.02 177.38 2i2x h ALA 10 N 5.40 1.30 -2.68 3.03 0.00 -1.17 -3.42 119.26 121.71 2i2x h ALA 10 Ca -0.48 -0.32 -0.66 0.00 0.00 0.00 0.00 54.91 53.45 2i2x h ALA 10 Cb 1.20 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.84 2i2x h ALA 10 CO 0.66 0.48 -0.46 0.71 0.00 0.00 0.00 179.25 180.64 2i2x s TYR 11 N -4.39 3.60 0.44 0.00 2.02 -1.23 -4.94 117.35 112.83 2i2x s TYR 11 Ca -0.05 0.55 0.21 0.00 -0.37 0.00 0.00 57.07 57.41 2i2x s TYR 11 Cb 0.14 -1.98 1.21 0.00 -0.40 0.00 0.00 41.96 40.93 2i2x s TYR 11 CO 0.75 0.70 2.03 0.00 -1.57 0.00 0.00 175.55 177.46 2i2x h ALA 12 N 5.07 1.49 -2.07 3.71 0.00 -1.94 -3.46 119.26 122.07 2i2x h ALA 12 Ca -0.54 -0.15 0.20 0.00 0.00 0.00 0.00 54.91 54.42 2i2x h ALA 12 Cb 1.22 -0.03 -0.12 0.00 0.00 0.00 0.00 17.79 18.87 2i2x h ALA 12 CO 0.59 0.20 0.59 0.54 0.00 0.00 0.00 179.25 181.17 2i2x s ASN 13 N -6.60 -0.20 0.22 0.00 2.20 -1.26 -5.06 114.94 104.24 2i2x s ASN 13 Ca -0.03 -0.20 -0.08 0.00 -0.94 0.00 0.00 52.86 51.60 2i2x s ASN 13 Cb 0.14 0.36 0.23 0.00 -2.00 0.00 0.00 41.25 39.99 2i2x s ASN 13 CO 0.64 -0.64 1.86 0.00 -2.94 0.00 0.00 177.10 176.02 2i2x h ALA 14 N 2.00 1.02 -0.01 3.54 0.00 -1.90 -2.28 119.26 121.64 2i2x h ALA 14 Ca -0.23 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2i2x h ALA 14 Cb 1.22 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 2i2x h ALA 14 CO 0.27 0.29 0.10 0.22 0.00 0.00 0.00 179.25 180.13 2i2x h ASP 15 N 0.95 0.00 1.18 0.00 3.58 -1.97 0.37 116.42 120.53 2i2x h ASP 15 Ca 0.31 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.75 2i2x h ASP 15 Cb 0.03 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.08 2i2x h ASP 15 CO -0.12 0.00 -0.08 -0.33 -2.88 0.00 0.00 179.24 175.83 2i2x h GLU 16 N 0.00 0.00 -6.64 0.28 5.08 -1.83 -3.45 114.58 108.02 2i2x h GLU 16 Ca 0.01 0.00 -0.51 0.00 -1.00 0.00 0.00 59.36 57.86 2i2x h GLU 16 Cb 0.20 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.42 2i2x h GLU 16 CO -0.00 0.08 0.21 -1.64 -1.00 0.00 0.00 179.01 176.66 2i2x s MET 17 N -3.56 4.49 0.28 2.33 -1.94 0.12 -5.07 119.30 115.94 2i2x s MET 17 Ca 0.02 1.12 -0.14 0.00 -1.71 0.00 0.00 55.69 54.98 2i2x s MET 17 Cb 0.09 -3.02 0.01 0.00 2.01 0.00 0.00 34.83 33.91 2i2x s MET 17 CO 0.60 0.44 0.57 -0.08 -0.01 0.00 0.00 175.02 176.54 2i2x s THR 18 N -1.39 0.00 0.41 2.05 -1.32 -1.26 -4.98 115.64 109.16 2i2x s THR 18 Ca 0.42 -1.29 -0.16 0.00 -1.21 0.00 0.00 61.69 59.45 2i2x s THR 18 Cb -0.20 -2.28 -0.09 0.00 -1.51 0.00 0.00 72.50 68.42 2i2x s THR 18 CO 0.24 0.00 0.86 0.72 -2.21 0.00 0.00 174.62 174.24 2i2x s PHE 19 N -3.70 3.39 0.00 9.09 -0.71 -1.18 -4.07 117.98 120.80 2i2x s PHE 19 Ca 0.20 1.36 0.00 0.00 -1.04 0.00 0.00 56.93 57.45 2i2x s PHE 19 Cb -0.02 -2.67 0.00 0.00 -1.21 0.00 0.00 43.02 39.12 2i2x s PHE 19 CO 0.10 -0.11 0.00 0.41 -1.34 0.00 0.00 175.22 174.28 2i2x n GLY 20 N -0.91 2.01 3.13 1.99 0.00 0.15 -4.87 105.19 106.68 2i2x n GLY 20 Ca 0.05 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.81 2i2x n GLY 20 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2i2x s VAL 21 N -2.39 1.41 0.26 1.61 -7.23 -1.26 -0.61 120.40 112.19 2i2x s VAL 21 Ca 0.00 -0.70 0.05 0.00 -1.81 0.00 0.00 61.98 59.52 2i2x s VAL 21 Cb 0.00 -1.21 -0.06 0.00 0.56 0.00 0.00 36.38 35.67 2i2x s VAL 21 CO 0.00 0.41 -0.02 -0.94 -0.31 0.00 0.00 175.10 174.24 2i2x s SER 22 N 0.09 2.26 0.19 4.85 1.04 -0.35 -4.57 113.70 117.21 2i2x s SER 22 Ca -0.05 -1.22 -0.11 0.00 0.48 0.00 0.00 55.95 55.05 2i2x s SER 22 Cb -0.12 -0.07 0.11 0.00 0.10 0.00 0.00 66.02 66.04 2i2x s SER 22 CO 0.02 -0.45 1.80 0.50 0.98 0.00 0.00 173.24 176.09 2i2x h LYS 23 N 2.36 0.93 -3.23 4.02 3.64 -1.52 -3.35 116.57 119.41 2i2x h LYS 23 Ca -0.39 -0.11 -0.64 0.00 -1.27 0.00 0.00 60.65 58.24 2i2x h LYS 23 Cb 1.23 -0.18 -0.41 0.00 -0.41 0.00 0.00 32.23 32.46 2i2x h LYS 23 CO 0.66 0.70 -0.52 0.71 -2.27 0.00 0.00 179.45 178.73 2i2x s TYR 24 N -5.84 3.48 0.59 1.91 2.02 -0.45 -5.05 117.35 114.02 2i2x s TYR 24 Ca -0.13 -3.22 -0.19 0.00 -0.37 0.00 0.00 57.07 53.16 2i2x s TYR 24 Cb 0.14 -2.83 -0.03 0.00 -0.40 0.00 0.00 41.96 38.83 2i2x s TYR 24 CO 0.79 -0.64 1.28 -2.14 -1.57 0.00 0.00 175.55 173.26 2i2x s PRO 25 N -1.01 2.89 -0.13 -1.71 0.02 -1.26 -4.45 135.00 129.36 2i2x s PRO 25 Ca 0.22 2.03 -0.03 0.00 0.02 0.00 0.00 61.00 63.24 2i2x s PRO 25 Cb -0.12 -2.01 -0.03 0.00 0.02 0.00 0.00 34.50 32.36 2i2x s PRO 25 CO -0.10 -1.32 -0.01 0.08 -0.33 0.00 0.00 177.00 175.31 2i2x s VAL 26 N -1.43 4.15 -0.15 3.83 1.01 -0.21 -4.95 120.40 122.64 2i2x s VAL 26 Ca 0.77 -0.28 -0.06 0.00 0.00 0.00 0.00 61.98 62.41 2i2x s VAL 26 Cb -0.36 -2.79 -0.04 0.00 0.00 0.00 0.00 36.38 33.19 2i2x s VAL 26 CO 0.40 0.53 0.06 -0.54 0.00 0.00 0.00 175.10 175.55 2i2x s LYS 27 N -0.15 3.65 0.08 2.72 1.02 -1.26 -0.05 119.74 125.76 2i2x s LYS 27 Ca 0.04 -0.33 -0.26 0.00 0.02 0.00 0.00 55.97 55.44 2i2x s LYS 27 Cb -0.13 -3.10 0.08 0.00 -0.52 0.00 0.00 37.83 34.17 2i2x s LYS 27 CO 0.02 0.45 0.76 0.00 -0.92 0.00 0.00 175.35 175.66 2i2x s ALA 28 N -0.15 -1.70 0.00 5.17 0.00 -0.52 -5.00 121.76 119.55 2i2x s ALA 28 Ca 0.07 0.72 0.00 0.00 0.00 0.00 0.00 51.96 52.75 2i2x s ALA 28 Cb -0.12 0.65 0.00 0.00 0.00 0.00 0.00 23.12 23.65 2i2x s ALA 28 CO 0.01 -0.74 0.00 0.41 0.00 0.00 0.00 175.76 175.44 2i2x n GLY 29 N -0.32 1.63 3.51 0.00 0.00 -1.26 -2.19 105.19 106.56 2i2x n GLY 29 Ca -0.12 -0.51 -0.43 0.00 0.00 0.00 0.00 46.02 44.96 2i2x n GLY 29 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2i2x s LEU 30 N 0.00 4.40 -1.23 0.99 1.43 0.13 -4.39 118.68 120.01 2i2x s LEU 30 Ca 0.00 -2.16 0.00 0.00 -1.03 0.00 0.00 54.13 50.94 2i2x s LEU 30 Cb 0.00 -2.48 0.00 0.00 0.03 0.00 0.00 46.19 43.74 2i2x s LEU 30 CO 0.00 -1.14 0.00 -0.67 0.23 0.00 0.00 176.35 174.77 2i2x n ASP 31 N 7.34 -4.71 -4.83 2.29 2.03 -1.26 -2.50 116.55 114.91 2i2x n ASP 31 Ca 0.34 0.29 -0.38 0.00 0.52 0.00 0.00 54.79 55.55 2i2x n ASP 31 Cb 0.48 -3.23 -0.06 0.00 -0.72 0.00 0.00 41.12 37.58 2i2x n ASP 31 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 2i2x s LEU 32 N -2.63 4.49 -0.08 -2.67 2.96 -0.93 -4.87 118.68 114.95 2i2x s LEU 32 Ca 0.00 1.04 0.04 0.00 -0.22 0.00 0.00 54.13 54.99 2i2x s LEU 32 Cb 0.00 -2.66 -0.00 0.00 0.50 0.00 0.00 46.19 44.03 2i2x s LEU 32 CO 0.00 0.31 -0.22 -1.61 -1.32 0.00 0.00 176.35 173.51 2i2x s GLU 33 N -1.09 2.67 -0.17 1.98 2.02 -1.26 -1.44 118.70 121.40 2i2x s GLU 33 Ca 0.25 -0.81 -0.06 0.00 0.02 0.00 0.00 54.97 54.38 2i2x s GLU 33 Cb -0.17 -2.10 -0.03 0.00 0.10 0.00 0.00 34.13 31.92 2i2x s GLU 33 CO 0.15 0.21 0.02 0.42 0.02 0.00 0.00 175.26 176.08 2i2x s ILE 34 N 0.24 4.37 -0.05 -1.63 1.01 0.93 -4.36 121.20 121.72 2i2x s ILE 34 Ca -0.14 -0.18 0.00 0.00 0.00 0.00 0.00 60.65 60.33 2i2x s ILE 34 Cb -0.16 -2.95 0.00 0.00 0.01 0.00 0.00 42.46 39.36 2i2x s ILE 34 CO 0.07 0.47 0.00 0.61 0.00 0.00 0.00 174.94 176.09 2i2x n GLY 35 N 3.57 0.40 1.28 6.18 0.00 -1.26 -1.04 105.19 114.31 2i2x n GLY 35 Ca -0.17 -1.03 -0.01 0.00 0.00 0.00 0.00 46.02 44.81 2i2x n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i2x n ALA 36 N 0.59 3.92 0.00 4.61 0.00 -1.09 -1.21 120.51 127.34 2i2x n ALA 36 Ca -0.00 -2.65 0.00 0.00 0.00 0.00 0.00 53.44 50.78 2i2x n ALA 36 Cb 0.12 -0.87 0.00 0.00 0.00 0.00 0.00 19.45 18.70 2i2x n ALA 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2i2x n GLY 37 N -0.71 1.13 3.41 0.00 0.00 0.22 -5.00 105.19 104.24 2i2x n GLY 37 Ca 0.32 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.19 2i2x n GLY 37 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2i2x s TYR 38 N -2.00 -0.49 0.34 1.61 1.13 -0.89 -4.88 117.35 112.16 2i2x s TYR 38 Ca 0.00 0.98 -0.06 0.00 -1.41 0.00 0.00 57.07 56.58 2i2x s TYR 38 Cb 0.00 0.24 -0.05 0.00 -1.10 0.00 0.00 41.96 41.05 2i2x s TYR 38 CO 0.00 -0.43 0.63 0.95 -2.51 0.00 0.00 175.55 174.19 2i2x s THR 39 N -0.73 4.95 -0.03 -3.49 -4.23 -1.26 -4.35 115.64 106.51 2i2x s THR 39 Ca -0.08 0.19 0.01 0.00 -1.18 0.00 0.00 61.69 60.64 2i2x s THR 39 Cb -0.03 -3.75 0.01 0.00 1.34 0.00 0.00 72.50 70.08 2i2x s THR 39 CO 0.05 -0.43 -0.04 -0.63 -0.54 0.00 0.00 174.62 173.03 2i2x s ILE 40 N -2.23 0.43 0.36 2.99 1.01 -0.98 -4.91 121.20 117.87 2i2x s ILE 40 Ca 0.46 -0.12 -0.26 0.00 0.00 0.00 0.00 60.65 60.74 2i2x s ILE 40 Cb -0.10 -0.43 -0.09 0.00 0.01 0.00 0.00 42.46 41.84 2i2x s ILE 40 CO 0.32 0.17 1.04 -2.16 0.00 0.00 0.00 174.94 174.32 2i2x s PRO 41 N 0.58 4.33 -0.27 2.79 0.04 -1.26 -1.15 135.00 140.07 2i2x s PRO 41 Ca -0.07 1.55 0.00 0.00 0.04 0.00 0.00 61.00 62.53 2i2x s PRO 41 Cb -0.10 -2.73 0.08 0.00 0.04 0.00 0.00 34.50 31.78 2i2x s PRO 41 CO -0.00 0.00 0.02 -2.00 0.04 0.00 0.00 177.00 175.06 2i2x s GLU 42 N -2.18 1.21 -0.06 4.56 2.12 0.34 -1.12 118.70 123.56 2i2x s GLU 42 Ca 0.54 -1.08 -0.24 0.00 0.36 0.00 0.00 54.97 54.55 2i2x s GLU 42 Cb -0.24 -2.45 -0.04 0.00 0.26 0.00 0.00 34.13 31.66 2i2x s GLU 42 CO 0.30 -0.77 0.71 -1.50 -0.54 0.00 0.00 175.26 173.46 2i2x s ILE 43 N 1.44 5.03 0.29 -3.70 1.10 -0.31 -3.37 121.20 121.68 2i2x s ILE 43 Ca 0.02 1.47 0.10 0.00 -0.51 0.00 0.00 60.65 61.73 2i2x s ILE 43 Cb -0.18 -4.05 -0.05 0.00 0.15 0.00 0.00 42.46 38.33 2i2x s ILE 43 CO -0.12 0.25 -0.04 0.20 -2.11 0.00 0.00 174.94 173.12 2i2x s ASN 44 N 0.78 4.25 -0.08 4.50 0.01 -1.26 -0.84 114.94 122.30 2i2x s ASN 44 Ca 0.38 -0.81 -0.31 0.00 -0.71 0.00 0.00 52.86 51.41 2i2x s ASN 44 Cb -0.18 -0.65 0.12 0.00 0.41 0.00 0.00 41.25 40.95 2i2x s ASN 44 CO 0.19 -0.05 1.05 -0.72 -1.51 0.00 0.00 177.10 176.06 2i2x s TYR 45 N -2.41 -0.23 -0.03 2.20 -0.85 -1.26 -3.99 117.35 110.78 2i2x s TYR 45 Ca 0.32 0.12 0.00 0.00 -0.52 0.00 0.00 57.07 57.00 2i2x s TYR 45 Cb -0.05 0.53 0.03 0.00 0.38 0.00 0.00 41.96 42.85 2i2x s TYR 45 CO 0.19 -0.40 0.00 0.00 -1.52 0.00 0.00 175.55 173.82 2i2x s ALA 46 N -2.79 0.30 0.66 9.51 0.00 -0.30 -4.59 121.76 124.55 2i2x s ALA 46 Ca 0.08 0.17 -0.18 0.00 0.00 0.00 0.00 51.96 52.03 2i2x s ALA 46 Cb -0.01 -0.31 -0.00 0.00 0.00 0.00 0.00 23.12 22.79 2i2x s ALA 46 CO -0.06 -0.07 1.27 -1.25 0.00 0.00 0.00 175.76 175.64 2i2x s PRO 47 N 1.02 2.50 0.87 0.00 0.04 -1.26 -1.44 135.00 136.72 2i2x s PRO 47 Ca -0.10 1.99 -0.10 0.00 0.04 0.00 0.00 61.00 62.83 2i2x s PRO 47 Cb -0.14 -1.85 0.12 0.00 0.04 0.00 0.00 34.50 32.67 2i2x s PRO 47 CO -0.02 -1.62 1.13 1.03 0.04 0.00 0.00 177.00 177.56 2i2x s ARG 48 N -3.47 1.41 0.36 4.56 0.52 -1.26 -4.82 118.95 116.25 2i2x s ARG 48 Ca 0.81 1.43 0.03 0.00 -0.52 0.00 0.00 55.73 57.49 2i2x s ARG 48 Cb -0.35 -1.78 0.69 0.00 0.52 0.00 0.00 34.95 34.02 2i2x s ARG 48 CO 0.40 -2.32 2.02 -1.35 0.02 0.00 0.00 175.30 174.07 2i2x h PRO 49 N -1.63 0.76 -0.15 3.54 0.11 -1.97 -2.64 132.00 130.01 2i2x h PRO 49 Ca -0.43 -0.05 0.04 0.00 0.11 0.00 0.00 66.00 65.67 2i2x h PRO 49 Cb 1.26 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 2i2x h PRO 49 CO 0.45 0.51 0.12 0.93 -0.21 0.00 0.00 178.00 179.79 2i2x h GLU 50 N 0.78 0.00 0.00 1.05 3.07 -2.01 -0.01 114.58 117.45 2i2x h GLU 50 Ca 0.21 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.07 2i2x h GLU 50 Cb -0.08 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.83 2i2x h GLU 50 CO -0.04 0.00 0.00 0.00 -1.40 0.00 0.00 179.01 177.57 2i2x n ALA 51 N -2.52 1.84 1.87 3.43 0.00 -0.99 -3.04 120.51 121.09 2i2x n ALA 51 Ca 0.01 -0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.54 2i2x n ALA 51 Cb 0.25 -1.35 0.51 0.00 0.00 0.00 0.00 19.45 18.86 2i2x n ALA 51 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2i2x n GLY 52 N 0.38 -0.78 0.14 0.00 0.00 -0.02 -2.35 105.19 102.56 2i2x n GLY 52 Ca 0.04 -0.17 -0.05 0.00 0.00 0.00 0.00 46.02 45.84 2i2x n GLY 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i2x h ALA 53 N 3.66 -0.54 -1.63 4.61 0.00 -1.72 -3.47 119.26 120.17 2i2x h ALA 53 Ca 0.00 -0.07 -0.56 0.00 0.00 0.00 0.00 54.91 54.28 2i2x h ALA 53 Cb 0.08 0.12 -0.08 0.00 0.00 0.00 0.00 17.79 17.92 2i2x h ALA 53 CO 0.00 -0.51 -0.49 -1.54 0.00 0.00 0.00 179.25 176.70 2i2x s SER 54 N -3.75 4.49 0.32 0.00 1.04 -1.26 -5.03 113.70 109.51 2i2x s SER 54 Ca -0.05 -1.02 0.05 0.00 0.48 0.00 0.00 55.95 55.41 2i2x s SER 54 Cb 0.00 -0.51 0.53 0.00 0.10 0.00 0.00 66.02 66.14 2i2x s SER 54 CO 0.14 -0.52 1.79 0.50 0.98 0.00 0.00 173.24 176.13 2i2x h LYS 55 N 1.42 0.40 -0.60 4.02 3.64 -1.91 -3.04 116.57 120.50 2i2x h LYS 55 Ca -0.43 -0.13 -0.09 0.00 -1.27 0.00 0.00 60.65 58.73 2i2x h LYS 55 Cb 1.25 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 33.02 2i2x h LYS 55 CO 0.68 0.59 0.02 0.93 -2.27 0.00 0.00 179.45 179.40 2i2x h GLU 56 N 0.37 1.05 0.00 1.90 3.07 -1.95 -0.61 114.58 118.41 2i2x h GLU 56 Ca 0.06 -0.32 -0.10 0.00 -0.50 0.00 0.00 59.36 58.50 2i2x h GLU 56 Cb 0.56 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.36 2i2x h GLU 56 CO 0.04 1.02 -0.46 0.87 -1.40 0.00 0.00 179.01 179.08 2i2x h LYS 57 N 0.95 0.00 0.06 2.33 1.57 -1.79 -1.79 116.57 117.90 2i2x h LYS 57 Ca 0.17 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.87 2i2x h LYS 57 Cb 0.53 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.85 2i2x h LYS 57 CO 0.03 0.46 -0.37 1.25 -0.57 0.00 0.00 179.45 180.24 2i2x h LEU 58 N 0.00 0.23 -0.39 2.94 5.85 -1.22 -2.30 115.31 120.42 2i2x h LEU 58 Ca -0.00 -0.94 0.07 0.00 0.84 0.00 0.00 57.88 57.84 2i2x h LEU 58 Cb 0.86 -0.07 -0.06 0.00 0.37 0.00 0.00 40.66 41.76 2i2x h LEU 58 CO 0.06 1.15 0.02 0.40 -0.34 0.00 0.00 178.44 179.73 2i2x h ILE 59 N -0.65 0.73 -0.49 4.05 2.04 -1.10 -1.52 117.51 120.56 2i2x h ILE 59 Ca -0.06 -0.05 0.05 0.00 1.00 0.00 0.00 64.86 65.80 2i2x h ILE 59 Cb 1.26 0.59 -0.05 0.00 -0.74 0.00 0.00 36.82 37.87 2i2x h ILE 59 CO 0.07 0.02 0.21 0.50 0.00 0.00 0.00 178.15 178.96 2i2x h LYS 60 N 0.13 0.41 -0.28 2.37 1.63 -1.36 -0.44 116.57 119.03 2i2x h LYS 60 Ca 0.19 -0.02 0.01 0.00 -0.85 0.00 0.00 60.65 59.98 2i2x h LYS 60 Cb 0.26 -0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 31.78 2i2x h LYS 60 CO -0.30 0.27 0.17 1.49 -3.45 0.00 0.00 179.45 177.63 2i2x h GLU 61 N 0.42 0.34 0.00 1.90 4.57 -1.09 -1.49 114.58 119.23 2i2x h GLU 61 Ca 0.22 -0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.37 2i2x h GLU 61 Cb 0.18 -0.08 -0.00 0.00 -0.16 0.00 0.00 28.75 28.69 2i2x h GLU 61 CO -0.19 0.23 -0.06 1.88 -1.18 0.00 0.00 179.01 179.69 2i2x h TYR 62 N 0.35 0.00 -0.04 0.92 0.05 -0.55 -0.62 116.97 117.08 2i2x h TYR 62 Ca 0.11 0.00 -0.21 0.00 0.05 0.00 0.00 58.73 58.67 2i2x h TYR 62 Cb -0.02 0.00 0.02 0.00 1.01 0.00 0.00 36.73 37.74 2i2x h TYR 62 CO -0.07 0.06 -0.81 0.93 -1.05 0.00 0.00 178.16 177.22 2i2x h GLU 63 N 0.00 0.62 0.12 4.88 5.08 -0.43 -1.75 114.58 123.10 2i2x h GLU 63 Ca -0.00 -0.61 -0.01 0.00 -1.00 0.00 0.00 59.36 57.74 2i2x h GLU 63 Cb 0.16 0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.58 2i2x h GLU 63 CO 0.01 1.22 -0.06 0.00 -1.00 0.00 0.00 179.01 179.18 2i2x h ARG 64 N 0.25 -0.15 -0.28 2.33 3.08 -0.71 -1.23 114.38 117.67 2i2x h ARG 64 Ca -0.09 0.01 0.06 0.00 0.07 0.00 0.00 59.98 60.03 2i2x h ARG 64 Cb 1.48 0.03 -0.07 0.00 0.08 0.00 0.00 29.97 31.49 2i2x h ARG 64 CO 0.16 -0.09 -0.15 0.82 -1.07 0.00 0.00 179.97 179.64 2i2x h ILE 65 N -0.16 0.55 -0.41 2.04 2.04 -1.15 0.72 117.51 121.14 2i2x h ILE 65 Ca -0.02 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.83 2i2x h ILE 65 Cb 0.12 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 36.74 2i2x h ILE 65 CO 0.03 0.00 0.19 0.74 0.00 0.00 0.00 178.15 179.11 2i2x h THR 66 N -0.11 1.18 -0.02 -0.27 2.02 -1.16 -2.35 112.91 112.19 2i2x h THR 66 Ca 0.15 -0.51 0.00 0.00 0.77 0.00 0.00 66.41 66.82 2i2x h THR 66 Cb 0.34 0.76 -0.00 0.00 -1.74 0.00 0.00 68.15 67.50 2i2x h THR 66 CO -0.35 0.19 0.01 0.74 0.37 0.00 0.00 175.52 176.48 2i2x h THR 67 N 0.52 1.03 -0.78 3.16 2.02 -0.81 -1.97 112.91 116.08 2i2x h THR 67 Ca 0.14 -0.07 0.14 0.00 0.77 0.00 0.00 66.41 67.39 2i2x h THR 67 Cb 0.12 1.03 -0.09 0.00 -1.74 0.00 0.00 68.15 67.48 2i2x h THR 67 CO -0.02 0.02 0.35 0.44 0.37 0.00 0.00 175.52 176.68 2i2x h ASP 68 N 0.00 0.37 0.60 4.18 5.19 -0.68 -1.07 116.42 125.02 2i2x h ASP 68 Ca 0.01 0.10 -0.03 0.00 -0.62 0.00 0.00 57.03 56.49 2i2x h ASP 68 Cb 0.02 0.05 0.01 0.00 0.18 0.00 0.00 39.33 39.59 2i2x h ASP 68 CO -0.00 0.16 -0.29 0.58 -3.12 0.00 0.00 179.24 176.57 2i2x h VAL 69 N 0.51 0.22 -0.83 -1.35 2.07 -1.26 -2.38 116.25 113.23 2i2x h VAL 69 Ca 0.42 -0.36 0.10 0.00 0.82 0.00 0.00 66.70 67.69 2i2x h VAL 69 Cb 0.61 0.30 -0.08 0.00 -1.52 0.00 0.00 31.29 30.60 2i2x h VAL 69 CO -0.38 0.03 0.46 0.24 0.02 0.00 0.00 177.57 177.95 2i2x h MET 70 N -1.09 0.73 -0.26 1.57 2.86 -1.25 0.30 114.93 117.79 2i2x h MET 70 Ca -0.08 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.49 2i2x h MET 70 Cb 0.66 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 32.15 2i2x h MET 70 CO 0.13 0.48 0.07 1.49 1.06 0.00 0.00 176.91 180.15 2i2x h GLU 71 N 0.75 0.41 -0.56 1.72 4.57 -1.23 -2.49 114.58 117.75 2i2x h GLU 71 Ca 0.41 -0.09 -0.04 0.00 -1.18 0.00 0.00 59.36 58.46 2i2x h GLU 71 Cb 0.42 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.93 2i2x h GLU 71 CO -0.27 0.49 0.21 -0.09 -1.18 0.00 0.00 179.01 178.17 2i2x h ARG 72 N 0.25 0.85 -0.08 1.92 9.65 -0.77 -1.81 114.38 124.39 2i2x h ARG 72 Ca 0.08 -0.17 0.03 0.00 -1.10 0.00 0.00 59.98 58.82 2i2x h ARG 72 Cb 0.26 -0.13 -0.03 0.00 -1.39 0.00 0.00 29.97 28.68 2i2x h ARG 72 CO -0.00 0.75 -0.09 0.52 2.80 0.00 0.00 179.97 183.95 2i2x h MET 73 N 0.78 -0.11 0.00 0.20 2.86 -0.79 -2.01 114.93 115.86 2i2x h MET 73 Ca 0.19 0.01 -0.05 0.00 -2.06 0.00 0.00 59.70 57.78 2i2x h MET 73 Cb 0.23 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.91 2i2x h MET 73 CO -0.01 -0.07 -0.24 -0.39 1.06 0.00 0.00 176.91 177.25 2i2x h VAL 74 N -0.12 0.95 0.00 -2.22 -1.51 -1.39 -1.16 116.25 110.80 2i2x h VAL 74 Ca 0.06 -0.90 -0.05 0.00 -1.23 0.00 0.00 66.70 64.59 2i2x h VAL 74 Cb 0.21 1.52 -0.01 0.00 -2.13 0.00 0.00 31.29 30.87 2i2x h VAL 74 CO -0.15 0.24 -0.24 1.56 -1.23 0.00 0.00 177.57 177.75 2i2x h GLN 75 N 0.00 0.00 0.00 5.19 1.08 -0.60 -3.18 115.11 117.60 2i2x h GLN 75 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2i2x h GLN 75 Cb 0.50 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.93 2i2x h GLN 75 CO 0.03 0.24 -0.71 0.28 -0.95 0.00 0.00 178.83 177.72 2i2x n VAL 76 N -3.39 0.00 -0.77 -0.54 0.31 -1.01 -5.01 118.33 107.92 2i2x n VAL 76 Ca 0.00 -0.21 0.00 0.00 -0.01 0.00 0.00 64.34 64.12 2i2x n VAL 76 Cb 0.45 0.91 0.00 0.00 -0.91 0.00 0.00 33.84 34.29 2i2x n VAL 76 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2i2x n GLY 77 N 1.35 1.24 3.72 2.92 0.00 -0.69 -5.06 105.19 108.67 2i2x n GLY 77 Ca 0.02 -0.38 -0.42 0.00 0.00 0.00 0.00 46.02 45.24 2i2x n GLY 77 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2i2x s PHE 78 N -2.00 3.61 -0.14 1.61 0.08 -0.53 -4.96 117.98 115.65 2i2x s PHE 78 Ca 0.00 1.58 0.26 0.00 0.12 0.00 0.00 56.93 58.89 2i2x s PHE 78 Cb 0.00 -3.22 0.73 0.00 -0.57 0.00 0.00 43.02 39.96 2i2x s PHE 78 CO 0.00 -0.43 1.75 -1.00 -0.10 0.00 0.00 175.22 175.43 2i2x h PRO 79 N 6.41 0.00 -2.97 0.24 0.13 -1.95 -3.42 132.00 130.43 2i2x h PRO 79 Ca -0.42 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.60 2i2x h PRO 79 Cb 1.22 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.14 2i2x h PRO 79 CO 0.76 0.09 -0.25 0.00 -0.23 0.00 0.00 178.00 178.37 2i2x s ALA 80 N -3.40 -0.84 -0.18 -0.56 0.00 -1.26 -1.59 121.76 113.92 2i2x s ALA 80 Ca 0.04 0.41 -0.24 0.00 0.00 0.00 0.00 51.96 52.16 2i2x s ALA 80 Cb 0.07 0.05 0.06 0.00 0.00 0.00 0.00 23.12 23.30 2i2x s ALA 80 CO 0.63 -0.26 0.64 -1.50 0.00 0.00 0.00 175.76 175.27 2i2x s ILE 81 N -1.26 0.00 -0.07 0.00 -1.16 -0.70 -4.41 121.20 113.60 2i2x s ILE 81 Ca -0.13 -0.03 0.04 0.00 -0.51 0.00 0.00 60.65 60.02 2i2x s ILE 81 Cb -0.05 -0.91 -0.02 0.00 0.61 0.00 0.00 42.46 42.09 2i2x s ILE 81 CO 0.04 -0.01 -0.19 -0.63 -2.81 0.00 0.00 174.94 171.34 2i2x s ILE 82 N -0.12 2.63 -0.18 2.00 1.01 -0.28 -2.54 121.20 123.73 2i2x s ILE 82 Ca -0.03 -0.85 -0.06 0.00 0.00 0.00 0.00 60.65 59.70 2i2x s ILE 82 Cb -0.03 -2.02 -0.03 0.00 0.01 0.00 0.00 42.46 40.38 2i2x s ILE 82 CO 0.03 0.56 0.03 -0.76 0.00 0.00 0.00 174.94 174.81 2i2x s LEU 83 N -0.20 3.56 -0.15 2.97 1.02 -0.88 -1.17 118.68 123.83 2i2x s LEU 83 Ca -0.01 -0.03 -0.02 0.00 0.02 0.00 0.00 54.13 54.09 2i2x s LEU 83 Cb -0.13 -1.89 -0.02 0.00 0.02 0.00 0.00 46.19 44.16 2i2x s LEU 83 CO 0.03 0.14 -0.08 -0.70 0.02 0.00 0.00 176.35 175.77 2i2x s GLU 84 N 0.53 3.51 -0.29 1.70 2.12 -0.02 -0.69 118.70 125.56 2i2x s GLU 84 Ca 0.01 -0.61 -0.05 0.00 0.36 0.00 0.00 54.97 54.68 2i2x s GLU 84 Cb -0.13 -2.80 0.02 0.00 0.26 0.00 0.00 34.13 31.48 2i2x s GLU 84 CO 0.02 0.18 0.04 0.99 -0.54 0.00 0.00 175.26 175.94 2i2x s THR 85 N 0.48 3.54 -0.31 -1.70 2.01 -0.01 -4.24 115.64 115.41 2i2x s THR 85 Ca -0.06 -0.91 -0.22 0.00 0.31 0.00 0.00 61.69 60.81 2i2x s THR 85 Cb -0.15 -2.86 -0.00 0.00 0.01 0.00 0.00 72.50 69.49 2i2x s THR 85 CO 0.04 0.06 0.70 -1.61 -0.69 0.00 0.00 174.62 173.12 2i2x s GLU 86 N 1.42 3.90 0.19 4.92 2.02 -1.26 -1.57 118.70 128.32 2i2x s GLU 86 Ca 0.01 0.40 -0.33 0.00 0.02 0.00 0.00 54.97 55.07 2i2x s GLU 86 Cb -0.18 -3.74 -0.14 0.00 0.10 0.00 0.00 34.13 30.17 2i2x s GLU 86 CO 0.00 -0.64 1.38 0.72 0.02 0.00 0.00 175.26 176.74 2i2x n HIS 87 N 6.05 1.91 -2.19 1.61 8.25 -0.69 -4.98 115.22 125.19 2i2x n HIS 87 Ca 0.01 0.48 -0.32 0.00 -0.26 0.00 0.00 57.72 57.63 2i2x n HIS 87 Cb 0.48 -2.42 -0.01 0.00 1.12 0.00 0.00 29.99 29.16 2i2x n HIS 87 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 2i2x s VAL 88 N 0.19 4.27 0.31 1.59 -7.23 -1.26 -4.66 120.40 113.61 2i2x s VAL 88 Ca 0.74 1.04 0.06 0.00 -1.81 0.00 0.00 61.98 62.00 2i2x s VAL 88 Cb -0.74 -3.60 0.32 0.00 0.56 0.00 0.00 36.38 32.92 2i2x s VAL 88 CO 0.47 -0.67 1.64 0.06 -0.31 0.00 0.00 175.10 176.29 2i2x h GLN 89 N 0.56 0.22 0.00 4.82 -0.00 -2.00 -0.96 115.11 117.75 2i2x h GLN 89 Ca -0.46 -0.01 -0.02 0.00 -0.00 0.00 0.00 58.65 58.15 2i2x h GLN 89 Cb 1.20 -0.05 -0.00 0.00 -0.00 0.00 0.00 27.48 28.63 2i2x h GLN 89 CO 0.60 0.14 -0.11 -0.56 -0.00 0.00 0.00 178.83 178.90 2i2x h GLN 90 N 0.22 0.00 0.00 0.06 -0.00 -1.97 0.17 115.11 113.59 2i2x h GLN 90 Ca 0.61 0.00 -0.05 0.00 -0.00 0.00 0.00 58.65 59.21 2i2x h GLN 90 Cb 1.31 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 28.78 2i2x h GLN 90 CO -0.66 0.11 -0.25 0.52 -0.00 0.00 0.00 178.83 178.54 2i2x h MET 91 N 0.00 0.00 0.00 0.06 2.86 -1.44 -2.07 114.93 114.34 2i2x h MET 91 Ca -0.00 0.00 -0.37 0.00 -2.06 0.00 0.00 59.70 57.27 2i2x h MET 91 Cb 0.50 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 32.09 2i2x h MET 91 CO 0.01 0.25 -2.38 0.43 1.06 0.00 0.00 176.91 176.28 2i2x n SER 92 N -3.37 2.09 0.15 1.22 7.64 -0.57 -2.93 113.62 117.86 2i2x n SER 92 Ca 0.00 -0.09 0.05 0.00 1.01 0.00 0.00 58.87 59.84 2i2x n SER 92 Cb 0.46 -0.41 0.49 0.00 -1.01 0.00 0.00 64.21 63.74 2i2x n SER 92 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 2i2x h ASN 93 N -0.08 0.17 -3.43 6.43 2.35 -0.82 -3.29 115.58 116.92 2i2x h ASN 93 Ca -0.55 -0.02 -0.68 0.00 -0.55 0.00 0.00 56.30 54.50 2i2x h ASN 93 Cb 1.81 -0.04 -0.37 0.00 0.05 0.00 0.00 38.32 39.77 2i2x h ASN 93 CO -0.11 0.23 -0.24 0.20 -1.65 0.00 0.00 177.43 175.85 2i2x s ASN 94 N -6.92 5.61 0.35 5.81 0.01 -0.78 -4.99 114.94 114.04 2i2x s ASN 94 Ca -0.06 -3.62 0.16 0.00 -0.71 0.00 0.00 52.86 48.64 2i2x s ASN 94 Cb 0.16 -1.84 1.20 0.00 0.41 0.00 0.00 41.25 41.18 2i2x s ASN 94 CO 0.71 -0.19 1.60 -0.65 -1.51 0.00 0.00 177.10 177.06 2i2x h PRO 95 N 6.03 0.07 0.00 -0.60 0.11 -1.70 0.20 132.00 136.11 2i2x h PRO 95 Ca 0.13 -0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.17 2i2x h PRO 95 Cb 0.82 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.91 2i2x h PRO 95 CO 0.80 0.05 -0.27 0.66 -0.21 0.00 0.00 178.00 179.03 2i2x h SER 96 N 0.07 0.00 0.21 -2.05 4.64 -1.94 -2.57 113.55 111.91 2i2x h SER 96 Ca 0.78 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 62.11 2i2x h SER 96 Cb 1.96 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 64.02 2i2x h SER 96 CO -0.75 0.27 -0.28 -0.50 -0.87 0.00 0.00 176.83 174.70 2i2x h TRP 97 N 0.00 -0.75 -0.60 4.77 4.06 -0.85 -1.03 115.95 121.55 2i2x h TRP 97 Ca -0.00 0.01 -0.00 0.00 2.06 0.00 0.00 58.89 60.95 2i2x h TRP 97 Cb 0.49 0.30 -0.03 0.00 -1.00 0.00 0.00 29.16 28.92 2i2x h TRP 97 CO 0.00 -0.39 0.36 0.78 -3.56 0.00 0.00 178.44 175.63 2i2x h GLY 98 N -0.55 0.88 0.77 1.49 0.00 -1.39 -1.76 103.07 102.51 2i2x h GLY 98 Ca 0.01 -0.37 0.08 0.00 0.00 0.00 0.00 47.33 47.05 2i2x h GLY 98 CO -0.11 0.36 0.59 0.00 0.00 0.00 0.00 176.54 177.38 2i2x h ALA 99 N 1.18 1.55 -0.19 3.60 0.00 -1.31 0.52 119.26 124.61 2i2x h ALA 99 Ca 0.22 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.99 2i2x h ALA 99 Cb -0.02 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.53 2i2x h ALA 99 CO -0.04 0.29 -0.35 0.93 0.00 0.00 0.00 179.25 180.08 2i2x h GLU 100 N 0.98 0.57 -0.13 0.00 5.08 -0.37 -0.79 114.58 119.93 2i2x h GLU 100 Ca 0.41 -0.36 0.04 0.00 -1.00 0.00 0.00 59.36 58.45 2i2x h GLU 100 Cb 0.29 0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.54 2i2x h GLU 100 CO -0.17 0.97 -0.16 0.28 -1.00 0.00 0.00 179.01 178.93 2i2x h VAL 101 N 0.23 0.59 -0.64 3.13 2.07 -0.96 -0.63 116.25 120.04 2i2x h VAL 101 Ca 0.01 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.65 2i2x h VAL 101 Cb 0.94 0.59 -0.09 0.00 -1.52 0.00 0.00 31.29 31.21 2i2x h VAL 101 CO 0.08 0.00 0.17 0.00 0.02 0.00 0.00 177.57 177.84 2i2x h ALA 102 N 0.86 0.79 -0.50 1.67 0.00 -0.60 0.03 119.26 121.51 2i2x h ALA 102 Ca 0.09 0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 2i2x h ALA 102 Cb 0.33 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2i2x h ALA 102 CO -0.24 -0.28 0.23 1.25 0.00 0.00 0.00 179.25 180.20 2i2x h HIS 103 N 0.30 0.73 -0.41 0.00 6.17 0.11 -0.33 115.15 121.73 2i2x h HIS 103 Ca 0.34 -0.04 -0.09 0.00 0.71 0.00 0.00 60.37 61.29 2i2x h HIS 103 Cb 0.50 -0.22 -0.01 0.00 2.52 0.00 0.00 27.41 30.20 2i2x h HIS 103 CO -0.23 0.59 -0.09 0.00 0.71 0.00 0.00 177.93 178.91 2i2x h ALA 104 N 1.07 0.56 0.03 5.26 0.00 -0.20 -0.32 119.26 125.66 2i2x h ALA 104 Ca 0.17 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 2i2x h ALA 104 Cb 0.14 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2i2x h ALA 104 CO -0.02 0.42 -0.01 1.96 0.00 0.00 0.00 179.25 181.60 2i2x h GLN 105 N 0.59 -0.04 -0.66 0.00 4.20 -0.93 -3.00 115.11 115.28 2i2x h GLN 105 Ca 0.10 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.79 2i2x h GLN 105 Cb 0.61 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.37 2i2x h GLN 105 CO 0.04 -0.00 0.30 -0.22 -0.67 0.00 0.00 178.83 178.27 2i2x h LYS 106 N -0.07 0.95 -0.32 1.46 1.63 -0.85 -1.60 116.57 117.78 2i2x h LYS 106 Ca -0.00 -0.14 0.07 0.00 -0.85 0.00 0.00 60.65 59.73 2i2x h LYS 106 Cb 0.06 -0.17 -0.08 0.00 -0.60 0.00 0.00 32.23 31.43 2i2x h LYS 106 CO 0.01 0.75 -0.25 1.15 -3.45 0.00 0.00 179.45 177.66 2i2x h THR 107 N 0.94 0.36 -0.62 1.00 2.02 -0.98 -0.78 112.91 114.86 2i2x h THR 107 Ca 0.23 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.37 2i2x h THR 107 Cb 0.13 0.36 -0.03 0.00 -1.74 0.00 0.00 68.15 66.87 2i2x h THR 107 CO -0.03 0.00 0.23 0.40 0.37 0.00 0.00 175.52 176.49 2i2x h ILE 108 N -0.22 1.24 -0.88 3.11 2.04 -1.27 -2.39 117.51 119.13 2i2x h ILE 108 Ca 0.16 -0.76 -0.01 0.00 1.00 0.00 0.00 64.86 65.25 2i2x h ILE 108 Cb 0.47 0.58 -0.04 0.00 -0.74 0.00 0.00 36.82 37.08 2i2x h ILE 108 CO -0.44 0.30 0.52 0.24 0.00 0.00 0.00 178.15 178.76 2i2x h MET 109 N 0.87 1.20 -0.73 2.37 2.86 -0.92 -2.45 114.93 118.14 2i2x h MET 109 Ca 0.20 -0.11 -0.01 0.00 -2.06 0.00 0.00 59.70 57.72 2i2x h MET 109 Cb 0.23 -0.25 -0.03 0.00 0.06 0.00 0.00 31.60 31.61 2i2x h MET 109 CO -0.01 0.85 0.43 0.93 1.06 0.00 0.00 176.91 180.16 2i2x h GLU 110 N 1.22 1.00 -0.26 1.72 5.08 -0.82 -0.67 114.58 121.85 2i2x h GLU 110 Ca 0.32 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 2i2x h GLU 110 Cb -0.04 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.00 2i2x h GLU 110 CO -0.06 0.72 0.17 -0.22 -1.00 0.00 0.00 179.01 178.62 2i2x h LYS 111 N 1.00 0.34 -0.55 2.33 3.64 -0.98 0.43 116.57 122.78 2i2x h LYS 111 Ca 0.26 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.54 2i2x h LYS 111 Cb -0.01 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.71 2i2x h LYS 111 CO -0.05 0.23 0.03 1.88 -2.27 0.00 0.00 179.45 179.27 2i2x h TYR 112 N 0.34 0.98 -0.25 1.91 -1.99 -1.31 -0.82 116.97 115.83 2i2x h TYR 112 Ca 0.09 -0.14 -0.05 0.00 2.00 0.00 0.00 58.73 60.63 2i2x h TYR 112 Cb -0.04 -0.27 -0.01 0.00 2.00 0.00 0.00 36.73 38.42 2i2x h TYR 112 CO -0.06 0.87 -0.04 1.25 -0.00 0.00 0.00 178.16 180.18 2i2x h HIS 113 N 0.85 0.51 -0.70 4.88 2.76 -0.79 0.12 115.15 122.79 2i2x h HIS 113 Ca 0.17 -0.10 -0.03 0.00 -2.20 0.00 0.00 60.37 58.21 2i2x h HIS 113 Cb 0.46 -0.13 -0.03 0.00 1.55 0.00 0.00 27.41 29.26 2i2x h HIS 113 CO 0.03 0.66 0.34 -0.44 -1.30 0.00 0.00 177.93 177.22 2i2x h ASP 114 N 0.21 0.91 -0.23 3.26 3.32 -0.75 0.30 116.42 123.44 2i2x h ASP 114 Ca 0.06 -0.13 -0.17 0.00 0.02 0.00 0.00 57.03 56.81 2i2x h ASP 114 Cb 0.49 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.81 2i2x h ASP 114 CO 0.02 0.78 -0.53 -0.33 -1.72 0.00 0.00 179.24 177.46 2i2x h GLU 115 N 0.97 0.76 0.00 3.56 5.08 -1.07 -3.40 114.58 120.48 2i2x h GLU 115 Ca 0.24 -0.52 -0.00 0.00 -1.00 0.00 0.00 59.36 58.08 2i2x h GLU 115 Cb 0.12 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.44 2i2x h GLU 115 CO -0.03 1.14 -1.02 0.66 -1.00 0.00 0.00 179.01 178.76 2i2x n TYR 116 N -4.09 0.00 -0.85 4.33 4.01 0.41 -5.02 117.16 115.96 2i2x n TYR 116 Ca -0.06 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.68 2i2x n TYR 116 Cb 0.62 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.64 2i2x n TYR 116 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2i2x n GLY 117 N 2.49 0.59 3.69 2.72 0.00 0.11 -5.02 105.19 109.77 2i2x n GLY 117 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2i2x n GLY 117 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2i2x s ILE 118 N -2.05 2.68 0.29 -0.61 2.07 -1.26 -4.97 121.20 117.34 2i2x s ILE 118 Ca 0.00 0.20 -0.29 0.00 -1.41 0.00 0.00 60.65 59.15 2i2x s ILE 118 Cb 0.00 -3.13 -0.09 0.00 0.13 0.00 0.00 42.46 39.37 2i2x s ILE 118 CO 0.00 0.00 1.08 -0.54 -1.91 0.00 0.00 174.94 173.57 2i2x s LYS 119 N 2.62 4.63 -0.00 3.50 1.02 -0.62 -4.57 119.74 126.31 2i2x s LYS 119 Ca 0.78 1.74 -0.28 0.00 0.02 0.00 0.00 55.97 58.23 2i2x s LYS 119 Cb -0.44 -3.14 0.10 0.00 -0.52 0.00 0.00 37.83 33.82 2i2x s LYS 119 CO 0.35 0.22 0.84 0.00 -0.92 0.00 0.00 175.35 175.83 2i2x s ALA 121 N -2.83 -0.38 -0.12 0.00 0.00 -1.05 0.17 121.76 117.55 2i2x s ALA 121 Ca 0.02 -0.36 0.00 0.00 0.00 0.00 0.00 51.96 51.62 2i2x s ALA 121 Cb -0.01 0.39 -0.02 0.00 0.00 0.00 0.00 23.12 23.48 2i2x s ALA 121 CO -0.07 -0.44 -0.13 -1.17 0.00 0.00 0.00 175.76 173.95 2i2x s LEU 122 N -2.43 2.75 -0.16 0.00 2.96 -1.26 -2.08 118.68 118.47 2i2x s LEU 122 Ca -0.01 -0.29 0.00 0.00 -0.22 0.00 0.00 54.13 53.61 2i2x s LEU 122 Cb 0.02 -1.61 -0.00 0.00 0.50 0.00 0.00 46.19 45.09 2i2x s LEU 122 CO -0.07 0.20 -0.15 -0.60 -1.32 0.00 0.00 176.35 174.41 2i2x s ARG 123 N 0.15 3.21 -0.17 1.98 3.52 0.13 -0.27 118.95 127.50 2i2x s ARG 123 Ca -0.07 -0.75 -0.05 0.00 -0.13 0.00 0.00 55.73 54.74 2i2x s ARG 123 Cb -0.15 -2.65 -0.03 0.00 -1.56 0.00 0.00 34.95 30.57 2i2x s ARG 123 CO 0.05 -0.01 -0.01 -1.01 -0.81 0.00 0.00 175.30 173.50 2i2x s HIS 124 N 0.88 3.06 -0.36 5.12 3.76 -0.59 -0.83 115.29 126.34 2i2x s HIS 124 Ca -0.04 -0.27 -0.01 0.00 -0.15 0.00 0.00 55.06 54.59 2i2x s HIS 124 Cb -0.15 -2.00 0.09 0.00 1.11 0.00 0.00 32.58 31.63 2i2x s HIS 124 CO -0.01 -0.04 0.10 0.99 -0.85 0.00 0.00 174.74 174.93 2i2x s THR 125 N 0.48 2.93 0.47 1.30 2.01 -0.61 -1.75 115.64 120.48 2i2x s THR 125 Ca -0.02 -1.93 -0.21 0.00 0.31 0.00 0.00 61.69 59.84 2i2x s THR 125 Cb -0.14 -2.95 -0.08 0.00 0.01 0.00 0.00 72.50 69.34 2i2x s THR 125 CO 0.02 -0.49 1.05 -0.63 -0.69 0.00 0.00 174.62 173.88 2i2x s ILE 126 N 1.11 3.70 0.13 1.82 1.09 -0.18 -1.70 121.20 127.18 2i2x s ILE 126 Ca 0.05 1.12 -0.30 0.00 -1.10 0.00 0.00 60.65 60.41 2i2x s ILE 126 Cb -0.21 -3.48 -0.07 0.00 -1.06 0.00 0.00 42.46 37.64 2i2x s ILE 126 CO -0.04 -0.17 1.09 -0.83 -0.10 0.00 0.00 174.94 174.88 2i2x s GLY 127 N -1.86 2.79 -0.84 6.18 0.00 -1.26 -4.30 107.32 108.03 2i2x s GLY 127 Ca 0.66 0.77 -0.25 0.00 0.00 0.00 0.00 44.72 45.90 2i2x s GLY 127 CO 0.22 1.70 1.86 -0.35 0.00 0.00 0.00 173.10 176.53 2i2x s ASP 128 N 0.20 5.34 0.00 1.64 -1.08 -1.26 -4.78 116.67 116.72 2i2x s ASP 128 Ca 0.51 -0.51 0.13 0.00 -0.52 0.00 0.00 52.55 52.16 2i2x s ASP 128 Cb -0.28 -2.55 0.38 0.00 -1.46 0.00 0.00 42.92 39.00 2i2x s ASP 128 CO 0.33 -2.51 1.31 2.30 0.52 0.00 0.00 175.17 177.12 2i2x n ILE 129 N 7.58 0.52 -1.37 4.11 -5.35 -1.26 -4.73 119.36 118.86 2i2x n ILE 129 Ca 0.34 -0.53 -0.36 0.00 -0.27 0.00 0.00 62.75 61.93 2i2x n ILE 129 Cb 0.49 0.28 -0.04 0.00 -1.74 0.00 0.00 39.64 38.62 2i2x n ILE 129 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 2i2x n ARG 130 N 0.67 3.61 -3.45 6.28 1.74 -1.26 -4.83 116.66 119.41 2i2x n ARG 130 Ca 0.14 -2.23 -0.13 0.00 -0.77 0.00 0.00 57.85 54.85 2i2x n ARG 130 Cb 0.34 -2.68 -0.03 0.00 -1.02 0.00 0.00 32.46 29.07 2i2x n ARG 130 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2i2x s GLU 131 N 1.54 1.22 0.00 5.56 2.12 -1.26 -0.42 118.70 127.45 2i2x s GLU 131 Ca 0.67 -0.31 0.00 0.00 0.36 0.00 0.00 54.97 55.70 2i2x s GLU 131 Cb 0.20 0.56 0.00 0.00 0.26 0.00 0.00 34.13 35.15 2i2x s GLU 131 CO -0.06 -0.50 0.00 0.27 -0.54 0.00 0.00 175.26 174.43 2i2x n ASN 132 N -0.06 1.85 0.02 -1.70 2.04 -0.59 -4.86 115.26 111.96 2i2x n ASN 132 Ca -0.17 -0.37 -0.00 0.00 -0.44 0.00 0.00 54.58 53.59 2i2x n ASN 132 Cb 0.63 0.00 0.29 0.00 -2.53 0.00 0.00 39.78 38.17 2i2x n ASN 132 CO 0.00 0.00 0.00 -0.09 -0.44 0.00 0.00 177.26 176.73 2i2x h ARG 133 N 0.00 0.47 0.00 -3.83 2.43 -2.02 -3.36 114.38 108.06 2i2x h ARG 133 Ca 0.00 -0.12 -0.01 0.00 -0.81 0.00 0.00 59.98 59.04 2i2x h ARG 133 Cb 0.00 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.49 2i2x h ARG 133 CO 0.00 0.55 -0.66 -0.85 -1.51 0.00 0.00 179.97 177.51 2i2x n GLU 134 N -4.24 0.47 -4.35 0.20 0.00 -1.26 -5.07 120.64 106.40 2i2x n GLU 134 Ca 0.01 0.46 -0.18 0.00 0.00 0.00 0.00 57.16 57.45 2i2x n GLU 134 Cb 0.28 -1.64 -0.10 0.00 0.00 0.00 0.00 31.44 29.99 2i2x n GLU 134 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.13 176.54 2i2x s PHE 135 N -2.39 1.61 0.77 -1.84 -0.12 -1.26 -4.99 117.98 109.76 2i2x s PHE 135 Ca -0.18 -1.21 -0.13 0.00 -0.05 0.00 0.00 56.93 55.36 2i2x s PHE 135 Cb 0.03 -0.95 0.06 0.00 -0.63 0.00 0.00 43.02 41.53 2i2x s PHE 135 CO 0.28 -0.34 1.15 -0.51 -0.05 0.00 0.00 175.22 175.75 2i2x s LEU 136 N -3.36 3.16 -0.38 -1.99 1.43 -1.26 -1.54 118.68 114.74 2i2x s LEU 136 Ca 0.36 2.15 0.12 0.00 -1.03 0.00 0.00 54.13 55.74 2i2x s LEU 136 Cb 0.07 -4.56 0.35 0.00 0.03 0.00 0.00 46.19 42.08 2i2x s LEU 136 CO 0.15 -2.32 0.75 0.00 0.23 0.00 0.00 176.35 175.16 2i2x n GLN 137 N -3.18 1.10 0.30 1.70 6.02 0.44 -4.80 117.38 118.95 2i2x n GLN 137 Ca 0.12 -3.45 0.18 0.00 -0.01 0.00 0.00 57.00 53.84 2i2x n GLN 137 Cb 0.51 -1.72 0.90 0.00 1.02 0.00 0.00 30.24 30.95 2i2x n GLN 137 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 2i2x h LEU 138 N 3.00 0.00 -2.49 1.08 3.38 -1.84 -2.60 115.31 115.83 2i2x h LEU 138 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2i2x h LEU 138 Cb 0.95 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.70 2i2x h LEU 138 CO 0.52 0.03 -0.17 0.54 0.09 0.00 0.00 178.44 179.45 2i2x n ARG 139 N -3.22 0.94 0.00 1.13 1.74 -1.26 -4.91 116.66 111.08 2i2x n ARG 139 Ca -0.01 -1.74 0.00 0.00 -0.77 0.00 0.00 57.85 55.32 2i2x n ARG 139 Cb 0.20 -1.02 0.00 0.00 -1.02 0.00 0.00 32.46 30.62 2i2x n ARG 139 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2i2x n GLY 140 N -0.72 1.34 0.31 -0.13 0.00 -0.98 -4.85 105.19 100.15 2i2x n GLY 140 Ca 0.07 -1.66 -0.04 0.00 0.00 0.00 0.00 46.02 44.40 2i2x n GLY 140 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2i2x h ASP 141 N 0.00 0.86 0.51 1.61 3.32 -1.99 -2.37 116.42 118.36 2i2x h ASP 141 Ca 0.00 -0.15 0.00 0.00 0.02 0.00 0.00 57.03 56.90 2i2x h ASP 141 Cb 0.00 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.32 2i2x h ASP 141 CO 0.00 0.82 0.00 0.29 -1.72 0.00 0.00 179.24 178.63 2i2x n LYS 142 N -4.27 0.11 -0.02 3.56 4.01 -1.26 -3.89 118.16 116.40 2i2x n LYS 142 Ca 0.05 0.16 -0.03 0.00 -0.51 0.00 0.00 58.31 57.97 2i2x n LYS 142 Cb 0.22 -1.50 0.21 0.00 -0.51 0.00 0.00 35.03 33.45 2i2x n LYS 142 CO 0.00 0.00 0.00 -0.92 -1.11 0.00 0.00 177.40 175.37 2i2x h TYR 143 N 0.00 0.62 -0.04 2.13 3.20 -1.73 -1.98 116.97 119.17 2i2x h TYR 143 Ca 0.00 -0.11 -0.14 0.00 3.14 0.00 0.00 58.73 61.63 2i2x h TYR 143 Cb 0.25 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.35 2i2x h TYR 143 CO 0.00 0.69 -0.59 0.66 -1.64 0.00 0.00 178.16 177.28 2i2x h SER 144 N 0.52 0.17 -0.27 -2.11 4.64 -1.79 -2.93 113.55 111.78 2i2x h SER 144 Ca 0.09 -0.09 -0.16 0.00 -0.47 0.00 0.00 61.79 61.15 2i2x h SER 144 Cb 0.56 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.60 2i2x h SER 144 CO 0.04 0.72 -0.44 0.58 -0.87 0.00 0.00 176.83 176.85 2i2x h VAL 145 N 0.11 1.28 -0.56 0.95 2.07 -1.70 -1.55 116.25 116.85 2i2x h VAL 145 Ca -0.01 -1.63 0.05 0.00 0.82 0.00 0.00 66.70 65.94 2i2x h VAL 145 Cb 1.07 1.50 -0.05 0.00 -1.52 0.00 0.00 31.29 32.30 2i2x h VAL 145 CO 0.09 0.53 0.28 0.15 0.02 0.00 0.00 177.57 178.64 2i2x h PHE 146 N 0.67 0.52 -0.19 1.57 3.57 -1.30 -0.41 116.94 121.36 2i2x h PHE 146 Ca 0.04 0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.46 2i2x h PHE 146 Cb 1.02 -0.15 -0.00 0.00 2.79 0.00 0.00 35.95 39.61 2i2x h PHE 146 CO 0.06 0.24 -0.27 -0.07 -2.23 0.00 0.00 178.31 176.04 2i2x h LEU 147 N 0.54 0.57 -0.76 0.59 3.38 -1.38 -3.02 115.31 115.23 2i2x h LEU 147 Ca 0.25 -0.51 0.13 0.00 0.09 0.00 0.00 57.88 57.84 2i2x h LEU 147 Cb 0.18 -0.16 -0.09 0.00 0.09 0.00 0.00 40.66 40.68 2i2x h LEU 147 CO -0.18 0.97 0.35 -0.33 0.09 0.00 0.00 178.44 179.34 2i2x h GLU 148 N 0.18 0.52 -0.71 1.13 5.08 -1.04 -0.67 114.58 119.07 2i2x h GLU 148 Ca 0.02 -0.03 0.10 0.00 -1.00 0.00 0.00 59.36 58.45 2i2x h GLU 148 Cb 0.85 -0.12 -0.07 0.00 0.50 0.00 0.00 28.75 29.90 2i2x h GLU 148 CO 0.06 0.34 0.34 0.00 -1.00 0.00 0.00 179.01 178.76 2i2x h ALA 149 N 1.51 0.98 0.32 3.43 0.00 -0.97 0.16 119.26 124.70 2i2x h ALA 149 Ca 0.41 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.36 2i2x h ALA 149 Cb 0.55 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2i2x h ALA 149 CO -0.35 -0.08 -0.15 0.74 0.00 0.00 0.00 179.25 179.41 2i2x h PHE 150 N 0.57 -0.40 -0.07 0.00 0.04 -1.04 -2.97 116.94 113.07 2i2x h PHE 150 Ca 0.36 -0.01 -0.09 0.00 2.80 0.00 0.00 57.97 61.03 2i2x h PHE 150 Cb 0.41 0.13 -0.01 0.00 2.20 0.00 0.00 35.95 38.68 2i2x h PHE 150 CO -0.12 -0.07 -0.36 1.49 -0.60 0.00 0.00 178.31 178.65 2i2x h GLU 151 N -0.77 0.14 -0.36 1.51 4.81 -0.99 0.70 114.58 119.62 2i2x h GLU 151 Ca -0.04 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.10 2i2x h GLU 151 Cb 0.51 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.87 2i2x h GLU 151 CO 0.07 0.49 0.12 1.96 -0.73 0.00 0.00 179.01 180.93 2i2x h GLN 152 N 0.12 0.55 -0.40 1.92 1.08 -0.77 -0.86 115.11 116.76 2i2x h GLN 152 Ca 0.01 -0.11 -0.04 0.00 -1.45 0.00 0.00 58.65 57.07 2i2x h GLN 152 Cb 0.71 -0.08 -0.02 0.00 -0.05 0.00 0.00 27.48 28.04 2i2x h GLN 152 CO 0.05 0.55 0.10 0.00 -0.95 0.00 0.00 178.83 178.59 2i2x h ALA 154 N 0.95 2.06 -0.01 0.00 0.00 -0.67 -1.84 119.26 119.75 2i2x h ALA 154 Ca 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2i2x h ALA 154 Cb 0.31 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2i2x h ALA 154 CO 0.00 -0.23 -0.21 0.39 0.00 0.00 0.00 179.25 179.20 2i2x n GLU 155 N -4.47 1.33 -0.16 0.00 1.02 -0.34 -4.31 120.64 113.71 2i2x n GLU 155 Ca 0.12 -0.92 0.08 0.00 -0.02 0.00 0.00 57.16 56.43 2i2x n GLU 155 Cb 0.45 -1.48 0.12 0.00 -0.02 0.00 0.00 31.44 30.52 2i2x n GLU 155 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2i2x n ASN 156 N -0.03 2.00 0.00 1.62 4.13 -0.76 -5.00 115.26 117.21 2i2x n ASN 156 Ca 0.13 -2.96 0.00 0.00 1.68 0.00 0.00 54.58 53.43 2i2x n ASN 156 Cb 0.41 -0.40 0.00 0.00 -1.54 0.00 0.00 39.78 38.25 2i2x n ASN 156 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2i2x n GLY 157 N -1.22 1.63 3.72 7.41 0.00 -1.08 -1.38 105.19 114.27 2i2x n GLY 157 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 2i2x n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i2x s ALA 158 N -1.57 3.49 -0.12 4.61 0.00 -0.80 -4.69 121.76 122.69 2i2x s ALA 158 Ca 0.00 0.99 0.12 0.00 0.00 0.00 0.00 51.96 53.07 2i2x s ALA 158 Cb 0.00 -3.49 -0.24 0.00 0.00 0.00 0.00 23.12 19.40 2i2x s ALA 158 CO 0.00 -0.52 0.37 -0.25 0.00 0.00 0.00 175.76 175.36 2i2x n ASP 159 N 3.80 0.79 -4.23 0.00 9.92 0.62 -4.56 116.55 122.89 2i2x n ASP 159 Ca 0.10 0.21 -0.28 0.00 -0.53 0.00 0.00 54.79 54.29 2i2x n ASP 159 Cb 0.44 0.19 -0.16 0.00 -0.64 0.00 0.00 41.12 40.95 2i2x n ASP 159 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2i2x s LEU 160 N -6.02 2.03 -0.15 0.64 1.43 -0.34 -1.45 118.68 114.82 2i2x s LEU 160 Ca -0.11 -0.39 0.02 0.00 -1.03 0.00 0.00 54.13 52.62 2i2x s LEU 160 Cb 0.07 -1.11 0.01 0.00 0.03 0.00 0.00 46.19 45.19 2i2x s LEU 160 CO 0.80 0.25 -0.20 -0.76 0.23 0.00 0.00 176.35 176.68 2i2x s LEU 161 N -0.44 2.22 0.25 1.79 1.43 -0.60 -1.54 118.68 121.78 2i2x s LEU 161 Ca 0.07 -0.58 0.01 0.00 -1.03 0.00 0.00 54.13 52.60 2i2x s LEU 161 Cb -0.09 -1.49 -0.04 0.00 0.03 0.00 0.00 46.19 44.60 2i2x s LEU 161 CO -0.00 0.06 0.13 -0.44 0.23 0.00 0.00 176.35 176.32 2i2x s SER 162 N 0.93 0.88 -0.08 2.29 0.01 -0.72 -1.87 113.70 115.14 2i2x s SER 162 Ca -0.04 -1.43 -0.30 0.00 1.31 0.00 0.00 55.95 55.49 2i2x s SER 162 Cb -0.15 0.29 0.07 0.00 0.21 0.00 0.00 66.02 66.44 2i2x s SER 162 CO -0.04 -0.81 0.68 0.54 0.41 0.00 0.00 173.24 174.02 2i2x s VAL 163 N -3.87 0.00 -0.78 3.43 0.11 -1.23 -1.01 120.40 117.06 2i2x s VAL 163 Ca 0.38 -0.01 -0.12 0.00 -2.93 0.00 0.00 61.98 59.31 2i2x s VAL 163 Cb 0.07 -0.99 0.20 0.00 -1.53 0.00 0.00 36.38 34.13 2i2x s VAL 163 CO 0.14 -0.00 0.69 -1.61 -3.33 0.00 0.00 175.10 170.99 2i2x s GLU 164 N -0.99 3.38 0.76 1.54 2.02 -1.26 -3.83 118.70 120.32 2i2x s GLU 164 Ca -0.10 -2.44 -0.11 0.00 0.02 0.00 0.00 54.97 52.34 2i2x s GLU 164 Cb -0.01 -4.29 0.05 0.00 0.10 0.00 0.00 34.13 29.98 2i2x s GLU 164 CO 0.09 -1.27 1.08 -1.54 0.02 0.00 0.00 175.26 173.64 2i2x s SER 165 N 1.93 4.80 0.00 -0.19 1.04 -1.26 -4.51 113.70 115.52 2i2x s SER 165 Ca 0.17 1.43 0.08 0.00 0.48 0.00 0.00 55.95 58.11 2i2x s SER 165 Cb -0.13 -2.21 0.16 0.00 0.10 0.00 0.00 66.02 63.94 2i2x s SER 165 CO -0.07 -1.79 1.02 0.23 0.98 0.00 0.00 173.24 173.61 2i2x n MET 166 N -3.33 1.81 -1.65 4.02 0.00 -1.26 -4.59 117.12 112.13 2i2x n MET 166 Ca 0.07 -1.54 -0.47 0.00 0.00 0.00 0.00 57.70 55.76 2i2x n MET 166 Cb 0.55 -1.18 -0.04 0.00 0.00 0.00 0.00 33.22 32.55 2i2x n MET 166 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2i2x n GLY 167 N 0.33 1.40 1.47 3.03 0.00 -1.26 -0.80 105.19 109.36 2i2x n GLY 167 Ca 0.07 0.85 0.00 0.00 0.00 0.00 0.00 46.02 46.94 2i2x n GLY 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i2x n GLY 168 N 4.82 1.17 0.40 -0.02 0.00 -1.26 -3.77 105.19 106.53 2i2x n GLY 168 Ca 0.25 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.47 2i2x n GLY 168 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2i2x h LYS 169 N 3.43 0.45 0.13 1.61 3.64 -1.27 -1.03 116.57 123.53 2i2x h LYS 169 Ca 0.00 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 2i2x h LYS 169 Cb 0.00 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.72 2i2x h LYS 169 CO 0.00 0.30 -0.06 1.05 -2.27 0.00 0.00 179.45 178.47 2i2x h GLU 170 N 0.46 -0.17 -0.75 1.90 9.09 -1.92 0.16 114.58 123.35 2i2x h GLU 170 Ca 0.55 0.01 -0.03 0.00 0.05 0.00 0.00 59.36 59.93 2i2x h GLU 170 Cb 1.29 0.04 -0.03 0.00 -1.65 0.00 0.00 28.75 28.39 2i2x h GLU 170 CO -0.27 0.27 0.33 0.28 0.05 0.00 0.00 179.01 179.67 2i2x h VAL 171 N -0.68 1.24 -0.35 -1.06 2.07 -1.93 -2.85 116.25 112.69 2i2x h VAL 171 Ca -0.02 -0.73 0.05 0.00 0.82 0.00 0.00 66.70 66.83 2i2x h VAL 171 Cb 0.51 0.32 -0.05 0.00 -1.52 0.00 0.00 31.29 30.55 2i2x h VAL 171 CO 0.03 0.30 0.05 0.15 0.02 0.00 0.00 177.57 178.13 2i2x h PHE 172 N 1.07 0.09 -0.22 1.57 3.57 -1.07 0.04 116.94 122.00 2i2x h PHE 172 Ca 0.26 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.76 2i2x h PHE 172 Cb 0.16 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 2i2x h PHE 172 CO 0.02 0.00 0.03 -0.44 -2.23 0.00 0.00 178.31 175.69 2i2x h ASP 173 N 0.17 0.28 -0.01 0.41 3.32 -0.73 -0.64 116.42 119.21 2i2x h ASP 173 Ca 0.17 -0.03 -0.12 0.00 0.02 0.00 0.00 57.03 57.07 2i2x h ASP 173 Cb 0.20 -0.07 0.01 0.00 0.22 0.00 0.00 39.33 39.69 2i2x h ASP 173 CO -0.23 0.31 -0.46 0.22 -1.72 0.00 0.00 179.24 177.36 2i2x h TYR 174 N 0.31 0.48 -0.56 4.55 5.03 -1.31 -3.36 116.97 122.10 2i2x h TYR 174 Ca 0.07 -0.25 -0.09 0.00 2.58 0.00 0.00 58.73 61.04 2i2x h TYR 174 Cb 0.15 -0.06 -0.02 0.00 1.55 0.00 0.00 36.73 38.36 2i2x h TYR 174 CO 0.00 1.06 0.01 0.00 -1.32 0.00 0.00 178.16 177.91 2i2x h ALA 175 N 0.31 0.76 0.00 1.82 0.00 -0.39 -3.23 119.26 118.53 2i2x h ALA 175 Ca -0.05 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.56 2i2x h ALA 175 Cb 1.18 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.76 2i2x h ALA 175 CO 0.09 0.58 0.00 -0.24 0.00 0.00 0.00 179.25 179.68 2i2x h VAL 176 N 0.87 0.00 -0.01 0.00 3.04 -1.28 -0.13 116.25 118.74 2i2x h VAL 176 Ca 0.16 -0.40 0.00 0.00 -1.01 0.00 0.00 66.70 65.45 2i2x h VAL 176 Cb 0.53 1.34 0.00 0.00 -2.01 0.00 0.00 31.29 31.15 2i2x h VAL 176 CO 0.03 0.00 -0.20 0.18 -1.01 0.00 0.00 177.57 176.57 2i2x n LEU 177 N -2.91 0.95 0.00 3.16 4.32 -1.22 -4.30 117.00 117.01 2i2x n LEU 177 Ca 0.01 -0.23 0.00 0.00 -0.02 0.00 0.00 56.01 55.77 2i2x n LEU 177 Cb 0.27 -0.12 0.00 0.00 -1.62 0.00 0.00 43.42 41.94 2i2x n LEU 177 CO 0.25 0.17 0.23 0.54 -1.22 0.00 0.00 177.39 177.36 2i2x n ARG 178 N -0.64 -0.06 -3.21 3.23 1.74 -0.09 -4.99 116.66 112.64 2i2x n ARG 178 Ca 0.13 -0.53 -0.23 0.00 -0.77 0.00 0.00 57.85 56.46 2i2x n ARG 178 Cb 0.33 -0.84 0.05 0.00 -1.02 0.00 0.00 32.46 30.99 2i2x n ARG 178 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2i2x n ASN 179 N -0.08 -6.22 -4.47 0.55 3.02 -1.12 -4.94 115.26 102.01 2i2x n ASN 179 Ca 0.00 -0.37 -0.44 0.00 -0.03 0.00 0.00 54.58 53.74 2i2x n ASN 179 Cb 0.14 -4.97 -0.01 0.00 -0.61 0.00 0.00 39.78 34.33 2i2x n ASN 179 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2i2x s ASP 180 N -2.92 6.85 0.08 6.41 2.15 -1.01 -4.86 116.67 123.36 2i2x s ASP 180 Ca 0.40 -2.49 -0.20 0.00 0.43 0.00 0.00 52.55 50.69 2i2x s ASP 180 Cb -0.18 -2.42 -0.10 0.00 -0.30 0.00 0.00 42.92 39.92 2i2x s ASP 180 CO 0.50 -0.94 1.57 0.40 -0.17 0.00 0.00 175.17 176.53 2i2x h ILE 181 N 5.31 1.20 -0.73 4.11 1.08 -1.92 0.03 117.51 126.60 2i2x h ILE 181 Ca 0.25 -0.64 0.16 0.00 -0.39 0.00 0.00 64.86 64.24 2i2x h ILE 181 Cb 0.94 1.28 -0.05 0.00 -3.07 0.00 0.00 36.82 35.92 2i2x h ILE 181 CO 1.21 0.20 0.49 -0.65 -0.69 0.00 0.00 178.15 178.71 2i2x h PRO 182 N 0.11 0.32 -0.10 2.37 0.11 -1.89 0.76 132.00 133.69 2i2x h PRO 182 Ca 0.06 -0.02 -0.14 0.00 0.11 0.00 0.00 66.00 66.01 2i2x h PRO 182 Cb 0.26 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.28 2i2x h PRO 182 CO 0.00 0.21 -0.54 0.78 -0.21 0.00 0.00 178.00 178.24 2i2x h GLY 183 N 0.33 0.30 0.92 -0.55 0.00 -1.46 -1.18 103.07 101.44 2i2x h GLY 183 Ca 0.36 -0.35 -0.05 0.00 0.00 0.00 0.00 47.33 47.29 2i2x h GLY 183 CO -0.10 0.31 0.02 1.41 0.00 0.00 0.00 176.54 178.18 2i2x h LEU 184 N 0.21 0.61 -0.69 3.11 4.07 0.45 0.83 115.31 123.91 2i2x h LEU 184 Ca 0.00 -0.30 0.04 0.00 0.08 0.00 0.00 57.88 57.71 2i2x h LEU 184 Cb 1.02 -0.16 -0.05 0.00 1.08 0.00 0.00 40.66 42.55 2i2x h LEU 184 CO 0.09 0.76 0.41 0.25 -1.08 0.00 0.00 178.44 178.87 2i2x h LEU 185 N 0.45 0.66 -0.00 1.67 6.46 -0.53 -1.24 115.31 122.77 2i2x h LEU 185 Ca 0.10 0.01 -0.11 0.00 -0.12 0.00 0.00 57.88 57.77 2i2x h LEU 185 Cb 0.43 -0.13 0.01 0.00 -0.73 0.00 0.00 40.66 40.25 2i2x h LEU 185 CO 0.02 0.44 -0.42 0.22 -0.62 0.00 0.00 178.44 178.07 2i2x h TYR 186 N 0.79 0.43 0.04 1.25 3.20 -1.13 -0.43 116.97 121.13 2i2x h TYR 186 Ca 0.29 -0.23 -0.00 0.00 3.14 0.00 0.00 58.73 61.92 2i2x h TYR 186 Cb 0.09 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 38.31 2i2x h TYR 186 CO -0.05 1.04 -0.02 0.66 -1.64 0.00 0.00 178.16 178.15 2i2x h SER 187 N -0.30 -0.05 0.00 -2.11 4.64 -0.69 -0.43 113.55 114.61 2i2x h SER 187 Ca -0.05 -0.32 -0.02 0.00 -0.47 0.00 0.00 61.79 60.93 2i2x h SER 187 Cb 1.15 0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 63.26 2i2x h SER 187 CO 0.08 0.29 -0.10 0.40 -0.87 0.00 0.00 176.83 176.63 2i2x h ILE 188 N -0.40 1.24 -0.03 0.95 2.04 -1.37 -1.70 117.51 118.24 2i2x h ILE 188 Ca -0.01 -1.96 -0.15 0.00 1.00 0.00 0.00 64.86 63.74 2i2x h ILE 188 Cb 0.36 2.37 -0.01 0.00 -0.74 0.00 0.00 36.82 38.80 2i2x h ILE 188 CO 0.01 0.42 -0.68 1.23 0.00 0.00 0.00 178.15 179.13 2i2x h GLY 189 N -1.00 0.16 0.00 5.37 0.00 -1.17 -3.20 103.07 103.24 2i2x h GLY 189 Ca -0.03 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.08 2i2x h GLY 189 CO -0.02 0.20 -0.07 0.00 0.00 0.00 0.00 176.54 176.66 2i2x h LEU 191 N -0.07 -1.11 -0.11 0.00 3.38 -1.21 -1.17 115.31 115.02 2i2x h LEU 191 Ca 0.00 0.19 0.03 0.00 0.09 0.00 0.00 57.88 58.19 2i2x h LEU 191 Cb 0.07 0.52 -0.03 0.00 0.09 0.00 0.00 40.66 41.31 2i2x h LEU 191 CO 0.00 -0.33 -0.07 1.23 0.09 0.00 0.00 178.44 179.36 2i2x h GLY 192 N -0.27 0.02 0.87 0.83 0.00 -1.30 -1.75 103.07 101.47 2i2x h GLY 192 Ca 0.16 0.09 0.10 0.00 0.00 0.00 0.00 47.33 47.69 2i2x h GLY 192 CO -0.53 -0.09 0.48 1.76 0.00 0.00 0.00 176.54 178.16 2i2x h SER 193 N -0.08 0.54 0.09 0.19 0.02 -1.49 -0.38 113.55 112.44 2i2x h SER 193 Ca 0.07 0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 61.03 2i2x h SER 193 Cb 0.18 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.62 2i2x h SER 193 CO -0.16 0.32 -0.04 0.40 -1.14 0.00 0.00 176.83 176.21 2i2x h ILE 194 N 0.60 1.14 -0.76 3.27 2.04 -0.51 -2.56 117.51 120.73 2i2x h ILE 194 Ca 0.34 -0.97 0.01 0.00 1.00 0.00 0.00 64.86 65.24 2i2x h ILE 194 Cb 0.53 1.75 -0.04 0.00 -0.74 0.00 0.00 36.82 38.32 2i2x h ILE 194 CO -0.12 0.23 0.50 -0.78 0.00 0.00 0.00 178.15 177.98 2i2x h ASP 195 N -0.58 0.88 -0.55 1.72 3.58 -1.05 -2.85 116.42 117.58 2i2x h ASP 195 Ca -0.01 -0.03 0.06 0.00 0.42 0.00 0.00 57.03 57.47 2i2x h ASP 195 Cb 0.47 -0.22 -0.06 0.00 1.72 0.00 0.00 39.33 41.25 2i2x h ASP 195 CO 0.02 0.64 0.25 0.24 -2.88 0.00 0.00 179.24 177.52 2i2x h MET 196 N 1.03 0.46 -0.90 0.28 2.86 -1.05 -1.00 114.93 116.61 2i2x h MET 196 Ca 0.28 -0.03 0.03 0.00 -2.06 0.00 0.00 59.70 57.92 2i2x h MET 196 Cb -0.11 -0.10 -0.05 0.00 0.06 0.00 0.00 31.60 31.40 2i2x h MET 196 CO -0.06 0.30 0.58 1.49 1.06 0.00 0.00 176.91 180.29 2i2x h GLU 197 N 0.47 1.11 0.39 1.72 4.81 -1.23 -0.72 114.58 121.14 2i2x h GLU 197 Ca 0.26 -0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 59.40 2i2x h GLU 197 Cb 0.23 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.36 2i2x h GLU 197 CO -0.22 0.73 -0.20 1.25 -0.73 0.00 0.00 179.01 179.85 2i2x h LEU 198 N 1.14 -0.47 -0.92 1.64 6.46 -1.06 -2.65 115.31 119.46 2i2x h LEU 198 Ca 0.35 0.02 -0.01 0.00 -0.12 0.00 0.00 57.88 58.12 2i2x h LEU 198 Cb -0.02 0.12 -0.04 0.00 -0.73 0.00 0.00 40.66 39.99 2i2x h LEU 198 CO -0.11 -0.33 0.54 0.16 -0.62 0.00 0.00 178.44 178.08 2i2x h ILE 199 N -0.54 1.26 0.00 4.05 3.07 -1.28 -2.99 117.51 121.09 2i2x h ILE 199 Ca -0.05 -0.58 -0.10 0.00 1.55 0.00 0.00 64.86 65.67 2i2x h ILE 199 Cb 0.41 -0.02 -0.01 0.00 -0.27 0.00 0.00 36.82 36.93 2i2x h ILE 199 CO 0.08 0.27 -0.49 -0.50 -1.05 0.00 0.00 178.15 176.46 2i2x h TRP 200 N 1.27 0.00 -0.08 0.16 4.06 -1.18 0.12 115.95 120.30 2i2x h TRP 200 Ca 0.33 0.00 0.03 0.00 2.06 0.00 0.00 58.89 61.30 2i2x h TRP 200 Cb -0.03 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.10 2i2x h TRP 200 CO 0.01 0.49 -0.08 1.15 -3.56 0.00 0.00 178.44 176.45 2i2x h THR 201 N 0.00 0.76 -0.34 1.49 2.02 -1.32 -1.58 112.91 113.95 2i2x h THR 201 Ca -0.00 0.00 -0.16 0.00 0.77 0.00 0.00 66.41 67.02 2i2x h THR 201 Cb 1.10 0.76 -0.00 0.00 -1.74 0.00 0.00 68.15 68.27 2i2x h THR 201 CO 0.06 0.00 -0.41 0.44 0.37 0.00 0.00 175.52 175.98 2i2x h ASP 202 N -0.11 0.94 -0.16 4.18 3.32 -1.37 -2.63 116.42 120.59 2i2x h ASP 202 Ca 0.06 -0.49 -0.01 0.00 0.02 0.00 0.00 57.03 56.61 2i2x h ASP 202 Cb 0.19 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 2i2x h ASP 202 CO -0.15 1.25 0.08 0.40 -1.72 0.00 0.00 179.24 179.10 2i2x h ILE 203 N 0.67 1.13 -0.98 0.35 2.04 -0.78 -1.61 117.51 118.33 2i2x h ILE 203 Ca 0.04 -0.39 0.08 0.00 1.00 0.00 0.00 64.86 65.59 2i2x h ILE 203 Cb 1.01 1.09 -0.07 0.00 -0.74 0.00 0.00 36.82 38.12 2i2x h ILE 203 CO 0.10 0.13 0.63 0.28 0.00 0.00 0.00 178.15 179.28 2i2x h SER 204 N 0.13 0.97 0.42 1.72 0.02 -1.34 0.34 113.55 115.81 2i2x h SER 204 Ca 0.06 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.00 2i2x h SER 204 Cb 0.13 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.49 2i2x h SER 204 CO -0.01 0.60 -0.20 0.50 -1.14 0.00 0.00 176.83 176.58 2i2x h LYS 205 N 1.09 -0.54 -0.93 3.45 3.64 -1.16 0.84 116.57 122.97 2i2x h LYS 205 Ca 0.44 0.04 0.22 0.00 -1.27 0.00 0.00 60.65 60.07 2i2x h LYS 205 Cb 0.26 0.12 -0.12 0.00 -0.41 0.00 0.00 32.23 32.08 2i2x h LYS 205 CO -0.19 -0.31 0.47 0.82 -2.27 0.00 0.00 179.45 177.98 2i2x h ILE 206 N -0.64 0.54 -0.04 2.00 2.04 -0.91 0.00 117.51 120.49 2i2x h ILE 206 Ca -0.06 -0.17 -0.01 0.00 1.00 0.00 0.00 64.86 65.62 2i2x h ILE 206 Cb 0.48 -0.01 -0.00 0.00 -0.74 0.00 0.00 36.82 36.54 2i2x h ILE 206 CO 0.09 0.09 -0.01 0.00 0.00 0.00 0.00 178.15 178.33 2i2x h ALA 207 N 1.69 0.06 -0.92 1.87 0.00 -0.30 -1.54 119.26 120.12 2i2x h ALA 207 Ca 0.57 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 55.31 2i2x h ALA 207 Cb 1.05 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.78 2i2x h ALA 207 CO -0.48 -0.25 0.60 -0.22 0.00 0.00 0.00 179.25 178.90 2i2x h LYS 208 N -0.24 1.21 -0.76 0.00 3.64 -0.43 -1.27 116.57 118.71 2i2x h LYS 208 Ca 0.01 -0.08 -0.02 0.00 -1.27 0.00 0.00 60.65 59.30 2i2x h LYS 208 Cb 0.36 -0.27 -0.04 0.00 -0.41 0.00 0.00 32.23 31.88 2i2x h LYS 208 CO 0.00 0.80 0.39 -0.22 -2.27 0.00 0.00 179.45 178.16 2i2x h LYS 209 N 1.24 1.08 -0.04 1.90 3.64 -0.83 -2.95 116.57 120.62 2i2x h LYS 209 Ca 0.34 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.57 2i2x h LYS 209 Cb -0.14 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 31.48 2i2x h LYS 209 CO -0.07 0.82 0.00 0.25 -2.27 0.00 0.00 179.45 178.18 2i2x n THR 210 N -4.41 0.03 -1.09 1.00 -2.24 -0.60 -4.94 114.28 102.02 2i2x n THR 210 Ca 0.07 -0.38 -0.03 0.00 -2.27 0.00 0.00 64.05 61.44 2i2x n THR 210 Cb 0.11 0.92 -0.01 0.00 -2.10 0.00 0.00 70.33 69.25 2i2x n THR 210 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2i2x n GLY 211 N 1.26 0.63 0.00 3.38 0.00 -0.56 -4.91 105.19 104.99 2i2x n GLY 211 Ca 0.17 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.67 2i2x n GLY 211 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2i2x n THR 212 N -2.81 0.00 -4.90 2.61 -2.24 -0.73 -5.03 114.28 101.18 2i2x n THR 212 Ca -0.03 0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.42 2i2x n THR 212 Cb 0.15 -0.80 -0.17 0.00 -2.10 0.00 0.00 70.33 67.42 2i2x n THR 212 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2i2x s ILE 213 N 0.99 2.09 -0.67 2.28 1.01 -0.53 -4.44 121.20 121.94 2i2x s ILE 213 Ca 0.00 -0.99 -0.25 0.00 0.00 0.00 0.00 60.65 59.42 2i2x s ILE 213 Cb 0.00 -1.82 0.05 0.00 0.01 0.00 0.00 42.46 40.70 2i2x s ILE 213 CO 0.00 0.55 1.09 -0.55 0.00 0.00 0.00 174.94 176.03 2i2x s SER 214 N 0.61 6.20 -0.10 3.58 0.15 -1.26 -1.56 113.70 121.32 2i2x s SER 214 Ca -0.12 -0.67 -0.04 0.00 0.70 0.00 0.00 55.95 55.81 2i2x s SER 214 Cb -0.17 -2.48 -0.01 0.00 -1.71 0.00 0.00 66.02 61.65 2i2x s SER 214 CO 0.03 -1.56 -0.09 0.00 1.20 0.00 0.00 173.24 172.82 2i2x h ALA 215 N 9.71 0.00 0.00 5.45 0.00 -1.62 0.71 119.26 133.50 2i2x h ALA 215 Ca -0.28 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.35 2i2x h ALA 215 Cb 1.06 0.25 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2i2x h ALA 215 CO 1.21 0.25 0.00 0.41 0.00 0.00 0.00 179.25 181.11 2i2x n GLY 216 N 1.71 -2.43 0.52 0.00 0.00 -1.22 -1.95 105.19 101.83 2i2x n GLY 216 Ca -0.03 -1.37 -0.04 0.00 0.00 0.00 0.00 46.02 44.57 2i2x n GLY 216 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2i2x n ASP 217 N 3.00 1.68 -3.72 1.61 -0.08 -1.26 -3.54 116.55 114.24 2i2x n ASP 217 Ca 0.00 -1.29 -0.13 0.00 -1.51 0.00 0.00 54.79 51.87 2i2x n ASP 217 Cb 0.00 0.02 -0.10 0.00 2.34 0.00 0.00 41.12 43.38 2i2x n ASP 217 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 2i2x s THR 218 N -0.78 -0.00 0.00 5.18 2.01 -1.25 -3.06 115.64 117.73 2i2x s THR 218 Ca 0.02 0.01 0.00 0.00 0.31 0.00 0.00 61.69 62.03 2i2x s THR 218 Cb -0.00 -0.62 0.00 0.00 0.01 0.00 0.00 72.50 71.89 2i2x s THR 218 CO 0.01 0.00 1.35 -0.67 -0.69 0.00 0.00 174.62 174.63 2i2x n ASP 219 N 3.00 3.79 -0.18 3.53 2.03 -1.26 -4.33 116.55 123.14 2i2x n ASP 219 Ca -0.14 -2.09 -0.01 0.00 0.52 0.00 0.00 54.79 53.07 2i2x n ASP 219 Cb 0.57 -0.73 0.08 0.00 -0.72 0.00 0.00 41.12 40.32 2i2x n ASP 219 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2i2x n ALA 221 N -2.70 1.27 -0.43 0.00 0.00 -1.26 -2.74 120.51 114.64 2i2x n ALA 221 Ca 0.07 0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.56 2i2x n ALA 221 Cb 0.30 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.56 2i2x n ALA 221 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2i2x n GLN 222 N -1.79 0.00 -0.38 0.00 6.02 -0.24 -4.59 117.38 116.40 2i2x n GLN 222 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.00 2i2x n GLN 222 Cb 0.08 -0.04 0.14 0.00 1.02 0.00 0.00 30.24 31.45 2i2x n GLN 222 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2i2x h ALA 223 N -0.28 1.34 -0.51 -1.58 0.00 -1.38 -1.67 119.26 115.17 2i2x h ALA 223 Ca 0.00 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 2i2x h ALA 223 Cb 0.00 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.41 2i2x h ALA 223 CO 0.00 0.56 -0.07 -0.91 0.00 0.00 0.00 179.25 178.83 2i2x h ASN 224 N 1.28 0.95 -0.63 0.00 2.35 -1.56 -1.76 115.58 116.22 2i2x h ASN 224 Ca 0.40 -0.34 0.05 0.00 -0.55 0.00 0.00 56.30 55.86 2i2x h ASN 224 Cb -0.01 -0.26 -0.05 0.00 0.05 0.00 0.00 38.32 38.05 2i2x h ASN 224 CO -0.12 1.07 0.34 0.74 -1.65 0.00 0.00 177.43 177.81 2i2x h THR 225 N 0.82 0.97 -0.13 2.81 2.02 -1.27 -0.44 112.91 117.68 2i2x h THR 225 Ca 0.14 -0.22 0.02 0.00 0.77 0.00 0.00 66.41 67.12 2i2x h THR 225 Cb 0.62 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 67.28 2i2x h THR 225 CO 0.04 0.12 0.00 0.00 0.37 0.00 0.00 175.52 176.05 2i2x h ALA 226 N 1.33 0.12 -0.95 6.16 0.00 -1.16 -1.89 119.26 122.87 2i2x h ALA 226 Ca 0.28 0.03 0.13 0.00 0.00 0.00 0.00 54.91 55.35 2i2x h ALA 226 Cb 0.17 0.06 -0.09 0.00 0.00 0.00 0.00 17.79 17.93 2i2x h ALA 226 CO -0.18 -0.45 0.57 1.98 0.00 0.00 0.00 179.25 181.18 2i2x h MET 227 N 0.05 0.85 -0.03 0.00 -1.53 -0.39 0.24 114.93 114.11 2i2x h MET 227 Ca 0.06 -0.05 -0.10 0.00 -3.44 0.00 0.00 59.70 56.17 2i2x h MET 227 Cb 0.07 -0.19 0.01 0.00 -0.55 0.00 0.00 31.60 30.93 2i2x h MET 227 CO -0.10 0.56 -0.36 0.74 0.14 0.00 0.00 176.91 177.89 2i2x h PHE 228 N 0.87 0.43 -0.91 1.39 0.04 -0.86 -0.88 116.94 117.03 2i2x h PHE 228 Ca 0.48 -0.21 0.14 0.00 2.80 0.00 0.00 57.97 61.18 2i2x h PHE 228 Cb 0.54 -0.06 -0.09 0.00 2.20 0.00 0.00 35.95 38.54 2i2x h PHE 228 CO -0.03 0.98 0.52 0.82 -0.60 0.00 0.00 178.31 180.00 2i2x h ILE 229 N -0.25 0.79 -0.72 -0.55 2.04 -1.19 -1.73 117.51 115.90 2i2x h ILE 229 Ca -0.04 -0.26 0.01 0.00 1.00 0.00 0.00 64.86 65.57 2i2x h ILE 229 Cb 1.06 -0.03 -0.04 0.00 -0.74 0.00 0.00 36.82 37.07 2i2x h ILE 229 CO 0.07 0.14 0.48 1.23 0.00 0.00 0.00 178.15 180.07 2i2x h GLY 230 N 0.76 1.02 0.00 5.37 0.00 -0.75 -3.35 103.07 106.12 2i2x h GLY 230 Ca 0.48 -0.38 0.00 0.00 0.00 0.00 0.00 47.33 47.44 2i2x h GLY 230 CO -0.33 0.37 0.00 0.61 0.00 0.00 0.00 176.54 177.19 2i2x n GLY 231 N -1.30 0.23 3.72 4.60 0.00 -0.35 -4.54 105.19 107.55 2i2x n GLY 231 Ca 0.07 -0.90 -0.30 0.00 0.00 0.00 0.00 46.02 44.89 2i2x n GLY 231 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2i2x s GLY 232 N -1.57 1.67 0.44 -0.02 0.00 -1.26 -4.88 107.32 101.70 2i2x s GLY 232 Ca 0.00 -1.08 0.24 0.00 0.00 0.00 0.00 44.72 43.88 2i2x s GLY 232 CO 0.00 -0.23 1.79 1.41 0.00 0.00 0.00 173.10 176.08 2i2x h LEU 233 N -2.25 0.30 -2.37 0.66 4.07 -1.98 -2.43 115.31 111.31 2i2x h LEU 233 Ca -0.44 0.06 0.00 0.00 0.08 0.00 0.00 57.88 57.57 2i2x h LEU 233 Cb 1.27 0.01 0.00 0.00 1.08 0.00 0.00 40.66 43.01 2i2x h LEU 233 CO 0.34 0.06 0.00 0.18 -1.08 0.00 0.00 178.44 177.94 2i2x n LEU 234 N -4.49 3.21 -4.79 1.67 4.77 -1.26 -4.99 117.00 111.13 2i2x n LEU 234 Ca 0.25 -1.59 -0.30 0.00 -0.03 0.00 0.00 56.01 54.33 2i2x n LEU 234 Cb 0.97 -0.24 0.09 0.00 -2.33 0.00 0.00 43.42 41.91 2i2x n LEU 234 CO 0.30 0.72 0.70 0.20 -1.33 0.00 0.00 177.39 177.98 2i2x s ASN 235 N -1.26 4.52 -0.18 -1.43 -0.87 -0.92 -5.00 114.94 109.81 2i2x s ASN 235 Ca 0.33 1.48 0.20 0.00 -1.57 0.00 0.00 52.86 53.31 2i2x s ASN 235 Cb 0.19 -2.24 0.47 0.00 -0.02 0.00 0.00 41.25 39.65 2i2x s ASN 235 CO 0.26 -1.97 1.15 2.29 -2.57 0.00 0.00 177.10 176.26 2i2x n LYS 236 N -3.45 1.50 -0.00 -0.60 2.85 -1.26 -4.81 118.16 112.39 2i2x n LYS 236 Ca 0.07 -3.14 0.06 0.00 -1.05 0.00 0.00 58.31 54.25 2i2x n LYS 236 Cb 0.55 -1.24 -0.08 0.00 -0.65 0.00 0.00 35.03 33.61 2i2x n LYS 236 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 2i2x n ASN 237 N -0.35 1.32 -3.49 -5.58 3.02 -1.26 -4.97 115.26 103.95 2i2x n ASN 237 Ca 0.14 -0.41 0.00 0.00 -0.03 0.00 0.00 54.58 54.29 2i2x n ASN 237 Cb 0.92 1.28 -0.04 0.00 -0.61 0.00 0.00 39.78 41.33 2i2x n ASN 237 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2i2x s LEU 238 N -3.21 -0.76 0.10 3.41 2.96 -1.26 -4.79 118.68 115.13 2i2x s LEU 238 Ca 0.00 1.05 -0.36 0.00 -0.22 0.00 0.00 54.13 54.60 2i2x s LEU 238 Cb 0.09 1.87 -0.17 0.00 0.50 0.00 0.00 46.19 48.48 2i2x s LEU 238 CO 0.52 -0.15 1.30 0.00 -1.32 0.00 0.00 176.35 176.70 2i2x n ALA 239 N 5.07 -1.04 0.14 5.97 0.00 -1.26 -4.41 120.51 124.98 2i2x n ALA 239 Ca -0.10 0.51 -0.00 0.00 0.00 0.00 0.00 53.44 53.84 2i2x n ALA 239 Cb 0.52 -2.06 0.24 0.00 0.00 0.00 0.00 19.45 18.15 2i2x n ALA 239 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2i2x h HIS 240 N 4.33 0.08 0.00 0.00 3.86 -1.95 -0.83 115.15 120.65 2i2x h HIS 240 Ca -0.47 -0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 58.71 2i2x h HIS 240 Cb 1.34 -0.02 -0.00 0.00 1.06 0.00 0.00 27.41 29.79 2i2x h HIS 240 CO 0.59 0.55 -0.01 1.79 0.86 0.00 0.00 177.93 181.71 2i2x h THR 241 N 0.06 0.16 0.13 2.45 1.35 -1.90 -1.77 112.91 113.39 2i2x h THR 241 Ca -0.00 -0.05 -0.33 0.00 -0.55 0.00 0.00 66.41 65.48 2i2x h THR 241 Cb 0.89 1.04 -0.01 0.00 -1.73 0.00 0.00 68.15 68.34 2i2x h THR 241 CO 0.07 0.01 -1.75 0.40 -0.25 0.00 0.00 175.52 173.99 2i2x h ILE 242 N 0.00 0.80 -0.96 6.82 2.04 -1.52 -3.30 117.51 121.39 2i2x h ILE 242 Ca -0.00 -2.37 0.19 0.00 1.00 0.00 0.00 64.86 63.68 2i2x h ILE 242 Cb 0.04 2.58 -0.09 0.00 -0.74 0.00 0.00 36.82 38.61 2i2x h ILE 242 CO 0.00 0.80 0.61 0.00 0.00 0.00 0.00 178.15 179.56 2i2x h ALA 243 N -0.00 1.92 -0.00 1.87 0.00 -1.08 -2.14 119.26 119.83 2i2x h ALA 243 Ca -0.38 0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.42 2i2x h ALA 243 Cb 1.92 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.63 2i2x h ALA 243 CO 0.07 -0.25 -0.73 -0.24 0.00 0.00 0.00 179.25 178.10 2i2x h VAL 244 N 0.61 1.52 -0.46 0.00 3.04 -1.46 -2.49 116.25 117.01 2i2x h VAL 244 Ca 0.52 -2.49 -0.05 0.00 -1.01 0.00 0.00 66.70 63.67 2i2x h VAL 244 Cb 1.01 2.34 -0.02 0.00 -2.01 0.00 0.00 31.29 32.61 2i2x h VAL 244 CO -0.28 0.71 0.08 0.40 -1.01 0.00 0.00 177.57 177.47 2i2x h ILE 245 N 0.01 1.25 -1.00 3.17 2.04 -1.47 -1.80 117.51 119.71 2i2x h ILE 245 Ca -0.01 -0.89 0.08 0.00 1.00 0.00 0.00 64.86 65.04 2i2x h ILE 245 Cb 1.29 0.95 -0.07 0.00 -0.74 0.00 0.00 36.82 38.25 2i2x h ILE 245 CO 0.10 0.31 0.64 0.00 0.00 0.00 0.00 178.15 179.20 2i2x h ALA 246 N 0.95 1.42 -0.51 1.87 0.00 -1.39 -0.95 119.26 120.66 2i2x h ALA 246 Ca 0.14 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 2i2x h ALA 246 Cb 0.38 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2i2x h ALA 246 CO 0.01 0.37 0.21 -0.09 0.00 0.00 0.00 179.25 179.75 2i2x h ARG 247 N 1.11 0.76 -0.58 0.00 9.65 -1.07 -1.39 114.38 122.86 2i2x h ARG 247 Ca 0.45 -0.13 0.00 0.00 -1.10 0.00 0.00 59.98 59.20 2i2x h ARG 247 Cb 0.27 -0.13 -0.03 0.00 -1.39 0.00 0.00 29.97 28.70 2i2x h ARG 247 CO -0.20 0.66 0.37 0.00 2.80 0.00 0.00 179.97 183.59 2i2x h ALA 248 N 1.06 0.73 -0.07 2.80 0.00 -0.62 -2.30 119.26 120.85 2i2x h ALA 248 Ca 0.17 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 2i2x h ALA 248 Cb 0.18 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2i2x h ALA 248 CO -0.02 0.19 -0.23 0.82 0.00 0.00 0.00 179.25 180.01 2i2x h ILE 249 N 0.78 1.20 0.00 0.00 2.04 -1.02 -2.61 117.51 117.91 2i2x h ILE 249 Ca 0.21 -0.95 -0.05 0.00 1.00 0.00 0.00 64.86 65.06 2i2x h ILE 249 Cb -0.06 1.41 -0.01 0.00 -0.74 0.00 0.00 36.82 37.42 2i2x h ILE 249 CO -0.04 0.28 -0.25 0.77 0.00 0.00 0.00 178.15 178.91 2i2x h SER 250 N 0.12 0.00 0.37 1.72 4.64 -0.69 -3.23 113.55 116.47 2i2x h SER 250 Ca 0.02 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2i2x h SER 250 Cb 0.48 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.55 2i2x h SER 250 CO 0.03 0.25 -0.38 0.00 -0.87 0.00 0.00 176.83 175.87 2i2x h ALA 251 N 1.75 -0.81 0.00 5.18 0.00 -1.18 -0.58 119.26 123.62 2i2x h ALA 251 Ca -0.00 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 2i2x h ALA 251 Cb 0.69 0.54 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 2i2x h ALA 251 CO 0.03 -0.99 -0.14 -1.00 0.00 0.00 0.00 179.25 177.15 2i2x h PRO 252 N -0.77 0.00 0.46 0.00 0.13 -1.71 0.43 132.00 130.54 2i2x h PRO 252 Ca -0.03 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.08 2i2x h PRO 252 Cb 0.69 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.83 2i2x h PRO 252 CO -0.07 0.14 -0.22 -0.09 -0.23 0.00 0.00 178.00 177.53 2i2x h ARG 253 N 0.00 -0.60 0.00 0.86 1.12 -1.54 -3.17 114.38 111.06 2i2x h ARG 253 Ca -0.00 0.04 -0.04 0.00 -1.11 0.00 0.00 59.98 58.87 2i2x h ARG 253 Cb 0.47 0.14 -0.01 0.00 -0.01 0.00 0.00 29.97 30.56 2i2x h ARG 253 CO 0.02 -0.35 -0.19 0.77 -3.11 0.00 0.00 179.97 177.11 2i2x h SER 254 N -0.72 0.00 -0.14 -3.80 0.02 -0.80 -2.11 113.55 106.00 2i2x h SER 254 Ca -0.06 0.00 0.04 0.00 -0.84 0.00 0.00 61.79 60.93 2i2x h SER 254 Cb 0.52 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.06 2i2x h SER 254 CO 0.10 0.19 0.13 0.25 -1.14 0.00 0.00 176.83 176.36 2i2x h LEU 255 N 0.00 0.00 -1.00 5.07 5.85 -0.89 -3.02 115.31 121.32 2i2x h LEU 255 Ca -0.00 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 2i2x h LEU 255 Cb 0.62 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.61 2i2x h LEU 255 CO 0.02 0.00 0.34 0.58 -0.34 0.00 0.00 178.44 179.05 2i2x h VAL 256 N 0.00 1.23 -0.89 1.05 2.07 -1.40 -2.16 116.25 116.16 2i2x h VAL 256 Ca 0.06 -0.67 0.11 0.00 0.82 0.00 0.00 66.70 67.03 2i2x h VAL 256 Cb 0.31 0.31 -0.08 0.00 -1.52 0.00 0.00 31.29 30.31 2i2x h VAL 256 CO -0.00 0.28 0.52 0.00 0.02 0.00 0.00 177.57 178.39 2i2x h ALA 257 N 1.33 1.31 -0.04 1.67 0.00 -1.73 -0.89 119.26 120.91 2i2x h ALA 257 Ca 0.25 0.04 -0.19 0.00 0.00 0.00 0.00 54.91 55.01 2i2x h ALA 257 Cb 0.12 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2i2x h ALA 257 CO -0.03 0.10 -0.81 1.88 0.00 0.00 0.00 179.25 180.40 2i2x h TYR 258 N 0.82 0.48 0.00 0.00 0.05 -1.60 -0.90 116.97 115.83 2i2x h TYR 258 Ca 0.44 -0.24 -0.04 0.00 0.05 0.00 0.00 58.73 58.95 2i2x h TYR 258 Cb 0.46 -0.07 -0.01 0.00 1.01 0.00 0.00 36.73 38.13 2i2x h TYR 258 CO -0.05 1.01 -0.18 0.93 -1.05 0.00 0.00 178.16 178.82 2i2x h GLU 259 N 0.22 0.00 -0.29 4.88 5.08 -0.76 -2.99 114.58 120.73 2i2x h GLU 259 Ca -0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2i2x h GLU 259 Cb 1.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.65 2i2x h GLU 259 CO 0.13 0.18 0.00 0.00 -1.00 0.00 0.00 179.01 178.33 2i2x n ALA 260 N -2.30 3.00 0.00 3.43 0.00 -0.41 -1.87 120.51 122.36 2i2x n ALA 260 Ca -0.01 -2.21 0.00 0.00 0.00 0.00 0.00 53.44 51.21 2i2x n ALA 260 Cb 0.31 -0.73 0.00 0.00 0.00 0.00 0.00 19.45 19.03 2i2x n ALA 260 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2i2x n GLY 261 N -0.36 1.80 3.76 0.00 0.00 -0.90 -3.90 105.19 105.59 2i2x n GLY 261 Ca 0.21 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.86 2i2x n GLY 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i2x s ALA 262 N -1.57 2.82 0.00 4.61 0.00 -0.39 -4.81 121.76 122.41 2i2x s ALA 262 Ca 0.00 1.04 0.00 0.00 0.00 0.00 0.00 51.96 53.00 2i2x s ALA 262 Cb 0.00 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.68 2i2x s ALA 262 CO 0.00 -0.95 0.41 1.33 0.00 0.00 0.00 175.76 176.55 2i2x n VAL 263 N -0.93 0.00 0.00 0.00 0.24 0.24 -4.35 118.33 113.54 2i2x n VAL 263 Ca 0.10 -0.43 0.00 0.00 -2.04 0.00 0.00 64.34 61.97 2i2x n VAL 263 Cb 0.48 1.13 0.00 0.00 -1.47 0.00 0.00 33.84 33.98 2i2x n VAL 263 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2i2x n GLY 264 N 0.04 -0.49 3.74 7.63 0.00 -0.82 -4.30 105.19 110.99 2i2x n GLY 264 Ca 0.00 -1.69 -0.41 0.00 0.00 0.00 0.00 46.02 43.92 2i2x n GLY 264 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2i2x s PRO 265 N -2.41 4.62 0.97 1.61 0.04 -1.25 -4.58 135.00 134.00 2i2x s PRO 265 Ca 0.00 1.72 -0.11 0.00 0.04 0.00 0.00 61.00 62.64 2i2x s PRO 265 Cb 0.00 -3.26 0.17 0.00 0.04 0.00 0.00 34.50 31.45 2i2x s PRO 265 CO 0.00 0.13 1.09 0.20 0.04 0.00 0.00 177.00 178.46 2i2x s GLY 266 N -0.34 1.62 0.39 0.56 0.00 -0.99 -3.89 107.32 104.66 2i2x s GLY 266 Ca 0.48 0.11 -0.26 0.00 0.00 0.00 0.00 44.72 45.05 2i2x s GLY 266 CO 0.36 0.64 1.21 0.54 0.00 0.00 0.00 173.10 175.85 2i2x s LYS 267 N -4.72 4.09 0.20 2.90 -0.14 -1.17 -2.06 119.74 118.83 2i2x s LYS 267 Ca 0.66 1.96 -0.13 0.00 -1.36 0.00 0.00 55.97 57.10 2i2x s LYS 267 Cb -0.21 -2.77 0.23 0.00 -1.68 0.00 0.00 37.83 33.40 2i2x s LYS 267 CO 0.59 -0.32 1.67 0.38 -0.76 0.00 0.00 175.35 176.91 2i2x h ASP 268 N 2.79 -0.27 0.00 2.83 3.04 -1.90 -1.27 116.42 121.64 2i2x h ASP 268 Ca -0.49 0.14 0.00 0.00 -3.24 0.00 0.00 57.03 53.44 2i2x h ASP 268 Cb 1.24 0.25 0.00 0.00 -1.04 0.00 0.00 39.33 39.78 2i2x h ASP 268 CO 0.63 -0.10 0.00 0.00 -2.04 0.00 0.00 179.24 177.73 2i2x n GLY 270 N 0.47 2.77 0.33 0.00 0.00 -0.48 -4.75 105.19 103.53 2i2x n GLY 270 Ca 0.16 -1.34 0.16 0.00 0.00 0.00 0.00 46.02 44.99 2i2x n GLY 270 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2i2x h TYR 271 N 7.58 0.00 0.00 1.61 -1.99 -1.85 0.14 116.97 122.45 2i2x h TYR 271 Ca 0.44 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.17 2i2x h TYR 271 Cb 0.80 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.53 2i2x h TYR 271 CO 1.38 0.00 0.00 1.05 -0.00 0.00 0.00 178.16 180.59 2i2x h GLU 272 N 0.00 0.00 -0.98 4.88 9.09 -1.88 -3.20 114.58 122.48 2i2x h GLU 272 Ca 0.09 0.00 0.28 0.00 0.05 0.00 0.00 59.36 59.79 2i2x h GLU 272 Cb 0.45 0.00 -0.04 0.00 -1.65 0.00 0.00 28.75 27.51 2i2x h GLU 272 CO -0.00 0.00 0.78 -0.91 0.05 0.00 0.00 179.01 178.93 2i2x h ASN 273 N 0.00 0.00 -0.79 3.06 2.35 -1.09 0.73 115.58 119.84 2i2x h ASN 273 Ca 0.00 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.71 2i2x h ASN 273 Cb 0.30 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.64 2i2x h ASN 273 CO 0.00 0.00 0.34 -0.29 -1.65 0.00 0.00 177.43 175.83 2i2x h ILE 274 N 0.00 1.26 -0.29 2.81 6.09 -1.77 0.36 117.51 125.97 2i2x h ILE 274 Ca 0.47 -0.77 -0.14 0.00 -1.37 0.00 0.00 64.86 63.05 2i2x h ILE 274 Cb 2.03 0.28 -0.01 0.00 0.47 0.00 0.00 36.82 39.59 2i2x h ILE 274 CO -0.00 0.32 -0.40 0.40 -3.07 0.00 0.00 178.15 175.39 2i2x h ILE 275 N 1.14 1.29 -0.53 2.19 2.04 0.20 -2.75 117.51 121.10 2i2x h ILE 275 Ca 0.27 -1.57 -0.12 0.00 1.00 0.00 0.00 64.86 64.44 2i2x h ILE 275 Cb 0.17 1.50 -0.02 0.00 -0.74 0.00 0.00 36.82 37.74 2i2x h ILE 275 CO -0.03 0.51 -0.13 0.58 0.00 0.00 0.00 178.15 179.08 2i2x h VAL 276 N 0.56 1.27 -0.69 1.67 2.07 -0.91 -2.80 116.25 117.42 2i2x h VAL 276 Ca 0.05 -1.29 -0.00 0.00 0.82 0.00 0.00 66.70 66.28 2i2x h VAL 276 Cb 0.93 1.01 -0.03 0.00 -1.52 0.00 0.00 31.29 31.68 2i2x h VAL 276 CO 0.08 0.45 0.42 0.50 0.02 0.00 0.00 177.57 179.04 2i2x h LYS 277 N 0.89 0.94 -0.92 1.57 3.64 -0.18 0.05 116.57 122.55 2i2x h LYS 277 Ca 0.13 -0.09 0.07 0.00 -1.27 0.00 0.00 60.65 59.50 2i2x h LYS 277 Cb 0.70 -0.20 -0.06 0.00 -0.41 0.00 0.00 32.23 32.26 2i2x h LYS 277 CO 0.05 0.67 0.60 0.00 -2.27 0.00 0.00 179.45 178.49 2i2x h ALA 278 N 1.22 1.51 0.01 5.00 0.00 -1.26 0.13 119.26 125.87 2i2x h ALA 278 Ca 0.25 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 2i2x h ALA 278 Cb -0.03 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.50 2i2x h ALA 278 CO -0.05 0.35 -0.14 0.82 0.00 0.00 0.00 179.25 180.23 2i2x h ILE 279 N 1.04 1.65 0.00 0.00 2.04 -1.23 -3.10 117.51 117.91 2i2x h ILE 279 Ca 0.40 -2.11 -0.27 0.00 1.00 0.00 0.00 64.86 63.88 2i2x h ILE 279 Cb 0.21 3.05 -0.05 0.00 -0.74 0.00 0.00 36.82 39.30 2i2x h ILE 279 CO -0.15 0.56 -1.76 0.35 0.00 0.00 0.00 178.15 177.15 2i2x n THR 280 N -4.57 1.43 -1.09 -0.27 -2.24 -0.02 -1.46 114.28 106.07 2i2x n THR 280 Ca -0.10 -0.77 -0.03 0.00 -2.27 0.00 0.00 64.05 60.87 2i2x n THR 280 Cb 0.49 -0.85 -0.01 0.00 -2.10 0.00 0.00 70.33 67.86 2i2x n THR 280 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2i2x n GLY 281 N 1.54 0.60 3.95 3.38 0.00 0.44 -4.79 105.19 110.31 2i2x n GLY 281 Ca -0.18 -0.34 -0.23 0.00 0.00 0.00 0.00 46.02 45.27 2i2x n GLY 281 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2i2x s MET 282 N -1.55 3.47 0.56 1.61 -1.94 -1.26 -1.34 119.30 118.86 2i2x s MET 282 Ca 0.00 -0.53 -0.17 0.00 -1.71 0.00 0.00 55.69 53.28 2i2x s MET 282 Cb 0.00 -2.81 -0.05 0.00 2.01 0.00 0.00 34.83 33.98 2i2x s MET 282 CO 0.00 0.33 1.06 -1.25 -0.01 0.00 0.00 175.02 175.15 2i2x s PRO 283 N -3.93 3.46 0.01 2.03 0.04 -1.26 -4.64 135.00 130.71 2i2x s PRO 283 Ca 0.37 1.27 0.01 0.00 0.04 0.00 0.00 61.00 62.69 2i2x s PRO 283 Cb -0.10 -2.05 -0.01 0.00 0.04 0.00 0.00 34.50 32.38 2i2x s PRO 283 CO 0.31 -0.70 -0.03 -1.64 0.04 0.00 0.00 177.00 174.98 2i2x s MET 284 N -3.79 0.28 0.21 4.56 -1.94 -1.26 -2.36 119.30 115.00 2i2x s MET 284 Ca 0.65 -0.33 -0.20 0.00 -1.71 0.00 0.00 55.69 54.11 2i2x s MET 284 Cb -0.16 -0.13 -0.08 0.00 2.01 0.00 0.00 34.83 36.46 2i2x s MET 284 CO 0.31 0.03 0.71 0.99 -0.01 0.00 0.00 175.02 177.06 2i2x s THR 285 N -0.62 4.58 0.28 2.05 2.01 -0.87 -0.98 115.64 122.08 2i2x s THR 285 Ca -0.05 1.28 0.05 0.00 0.31 0.00 0.00 61.69 63.28 2i2x s THR 285 Cb -0.05 -3.86 -0.06 0.00 0.01 0.00 0.00 72.50 68.54 2i2x s THR 285 CO -0.00 0.23 -0.02 -0.04 -0.69 0.00 0.00 174.62 174.10 2i2x s MET 286 N -1.92 1.53 -0.00 4.92 -1.94 -0.22 -3.89 119.30 117.77 2i2x s MET 286 Ca 0.42 -1.80 -0.04 0.00 -1.71 0.00 0.00 55.69 52.56 2i2x s MET 286 Cb -0.17 -0.98 -0.00 0.00 2.01 0.00 0.00 34.83 35.68 2i2x s MET 286 CO 0.21 -0.04 0.08 -1.83 -0.01 0.00 0.00 175.02 173.43 2i2x s GLU 287 N -3.79 0.34 0.00 2.03 -1.05 -1.20 -1.21 118.70 113.81 2i2x s GLU 287 Ca 0.31 -0.32 0.00 0.00 -0.15 0.00 0.00 54.97 54.81 2i2x s GLU 287 Cb 0.05 0.14 0.00 0.00 -0.44 0.00 0.00 34.13 33.88 2i2x s GLU 287 CO 0.12 -0.07 0.00 0.41 0.95 0.00 0.00 175.26 176.67 2i2x n GLY 288 N 1.91 1.02 0.30 -3.83 0.00 -1.26 -4.90 105.19 98.42 2i2x n GLY 288 Ca -0.20 0.39 0.19 0.00 0.00 0.00 0.00 46.02 46.40 2i2x n GLY 288 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2i2x h LYS 289 N 0.00 0.00 -0.48 1.61 2.10 -1.59 0.13 116.57 118.34 2i2x h LYS 289 Ca 0.00 0.00 -0.11 0.00 -2.00 0.00 0.00 60.65 58.54 2i2x h LYS 289 Cb 0.00 0.00 -0.07 0.00 -0.90 0.00 0.00 32.23 31.26 2i2x h LYS 289 CO 0.00 0.02 0.09 2.41 -2.00 0.00 0.00 179.45 179.97 2i2x n THR 290 N -3.19 2.62 -1.19 0.07 -1.04 -1.26 -4.19 114.28 106.10 2i2x n THR 290 Ca -0.01 -1.91 0.08 0.00 -2.04 0.00 0.00 64.05 60.17 2i2x n THR 290 Cb 0.20 -0.31 0.17 0.00 -1.82 0.00 0.00 70.33 68.58 2i2x n THR 290 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 2i2x n SER 291 N -0.41 2.41 0.26 8.00 3.41 0.45 -4.10 113.62 123.63 2i2x n SER 291 Ca 0.31 -3.29 0.11 0.00 -0.26 0.00 0.00 58.87 55.74 2i2x n SER 291 Cb 1.13 -0.48 0.68 0.00 -0.26 0.00 0.00 64.21 65.29 2i2x n SER 291 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 2i2x h THR 292 N 0.48 0.74 -1.01 6.66 1.35 -1.69 -1.29 112.91 118.15 2i2x h THR 292 Ca 0.01 -0.49 0.26 0.00 -0.55 0.00 0.00 66.41 65.65 2i2x h THR 292 Cb 1.09 1.29 -0.07 0.00 -1.73 0.00 0.00 68.15 68.73 2i2x h THR 292 CO 0.05 0.12 0.68 0.00 -0.25 0.00 0.00 175.52 176.11 2i2x h ALA 294 N 1.58 0.28 -1.67 0.00 0.00 -1.07 -3.45 119.26 114.93 2i2x h ALA 294 Ca 0.54 -1.21 0.18 0.00 0.00 0.00 0.00 54.91 54.43 2i2x h ALA 294 Cb 1.56 0.64 -0.19 0.00 0.00 0.00 0.00 17.79 19.79 2i2x h ALA 294 CO -0.19 0.89 0.69 -3.38 0.00 0.00 0.00 179.25 177.25 2i2x s HIS 295 N -2.44 -0.22 0.43 0.00 0.00 -1.04 -5.04 115.29 106.97 2i2x s HIS 295 Ca -0.24 0.22 -0.23 0.00 -3.00 0.00 0.00 55.06 51.81 2i2x s HIS 295 Cb 0.05 0.51 -0.09 0.00 -4.00 0.00 0.00 32.58 29.05 2i2x s HIS 295 CO 0.69 -0.31 1.02 0.45 -1.00 0.00 0.00 174.74 175.60 2i2x s SER 296 N -1.95 6.69 0.31 7.38 0.15 -1.26 -3.97 113.70 121.05 2i2x s SER 296 Ca 0.06 1.94 -0.00 0.00 0.70 0.00 0.00 55.95 58.65 2i2x s SER 296 Cb -0.01 -2.57 -0.01 0.00 -1.71 0.00 0.00 66.02 61.72 2i2x s SER 296 CO -0.05 -0.53 0.38 1.51 1.20 0.00 0.00 173.24 175.74 2i2x s ASP 297 N -1.79 0.95 -0.04 5.45 1.47 -1.26 -5.04 116.67 116.41 2i2x s ASP 297 Ca 0.61 -1.50 0.07 0.00 1.18 0.00 0.00 52.55 52.90 2i2x s ASP 297 Cb -0.18 0.59 0.14 0.00 -0.34 0.00 0.00 42.92 43.13 2i2x s ASP 297 CO 0.23 -1.16 1.09 0.55 0.68 0.00 0.00 175.17 176.56 2i2x n VAL 298 N -0.53 1.28 -2.67 2.11 3.14 -1.26 -4.53 118.33 115.88 2i2x n VAL 298 Ca 0.03 -1.35 -0.07 0.00 -2.96 0.00 0.00 64.34 59.98 2i2x n VAL 298 Cb 0.62 0.28 0.04 0.00 -1.06 0.00 0.00 33.84 33.72 2i2x n VAL 298 CO 0.00 0.00 0.00 1.15 -6.46 0.00 0.00 176.83 171.52 2i2x n MET 299 N -0.60 1.89 -0.34 1.45 -0.00 -1.26 -4.67 117.12 113.59 2i2x n MET 299 Ca 0.06 -3.58 0.03 0.00 -0.00 0.00 0.00 57.70 54.22 2i2x n MET 299 Cb 0.40 -1.62 0.18 0.00 -0.00 0.00 0.00 33.22 32.17 2i2x n MET 299 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 175.97 176.75 2i2x h GLY 300 N 2.67 1.45 0.32 3.17 0.00 -1.91 -2.99 103.07 105.79 2i2x h GLY 300 Ca -0.04 -0.42 -0.36 0.00 0.00 0.00 0.00 47.33 46.51 2i2x h GLY 300 CO 0.39 0.26 -2.03 0.70 0.00 0.00 0.00 176.54 175.86 2i2x n ASN 301 N -4.59 2.03 -0.33 0.19 5.03 -1.26 -1.60 115.26 114.74 2i2x n ASN 301 Ca 0.15 0.18 0.21 0.00 0.87 0.00 0.00 54.58 55.99 2i2x n ASN 301 Cb 0.22 -0.78 0.42 0.00 -1.02 0.00 0.00 39.78 38.63 2i2x n ASN 301 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.26 175.68 2i2x h LEU 302 N -0.22 0.37 -1.83 3.41 6.46 -1.44 -1.16 115.31 120.90 2i2x h LEU 302 Ca -0.47 0.19 0.00 0.00 -0.12 0.00 0.00 57.88 57.48 2i2x h LEU 302 Cb 1.84 0.18 0.00 0.00 -0.73 0.00 0.00 40.66 41.95 2i2x h LEU 302 CO -0.05 -0.14 0.00 -0.37 -0.62 0.00 0.00 178.44 177.26 2i2x h VAL 303 N 0.29 0.00 0.00 1.05 -1.51 -1.76 -1.23 116.25 113.09 2i2x h VAL 303 Ca 0.68 -0.17 0.00 0.00 -1.23 0.00 0.00 66.70 65.99 2i2x h VAL 303 Cb 1.52 0.99 0.00 0.00 -2.13 0.00 0.00 31.29 31.67 2i2x h VAL 303 CO -0.62 0.00 0.00 0.24 -1.23 0.00 0.00 177.57 175.96 2i2x h MET 304 N 0.00 0.00 -0.95 5.19 2.86 -1.49 -3.35 114.93 117.19 2i2x h MET 304 Ca 0.00 0.00 0.26 0.00 -2.06 0.00 0.00 59.70 57.90 2i2x h MET 304 Cb 0.19 0.00 -0.13 0.00 0.06 0.00 0.00 31.60 31.72 2i2x h MET 304 CO 0.00 0.00 0.48 -0.56 1.06 0.00 0.00 176.91 177.89 2i2x h GLN 305 N 0.00 0.40 -0.26 1.72 3.07 -1.36 -1.59 115.11 117.09 2i2x h GLN 305 Ca 0.00 -0.02 -0.23 0.00 0.09 0.00 0.00 58.65 58.49 2i2x h GLN 305 Cb 0.57 -0.09 -0.37 0.00 0.08 0.00 0.00 27.48 27.66 2i2x h GLN 305 CO 0.00 0.26 -1.03 0.00 0.09 0.00 0.00 178.83 178.16 2i2x n ASP 308 N -1.63 2.20 -4.17 0.00 8.00 -0.16 0.29 116.55 121.09 2i2x n ASP 308 Ca 0.09 0.00 -0.18 0.00 0.71 0.00 0.00 54.79 55.41 2i2x n ASP 308 Cb 0.53 1.00 -0.12 0.00 -0.02 0.00 0.00 41.12 42.51 2i2x n ASP 308 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2i2x s TRP 310 N -1.46 1.64 0.13 0.00 -0.00 -0.30 -1.06 118.94 117.90 2i2x s TRP 310 Ca -0.01 -1.17 0.07 0.00 -0.00 0.00 0.00 56.10 55.00 2i2x s TRP 310 Cb -0.09 -1.28 -0.04 0.00 -0.00 0.00 0.00 33.47 32.06 2i2x s TRP 310 CO 0.02 -0.65 -0.08 0.45 -0.00 0.00 0.00 176.95 176.69 2i2x s SER 311 N 1.65 4.44 0.00 5.86 0.15 -0.35 -0.51 113.70 124.95 2i2x s SER 311 Ca -0.02 -0.42 0.19 0.00 0.70 0.00 0.00 55.95 56.40 2i2x s SER 311 Cb -0.17 -0.85 0.52 0.00 -1.71 0.00 0.00 66.02 63.82 2i2x s SER 311 CO -0.07 0.15 1.44 -0.46 1.20 0.00 0.00 173.24 175.49 2i2x n ASN 312 N 0.42 2.98 0.00 5.45 6.94 -1.22 -4.31 115.26 125.53 2i2x n ASN 312 Ca -0.12 -1.96 0.00 0.00 -0.02 0.00 0.00 54.58 52.48 2i2x n ASN 312 Cb 0.53 -0.32 0.00 0.00 -2.36 0.00 0.00 39.78 37.63 2i2x n ASN 312 CO 0.00 0.00 0.00 1.21 -1.03 0.00 0.00 177.26 177.44 2i2x n GLU 313 N 1.14 0.00 -3.65 -3.83 4.07 -1.26 -4.41 120.64 112.70 2i2x n GLU 313 Ca 0.19 0.00 -0.04 0.00 -0.06 0.00 0.00 57.16 57.25 2i2x n GLU 313 Cb 0.49 0.00 -0.07 0.00 -0.06 0.00 0.00 31.44 31.80 2i2x n GLU 313 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 2i2x s SER 314 N 0.00 -0.11 -0.10 4.31 0.15 -1.26 -4.62 113.70 112.07 2i2x s SER 314 Ca 0.00 0.20 -0.17 0.00 0.70 0.00 0.00 55.95 56.69 2i2x s SER 314 Cb 0.00 0.20 0.04 0.00 -1.71 0.00 0.00 66.02 64.55 2i2x s SER 314 CO 0.00 -0.04 0.42 0.54 1.20 0.00 0.00 173.24 175.36 2i2x s VAL 315 N -0.03 0.02 0.20 4.45 0.11 -1.26 -2.79 120.40 121.11 2i2x s VAL 315 Ca 0.07 -0.16 -0.30 0.00 -2.93 0.00 0.00 61.98 58.66 2i2x s VAL 315 Cb -0.05 -0.65 -0.09 0.00 -1.53 0.00 0.00 36.38 34.07 2i2x s VAL 315 CO -0.14 -0.09 1.29 -0.70 -3.33 0.00 0.00 175.10 172.14 2i2x s GLU 316 N -0.43 4.41 -0.43 1.54 2.12 -1.26 -1.15 118.70 123.49 2i2x s GLU 316 Ca -0.06 2.03 -0.27 0.00 0.36 0.00 0.00 54.97 57.03 2i2x s GLU 316 Cb -0.03 -3.20 -0.04 0.00 0.26 0.00 0.00 34.13 31.12 2i2x s GLU 316 CO 0.03 -0.22 2.12 -0.47 -0.54 0.00 0.00 175.26 176.18 2i2x s TYR 317 N 0.03 1.37 0.14 5.30 5.04 -0.52 -4.77 117.35 123.94 2i2x s TYR 317 Ca 0.56 0.99 -0.01 0.00 -2.44 0.00 0.00 57.07 56.16 2i2x s TYR 317 Cb -0.36 -3.88 0.01 0.00 0.35 0.00 0.00 41.96 38.08 2i2x s TYR 317 CO 0.38 -2.89 0.21 -2.39 -1.34 0.00 0.00 175.55 169.53 2i2x n HIS 318 N 13.19 -0.94 -3.73 4.97 1.44 -1.26 -4.45 115.22 124.45 2i2x n HIS 318 Ca 0.29 -0.88 -0.32 0.00 -2.01 0.00 0.00 57.72 54.80 2i2x n HIS 318 Cb 0.51 0.24 -0.05 0.00 0.12 0.00 0.00 29.99 30.80 2i2x n HIS 318 CO 0.00 0.00 0.00 0.20 -2.81 0.00 0.00 176.34 173.73 2i2x s GLY 319 N -1.83 2.24 0.30 -1.39 0.00 -1.26 -0.56 107.32 104.81 2i2x s GLY 319 Ca 0.10 -0.60 0.03 0.00 0.00 0.00 0.00 44.72 44.26 2i2x s GLY 319 CO 0.07 -0.50 0.05 -0.54 0.00 0.00 0.00 173.10 172.19 2i2x s GLU 320 N -2.39 1.56 0.28 2.90 0.41 0.52 -4.84 118.70 117.14 2i2x s GLU 320 Ca 0.37 -1.85 0.01 0.00 -0.41 0.00 0.00 54.97 53.09 2i2x s GLU 320 Cb -0.13 -0.72 0.56 0.00 -1.78 0.00 0.00 34.13 32.07 2i2x s GLU 320 CO 0.23 -0.19 1.82 0.74 -0.49 0.00 0.00 175.26 177.37 2i2x h PHE 321 N 2.22 1.07 -0.17 1.61 0.04 -1.99 -2.38 116.94 117.34 2i2x h PHE 321 Ca -0.40 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.40 2i2x h PHE 321 Cb 1.24 -0.33 0.00 0.00 2.20 0.00 0.00 35.95 39.06 2i2x h PHE 321 CO 0.55 0.39 0.00 0.41 -0.60 0.00 0.00 178.31 179.06 2i2x n GLY 322 N -1.34 -0.02 0.00 -1.45 0.00 -1.26 -5.00 105.19 96.13 2i2x n GLY 322 Ca 0.19 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.91 2i2x n GLY 322 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i2x n GLY 323 N 0.96 0.60 3.77 -0.02 0.00 -0.90 -4.82 105.19 104.78 2i2x n GLY 323 Ca 0.12 -2.20 -0.40 0.00 0.00 0.00 0.00 46.02 43.55 2i2x n GLY 323 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2i2x s THR 324 N -0.67 2.97 0.32 2.61 2.01 -1.26 -0.35 115.64 121.27 2i2x s THR 324 Ca 0.00 0.94 0.09 0.00 0.31 0.00 0.00 61.69 63.03 2i2x s THR 324 Cb 0.00 -3.59 0.36 0.00 0.01 0.00 0.00 72.50 69.28 2i2x s THR 324 CO 0.00 0.20 1.61 0.00 -0.69 0.00 0.00 174.62 175.73 2i2x h THR 325 N 2.88 0.13 0.00 -0.82 1.03 -1.13 0.21 112.91 115.21 2i2x h THR 325 Ca -0.48 -0.04 0.00 0.00 -0.01 0.00 0.00 66.41 65.88 2i2x h THR 325 Cb 1.23 0.02 0.00 0.00 -1.07 0.00 0.00 68.15 68.33 2i2x h THR 325 CO 0.65 0.02 0.00 -0.37 -0.01 0.00 0.00 175.52 175.81 2i2x h VAL 326 N 0.10 0.00 0.00 0.00 -1.51 -1.88 -2.45 116.25 110.52 2i2x h VAL 326 Ca 0.67 -0.90 -0.23 0.00 -1.23 0.00 0.00 66.70 65.01 2i2x h VAL 326 Cb 1.54 1.90 0.02 0.00 -2.13 0.00 0.00 31.29 32.62 2i2x h VAL 326 CO -0.77 0.00 -0.90 1.56 -1.23 0.00 0.00 177.57 176.24 2i2x h GLN 327 N 0.00 0.60 0.28 5.19 4.20 -0.92 -1.89 115.11 122.58 2i2x h GLN 327 Ca 0.00 -0.65 -0.00 0.00 0.06 0.00 0.00 58.65 58.06 2i2x h GLN 327 Cb 0.91 0.19 -0.02 0.00 0.30 0.00 0.00 27.48 28.86 2i2x h GLN 327 CO 0.00 1.25 -0.26 0.00 -0.67 0.00 0.00 178.83 179.16 2i2x h TRP 329 N -0.56 0.14 -0.11 0.00 4.06 -1.54 -2.91 115.95 115.04 2i2x h TRP 329 Ca -0.01 -0.07 -0.15 0.00 2.06 0.00 0.00 58.89 60.72 2i2x h TRP 329 Cb 0.51 -0.02 -0.01 0.00 -1.00 0.00 0.00 29.16 28.64 2i2x h TRP 329 CO -0.16 0.78 -0.59 0.66 -3.56 0.00 0.00 178.44 175.57 2i2x h SER 330 N 0.07 0.40 -0.22 -3.49 4.64 -1.26 -1.09 113.55 112.59 2i2x h SER 330 Ca -0.02 -0.23 -0.01 0.00 -0.47 0.00 0.00 61.79 61.06 2i2x h SER 330 Cb 1.27 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 63.23 2i2x h SER 330 CO 0.10 0.90 0.11 -0.08 -0.87 0.00 0.00 176.83 176.99 2i2x h GLU 331 N 0.27 0.38 0.02 4.77 4.81 -1.17 0.18 114.58 123.84 2i2x h GLU 331 Ca -0.00 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.18 2i2x h GLU 331 Cb 1.11 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.42 2i2x h GLU 331 CO 0.10 0.32 -0.01 1.15 -0.73 0.00 0.00 179.01 179.83 2i2x h THR 332 N 0.38 1.43 -0.86 0.32 2.02 -1.26 -1.87 112.91 113.06 2i2x h THR 332 Ca 0.10 -1.82 0.22 0.00 0.77 0.00 0.00 66.41 65.67 2i2x h THR 332 Cb 0.08 2.59 -0.15 0.00 -1.74 0.00 0.00 68.15 68.93 2i2x h THR 332 CO -0.01 0.44 0.03 -0.07 0.37 0.00 0.00 175.52 176.28 2i2x h LEU 333 N -0.88 -0.37 -0.55 2.58 3.38 -1.17 0.01 115.31 118.32 2i2x h LEU 333 Ca -0.00 0.23 -0.13 0.00 0.09 0.00 0.00 57.88 58.06 2i2x h LEU 333 Cb 0.75 0.39 -0.01 0.00 0.09 0.00 0.00 40.66 41.88 2i2x h LEU 333 CO 0.01 -0.24 -0.27 0.00 0.09 0.00 0.00 178.44 178.02 2i2x h ALA 334 N 1.83 0.73 -0.33 1.53 0.00 -0.58 -2.46 119.26 119.98 2i2x h ALA 334 Ca 0.50 -0.41 -0.15 0.00 0.00 0.00 0.00 54.91 54.85 2i2x h ALA 334 Cb 0.95 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 2i2x h ALA 334 CO -0.77 0.66 -0.41 1.88 0.00 0.00 0.00 179.25 180.62 2i2x h TYR 335 N 0.75 0.96 -0.53 0.00 0.05 -0.35 -2.03 116.97 115.82 2i2x h TYR 335 Ca 0.09 -0.29 0.10 0.00 0.05 0.00 0.00 58.73 58.68 2i2x h TYR 335 Cb 0.83 -0.20 -0.08 0.00 1.01 0.00 0.00 36.73 38.29 2i2x h TYR 335 CO 0.05 1.07 0.05 -0.44 -1.05 0.00 0.00 178.16 177.84 2i2x h ASP 336 N 0.65 -0.13 -0.09 3.88 3.32 -0.94 -1.68 116.42 121.43 2i2x h ASP 336 Ca 0.05 0.12 -0.08 0.00 0.02 0.00 0.00 57.03 57.14 2i2x h ASP 336 Cb 0.97 0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.69 2i2x h ASP 336 CO 0.09 -0.04 -0.16 0.00 -1.72 0.00 0.00 179.24 177.41 2i2x h ALA 338 N 1.41 1.03 0.07 0.00 0.00 -0.61 0.74 119.26 121.90 2i2x h ALA 338 Ca 0.07 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 54.86 2i2x h ALA 338 Cb 0.53 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2i2x h ALA 338 CO 0.03 0.57 -0.11 1.25 0.00 0.00 0.00 179.25 180.99 2i2x h LEU 339 N 1.13 -0.29 -0.32 0.00 5.85 -1.00 0.10 115.31 120.77 2i2x h LEU 339 Ca 0.28 0.03 0.01 0.00 0.84 0.00 0.00 57.88 59.05 2i2x h LEU 339 Cb 0.07 0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 2i2x h LEU 339 CO -0.04 -0.16 0.19 0.24 -0.34 0.00 0.00 178.44 178.33 2i2x h MET 340 N -0.22 0.38 -0.24 1.25 2.86 -1.17 -2.22 114.93 115.58 2i2x h MET 340 Ca 0.02 -0.02 -0.09 0.00 -2.06 0.00 0.00 59.70 57.55 2i2x h MET 340 Cb 0.23 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.79 2i2x h MET 340 CO -0.06 0.25 -0.22 -0.91 1.06 0.00 0.00 176.91 177.03 2i2x h ASN 341 N 0.39 0.44 -0.44 1.22 2.35 -0.64 0.15 115.58 119.05 2i2x h ASN 341 Ca 0.12 -0.14 -0.02 0.00 -0.55 0.00 0.00 56.30 55.72 2i2x h ASN 341 Cb -0.01 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.22 2i2x h ASN 341 CO -0.05 0.67 0.21 0.74 -1.65 0.00 0.00 177.43 177.34 2i2x h THR 342 N 0.40 1.17 -0.38 2.81 2.02 -0.76 0.58 112.91 118.74 2i2x h THR 342 Ca 0.06 -0.52 -0.16 0.00 0.77 0.00 0.00 66.41 66.56 2i2x h THR 342 Cb 0.61 0.59 -0.01 0.00 -1.74 0.00 0.00 68.15 67.60 2i2x h THR 342 CO 0.04 0.21 -0.40 0.00 0.37 0.00 0.00 175.52 175.74 2i2x h ALA 343 N 1.56 0.56 0.33 6.16 0.00 -0.14 -2.43 119.26 125.29 2i2x h ALA 343 Ca 0.17 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 2i2x h ALA 343 Cb 0.11 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2i2x h ALA 343 CO -0.02 0.68 -0.27 -0.07 0.00 0.00 0.00 179.25 179.57 2i2x h LEU 344 N 0.77 -0.70 -2.22 0.00 3.38 -0.74 0.65 115.31 116.44 2i2x h LEU 344 Ca 0.06 0.06 0.02 0.00 0.09 0.00 0.00 57.88 58.11 2i2x h LEU 344 Cb 1.00 0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.97 2i2x h LEU 344 CO 0.10 -0.40 0.07 -0.33 0.09 0.00 0.00 178.44 177.97 2i2x h GLU 345 N -0.60 0.00 -0.35 1.13 4.39 -0.87 -2.48 114.58 115.79 2i2x h GLU 345 Ca -0.02 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.68 2i2x h GLU 345 Cb 0.53 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.18 2i2x h GLU 345 CO -0.02 0.00 0.00 0.25 -1.16 0.00 0.00 179.01 178.08 2i2x n THR 346 N -4.13 0.92 -2.72 1.13 -2.24 -0.92 -4.98 114.28 101.34 2i2x n THR 346 Ca -0.01 -0.96 -0.15 0.00 -2.27 0.00 0.00 64.05 60.67 2i2x n THR 346 Cb 0.18 0.56 0.02 0.00 -2.10 0.00 0.00 70.33 68.99 2i2x n THR 346 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2i2x n LYS 347 N 0.63 -3.09 -0.06 -0.78 4.01 -0.37 -4.92 118.16 113.57 2i2x n LYS 347 Ca 0.12 0.60 0.07 0.00 -0.51 0.00 0.00 58.31 58.59 2i2x n LYS 347 Cb 0.43 -4.81 0.10 0.00 -0.51 0.00 0.00 35.03 30.24 2i2x n LYS 347 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 2i2x n ASN 348 N -1.01 2.30 -0.16 4.39 4.13 0.21 -4.76 115.26 120.37 2i2x n ASN 348 Ca -0.08 -2.73 -0.06 0.00 1.68 0.00 0.00 54.58 53.39 2i2x n ASN 348 Cb 0.58 -0.30 0.11 0.00 -1.54 0.00 0.00 39.78 38.64 2i2x n ASN 348 CO 0.00 0.00 0.00 -2.24 0.28 0.00 0.00 177.26 175.30 2i2x h ASP 349 N 0.09 0.89 -0.47 6.41 2.03 -1.82 -2.86 116.42 120.69 2i2x h ASP 349 Ca 0.00 -0.21 -0.10 0.00 -0.73 0.00 0.00 57.03 55.98 2i2x h ASP 349 Cb 0.86 -0.24 -0.01 0.00 -0.83 0.00 0.00 39.33 39.11 2i2x h ASP 349 CO 0.01 0.92 -0.12 0.11 -1.03 0.00 0.00 179.24 179.13 2i2x h LYS 350 N 0.87 0.90 -0.73 4.15 1.57 -1.90 0.41 116.57 121.84 2i2x h LYS 350 Ca 0.17 -0.35 -0.06 0.00 -1.87 0.00 0.00 60.65 58.55 2i2x h LYS 350 Cb 0.44 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.67 2i2x h LYS 350 CO 0.02 1.00 0.23 -0.24 -0.57 0.00 0.00 179.45 179.89 2i2x h VAL 351 N 0.75 1.26 -0.25 0.50 3.04 -1.91 -1.13 116.25 118.50 2i2x h VAL 351 Ca 0.12 -0.89 -0.08 0.00 -1.01 0.00 0.00 66.70 64.83 2i2x h VAL 351 Cb 0.67 0.45 -0.01 0.00 -2.01 0.00 0.00 31.29 30.39 2i2x h VAL 351 CO 0.05 0.35 -0.17 0.25 -1.01 0.00 0.00 177.57 177.04 2i2x h LEU 352 N 1.08 0.58 -0.75 3.16 5.85 -1.23 0.15 115.31 124.16 2i2x h LEU 352 Ca 0.24 -0.44 0.17 0.00 0.84 0.00 0.00 57.88 58.69 2i2x h LEU 352 Cb 0.29 -0.16 -0.12 0.00 0.37 0.00 0.00 40.66 41.04 2i2x h LEU 352 CO -0.01 0.89 0.08 -0.09 -0.34 0.00 0.00 178.44 178.97 2i2x h ARG 353 N 0.27 0.15 -0.21 1.25 1.12 0.04 -0.36 114.38 116.65 2i2x h ARG 353 Ca 0.05 -0.01 -0.14 0.00 -1.11 0.00 0.00 59.98 58.77 2i2x h ARG 353 Cb 0.70 -0.03 -0.01 0.00 -0.01 0.00 0.00 29.97 30.61 2i2x h ARG 353 CO 0.05 0.10 -0.47 -0.44 -3.11 0.00 0.00 179.97 176.10 2i2x h ASP 354 N 0.16 0.59 -0.55 -3.80 3.32 -0.80 -1.48 116.42 113.86 2i2x h ASP 354 Ca 0.42 -0.29 -0.02 0.00 0.02 0.00 0.00 57.03 57.17 2i2x h ASP 354 Cb 0.74 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 40.10 2i2x h ASP 354 CO -0.61 0.97 0.29 -0.07 -1.72 0.00 0.00 179.24 178.10 2i2x h LEU 355 N 0.43 0.71 0.00 1.55 4.07 -0.13 0.55 115.31 122.49 2i2x h LEU 355 Ca 0.02 -0.11 -0.00 0.00 0.08 0.00 0.00 57.88 57.88 2i2x h LEU 355 Cb 0.99 -0.18 0.00 0.00 1.08 0.00 0.00 40.66 42.55 2i2x h LEU 355 CO 0.09 0.62 -0.00 0.24 -1.08 0.00 0.00 178.44 178.30 2i2x h MET 356 N 0.75 -0.00 -0.20 1.13 2.86 -0.90 -1.94 114.93 116.63 2i2x h MET 356 Ca 0.19 0.00 0.05 0.00 -2.06 0.00 0.00 59.70 57.89 2i2x h MET 356 Cb 0.08 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 31.68 2i2x h MET 356 CO -0.03 0.29 -0.23 1.98 1.06 0.00 0.00 176.91 179.98 2i2x h MET 357 N -0.30 -0.25 -0.11 1.72 1.85 -1.21 -2.64 114.93 114.00 2i2x h MET 357 Ca -0.00 0.02 -0.05 0.00 -0.61 0.00 0.00 59.70 59.05 2i2x h MET 357 Cb 0.30 0.06 -0.01 0.00 0.43 0.00 0.00 31.60 32.37 2i2x h MET 357 CO 0.00 -0.16 -0.18 1.25 -0.40 0.00 0.00 176.91 177.42 2i2x h LEU 358 N -0.26 0.16 -0.74 3.39 5.85 -0.75 -1.50 115.31 121.46 2i2x h LEU 358 Ca 0.12 -0.04 0.16 0.00 0.84 0.00 0.00 57.88 58.97 2i2x h LEU 358 Cb 0.44 -0.04 -0.11 0.00 0.37 0.00 0.00 40.66 41.32 2i2x h LEU 358 CO -0.34 0.35 0.18 -1.28 -0.34 0.00 0.00 178.44 177.01 2i2x h SER 359 N 0.16 0.00 -0.01 1.25 0.87 -1.16 -3.14 113.55 111.53 2i2x h SER 359 Ca 0.03 0.15 0.00 0.00 -1.23 0.00 0.00 61.79 60.74 2i2x h SER 359 Cb 0.41 0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.57 2i2x h SER 359 CO 0.03 -0.05 -0.02 0.47 -0.53 0.00 0.00 176.83 176.73 2i2x n ASP 360 N -5.16 1.47 -0.36 6.23 8.00 -0.99 -4.71 116.55 121.03 2i2x n ASP 360 Ca 0.14 -1.24 0.27 0.00 0.71 0.00 0.00 54.79 54.68 2i2x n ASP 360 Cb 0.47 0.07 0.55 0.00 -0.02 0.00 0.00 41.12 42.19 2i2x n ASP 360 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 2i2x h ARG 361 N 1.24 0.29 -0.33 -1.24 2.43 -1.23 -0.33 114.38 115.20 2i2x h ARG 361 Ca 0.00 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 2i2x h ARG 361 Cb 0.27 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 2i2x h ARG 361 CO 0.00 0.19 0.00 0.66 -1.51 0.00 0.00 179.97 179.31 2i2x n TYR 362 N -4.67 0.43 0.14 2.20 4.01 -1.26 -3.13 117.16 114.89 2i2x n TYR 362 Ca 0.29 -0.29 -0.00 0.00 -0.16 0.00 0.00 57.90 57.74 2i2x n TYR 362 Cb 1.04 -0.01 0.25 0.00 -0.31 0.00 0.00 39.34 40.31 2i2x n TYR 362 CO 0.00 0.00 0.00 -0.09 -0.46 0.00 0.00 176.86 176.31 2i2x h ARG 363 N 3.34 0.07 -1.58 -0.72 2.43 -1.35 -3.43 114.38 113.13 2i2x h ARG 363 Ca 0.00 -0.04 0.13 0.00 -0.81 0.00 0.00 59.98 59.27 2i2x h ARG 363 Cb 0.82 0.00 -0.22 0.00 -0.42 0.00 0.00 29.97 30.15 2i2x h ARG 363 CO 0.00 0.54 0.64 0.34 -1.51 0.00 0.00 179.97 179.98 2i2x s ASP 364 N -6.89 -0.28 0.45 -3.80 -1.08 -1.26 -5.02 116.67 98.79 2i2x s ASP 364 Ca -0.03 0.23 0.12 0.00 -0.52 0.00 0.00 52.55 52.35 2i2x s ASP 364 Cb 0.13 0.25 1.04 0.00 -1.46 0.00 0.00 42.92 42.88 2i2x s ASP 364 CO 0.75 -0.32 2.06 1.55 0.52 0.00 0.00 175.17 179.73 2i2x h PRO 365 N 2.31 0.33 0.00 4.34 0.13 -1.89 -0.73 132.00 136.50 2i2x h PRO 365 Ca -0.16 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 64.93 2i2x h PRO 365 Cb 1.18 -0.08 -0.00 0.00 0.13 0.00 0.00 31.00 32.23 2i2x h PRO 365 CO 0.28 0.22 -0.10 1.96 -0.23 0.00 0.00 178.00 180.13 2i2x h GLN 366 N 0.34 0.00 0.10 0.86 4.20 -1.96 -2.49 115.11 116.17 2i2x h GLN 366 Ca 0.14 0.00 -0.29 0.00 0.06 0.00 0.00 58.65 58.56 2i2x h GLN 366 Cb 0.14 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.91 2i2x h GLN 366 CO -0.03 0.10 -1.51 0.00 -0.67 0.00 0.00 178.83 176.72 2i2x h ALA 367 N 1.90 0.24 -0.73 3.87 0.00 -1.70 -3.35 119.26 119.48 2i2x h ALA 367 Ca -0.00 -1.16 0.14 0.00 0.00 0.00 0.00 54.91 53.89 2i2x h ALA 367 Cb 0.21 0.56 -0.10 0.00 0.00 0.00 0.00 17.79 18.47 2i2x h ALA 367 CO 0.01 0.91 0.26 -0.92 0.00 0.00 0.00 179.25 179.51 2i2x h TYR 368 N -0.31 0.43 -0.09 0.00 3.20 -0.71 -0.58 116.97 118.90 2i2x h TYR 368 Ca -0.33 0.04 -0.12 0.00 3.14 0.00 0.00 58.73 61.45 2i2x h TYR 368 Cb 1.76 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 39.94 2i2x h TYR 368 CO 0.11 0.02 -0.48 1.98 -1.64 0.00 0.00 178.16 178.15 2i2x h MET 369 N 0.39 0.22 -0.00 1.82 4.05 -1.68 -2.99 114.93 116.73 2i2x h MET 369 Ca 0.40 -0.12 0.00 0.00 -0.28 0.00 0.00 59.70 59.70 2i2x h MET 369 Cb 0.63 0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.43 2i2x h MET 369 CO -0.42 0.65 -0.18 1.28 0.23 0.00 0.00 176.91 178.47 2i2x n LEU 370 N -3.97 0.22 -4.64 3.39 4.32 -0.32 -2.60 117.00 113.40 2i2x n LEU 370 Ca -0.02 0.27 -0.46 0.00 -0.02 0.00 0.00 56.01 55.79 2i2x n LEU 370 Cb 0.53 -0.38 -0.03 0.00 -1.62 0.00 0.00 43.42 41.92 2i2x n LEU 370 CO 0.42 0.05 0.92 0.00 -1.22 0.00 0.00 177.39 177.57 2i2x n ALA 371 N -1.43 0.54 -0.14 -1.18 0.00 -0.66 -4.60 120.51 113.03 2i2x n ALA 371 Ca 0.08 0.43 0.22 0.00 0.00 0.00 0.00 53.44 54.16 2i2x n ALA 371 Cb 0.33 -2.20 0.63 0.00 0.00 0.00 0.00 19.45 18.22 2i2x n ALA 371 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 177.50 177.60 2i2x h TYR 372 N 3.93 0.19 -0.28 0.00 -0.00 -1.91 0.12 116.97 119.03 2i2x h TYR 372 Ca -0.44 0.01 -0.19 0.00 -0.00 0.00 0.00 58.73 58.10 2i2x h TYR 372 Cb 1.30 -0.06 0.00 0.00 -0.00 0.00 0.00 36.73 37.97 2i2x h TYR 372 CO 0.56 0.06 -0.57 0.38 -0.00 0.00 0.00 178.16 178.59 2i2x h ASP 373 N 0.15 0.98 -0.10 0.10 2.03 -1.92 -1.18 116.42 116.48 2i2x h ASP 373 Ca 0.38 -0.54 -0.18 0.00 -0.73 0.00 0.00 57.03 55.96 2i2x h ASP 373 Cb 1.28 -0.28 -0.00 0.00 -0.83 0.00 0.00 39.33 39.49 2i2x h ASP 373 CO -0.06 1.34 -0.57 0.78 -1.03 0.00 0.00 179.24 179.69 2i2x h ASN 374 N 0.65 0.78 -0.59 4.15 2.35 -1.48 -2.11 115.58 119.33 2i2x h ASN 374 Ca 0.01 -0.43 -0.00 0.00 -0.55 0.00 0.00 56.30 55.33 2i2x h ASN 374 Cb 1.18 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 39.30 2i2x h ASN 374 CO 0.13 1.19 0.36 0.00 -1.65 0.00 0.00 177.43 177.45 2i2x h ALA 375 N 0.83 0.75 -0.03 -0.83 0.00 -0.55 0.15 119.26 119.58 2i2x h ALA 375 Ca 0.00 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.85 2i2x h ALA 375 Cb 1.15 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 2i2x h ALA 375 CO 0.12 0.23 -0.01 -0.92 0.00 0.00 0.00 179.25 178.67 2i2x h TYR 376 N 0.80 -0.02 -0.81 0.00 5.03 -1.16 -1.16 116.97 119.65 2i2x h TYR 376 Ca 0.21 0.00 0.15 0.00 2.58 0.00 0.00 58.73 61.67 2i2x h TYR 376 Cb -0.03 0.01 -0.10 0.00 1.55 0.00 0.00 36.73 38.17 2i2x h TYR 376 CO -0.02 -0.01 0.38 -0.09 -1.32 0.00 0.00 178.16 177.09 2i2x h ARG 377 N 0.00 0.52 -0.84 1.82 2.43 -0.64 -0.49 114.38 117.19 2i2x h ARG 377 Ca 0.01 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.12 2i2x h ARG 377 Cb 0.02 -0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 29.42 2i2x h ARG 377 CO -0.03 0.34 0.38 0.28 -1.51 0.00 0.00 179.97 179.43 2i2x h VAL 378 N 0.53 1.26 -0.36 0.20 2.07 -0.61 -2.44 116.25 116.91 2i2x h VAL 378 Ca 0.45 -0.77 -0.02 0.00 0.82 0.00 0.00 66.70 67.19 2i2x h VAL 378 Cb 0.67 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 2i2x h VAL 378 CO -0.39 0.32 0.15 1.23 0.02 0.00 0.00 177.57 178.91 2i2x h GLY 379 N 1.21 0.53 1.19 2.17 0.00 0.12 -2.23 103.07 106.06 2i2x h GLY 379 Ca 0.29 -0.24 -0.10 0.00 0.00 0.00 0.00 47.33 47.28 2i2x h GLY 379 CO -0.03 0.23 -0.07 1.46 0.00 0.00 0.00 176.54 178.13 2i2x h GLN 380 N 0.50 0.95 0.00 4.80 4.20 -0.72 -2.40 115.11 122.44 2i2x h GLN 380 Ca 0.13 -0.32 -0.07 0.00 0.06 0.00 0.00 58.65 58.44 2i2x h GLN 380 Cb 0.09 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.78 2i2x h GLN 380 CO -0.01 0.98 -0.35 0.66 -0.67 0.00 0.00 178.83 179.44 2i2x h SER 381 N 0.86 0.00 0.05 1.46 4.64 -1.21 -2.58 113.55 116.77 2i2x h SER 381 Ca 0.15 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.46 2i2x h SER 381 Cb 0.60 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 2i2x h SER 381 CO 0.04 0.35 -0.02 0.40 -0.87 0.00 0.00 176.83 176.72 2i2x h ILE 382 N 0.00 1.31 0.00 0.95 2.04 -1.19 -3.37 117.51 117.25 2i2x h ILE 382 Ca -0.00 -1.50 -0.12 0.00 1.00 0.00 0.00 64.86 64.24 2i2x h ILE 382 Cb 0.73 2.25 -0.02 0.00 -0.74 0.00 0.00 36.82 39.04 2i2x h ILE 382 CO 0.04 0.36 -0.55 -0.37 0.00 0.00 0.00 178.15 177.63 2i2x h VAL 383 N -0.77 1.31 -0.26 1.67 -1.51 -1.38 -2.68 116.25 112.63 2i2x h VAL 383 Ca -0.01 -1.94 0.08 0.00 -1.23 0.00 0.00 66.70 63.60 2i2x h VAL 383 Cb 0.64 2.07 -0.01 0.00 -2.13 0.00 0.00 31.29 31.86 2i2x h VAL 383 CO 0.01 0.54 0.28 0.07 -1.23 0.00 0.00 177.57 177.24 2i2x h LYS 384 N 0.00 0.00 -0.63 5.19 2.10 -1.61 0.11 116.57 121.73 2i2x h LYS 384 Ca -0.01 0.00 -0.45 0.00 -2.00 0.00 0.00 60.65 58.19 2i2x h LYS 384 Cb 1.03 0.00 -0.39 0.00 -0.90 0.00 0.00 32.23 31.97 2i2x h LYS 384 CO 0.07 0.00 -0.85 -0.25 -2.00 0.00 0.00 179.45 176.43 2i2x n ASP 385 N -3.82 4.08 -0.42 7.07 10.43 -1.05 -4.96 116.55 127.87 2i2x n ASP 385 Ca 0.04 -3.46 0.37 0.00 2.57 0.00 0.00 54.79 54.30 2i2x n ASP 385 Cb 0.42 -0.38 0.64 0.00 1.84 0.00 0.00 41.12 43.65 2i2x n ASP 385 CO 0.00 0.00 0.00 1.23 -1.07 0.00 0.00 177.20 177.36 2i2x h GLY 386 N 2.13 1.64 2.00 0.44 0.00 -0.46 -1.29 103.07 107.54 2i2x h GLY 386 Ca 0.25 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.46 2i2x h GLY 386 CO 0.60 -0.56 0.00 -0.55 0.00 0.00 0.00 176.54 176.03 2i2x h ASP 387 N 0.03 0.00 -3.35 0.19 3.32 -1.86 -3.42 116.42 111.34 2i2x h ASP 387 Ca 0.86 0.00 -0.73 0.00 0.02 0.00 0.00 57.03 57.18 2i2x h ASP 387 Cb 2.58 0.00 -0.27 0.00 0.22 0.00 0.00 39.33 41.86 2i2x h ASP 387 CO -0.55 0.00 -0.40 0.21 -1.72 0.00 0.00 179.24 176.79 2i2x s ASN 388 N -5.58 5.81 0.47 6.45 3.84 -0.48 -4.93 114.94 120.51 2i2x s ASN 388 Ca 0.05 -1.61 0.19 0.00 0.21 0.00 0.00 52.86 51.70 2i2x s ASN 388 Cb 0.08 -2.05 1.17 0.00 -0.55 0.00 0.00 41.25 39.90 2i2x s ASN 388 CO 0.58 -0.63 1.96 0.16 -2.79 0.00 0.00 177.10 176.38 2i2x h ILE 389 N 6.01 0.80 0.02 -5.21 3.07 -1.84 -1.24 117.51 119.12 2i2x h ILE 389 Ca -0.24 -0.09 -0.00 0.00 1.55 0.00 0.00 64.86 66.08 2i2x h ILE 389 Cb 1.09 0.52 0.00 0.00 -0.27 0.00 0.00 36.82 38.15 2i2x h ILE 389 CO 0.84 0.05 -0.01 0.22 -1.05 0.00 0.00 178.15 178.20 2i2x h TYR 390 N 0.26 -0.02 -0.06 0.16 3.20 -1.92 -3.11 116.97 115.47 2i2x h TYR 390 Ca 0.30 -0.00 -0.18 0.00 3.14 0.00 0.00 58.73 61.99 2i2x h TYR 390 Cb 0.83 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 39.10 2i2x h TYR 390 CO -0.00 0.73 -0.75 1.25 -1.64 0.00 0.00 178.16 177.75 2i2x h LEU 391 N -0.86 0.44 -0.71 2.82 5.85 -1.81 -0.95 115.31 120.09 2i2x h LEU 391 Ca -0.00 -0.29 -0.02 0.00 0.84 0.00 0.00 57.88 58.40 2i2x h LEU 391 Cb 0.76 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.63 2i2x h LEU 391 CO 0.00 1.03 0.36 0.08 -0.34 0.00 0.00 178.44 179.58 2i2x h ARG 392 N 0.24 1.01 -0.41 1.25 0.11 -1.38 0.38 114.38 115.59 2i2x h ARG 392 Ca -0.03 -0.14 -0.04 0.00 0.10 0.00 0.00 59.98 59.87 2i2x h ARG 392 Cb 1.32 -0.19 -0.02 0.00 1.11 0.00 0.00 29.97 32.20 2i2x h ARG 392 CO 0.13 0.78 0.08 0.00 0.10 0.00 0.00 179.97 181.06 2i2x h ALA 393 N 1.18 0.54 -0.54 0.08 0.00 -1.43 -1.80 119.26 117.28 2i2x h ALA 393 Ca 0.25 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 2i2x h ALA 393 Cb 0.08 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2i2x h ALA 393 CO -0.03 0.24 0.19 -0.22 0.00 0.00 0.00 179.25 179.42 2i2x h LYS 394 N 0.52 0.83 -0.58 0.00 3.64 -0.86 -1.08 116.57 119.04 2i2x h LYS 394 Ca 0.13 -0.17 0.12 0.00 -1.27 0.00 0.00 60.65 59.45 2i2x h LYS 394 Cb 0.34 -0.13 -0.10 0.00 -0.41 0.00 0.00 32.23 31.93 2i2x h LYS 394 CO 0.00 0.75 -0.04 -0.91 -2.27 0.00 0.00 179.45 176.98 2i2x h ASN 395 N 0.75 -0.34 -0.74 4.20 4.21 -0.19 -0.55 115.58 122.91 2i2x h ASN 395 Ca 0.18 0.15 -0.01 0.00 1.21 0.00 0.00 56.30 57.83 2i2x h ASN 395 Cb 0.25 0.29 -0.04 0.00 -1.12 0.00 0.00 38.32 37.70 2i2x h ASN 395 CO -0.01 -0.13 0.41 0.00 -1.29 0.00 0.00 177.43 176.41 2i2x h ALA 396 N 1.54 1.31 -0.15 -0.83 0.00 -0.75 0.27 119.26 120.64 2i2x h ALA 396 Ca 0.29 -0.11 -0.15 0.00 0.00 0.00 0.00 54.91 54.94 2i2x h ALA 396 Cb 0.47 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2i2x h ALA 396 CO -0.53 0.57 -0.47 0.00 0.00 0.00 0.00 179.25 178.81 2i2x h ALA 397 N 1.40 0.27 -0.14 0.00 0.00 -0.31 -0.66 119.26 119.82 2i2x h ALA 397 Ca 0.27 -0.49 -0.21 0.00 0.00 0.00 0.00 54.91 54.48 2i2x h ALA 397 Cb 0.02 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.79 2i2x h ALA 397 CO -0.04 0.42 -0.76 0.82 0.00 0.00 0.00 179.25 179.69 2i2x h ILE 398 N 0.24 1.30 -0.42 0.00 2.04 -0.88 -2.34 117.51 117.45 2i2x h ILE 398 Ca -0.02 -2.00 0.00 0.00 1.00 0.00 0.00 64.86 63.85 2i2x h ILE 398 Cb 1.10 1.99 -0.02 0.00 -0.74 0.00 0.00 36.82 39.15 2i2x h ILE 398 CO 0.10 0.63 0.27 -0.08 0.00 0.00 0.00 178.15 179.07 2i2x h GLU 399 N 0.49 0.57 -0.67 2.37 4.57 -0.45 -1.21 114.58 120.25 2i2x h GLU 399 Ca -0.05 -0.04 0.11 0.00 -1.18 0.00 0.00 59.36 58.21 2i2x h GLU 399 Cb 1.38 -0.12 -0.12 0.00 -0.16 0.00 0.00 28.75 29.72 2i2x h GLU 399 CO 0.15 0.40 -0.35 0.00 -1.18 0.00 0.00 179.01 178.02 2i2x h ASN 402 N 0.82 0.97 -0.37 0.00 2.35 -0.14 -1.16 115.58 118.06 2i2x h ASN 402 Ca 0.40 -0.35 -0.01 0.00 -0.55 0.00 0.00 56.30 55.79 2i2x h ASN 402 Cb 0.34 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.43 2i2x h ASN 402 CO -0.24 1.10 0.20 0.40 -1.65 0.00 0.00 177.43 177.24 2i2x h ILE 403 N 0.84 1.14 -0.66 2.81 2.04 0.04 -1.51 117.51 122.21 2i2x h ILE 403 Ca 0.13 -0.37 -0.06 0.00 1.00 0.00 0.00 64.86 65.56 2i2x h ILE 403 Cb 0.65 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 37.43 2i2x h ILE 403 CO 0.05 0.15 0.19 0.40 0.00 0.00 0.00 178.15 178.94 2i2x h ILE 404 N 0.46 1.25 0.01 -0.67 1.08 -0.89 -1.60 117.51 117.16 2i2x h ILE 404 Ca 0.13 -0.87 -0.00 0.00 -0.39 0.00 0.00 64.86 63.73 2i2x h ILE 404 Cb 0.06 0.53 0.00 0.00 -3.07 0.00 0.00 36.82 34.34 2i2x h ILE 404 CO -0.02 0.33 -0.01 -0.33 -0.69 0.00 0.00 178.15 177.44 2i2x h GLU 405 N 0.98 -0.01 -0.52 2.37 5.08 -0.89 -0.63 114.58 120.95 2i2x h GLU 405 Ca 0.21 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.64 2i2x h GLU 405 Cb 0.30 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.50 2i2x h GLU 405 CO -0.01 0.04 0.22 0.93 -1.00 0.00 0.00 179.01 179.20 2i2x h GLU 406 N -0.07 0.42 -0.58 2.33 5.08 -1.14 -1.37 114.58 119.26 2i2x h GLU 406 Ca -0.00 -0.03 0.03 0.00 -1.00 0.00 0.00 59.36 58.36 2i2x h GLU 406 Cb 0.06 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.18 2i2x h GLU 406 CO 0.00 0.28 0.35 0.78 -1.00 0.00 0.00 179.01 179.42 2i2x h GLY 407 N 0.43 0.82 1.55 -3.84 0.00 -1.08 -2.41 103.07 98.54 2i2x h GLY 407 Ca 0.24 -0.26 -0.03 0.00 0.00 0.00 0.00 47.33 47.29 2i2x h GLY 407 CO -0.21 0.22 0.14 0.00 0.00 0.00 0.00 176.54 176.68 2i2x h ALA 408 N 1.26 1.49 0.00 3.60 0.00 -0.48 -0.07 119.26 125.05 2i2x h ALA 408 Ca 0.23 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2i2x h ALA 408 Cb 0.03 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.65 2i2x h ALA 408 CO -0.10 0.39 0.00 0.00 0.00 0.00 0.00 179.25 179.54 2i2x h ALA 409 N 1.58 1.00 -3.00 0.00 0.00 -0.81 -3.41 119.26 114.62 2i2x h ALA 409 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2i2x h ALA 409 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2i2x h ALA 409 CO -0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.65 2i2x n GLY 410 N 0.66 0.71 0.39 0.00 0.00 -0.19 -4.99 105.19 101.77 2i2x n GLY 410 Ca 0.03 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.13 2i2x n GLY 410 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2i2x n LYS 411 N 0.00 1.59 -2.14 1.61 5.02 -0.96 -4.89 118.16 118.38 2i2x n LYS 411 Ca 0.00 -0.86 -0.43 0.00 -2.02 0.00 0.00 58.31 55.01 2i2x n LYS 411 Cb 0.00 -1.31 -0.03 0.00 -0.02 0.00 0.00 35.03 33.67 2i2x n LYS 411 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2i2x s LEU 412 N -2.11 4.05 -0.77 -0.35 2.96 -0.34 -4.93 118.68 117.19 2i2x s LEU 412 Ca 0.14 1.78 -0.14 0.00 -0.22 0.00 0.00 54.13 55.69 2i2x s LEU 412 Cb 0.14 -3.53 0.20 0.00 0.50 0.00 0.00 46.19 43.50 2i2x s LEU 412 CO 0.43 -1.10 0.71 -0.70 -1.32 0.00 0.00 176.35 174.38 2i2x s GLU 413 N 4.33 3.48 0.20 1.98 2.12 -1.26 -4.07 118.70 125.47 2i2x s GLU 413 Ca 0.69 -2.33 -0.14 0.00 0.36 0.00 0.00 54.97 53.55 2i2x s GLU 413 Cb -0.26 -4.39 -0.07 0.00 0.26 0.00 0.00 34.13 29.66 2i2x s GLU 413 CO 0.27 -1.30 0.60 -0.51 -0.54 0.00 0.00 175.26 173.78 2i2x s LEU 414 N 0.42 4.26 0.84 2.70 1.43 -1.26 -5.05 118.68 122.01 2i2x s LEU 414 Ca 0.15 1.11 -0.11 0.00 -1.03 0.00 0.00 54.13 54.25 2i2x s LEU 414 Cb -0.14 -3.52 0.09 0.00 0.03 0.00 0.00 46.19 42.65 2i2x s LEU 414 CO -0.07 0.01 1.09 -0.94 0.23 0.00 0.00 176.35 176.67 2i2x s SER 415 N -1.94 4.01 0.38 2.29 1.04 -1.26 -4.85 113.70 113.36 2i2x s SER 415 Ca 0.43 1.59 0.06 0.00 0.48 0.00 0.00 55.95 58.51 2i2x s SER 415 Cb -0.14 -2.29 0.77 0.00 0.10 0.00 0.00 66.02 64.46 2i2x s SER 415 CO 0.20 -2.32 2.02 0.03 0.98 0.00 0.00 173.24 174.15 2i2x h ARG 416 N -1.33 0.67 -0.18 4.02 3.08 -1.99 -1.04 114.38 117.62 2i2x h ARG 416 Ca -0.47 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 59.52 2i2x h ARG 416 Cb 1.26 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 31.15 2i2x h ARG 416 CO 0.54 0.45 0.04 0.35 -1.07 0.00 0.00 179.97 180.28 2i2x h PHE 417 N 0.69 0.31 -0.66 3.04 3.04 -1.99 -1.75 116.94 119.63 2i2x h PHE 417 Ca 0.22 -0.04 -0.06 0.00 3.98 0.00 0.00 57.97 62.08 2i2x h PHE 417 Cb 0.04 -0.09 -0.03 0.00 2.56 0.00 0.00 35.95 38.43 2i2x h PHE 417 CO -0.00 0.43 0.18 0.93 -2.02 0.00 0.00 178.31 177.84 2i2x h GLU 418 N 0.10 1.02 -0.71 1.11 5.08 -1.81 -0.33 114.58 119.06 2i2x h GLU 418 Ca 0.06 -0.22 -0.01 0.00 -1.00 0.00 0.00 59.36 58.19 2i2x h GLU 418 Cb 0.28 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.35 2i2x h GLU 418 CO 0.00 0.89 0.42 1.15 -1.00 0.00 0.00 179.01 180.47 2i2x h THR 419 N 0.98 1.21 0.03 1.13 2.02 -1.06 -1.70 112.91 115.52 2i2x h THR 419 Ca 0.21 -0.47 -0.00 0.00 0.77 0.00 0.00 66.41 66.92 2i2x h THR 419 Cb 0.31 0.24 0.00 0.00 -1.74 0.00 0.00 68.15 66.96 2i2x h THR 419 CO -0.00 0.22 -0.01 0.50 0.37 0.00 0.00 175.52 176.59 2i2x h LYS 420 N 0.96 -0.03 -0.98 6.66 1.63 -0.96 -1.59 116.57 122.26 2i2x h LYS 420 Ca 0.25 0.00 0.18 0.00 -0.85 0.00 0.00 60.65 60.23 2i2x h LYS 420 Cb -0.01 0.01 -0.09 0.00 -0.60 0.00 0.00 32.23 31.53 2i2x h LYS 420 CO -0.05 0.54 0.61 0.00 -3.45 0.00 0.00 179.45 177.11 2i2x h ALA 421 N 0.30 1.76 -0.14 5.00 0.00 -1.03 0.27 119.26 125.40 2i2x h ALA 421 Ca -0.00 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 2i2x h ALA 421 Cb 0.59 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 2i2x h ALA 421 CO 0.01 -0.08 -0.05 1.25 0.00 0.00 0.00 179.25 180.37 2i2x h LEU 422 N 0.74 0.30 -0.57 0.00 5.85 -1.24 -1.25 115.31 119.14 2i2x h LEU 422 Ca 0.54 -0.39 0.01 0.00 0.84 0.00 0.00 57.88 58.87 2i2x h LEU 422 Cb 0.87 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.79 2i2x h LEU 422 CO -0.31 0.62 0.37 0.00 -0.34 0.00 0.00 178.44 178.78 2i2x h ALA 423 N 0.69 0.72 -0.64 1.25 0.00 -0.68 0.29 119.26 120.87 2i2x h ALA 423 Ca 0.03 -0.04 0.08 0.00 0.00 0.00 0.00 54.91 54.98 2i2x h ALA 423 Cb 0.50 -0.23 -0.06 0.00 0.00 0.00 0.00 17.79 18.00 2i2x h ALA 423 CO 0.02 0.15 0.32 -0.44 0.00 0.00 0.00 179.25 179.30 2i2x h ASP 424 N 0.77 0.42 -0.36 0.00 3.32 -0.93 -1.23 116.42 118.40 2i2x h ASP 424 Ca 0.21 0.05 -0.14 0.00 0.02 0.00 0.00 57.03 57.16 2i2x h ASP 424 Cb -0.09 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 2i2x h ASP 424 CO -0.05 0.26 -0.34 0.00 -1.72 0.00 0.00 179.24 177.39 2i2x h ALA 425 N 1.38 0.52 -0.21 3.45 0.00 -0.63 -0.67 119.26 123.10 2i2x h ALA 425 Ca 0.31 -0.43 0.02 0.00 0.00 0.00 0.00 54.91 54.80 2i2x h ALA 425 Cb 0.28 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2i2x h ALA 425 CO -0.23 0.59 0.08 -0.22 0.00 0.00 0.00 179.25 179.46 2i2x h LYS 426 N 0.66 0.17 -0.45 0.00 3.64 -0.78 -0.46 116.57 119.35 2i2x h LYS 426 Ca 0.06 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.45 2i2x h LYS 426 Cb 0.93 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.68 2i2x h LYS 426 CO 0.09 0.12 0.27 0.00 -2.27 0.00 0.00 179.45 177.65 2i2x h ALA 427 N 1.12 0.57 -0.98 5.00 0.00 -1.10 0.59 119.26 124.47 2i2x h ALA 427 Ca 0.09 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.06 2i2x h ALA 427 Cb 0.05 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 17.64 2i2x h ALA 427 CO -0.09 -0.04 0.63 0.00 0.00 0.00 0.00 179.25 179.75 2i2x h ALA 428 N 1.20 1.38 -0.08 0.00 0.00 -0.85 -2.50 119.26 118.40 2i2x h ALA 428 Ca 0.18 -0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.87 2i2x h ALA 428 Cb 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.52 2i2x h ALA 428 CO -0.08 0.38 -0.77 -0.07 0.00 0.00 0.00 179.25 178.71 2i2x h LEU 429 N 1.11 0.60 -1.24 0.00 3.38 -0.16 -3.27 115.31 115.73 2i2x h LEU 429 Ca 0.43 -0.41 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 2i2x h LEU 429 Cb 0.22 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 2i2x h LEU 429 CO -0.19 1.17 -0.31 -0.33 0.09 0.00 0.00 178.44 178.87 2i2x h GLU 430 N 0.33 0.00 0.00 1.13 5.08 -0.62 -2.80 114.58 117.70 2i2x h GLU 430 Ca -0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2i2x h GLU 430 Cb 1.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.62 2i2x h GLU 430 CO 0.14 0.31 0.00 0.00 -1.00 0.00 0.00 179.01 178.46 2i2x n ALA 431 N -2.33 2.02 -1.80 3.43 0.00 -0.97 -4.84 120.51 116.02 2i2x n ALA 431 Ca -0.01 -0.05 -0.35 0.00 0.00 0.00 0.00 53.44 53.04 2i2x n ALA 431 Cb 0.42 -1.39 -0.06 0.00 0.00 0.00 0.00 19.45 18.43 2i2x n ALA 431 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2i2x s LEU 432 N -3.44 4.04 0.29 0.00 1.43 -1.06 -4.99 118.68 114.95 2i2x s LEU 432 Ca 0.10 1.83 -0.29 0.00 -1.03 0.00 0.00 54.13 54.74 2i2x s LEU 432 Cb 0.14 -4.37 -0.10 0.00 0.03 0.00 0.00 46.19 41.89 2i2x s LEU 432 CO 0.44 -0.40 1.30 -2.16 0.23 0.00 0.00 176.35 175.76 2i2x s PRO 433 N -2.83 4.38 0.47 1.29 0.04 -1.26 -4.91 135.00 132.19 2i2x s PRO 433 Ca 0.60 2.15 0.18 0.00 0.04 0.00 0.00 61.00 63.97 2i2x s PRO 433 Cb -0.15 -3.11 1.17 0.00 0.04 0.00 0.00 34.50 32.45 2i2x s PRO 433 CO 0.19 -0.19 2.00 -0.44 0.04 0.00 0.00 177.00 178.60 2i2x h ASP 434 N 4.00 0.22 -2.65 6.66 5.19 -1.95 -3.44 116.42 124.46 2i2x h ASP 434 Ca -0.48 0.01 -0.55 0.00 -0.62 0.00 0.00 57.03 55.39 2i2x h ASP 434 Cb 1.22 -0.04 -0.01 0.00 0.18 0.00 0.00 39.33 40.69 2i2x h ASP 434 CO 0.69 0.13 1.05 -0.62 -3.12 0.00 0.00 179.24 177.38 2i2x s ASP 435 N -6.30 6.68 0.11 6.45 2.15 -1.26 -4.76 116.67 119.74 2i2x s ASP 435 Ca -0.07 2.24 -0.20 0.00 0.43 0.00 0.00 52.55 54.95 2i2x s ASP 435 Cb 0.19 -2.54 -0.09 0.00 -0.30 0.00 0.00 42.92 40.19 2i2x s ASP 435 CO 0.74 -0.90 1.75 -0.03 -0.17 0.00 0.00 175.17 176.56 2i2x h MET 436 N 9.24 0.21 -0.58 4.34 1.85 -1.99 -2.98 114.93 125.01 2i2x h MET 436 Ca -0.39 -0.02 0.03 0.00 -0.61 0.00 0.00 59.70 58.71 2i2x h MET 436 Cb 1.18 -0.05 -0.04 0.00 0.43 0.00 0.00 31.60 33.12 2i2x h MET 436 CO 0.95 0.16 0.35 -0.44 -0.40 0.00 0.00 176.91 177.53 2i2x h ASP 437 N 0.20 0.58 0.00 1.39 3.32 -1.98 0.83 116.42 120.76 2i2x h ASP 437 Ca 0.06 0.00 0.03 0.00 0.02 0.00 0.00 57.03 57.14 2i2x h ASP 437 Cb -0.00 -0.12 -0.05 0.00 0.22 0.00 0.00 39.33 39.38 2i2x h ASP 437 CO -0.01 0.40 -0.28 0.50 -1.72 0.00 0.00 179.24 178.13 2i2x h LYS 438 N 0.70 -0.41 0.18 3.56 3.11 -1.97 -0.61 116.57 121.14 2i2x h LYS 438 Ca 0.23 0.03 -0.01 0.00 -2.81 0.00 0.00 60.65 58.09 2i2x h LYS 438 Cb 0.02 0.09 0.00 0.00 -1.00 0.00 0.00 32.23 31.34 2i2x h LYS 438 CO -0.10 -0.27 -0.09 0.35 -2.81 0.00 0.00 179.45 176.53 2i2x h PHE 439 N -0.43 -0.23 -0.78 1.91 3.57 -1.27 -0.90 116.94 118.81 2i2x h PHE 439 Ca 0.06 -0.01 0.13 0.00 3.53 0.00 0.00 57.97 61.68 2i2x h PHE 439 Cb 0.51 0.08 -0.09 0.00 2.79 0.00 0.00 35.95 39.24 2i2x h PHE 439 CO -0.31 -0.08 0.38 0.52 -2.23 0.00 0.00 178.31 176.59 2i2x h MET 440 N -0.32 0.57 -0.06 1.11 2.86 -0.74 -0.51 114.93 117.84 2i2x h MET 440 Ca -0.03 -0.03 -0.23 0.00 -2.06 0.00 0.00 59.70 57.35 2i2x h MET 440 Cb 0.25 -0.13 0.01 0.00 0.06 0.00 0.00 31.60 31.79 2i2x h MET 440 CO 0.04 0.38 -0.89 0.22 1.06 0.00 0.00 176.91 177.72 2i2x h ASP 441 N 0.59 0.78 -0.30 1.22 3.58 -0.90 -1.48 116.42 119.91 2i2x h ASP 441 Ca 0.41 -0.57 0.01 0.00 0.42 0.00 0.00 57.03 57.31 2i2x h ASP 441 Cb 0.54 -0.24 -0.02 0.00 1.72 0.00 0.00 39.33 41.33 2i2x h ASP 441 CO -0.33 1.36 0.17 0.44 -2.88 0.00 0.00 179.24 178.00 2i2x h ASP 442 N 0.39 0.26 -0.42 2.28 5.19 -0.79 -2.89 116.42 120.44 2i2x h ASP 442 Ca -0.08 0.01 -0.15 0.00 -0.62 0.00 0.00 57.03 56.19 2i2x h ASP 442 Cb 1.52 -0.05 -0.01 0.00 0.18 0.00 0.00 39.33 40.97 2i2x h ASP 442 CO 0.17 0.19 -0.30 0.00 -3.12 0.00 0.00 179.24 176.19 2i2x h LEU 444 N 0.81 -0.36 -0.17 0.00 6.46 -1.26 0.24 115.31 121.02 2i2x h LEU 444 Ca 0.09 0.12 -0.23 0.00 -0.12 0.00 0.00 57.88 57.74 2i2x h LEU 444 Cb 0.88 0.24 0.01 0.00 -0.73 0.00 0.00 40.66 41.06 2i2x h LEU 444 CO 0.08 -0.13 -0.90 0.71 -0.62 0.00 0.00 178.44 177.58 2i2x h THR 445 N 0.00 1.34 -0.11 1.05 1.35 -1.47 -1.75 112.91 113.33 2i2x h THR 445 Ca 0.19 -2.26 -0.00 0.00 -0.55 0.00 0.00 66.41 63.79 2i2x h THR 445 Cb 0.29 2.28 -0.01 0.00 -1.73 0.00 0.00 68.15 68.99 2i2x h THR 445 CO -0.41 0.69 0.06 0.50 -0.25 0.00 0.00 175.52 176.11 2i2x h LYS 446 N 0.33 0.15 0.00 4.72 3.64 -1.01 -1.71 116.57 122.69 2i2x h LYS 446 Ca -0.08 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.22 2i2x h LYS 446 Cb 1.53 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 33.31 2i2x h LYS 446 CO 0.17 0.16 -0.46 1.88 -2.27 0.00 0.00 179.45 178.93 2i2x h TYR 447 N 0.09 0.00 -0.62 1.91 0.05 -0.59 0.16 116.97 117.97 2i2x h TYR 447 Ca 0.04 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.81 2i2x h TYR 447 Cb 0.06 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 37.77 2i2x h TYR 447 CO -0.05 0.29 0.36 -0.22 -1.05 0.00 0.00 178.16 177.50 2i2x h LYS 448 N 0.00 0.86 -0.12 4.88 3.64 -1.28 -0.38 116.57 124.16 2i2x h LYS 448 Ca -0.02 -0.09 -0.06 0.00 -1.27 0.00 0.00 60.65 59.21 2i2x h LYS 448 Cb 1.24 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 32.88 2i2x h LYS 448 CO 0.04 0.63 -0.16 1.03 -2.27 0.00 0.00 179.45 178.72 2i2x h SER 449 N 0.85 0.35 1.29 4.20 0.87 -1.03 -3.37 113.55 116.71 2i2x h SER 449 Ca 0.22 -0.51 -0.07 0.00 -1.23 0.00 0.00 61.79 60.20 2i2x h SER 449 Cb 0.01 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 61.86 2i2x h SER 449 CO -0.04 0.79 -0.74 -0.33 -0.53 0.00 0.00 176.83 175.98 2i2x h GLU 450 N -0.08 0.00 -3.76 2.24 5.08 -0.58 -3.43 114.58 114.05 2i2x h GLU 450 Ca 0.01 0.00 -0.61 0.00 -1.00 0.00 0.00 59.36 57.76 2i2x h GLU 450 Cb 0.71 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 29.56 2i2x h GLU 450 CO 0.04 0.22 -0.74 0.08 -1.00 0.00 0.00 179.01 177.61 2i2x s VAL 451 N -3.10 1.46 0.46 3.13 1.01 -0.16 -5.01 120.40 118.18 2i2x s VAL 451 Ca 0.02 -1.98 0.16 0.00 0.00 0.00 0.00 61.98 60.18 2i2x s VAL 451 Cb 0.08 -2.07 0.33 0.00 0.00 0.00 0.00 36.38 34.72 2i2x s VAL 451 CO 0.76 -0.70 2.00 0.11 0.00 0.00 0.00 175.10 177.27 2i2x h LYS 452 N 7.62 0.29 0.00 2.72 1.79 -1.82 -1.19 116.57 125.98 2i2x h LYS 452 Ca -0.08 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.37 2i2x h LYS 452 Cb 0.99 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.58 2i2x h LYS 452 CO 0.50 0.19 0.00 1.33 -1.08 0.00 0.00 179.45 180.39 2i2x n VAL 453 N -4.46 0.47 -1.64 0.50 0.24 -1.26 -4.80 118.33 107.38 2i2x n VAL 453 Ca 0.08 -0.22 -0.43 0.00 -2.04 0.00 0.00 64.34 61.73 2i2x n VAL 453 Cb 0.38 -0.57 -0.03 0.00 -1.47 0.00 0.00 33.84 32.14 2i2x n VAL 453 CO 0.00 0.00 0.00 0.33 -2.14 0.00 0.00 176.83 175.02 2i2x n PHE 454 N -2.10 2.34 -3.96 6.34 7.35 -0.45 -4.69 117.46 122.29 2i2x n PHE 454 Ca 0.06 -0.25 -0.30 0.00 -0.76 0.00 0.00 57.45 56.19 2i2x n PHE 454 Cb 0.41 -2.76 -0.14 0.00 0.35 0.00 0.00 39.48 37.33 2i2x n PHE 454 CO 0.00 0.00 0.00 0.15 -0.76 0.00 0.00 176.76 176.15 2i2x s LYS 455 N 4.90 1.66 0.46 -4.13 -0.14 -1.26 -4.92 119.74 116.30 2i2x s LYS 455 Ca 0.93 -2.19 0.23 0.00 -1.36 0.00 0.00 55.97 53.58 2i2x s LYS 455 Cb -0.46 -3.15 1.23 0.00 -1.68 0.00 0.00 37.83 33.77 2i2x s LYS 455 CO 0.42 -1.03 1.84 -1.35 -0.76 0.00 0.00 175.35 174.47 2i2x h PRO 456 N 7.07 0.26 0.00 -1.68 0.11 -1.96 0.84 132.00 136.64 2i2x h PRO 456 Ca -0.06 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.03 2i2x h PRO 456 Cb 0.96 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.01 2i2x h PRO 456 CO 0.59 0.17 0.00 1.05 -0.21 0.00 0.00 178.00 179.60 2i2x h GLU 457 N 0.26 0.00 0.00 1.05 9.09 -1.94 -0.67 114.58 122.38 2i2x h GLU 457 Ca 0.49 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.90 2i2x h GLU 457 Cb 1.47 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.57 2i2x h GLU 457 CO -0.14 0.00 0.00 -0.91 0.05 0.00 0.00 179.01 178.01 2i2x h ASN 458 N 0.00 0.00 0.00 3.06 2.35 -1.22 -2.85 115.58 116.92 2i2x h ASN 458 Ca 0.00 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2i2x h ASN 458 Cb 0.02 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.39 2i2x h ASN 458 CO 0.00 0.00 -0.17 -1.22 -1.65 0.00 0.00 177.43 174.39 2i2x n TYR 459 N -3.00 0.00 -3.20 1.19 4.01 -0.30 -4.64 117.16 111.22 2i2x n TYR 459 Ca -0.01 -1.10 -0.19 0.00 -0.16 0.00 0.00 57.90 56.43 2i2x n TYR 459 Cb 0.16 -0.17 0.05 0.00 -0.31 0.00 0.00 39.34 39.06 2i2x n TYR 459 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2i2x n GLY 460 N -1.27 -0.31 0.64 2.72 0.00 -1.07 -5.01 105.19 100.89 2i2x n GLY 460 Ca 0.16 0.05 0.08 0.00 0.00 0.00 0.00 46.02 46.31 2i2x n GLY 460 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01