#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ur2 n GLY 26 N 0.00 -1.15 0.23 3.38 0.00 -1.25 -4.80 105.19 101.59 1ur2 n GLY 26 Ca 0.00 -1.75 -0.02 0.00 0.00 0.00 0.00 46.02 44.24 1ur2 n GLY 26 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1ur2 h LEU 27 N 0.00 0.37 -1.73 0.99 3.38 -1.77 -1.59 115.31 114.96 1ur2 h LEU 27 Ca -0.37 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.63 1ur2 h LEU 27 Cb 1.05 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.77 1ur2 h LEU 27 CO 0.27 0.24 -0.01 0.07 0.09 0.00 0.00 178.44 179.11 1ur2 h LYS 28 N 0.51 0.16 0.03 1.13 5.09 -1.17 -1.39 116.57 120.93 1ur2 h LYS 28 Ca 0.27 -0.02 -0.14 0.00 0.09 0.00 0.00 60.65 60.84 1ur2 h LYS 28 Cb 0.22 -0.03 0.01 0.00 0.10 0.00 0.00 32.23 32.53 1ur2 h LYS 28 CO -0.21 0.18 -0.57 0.77 -2.09 0.00 0.00 179.45 177.54 1ur2 h SER 29 N 0.16 0.46 -0.87 7.07 0.02 -1.68 -2.60 113.55 116.10 1ur2 h SER 29 Ca 0.04 -0.81 0.10 0.00 -0.84 0.00 0.00 61.79 60.28 1ur2 h SER 29 Cb 0.12 -0.14 -0.06 0.00 0.14 0.00 0.00 62.40 62.46 1ur2 h SER 29 CO 0.00 1.21 0.56 0.00 -1.14 0.00 0.00 176.83 177.46 1ur2 h ALA 30 N 0.26 1.67 -0.62 3.77 0.00 -0.85 -2.38 119.26 121.11 1ur2 h ALA 30 Ca -0.08 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1ur2 h ALA 30 Cb 1.32 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1ur2 h ALA 30 CO 0.11 0.15 0.00 0.66 0.00 0.00 0.00 179.25 180.17 1ur2 n TYR 31 N -4.52 1.34 -0.30 0.00 4.02 -0.56 -4.67 117.16 112.46 1ur2 n TYR 31 Ca 0.15 -0.61 0.06 0.00 -0.01 0.00 0.00 57.90 57.49 1ur2 n TYR 31 Cb 0.32 -0.21 0.21 0.00 -0.02 0.00 0.00 39.34 39.63 1ur2 n TYR 31 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 176.86 175.63 1ur2 h LYS 32 N 3.86 0.68 -0.00 -0.72 3.64 -1.01 0.24 116.57 123.25 1ur2 h LYS 32 Ca 0.00 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1ur2 h LYS 32 Cb 1.36 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 1ur2 h LYS 32 CO 0.19 0.45 -0.02 -3.47 -2.27 0.00 0.00 179.45 174.33 1ur2 n ASP 33 N -4.82 0.16 -0.05 4.20 2.03 -1.26 -4.21 116.55 112.60 1ur2 n ASP 33 Ca 0.16 -0.69 -0.07 0.00 0.52 0.00 0.00 54.79 54.71 1ur2 n ASP 33 Cb 0.38 -0.10 -0.02 0.00 -0.72 0.00 0.00 41.12 40.65 1ur2 n ASP 33 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1ur2 n ASN 34 N -1.01 1.68 -3.59 1.67 5.03 0.00 -5.04 115.26 114.00 1ur2 n ASN 34 Ca 0.19 0.27 -0.05 0.00 0.87 0.00 0.00 54.58 55.86 1ur2 n ASN 34 Cb 0.19 -0.62 -0.02 0.00 -1.02 0.00 0.00 39.78 38.32 1ur2 n ASN 34 CO 0.00 0.00 0.00 0.72 -1.83 0.00 0.00 177.26 176.15 1ur2 s PHE 35 N -2.63 -0.21 0.61 3.10 -0.12 -0.79 -4.78 117.98 113.17 1ur2 s PHE 35 Ca -0.20 0.07 -0.19 0.00 -0.05 0.00 0.00 56.93 56.55 1ur2 s PHE 35 Cb 0.03 0.55 -0.02 0.00 -0.63 0.00 0.00 43.02 42.95 1ur2 s PHE 35 CO 0.30 -0.48 1.28 -0.51 -0.05 0.00 0.00 175.22 175.76 1ur2 s LEU 36 N -2.56 3.65 -0.19 -1.99 1.43 -0.62 -4.52 118.68 113.88 1ur2 s LEU 36 Ca 0.09 2.59 0.00 0.00 -1.03 0.00 0.00 54.13 55.78 1ur2 s LEU 36 Cb -0.00 -4.55 0.02 0.00 0.03 0.00 0.00 46.19 41.68 1ur2 s LEU 36 CO -0.05 -1.82 -0.17 -0.63 0.23 0.00 0.00 176.35 173.91 1ur2 s ILE 37 N -1.42 2.29 0.32 -0.59 -1.09 -1.26 -1.08 121.20 118.37 1ur2 s ILE 37 Ca 0.79 -0.89 0.08 0.00 -2.23 0.00 0.00 60.65 58.41 1ur2 s ILE 37 Cb -0.36 -1.99 -0.06 0.00 -1.58 0.00 0.00 42.46 38.46 1ur2 s ILE 37 CO 0.39 0.50 -0.07 -0.83 -1.23 0.00 0.00 174.94 173.70 1ur2 s GLY 38 N 1.32 2.05 -0.02 6.18 0.00 -0.31 -0.73 107.32 115.81 1ur2 s GLY 38 Ca 0.05 -2.02 -0.03 0.00 0.00 0.00 0.00 44.72 42.71 1ur2 s GLY 38 CO -0.11 -1.95 0.07 0.00 0.00 0.00 0.00 173.10 171.11 1ur2 s ALA 39 N -2.80 -0.17 0.02 3.20 0.00 -0.58 -1.30 121.76 120.13 1ur2 s ALA 39 Ca 0.31 0.01 -0.30 0.00 0.00 0.00 0.00 51.96 51.98 1ur2 s ALA 39 Cb 0.03 -0.04 -0.04 0.00 0.00 0.00 0.00 23.12 23.08 1ur2 s ALA 39 CO 0.15 -0.10 1.15 0.00 0.00 0.00 0.00 175.76 176.96 1ur2 s ALA 40 N -0.52 3.36 -0.17 0.00 0.00 -0.35 -2.15 121.76 121.94 1ur2 s ALA 40 Ca -0.06 0.72 -0.01 0.00 0.00 0.00 0.00 51.96 52.60 1ur2 s ALA 40 Cb -0.04 -3.44 -0.01 0.00 0.00 0.00 0.00 23.12 19.64 1ur2 s ALA 40 CO 0.00 -0.47 -0.11 -0.51 0.00 0.00 0.00 175.76 174.67 1ur2 s LEU 41 N 1.34 2.71 1.04 0.00 1.43 -0.08 -3.56 118.68 121.55 1ur2 s LEU 41 Ca 0.56 -0.39 -0.16 0.00 -1.03 0.00 0.00 54.13 53.11 1ur2 s LEU 41 Cb -0.26 -1.64 0.21 0.00 0.03 0.00 0.00 46.19 44.53 1ur2 s LEU 41 CO 0.27 0.08 1.19 0.54 0.23 0.00 0.00 176.35 178.66 1ur2 s ASN 42 N 0.87 2.42 0.30 2.29 2.20 -1.26 -1.70 114.94 120.05 1ur2 s ASN 42 Ca -0.03 0.61 0.04 0.00 -0.94 0.00 0.00 52.86 52.54 1ur2 s ASN 42 Cb -0.15 -0.88 0.48 0.00 -2.00 0.00 0.00 41.25 38.70 1ur2 s ASN 42 CO 0.00 -3.19 1.76 0.00 -2.94 0.00 0.00 177.10 172.73 1ur2 h ALA 43 N -1.95 1.18 -0.22 3.54 0.00 -1.98 -1.39 119.26 118.45 1ur2 h ALA 43 Ca -0.46 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.11 1ur2 h ALA 43 Cb 1.29 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1ur2 h ALA 43 CO 0.44 0.53 0.09 1.15 0.00 0.00 0.00 179.25 181.45 1ur2 h THR 44 N 0.38 1.16 -0.24 0.00 2.02 -2.01 -2.65 112.91 111.57 1ur2 h THR 44 Ca 0.06 -0.48 -0.04 0.00 0.77 0.00 0.00 66.41 66.72 1ur2 h THR 44 Cb 0.62 1.08 -0.01 0.00 -1.74 0.00 0.00 68.15 68.10 1ur2 h THR 44 CO 0.04 0.16 0.00 0.40 0.37 0.00 0.00 175.52 176.50 1ur2 h ILE 45 N 0.20 1.25 0.00 3.11 2.04 -1.88 -3.04 117.51 119.20 1ur2 h ILE 45 Ca 0.07 -0.88 0.00 0.00 1.00 0.00 0.00 64.86 65.05 1ur2 h ILE 45 Cb 0.17 1.37 0.00 0.00 -0.74 0.00 0.00 36.82 37.61 1ur2 h ILE 45 CO -0.01 0.28 0.00 0.00 0.00 0.00 0.00 178.15 178.42 1ur2 n ALA 46 N -2.34 1.63 0.29 1.87 0.00 -0.54 -2.03 120.51 119.39 1ur2 n ALA 46 Ca -0.04 -0.04 0.16 0.00 0.00 0.00 0.00 53.44 53.53 1ur2 n ALA 46 Cb 0.24 -1.23 0.86 0.00 0.00 0.00 0.00 19.45 19.31 1ur2 n ALA 46 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1ur2 h SER 47 N 0.00 0.00 0.00 0.00 4.64 -1.35 -3.40 113.55 113.45 1ur2 h SER 47 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ur2 h SER 47 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 1ur2 h SER 47 CO 0.00 0.06 0.00 0.61 -0.87 0.00 0.00 176.83 176.63 1ur2 n GLY 48 N -0.68 0.66 0.25 -0.77 0.00 -0.86 -4.92 105.19 98.86 1ur2 n GLY 48 Ca -0.02 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.15 1ur2 n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ur2 h ALA 49 N 0.00 1.00 -2.45 4.61 0.00 -1.81 -3.41 119.26 117.20 1ur2 h ALA 49 Ca 0.00 0.00 -0.77 0.00 0.00 0.00 0.00 54.91 54.14 1ur2 h ALA 49 Cb 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 17.79 17.54 1ur2 h ALA 49 CO 0.00 0.00 -0.07 0.34 0.00 0.00 0.00 179.25 179.52 1ur2 s ASP 50 N -5.94 6.47 0.32 0.00 -1.08 -1.26 -4.92 116.67 110.25 1ur2 s ASP 50 Ca 0.04 -2.23 0.01 0.00 -0.52 0.00 0.00 52.55 49.86 1ur2 s ASP 50 Cb 0.07 -2.21 0.56 0.00 -1.46 0.00 0.00 42.92 39.88 1ur2 s ASP 50 CO 0.61 -0.72 1.97 1.05 0.52 0.00 0.00 175.17 178.59 1ur2 h GLU 51 N 8.35 0.94 -0.35 4.34 -0.00 -1.99 0.38 114.58 126.25 1ur2 h GLU 51 Ca -0.10 -0.06 -0.02 0.00 -0.00 0.00 0.00 59.36 59.18 1ur2 h GLU 51 Cb 1.07 -0.21 -0.02 0.00 -0.00 0.00 0.00 28.75 29.59 1ur2 h GLU 51 CO 0.90 0.62 0.13 0.00 -0.00 0.00 0.00 179.01 180.67 1ur2 h ARG 52 N 0.97 0.54 -0.44 1.06 3.08 -1.98 -0.47 114.38 117.14 1ur2 h ARG 52 Ca 0.30 -0.10 -0.13 0.00 0.07 0.00 0.00 59.98 60.12 1ur2 h ARG 52 Cb 0.01 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 1ur2 h ARG 52 CO -0.08 0.54 -0.24 -0.07 -1.07 0.00 0.00 179.97 179.04 1ur2 h LEU 53 N 0.42 0.95 -0.69 3.04 3.38 -1.87 -1.18 115.31 119.36 1ur2 h LEU 53 Ca 0.12 -0.37 0.08 0.00 0.09 0.00 0.00 57.88 57.80 1ur2 h LEU 53 Cb 0.21 -0.26 -0.07 0.00 0.09 0.00 0.00 40.66 40.63 1ur2 h LEU 53 CO -0.01 1.14 0.36 0.78 0.09 0.00 0.00 178.44 180.80 1ur2 h ASN 54 N 0.79 0.49 -0.16 -0.43 2.35 -0.58 0.25 115.58 118.29 1ur2 h ASN 54 Ca 0.10 0.05 -0.03 0.00 -0.55 0.00 0.00 56.30 55.87 1ur2 h ASN 54 Cb 0.80 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 39.13 1ur2 h ASN 54 CO 0.07 0.29 -0.02 0.74 -1.65 0.00 0.00 177.43 176.86 1ur2 h THR 55 N 0.63 1.27 -0.11 2.81 2.02 -0.86 -2.16 112.91 116.51 1ur2 h THR 55 Ca 0.33 -0.92 0.00 0.00 0.77 0.00 0.00 66.41 66.59 1ur2 h THR 55 Cb 0.30 1.55 -0.01 0.00 -1.74 0.00 0.00 68.15 68.26 1ur2 h THR 55 CO -0.24 0.27 0.07 0.25 0.37 0.00 0.00 175.52 176.24 1ur2 h LEU 56 N 0.03 0.13 -0.32 2.58 6.46 -0.81 -2.19 115.31 121.18 1ur2 h LEU 56 Ca 0.04 -0.03 -0.01 0.00 -0.12 0.00 0.00 57.88 57.77 1ur2 h LEU 56 Cb 0.42 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 40.31 1ur2 h LEU 56 CO 0.01 0.11 0.17 0.40 -0.62 0.00 0.00 178.44 178.51 1ur2 h ILE 57 N 0.13 1.14 -0.45 4.05 2.04 -0.47 -0.03 117.51 123.92 1ur2 h ILE 57 Ca 0.04 -0.38 -0.02 0.00 1.00 0.00 0.00 64.86 65.50 1ur2 h ILE 57 Cb 0.01 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 36.87 1ur2 h ILE 57 CO -0.01 0.14 0.21 0.00 0.00 0.00 0.00 178.15 178.50 1ur2 h ALA 58 N 1.03 1.52 -0.29 1.87 0.00 -1.35 -0.20 119.26 121.84 1ur2 h ALA 58 Ca 0.11 -0.10 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 1ur2 h ALA 58 Cb 0.08 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1ur2 h ALA 58 CO -0.02 0.38 -0.19 -0.22 0.00 0.00 0.00 179.25 179.20 1ur2 h LYS 59 N 0.63 0.64 0.01 0.00 3.64 -0.84 -3.40 116.57 117.26 1ur2 h LYS 59 Ca 0.16 -0.30 -0.36 0.00 -1.27 0.00 0.00 60.65 58.88 1ur2 h LYS 59 Cb 0.08 -0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 31.83 1ur2 h LYS 59 CO -0.02 0.89 -2.26 0.39 -2.27 0.00 0.00 179.45 176.18 1ur2 n GLU 60 N -4.36 0.68 -5.02 1.90 -0.58 -0.07 -3.92 120.64 109.27 1ur2 n GLU 60 Ca -0.04 0.09 -0.30 0.00 -0.42 0.00 0.00 57.16 56.50 1ur2 n GLU 60 Cb 0.41 -1.58 -0.15 0.00 -0.57 0.00 0.00 31.44 29.54 1ur2 n GLU 60 CO 0.00 0.00 0.00 -0.06 -0.48 0.00 0.00 177.13 176.59 1ur2 s PHE 61 N -2.52 2.23 -0.02 -0.32 0.08 -0.12 -0.76 117.98 116.55 1ur2 s PHE 61 Ca -0.15 -0.41 0.03 0.00 0.12 0.00 0.00 56.93 56.52 1ur2 s PHE 61 Cb 0.07 -1.38 0.04 0.00 -0.57 0.00 0.00 43.02 41.18 1ur2 s PHE 61 CO 0.78 0.06 1.02 0.27 -0.10 0.00 0.00 175.22 177.25 1ur2 n ASN 62 N 2.06 2.05 -3.91 1.36 0.23 0.09 -4.61 115.26 112.54 1ur2 n ASN 62 Ca -0.16 -2.16 -0.10 0.00 -0.53 0.00 0.00 54.58 51.62 1ur2 n ASN 62 Cb 0.52 -0.06 -0.11 0.00 -2.08 0.00 0.00 39.78 38.04 1ur2 n ASN 62 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 1ur2 s SER 63 N -1.27 0.10 0.04 0.53 0.15 -1.09 -1.46 113.70 110.70 1ur2 s SER 63 Ca 0.05 -0.26 -0.00 0.00 0.70 0.00 0.00 55.95 56.43 1ur2 s SER 63 Cb 0.04 0.15 -0.03 0.00 -1.71 0.00 0.00 66.02 64.47 1ur2 s SER 63 CO 0.00 -0.27 -0.04 0.27 1.20 0.00 0.00 173.24 174.41 1ur2 s ILE 64 N -1.12 0.24 -0.02 6.45 -4.36 0.06 -1.52 121.20 120.93 1ur2 s ILE 64 Ca -0.12 -1.46 0.02 0.00 -0.26 0.00 0.00 60.65 58.83 1ur2 s ILE 64 Cb -0.07 -1.03 0.01 0.00 1.25 0.00 0.00 42.46 42.61 1ur2 s ILE 64 CO 0.00 -0.78 -0.05 -0.89 0.24 0.00 0.00 174.94 173.46 1ur2 s THR 65 N -2.88 0.49 -0.00 8.37 2.01 -0.91 -1.46 115.64 121.26 1ur2 s THR 65 Ca -0.02 -0.21 -0.30 0.00 0.31 0.00 0.00 61.69 61.47 1ur2 s THR 65 Cb 0.00 -0.46 -0.04 0.00 0.01 0.00 0.00 72.50 72.01 1ur2 s THR 65 CO -0.06 0.17 1.21 -2.16 -0.69 0.00 0.00 174.62 173.09 1ur2 s PRO 66 N 0.24 4.39 0.23 4.92 0.04 -1.26 -0.91 135.00 142.66 1ur2 s PRO 66 Ca -0.03 1.73 -0.03 0.00 0.04 0.00 0.00 61.00 62.71 1ur2 s PRO 66 Cb -0.07 -3.47 0.25 0.00 0.04 0.00 0.00 34.50 31.26 1ur2 s PRO 66 CO -0.00 -0.36 1.68 1.49 0.04 0.00 0.00 177.00 179.84 1ur2 h GLU 67 N 7.19 0.75 0.00 4.56 4.81 -1.66 -3.41 114.58 126.82 1ur2 h GLU 67 Ca -0.38 -0.27 0.00 0.00 -0.13 0.00 0.00 59.36 58.58 1ur2 h GLU 67 Cb 1.19 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.51 1ur2 h GLU 67 CO 0.85 0.86 0.00 0.09 -0.73 0.00 0.00 179.01 180.08 1ur2 n ASN 68 N -4.15 0.00 0.17 1.04 3.02 -1.26 -4.97 115.26 109.11 1ur2 n ASN 68 Ca 0.01 0.00 0.13 0.00 -0.03 0.00 0.00 54.58 54.69 1ur2 n ASN 68 Cb 0.39 0.00 0.57 0.00 -0.61 0.00 0.00 39.78 40.13 1ur2 n ASN 68 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ur2 n MET 70 N -2.46 2.48 -2.38 0.00 2.81 -1.26 -3.86 117.12 112.44 1ur2 n MET 70 Ca 0.01 -2.28 -0.40 0.00 -1.81 0.00 0.00 57.70 53.22 1ur2 n MET 70 Cb 0.22 -1.50 -0.04 0.00 -0.71 0.00 0.00 33.22 31.20 1ur2 n MET 70 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1ur2 s LYS 71 N -1.38 4.55 0.17 0.03 1.02 -0.64 -4.02 119.74 119.46 1ur2 s LYS 71 Ca 0.38 1.90 -0.23 0.00 0.02 0.00 0.00 55.97 58.05 1ur2 s LYS 71 Cb 0.22 -3.14 0.07 0.00 -0.52 0.00 0.00 37.83 34.46 1ur2 s LYS 71 CO 0.30 0.10 1.59 2.35 -0.92 0.00 0.00 175.35 178.77 1ur2 h TRP 72 N 3.66 -0.92 0.00 3.18 2.91 -1.79 0.26 115.95 123.25 1ur2 h TRP 72 Ca -0.47 0.06 0.00 0.00 1.13 0.00 0.00 58.89 59.61 1ur2 h TRP 72 Cb 1.22 0.47 0.00 0.00 -0.51 0.00 0.00 29.16 30.33 1ur2 h TRP 72 CO 0.58 -0.38 0.00 0.41 -1.03 0.00 0.00 178.44 178.02 1ur2 n GLY 73 N -1.42 -1.03 0.13 2.65 0.00 0.13 -1.41 105.19 104.24 1ur2 n GLY 73 Ca 0.02 -0.07 -0.23 0.00 0.00 0.00 0.00 46.02 45.73 1ur2 n GLY 73 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ur2 n VAL 74 N -1.41 1.53 0.13 1.61 0.31 -0.33 -4.46 118.33 115.70 1ur2 n VAL 74 Ca 0.06 -0.48 -0.01 0.00 -0.01 0.00 0.00 64.34 63.90 1ur2 n VAL 74 Cb 0.19 -1.65 0.25 0.00 -0.91 0.00 0.00 33.84 31.72 1ur2 n VAL 74 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1ur2 h LEU 75 N -0.42 0.14 -8.57 7.52 5.85 -0.98 -3.46 115.31 115.39 1ur2 h LEU 75 Ca -0.61 -0.06 -0.49 0.00 0.84 0.00 0.00 57.88 57.56 1ur2 h LEU 75 Cb 1.77 -0.04 -0.22 0.00 0.37 0.00 0.00 40.66 42.55 1ur2 h LEU 75 CO -0.21 0.57 -0.81 -0.13 -0.34 0.00 0.00 178.44 177.52 1ur2 s ARG 76 N -4.06 1.00 0.81 1.25 0.52 -0.50 -1.62 118.95 116.34 1ur2 s ARG 76 Ca -0.03 -1.08 -0.05 0.00 -0.52 0.00 0.00 55.73 54.04 1ur2 s ARG 76 Cb 0.13 -1.14 0.17 0.00 0.52 0.00 0.00 34.95 34.63 1ur2 s ARG 76 CO 0.76 0.26 1.11 -0.40 0.02 0.00 0.00 175.30 177.05 1ur2 n ASP 77 N 1.15 0.98 0.22 0.23 5.68 -0.29 -4.43 116.55 120.09 1ur2 n ASP 77 Ca -0.20 -1.95 0.15 0.00 -0.50 0.00 0.00 54.79 52.30 1ur2 n ASP 77 Cb 0.54 -0.76 0.69 0.00 -1.14 0.00 0.00 41.12 40.44 1ur2 n ASP 77 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1ur2 h ALA 78 N -0.97 1.00 -0.12 2.12 0.00 -1.92 -0.78 119.26 118.59 1ur2 h ALA 78 Ca -0.36 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1ur2 h ALA 78 Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1ur2 h ALA 78 CO 0.34 0.00 0.00 1.04 0.00 0.00 0.00 179.25 180.63 1ur2 n GLN 79 N -2.68 1.75 -0.69 0.00 6.02 -1.26 -4.82 117.38 115.69 1ur2 n GLN 79 Ca 0.00 -1.11 0.00 0.00 -0.01 0.00 0.00 57.00 55.89 1ur2 n GLN 79 Cb 0.21 -1.43 0.00 0.00 1.02 0.00 0.00 30.24 30.04 1ur2 n GLN 79 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ur2 n GLY 80 N 1.16 0.71 3.75 1.08 0.00 -0.30 -5.03 105.19 106.57 1ur2 n GLY 80 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 1ur2 n GLY 80 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ur2 s GLN 81 N -0.31 4.79 -0.06 1.61 -0.21 -1.26 -4.77 119.66 119.46 1ur2 s GLN 81 Ca 0.00 1.53 -0.04 0.00 0.02 0.00 0.00 55.36 56.87 1ur2 s GLN 81 Cb 0.00 -3.22 -0.04 0.00 1.00 0.00 0.00 33.01 30.75 1ur2 s GLN 81 CO 0.00 0.44 0.13 -1.58 -2.12 0.00 0.00 175.29 172.16 1ur2 s TRP 82 N -1.22 3.47 -0.19 0.91 0.52 -1.26 -1.14 118.94 120.03 1ur2 s TRP 82 Ca 0.42 0.38 -0.04 0.00 0.02 0.00 0.00 56.10 56.89 1ur2 s TRP 82 Cb -0.26 -1.85 0.06 0.00 -1.15 0.00 0.00 33.47 30.27 1ur2 s TRP 82 CO 0.33 0.65 0.06 1.21 0.02 0.00 0.00 176.95 179.21 1ur2 s ASN 83 N -1.43 2.76 0.00 2.95 3.84 -0.64 -5.02 114.94 117.40 1ur2 s ASN 83 Ca 0.20 -0.79 0.19 0.00 0.21 0.00 0.00 52.86 52.67 1ur2 s ASN 83 Cb -0.12 -0.47 0.75 0.00 -0.55 0.00 0.00 41.25 40.86 1ur2 s ASN 83 CO 0.10 -0.33 1.53 0.79 -2.79 0.00 0.00 177.10 176.41 1ur2 n TRP 84 N 5.13 0.20 0.02 0.43 7.02 -1.26 -4.58 117.44 124.40 1ur2 n TRP 84 Ca -0.08 -0.10 -0.10 0.00 -1.02 0.00 0.00 57.50 56.20 1ur2 n TRP 84 Cb 0.47 0.00 -0.04 0.00 -2.42 0.00 0.00 31.31 29.33 1ur2 n TRP 84 CO 0.00 0.00 0.00 -0.22 -2.02 0.00 0.00 177.69 175.45 1ur2 h LYS 85 N 1.78 -0.34 0.08 -0.99 3.64 -1.96 0.54 116.57 119.32 1ur2 h LYS 85 Ca 0.00 0.02 -0.28 0.00 -1.27 0.00 0.00 60.65 59.12 1ur2 h LYS 85 Cb 0.39 0.08 0.02 0.00 -0.41 0.00 0.00 32.23 32.31 1ur2 h LYS 85 CO 0.00 -0.22 -1.17 -0.44 -2.27 0.00 0.00 179.45 175.35 1ur2 h ASP 86 N -0.35 0.82 -0.50 4.20 3.32 -1.94 -2.35 116.42 119.62 1ur2 h ASP 86 Ca 0.09 -0.73 -0.03 0.00 0.02 0.00 0.00 57.03 56.38 1ur2 h ASP 86 Cb 0.48 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.75 1ur2 h ASP 86 CO -0.29 1.54 0.19 0.00 -1.72 0.00 0.00 179.24 178.95 1ur2 h ALA 87 N 0.39 0.65 -0.66 3.45 0.00 -1.76 -0.01 119.26 121.32 1ur2 h ALA 87 Ca -0.16 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.52 1ur2 h ALA 87 Cb 1.83 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 19.40 1ur2 h ALA 87 CO 0.22 0.27 0.12 -0.44 0.00 0.00 0.00 179.25 179.42 1ur2 h ASP 88 N 0.67 1.02 -0.62 0.00 3.32 -0.94 -2.03 116.42 117.84 1ur2 h ASP 88 Ca 0.17 -0.23 0.01 0.00 0.02 0.00 0.00 57.03 56.99 1ur2 h ASP 88 Cb 0.21 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.46 1ur2 h ASP 88 CO -0.01 1.01 0.41 0.00 -1.72 0.00 0.00 179.24 178.92 1ur2 h ALA 89 N 1.11 0.79 -0.37 3.45 0.00 -0.88 0.62 119.26 123.99 1ur2 h ALA 89 Ca 0.20 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.10 1ur2 h ALA 89 Cb 0.41 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1ur2 h ALA 89 CO 0.01 0.20 0.18 0.35 0.00 0.00 0.00 179.25 179.99 1ur2 h PHE 90 N 0.82 0.33 -0.20 0.00 3.04 -0.71 -0.36 116.94 119.86 1ur2 h PHE 90 Ca 0.23 0.02 -0.13 0.00 3.98 0.00 0.00 57.97 62.06 1ur2 h PHE 90 Cb -0.08 -0.09 -0.01 0.00 2.56 0.00 0.00 35.95 38.33 1ur2 h PHE 90 CO -0.03 0.17 -0.43 0.28 -2.02 0.00 0.00 178.31 176.27 1ur2 h VAL 91 N 0.37 1.31 -0.74 1.41 2.07 -1.11 -1.36 116.25 118.19 1ur2 h VAL 91 Ca 0.16 -1.61 -0.02 0.00 0.82 0.00 0.00 66.70 66.05 1ur2 h VAL 91 Cb 0.08 1.62 -0.04 0.00 -1.52 0.00 0.00 31.29 31.43 1ur2 h VAL 91 CO -0.12 0.50 0.38 0.00 0.02 0.00 0.00 177.57 178.35 1ur2 h ALA 92 N 1.13 1.27 0.03 1.67 0.00 -0.57 -0.30 119.26 122.49 1ur2 h ALA 92 Ca 0.03 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1ur2 h ALA 92 Cb 0.92 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1ur2 h ALA 92 CO 0.08 0.57 -0.01 0.35 0.00 0.00 0.00 179.25 180.24 1ur2 h PHE 93 N 1.04 -0.04 -0.51 0.00 3.04 -0.61 0.52 116.94 120.39 1ur2 h PHE 93 Ca 0.26 -0.00 -0.04 0.00 3.98 0.00 0.00 57.97 62.17 1ur2 h PHE 93 Cb 0.07 0.01 -0.02 0.00 2.56 0.00 0.00 35.95 38.56 1ur2 h PHE 93 CO 0.01 0.24 0.15 0.78 -2.02 0.00 0.00 178.31 177.46 1ur2 h GLY 94 N -0.31 0.81 0.89 2.40 0.00 -1.15 -2.08 103.07 103.64 1ur2 h GLY 94 Ca -0.00 -0.44 -0.05 0.00 0.00 0.00 0.00 47.33 46.84 1ur2 h GLY 94 CO 0.01 0.41 0.01 -0.84 0.00 0.00 0.00 176.54 176.13 1ur2 h THR 95 N 0.74 1.25 -0.88 4.70 2.02 -0.93 -0.50 112.91 119.31 1ur2 h THR 95 Ca 0.17 -0.92 0.04 0.00 0.77 0.00 0.00 66.41 66.47 1ur2 h THR 95 Cb 0.23 1.25 -0.06 0.00 -1.74 0.00 0.00 68.15 67.84 1ur2 h THR 95 CO -0.01 0.30 0.56 0.50 0.37 0.00 0.00 175.52 177.24 1ur2 h LYS 96 N 0.34 1.04 -0.42 6.66 3.64 -0.58 -2.74 116.57 124.51 1ur2 h LYS 96 Ca 0.09 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1ur2 h LYS 96 Cb 0.42 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.01 1ur2 h LYS 96 CO 0.01 0.69 0.00 0.72 -2.27 0.00 0.00 179.45 178.60 1ur2 n HIS 97 N -4.55 0.55 -3.82 1.91 8.25 -0.81 -4.97 115.22 111.77 1ur2 n HIS 97 Ca 0.12 -0.27 -0.28 0.00 -0.26 0.00 0.00 57.72 57.02 1ur2 n HIS 97 Cb 0.12 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.24 1ur2 n HIS 97 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1ur2 n ASN 98 N 1.25 -2.60 -4.82 0.41 5.15 -0.33 -4.99 115.26 109.32 1ur2 n ASN 98 Ca 0.19 -1.01 -0.36 0.00 -0.60 0.00 0.00 54.58 52.81 1ur2 n ASN 98 Cb 0.54 -3.22 -0.07 0.00 -0.53 0.00 0.00 39.78 36.50 1ur2 n ASN 98 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1ur2 s LEU 99 N -6.76 4.14 0.30 1.20 1.43 -0.40 -5.00 118.68 113.59 1ur2 s LEU 99 Ca 0.22 0.34 -0.29 0.00 -1.03 0.00 0.00 54.13 53.37 1ur2 s LEU 99 Cb -0.08 -2.08 -0.11 0.00 0.03 0.00 0.00 46.19 43.95 1ur2 s LEU 99 CO 0.87 0.37 1.49 -2.28 0.23 0.00 0.00 176.35 177.04 1ur2 s HIS 100 N -1.04 2.84 -0.06 0.29 5.65 -0.53 -4.71 115.29 117.72 1ur2 s HIS 100 Ca 0.17 1.00 0.03 0.00 0.25 0.00 0.00 55.06 56.51 1ur2 s HIS 100 Cb -0.12 -3.94 0.01 0.00 -1.18 0.00 0.00 32.58 27.35 1ur2 s HIS 100 CO 0.06 -2.99 -0.15 -1.64 -0.65 0.00 0.00 174.74 169.37 1ur2 s MET 101 N -0.89 1.88 -0.22 2.88 1.00 -1.26 -0.76 119.30 121.92 1ur2 s MET 101 Ca 0.58 -0.54 -0.05 0.00 0.00 0.00 0.00 55.69 55.68 1ur2 s MET 101 Cb -0.45 -1.56 -0.02 0.00 0.00 0.00 0.00 34.83 32.81 1ur2 s MET 101 CO 0.50 0.13 -0.00 0.08 0.00 0.00 0.00 175.02 175.72 1ur2 s VAL 102 N 0.38 3.73 0.27 -6.03 1.01 -0.54 -1.07 120.40 118.15 1ur2 s VAL 102 Ca -0.11 -0.37 -0.30 0.00 0.00 0.00 0.00 61.98 61.20 1ur2 s VAL 102 Cb -0.14 -2.71 -0.09 0.00 0.00 0.00 0.00 36.38 33.43 1ur2 s VAL 102 CO 0.04 0.40 1.08 -0.83 0.00 0.00 0.00 175.10 175.79 1ur2 s GLY 103 N 1.43 3.06 -0.14 4.51 0.00 0.39 -4.01 107.32 112.55 1ur2 s GLY 103 Ca 0.05 0.85 -0.04 0.00 0.00 0.00 0.00 44.72 45.59 1ur2 s GLY 103 CO -0.00 1.47 0.22 -1.58 0.00 0.00 0.00 173.10 173.21 1ur2 s HIS 104 N -1.09 -0.30 -0.02 1.90 5.04 -1.26 -0.91 115.29 118.65 1ur2 s HIS 104 Ca 0.44 0.60 -0.08 0.00 -1.54 0.00 0.00 55.06 54.48 1ur2 s HIS 104 Cb -0.31 -0.22 0.01 0.00 0.04 0.00 0.00 32.58 32.10 1ur2 s HIS 104 CO 0.39 -0.42 0.17 -0.08 -2.34 0.00 0.00 174.74 172.46 1ur2 s THR 105 N 2.35 0.06 -0.05 0.89 -1.32 -1.26 -3.72 115.64 112.60 1ur2 s THR 105 Ca 0.04 -0.51 -0.26 0.00 -1.21 0.00 0.00 61.69 59.75 1ur2 s THR 105 Cb -0.13 -0.41 -0.21 0.00 -1.51 0.00 0.00 72.50 70.23 1ur2 s THR 105 CO -0.09 -0.28 1.14 -0.07 -2.21 0.00 0.00 174.62 173.11 1ur2 h LEU 106 N 4.59 -0.02 -7.50 9.08 3.38 -1.28 -3.41 115.31 120.16 1ur2 h LEU 106 Ca -0.29 -0.58 -0.55 0.00 0.09 0.00 0.00 57.88 56.55 1ur2 h LEU 106 Cb 1.19 0.00 -0.39 0.00 0.09 0.00 0.00 40.66 41.56 1ur2 h LEU 106 CO 0.40 0.58 -0.78 -0.69 0.09 0.00 0.00 178.44 178.04 1ur2 s VAL 107 N -3.81 1.00 0.02 1.22 1.01 -0.14 -4.82 120.40 114.88 1ur2 s VAL 107 Ca -0.16 -0.74 -0.21 0.00 0.00 0.00 0.00 61.98 60.86 1ur2 s VAL 107 Cb 0.01 -1.31 0.04 0.00 0.00 0.00 0.00 36.38 35.12 1ur2 s VAL 107 CO 0.66 -0.05 0.47 0.86 0.00 0.00 0.00 175.10 177.05 1ur2 s TRP 108 N 1.66 -0.36 -1.22 5.22 -0.00 -1.26 -1.93 118.94 121.04 1ur2 s TRP 108 Ca -0.02 0.45 0.27 0.00 -0.00 0.00 0.00 56.10 56.80 1ur2 s TRP 108 Cb -0.17 0.27 0.83 0.00 -0.00 0.00 0.00 33.47 34.40 1ur2 s TRP 108 CO -0.07 -0.57 1.63 -2.39 -0.00 0.00 0.00 176.95 175.54 1ur2 n HIS 109 N 0.67 0.00 -4.15 5.86 1.44 -1.26 -4.84 115.22 112.93 1ur2 n HIS 109 Ca -0.19 0.00 -0.25 0.00 -2.01 0.00 0.00 57.72 55.27 1ur2 n HIS 109 Cb 0.59 -0.27 -0.06 0.00 0.12 0.00 0.00 29.99 30.36 1ur2 n HIS 109 CO 0.00 0.00 0.00 -1.12 -2.81 0.00 0.00 176.34 172.41 1ur2 s SER 110 N -2.83 5.20 -1.31 4.39 0.01 -1.26 -4.64 113.70 113.26 1ur2 s SER 110 Ca 0.17 -0.28 -0.03 0.00 1.31 0.00 0.00 55.95 57.11 1ur2 s SER 110 Cb 0.19 -1.25 -0.00 0.00 0.21 0.00 0.00 66.02 65.16 1ur2 s SER 110 CO 0.60 0.05 0.61 0.00 0.41 0.00 0.00 173.24 174.91 1ur2 n GLN 111 N -0.50 -3.74 -3.74 12.44 6.02 -1.26 -4.86 117.38 121.74 1ur2 n GLN 111 Ca -0.08 0.52 -0.12 0.00 -0.01 0.00 0.00 57.00 57.31 1ur2 n GLN 111 Cb 0.56 -4.81 -0.11 0.00 1.02 0.00 0.00 30.24 26.90 1ur2 n GLN 111 CO 0.00 0.00 0.00 -1.50 -1.01 0.00 0.00 177.06 174.55 1ur2 s ILE 112 N -3.75 -0.01 0.34 5.09 2.07 -1.26 -0.69 121.20 122.99 1ur2 s ILE 112 Ca 0.08 0.03 -0.28 0.00 -1.41 0.00 0.00 60.65 59.07 1ur2 s ILE 112 Cb -0.02 -0.52 -0.10 0.00 0.13 0.00 0.00 42.46 41.95 1ur2 s ILE 112 CO 0.85 0.01 1.24 -1.00 -1.91 0.00 0.00 174.94 174.13 1ur2 s HIS 113 N 0.53 3.14 0.52 3.50 3.76 -1.26 -4.89 115.29 120.60 1ur2 s HIS 113 Ca -0.03 1.50 0.32 0.00 -0.15 0.00 0.00 55.06 56.70 1ur2 s HIS 113 Cb -0.04 -3.55 1.81 0.00 1.11 0.00 0.00 32.58 31.90 1ur2 s HIS 113 CO -0.03 -1.52 2.21 -0.44 -0.85 0.00 0.00 174.74 174.11 1ur2 h ASP 114 N 3.29 0.00 0.01 1.40 3.32 -1.97 -1.70 116.42 120.77 1ur2 h ASP 114 Ca -0.48 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.56 1ur2 h ASP 114 Cb 1.23 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.78 1ur2 h ASP 114 CO 0.65 0.04 -0.00 -0.33 -1.72 0.00 0.00 179.24 177.88 1ur2 h GLU 115 N 0.00 0.00 -0.44 3.56 3.07 -1.88 -0.01 114.58 118.88 1ur2 h GLU 115 Ca -0.00 0.00 -0.05 0.00 -0.50 0.00 0.00 59.36 58.81 1ur2 h GLU 115 Cb 0.14 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.03 1ur2 h GLU 115 CO 0.01 0.00 0.08 0.28 -1.40 0.00 0.00 179.01 177.97 1ur2 h VAL 116 N 0.00 1.21 0.00 3.13 2.07 -1.62 -3.34 116.25 117.70 1ur2 h VAL 116 Ca -0.00 -0.77 0.00 0.00 0.82 0.00 0.00 66.70 66.75 1ur2 h VAL 116 Cb 0.01 0.79 0.00 0.00 -1.52 0.00 0.00 31.29 30.57 1ur2 h VAL 116 CO 0.00 0.28 -1.62 0.49 0.02 0.00 0.00 177.57 176.74 1ur2 n PHE 117 N -4.29 0.00 -4.41 1.57 3.72 -0.15 -4.89 117.46 109.01 1ur2 n PHE 117 Ca 0.03 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.23 1ur2 n PHE 117 Cb 0.23 -0.32 -0.14 0.00 -0.94 0.00 0.00 39.48 38.31 1ur2 n PHE 117 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1ur2 s LYS 118 N -2.98 0.93 0.91 -1.08 1.02 -0.39 -1.77 119.74 116.38 1ur2 s LYS 118 Ca -0.05 -0.63 -0.12 0.00 0.02 0.00 0.00 55.97 55.19 1ur2 s LYS 118 Cb 0.09 -0.92 0.14 0.00 -0.52 0.00 0.00 37.83 36.63 1ur2 s LYS 118 CO 0.61 0.24 1.09 -0.80 -0.92 0.00 0.00 175.35 175.56 1ur2 s ASN 119 N -0.83 3.28 0.58 2.83 0.01 0.70 -4.52 114.94 116.99 1ur2 s ASN 119 Ca 0.02 1.53 0.34 0.00 -0.71 0.00 0.00 52.86 54.04 1ur2 s ASN 119 Cb -0.07 -2.20 1.78 0.00 0.41 0.00 0.00 41.25 41.17 1ur2 s ASN 119 CO 0.01 -2.76 2.17 0.00 -1.51 0.00 0.00 177.10 175.00 1ur2 h ALA 120 N -1.63 1.18 -0.00 0.60 0.00 -1.97 -0.55 119.26 116.88 1ur2 h ALA 120 Ca -0.50 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1ur2 h ALA 120 Cb 1.29 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1ur2 h ALA 120 CO 0.54 0.06 -0.01 -0.40 0.00 0.00 0.00 179.25 179.44 1ur2 n ASP 121 N -3.41 0.07 0.00 0.00 5.68 -1.26 -4.91 116.55 112.72 1ur2 n ASP 121 Ca -0.02 -0.49 0.00 0.00 -0.50 0.00 0.00 54.79 53.78 1ur2 n ASP 121 Cb 0.18 -0.16 0.00 0.00 -1.14 0.00 0.00 41.12 40.00 1ur2 n ASP 121 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ur2 n GLY 122 N 1.19 2.65 3.79 6.12 0.00 -0.21 -5.08 105.19 113.64 1ur2 n GLY 122 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 1ur2 n GLY 122 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ur2 s SER 123 N -1.31 6.23 0.39 1.61 1.04 -1.26 -4.72 113.70 115.68 1ur2 s SER 123 Ca 0.00 2.06 -0.24 0.00 0.48 0.00 0.00 55.95 58.24 1ur2 s SER 123 Cb 0.00 -2.57 -0.09 0.00 0.10 0.00 0.00 66.02 63.45 1ur2 s SER 123 CO 0.00 -0.87 1.04 -0.31 0.98 0.00 0.00 173.24 174.09 1ur2 s TYR 124 N -1.82 3.31 0.75 5.02 2.02 -1.26 -0.21 117.35 125.16 1ur2 s TYR 124 Ca 0.67 1.65 -0.11 0.00 -0.37 0.00 0.00 57.07 58.91 1ur2 s TYR 124 Cb -0.21 -3.11 0.04 0.00 -0.40 0.00 0.00 41.96 38.28 1ur2 s TYR 124 CO 0.25 -0.55 1.10 0.96 -1.57 0.00 0.00 175.55 175.73 1ur2 s ILE 125 N -1.64 3.30 0.75 2.71 -4.36 -0.73 -4.81 121.20 116.42 1ur2 s ILE 125 Ca 0.57 0.42 -0.13 0.00 -0.26 0.00 0.00 60.65 61.25 1ur2 s ILE 125 Cb -0.22 -3.29 0.05 0.00 1.25 0.00 0.00 42.46 40.26 1ur2 s ILE 125 CO 0.28 -0.55 1.14 -0.94 0.24 0.00 0.00 174.94 175.11 1ur2 s SER 126 N -4.12 4.30 0.26 4.36 1.04 -1.26 -4.85 113.70 113.42 1ur2 s SER 126 Ca 0.59 2.09 -0.03 0.00 0.48 0.00 0.00 55.95 59.09 1ur2 s SER 126 Cb -0.13 -2.56 0.45 0.00 0.10 0.00 0.00 66.02 63.88 1ur2 s SER 126 CO 0.53 -2.18 1.82 0.50 0.98 0.00 0.00 173.24 174.88 1ur2 h LYS 127 N -0.70 0.82 -0.72 4.02 3.64 -1.97 -1.47 116.57 120.20 1ur2 h LYS 127 Ca -0.45 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 58.84 1ur2 h LYS 127 Cb 1.26 -0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 32.86 1ur2 h LYS 127 CO 0.50 0.54 0.32 0.00 -2.27 0.00 0.00 179.45 178.54 1ur2 h ALA 128 N 1.48 0.93 -0.48 5.00 0.00 -1.95 0.15 119.26 124.40 1ur2 h ALA 128 Ca 0.43 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 55.11 1ur2 h ALA 128 Cb 0.41 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1ur2 h ALA 128 CO -0.26 0.52 0.05 0.00 0.00 0.00 0.00 179.25 179.56 1ur2 h ALA 129 N 1.15 0.64 -0.43 0.00 0.00 -1.79 -2.11 119.26 116.72 1ur2 h ALA 129 Ca 0.24 -0.25 -0.13 0.00 0.00 0.00 0.00 54.91 54.78 1ur2 h ALA 129 Cb 0.16 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1ur2 h ALA 129 CO -0.03 0.39 -0.23 1.25 0.00 0.00 0.00 179.25 180.64 1ur2 h LEU 130 N 0.68 0.90 -0.82 0.00 5.85 -1.07 -2.45 115.31 118.40 1ur2 h LEU 130 Ca 0.14 -0.34 0.09 0.00 0.84 0.00 0.00 57.88 58.62 1ur2 h LEU 130 Cb 0.43 -0.25 -0.07 0.00 0.37 0.00 0.00 40.66 41.14 1ur2 h LEU 130 CO 0.01 1.09 0.47 -0.61 -0.34 0.00 0.00 178.44 179.06 1ur2 h GLN 131 N 0.76 0.76 -0.72 1.25 5.75 -0.56 -0.73 115.11 121.63 1ur2 h GLN 131 Ca 0.10 -0.05 -0.06 0.00 -0.15 0.00 0.00 58.65 58.50 1ur2 h GLN 131 Cb 0.78 -0.17 -0.03 0.00 1.07 0.00 0.00 27.48 29.12 1ur2 h GLN 131 CO 0.06 0.51 0.23 -0.22 -2.65 0.00 0.00 178.83 176.76 1ur2 h LYS 132 N 0.79 1.11 -0.52 1.69 3.64 -1.10 -0.25 116.57 121.93 1ur2 h LYS 132 Ca 0.39 -0.23 -0.08 0.00 -1.27 0.00 0.00 60.65 59.46 1ur2 h LYS 132 Cb 0.35 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 1ur2 h LYS 132 CO -0.24 0.94 0.02 0.87 -2.27 0.00 0.00 179.45 178.76 1ur2 h LYS 133 N 1.07 0.91 -0.54 1.90 1.57 -0.91 -1.70 116.57 118.87 1ur2 h LYS 133 Ca 0.23 -0.28 -0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1ur2 h LYS 133 Cb 0.29 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.49 1ur2 h LYS 133 CO -0.01 0.92 0.32 1.98 -0.57 0.00 0.00 179.45 182.10 1ur2 h MET 134 N 0.78 0.74 -0.24 3.15 4.05 -0.65 -0.43 114.93 122.34 1ur2 h MET 134 Ca 0.15 -0.07 0.02 0.00 -0.28 0.00 0.00 59.70 59.52 1ur2 h MET 134 Cb 0.50 -0.15 -0.02 0.00 -0.80 0.00 0.00 31.60 31.13 1ur2 h MET 134 CO 0.02 0.54 0.09 0.93 0.23 0.00 0.00 176.91 178.73 1ur2 h GLU 135 N 0.73 0.20 -0.59 0.39 5.08 -0.85 -0.15 114.58 119.39 1ur2 h GLU 135 Ca 0.19 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.52 1ur2 h GLU 135 Cb -0.01 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.17 1ur2 h GLU 135 CO -0.04 0.14 0.28 1.49 -1.00 0.00 0.00 179.01 179.88 1ur2 h GLU 136 N 0.21 0.86 -0.07 2.33 4.81 -1.11 -0.69 114.58 120.92 1ur2 h GLU 136 Ca 0.10 -0.13 -0.01 0.00 -0.13 0.00 0.00 59.36 59.19 1ur2 h GLU 136 Cb 0.05 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 29.28 1ur2 h GLU 136 CO -0.09 0.70 0.01 1.25 -0.73 0.00 0.00 179.01 180.15 1ur2 h HIS 137 N 0.81 0.12 -0.24 0.92 2.76 -0.62 -1.37 115.15 117.53 1ur2 h HIS 137 Ca 0.20 -0.02 -0.09 0.00 -2.20 0.00 0.00 60.37 58.26 1ur2 h HIS 137 Cb 0.13 -0.03 -0.00 0.00 1.55 0.00 0.00 27.41 29.06 1ur2 h HIS 137 CO 0.00 0.34 -0.21 0.82 -1.30 0.00 0.00 177.93 177.57 1ur2 h ILE 138 N -0.13 1.32 -0.96 6.26 2.04 -1.00 -0.26 117.51 124.77 1ur2 h ILE 138 Ca 0.02 -1.37 0.01 0.00 1.00 0.00 0.00 64.86 64.53 1ur2 h ILE 138 Cb 0.28 1.67 -0.05 0.00 -0.74 0.00 0.00 36.82 37.98 1ur2 h ILE 138 CO 0.00 0.42 0.64 0.74 0.00 0.00 0.00 178.15 179.95 1ur2 h THR 139 N 0.27 1.25 0.10 -0.27 2.02 -1.12 0.49 112.91 115.65 1ur2 h THR 139 Ca 0.04 -0.45 -0.01 0.00 0.77 0.00 0.00 66.41 66.77 1ur2 h THR 139 Cb 0.76 -0.17 0.00 0.00 -1.74 0.00 0.00 68.15 67.00 1ur2 h THR 139 CO 0.05 0.24 -0.05 0.74 0.37 0.00 0.00 175.52 176.87 1ur2 h THR 140 N 1.30 1.09 0.12 3.16 2.02 -1.14 -2.37 112.91 117.09 1ur2 h THR 140 Ca 0.35 -1.24 -0.01 0.00 0.77 0.00 0.00 66.41 66.28 1ur2 h THR 140 Cb -0.15 1.81 0.00 0.00 -1.74 0.00 0.00 68.15 68.08 1ur2 h THR 140 CO -0.08 0.28 -0.06 0.25 0.37 0.00 0.00 175.52 176.28 1ur2 h LEU 141 N -0.77 -0.13 -1.28 2.58 5.85 -0.94 -0.83 115.31 119.78 1ur2 h LEU 141 Ca -0.01 -0.43 -0.07 0.00 0.84 0.00 0.00 57.88 58.20 1ur2 h LEU 141 Cb 0.56 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 1ur2 h LEU 141 CO 0.02 0.44 -0.34 0.00 -0.34 0.00 0.00 178.44 178.22 1ur2 h ALA 142 N -0.10 1.41 -0.40 1.25 0.00 -1.09 -2.92 119.26 117.41 1ur2 h ALA 142 Ca -0.02 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 54.51 1ur2 h ALA 142 Cb 0.55 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1ur2 h ALA 142 CO 0.03 0.44 -0.02 0.78 0.00 0.00 0.00 179.25 180.48 1ur2 h GLY 143 N 1.04 0.77 0.73 0.00 0.00 -1.38 -1.34 103.07 102.89 1ur2 h GLY 143 Ca 0.00 -0.58 0.06 0.00 0.00 0.00 0.00 47.33 46.82 1ur2 h GLY 143 CO 0.05 0.53 0.58 -0.09 0.00 0.00 0.00 176.54 177.61 1ur2 h ARG 144 N 0.54 1.03 -0.46 4.80 2.43 -0.95 -2.69 114.38 119.08 1ur2 h ARG 144 Ca 0.11 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 1ur2 h ARG 144 Cb 0.50 -0.23 0.00 0.00 -0.42 0.00 0.00 29.97 29.82 1ur2 h ARG 144 CO 0.02 0.68 0.00 0.66 -1.51 0.00 0.00 179.97 179.82 1ur2 n TYR 145 N -4.57 1.16 -1.63 2.20 4.01 -1.20 -4.98 117.16 112.15 1ur2 n TYR 145 Ca 0.14 -0.68 -0.54 0.00 -0.16 0.00 0.00 57.90 56.66 1ur2 n TYR 145 Cb 0.18 -0.24 -0.06 0.00 -0.31 0.00 0.00 39.34 38.90 1ur2 n TYR 145 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 1ur2 n LYS 146 N 0.46 1.11 0.00 -0.72 4.81 -0.51 -0.37 118.16 122.94 1ur2 n LYS 146 Ca 0.22 0.40 0.00 0.00 -0.87 0.00 0.00 58.31 58.06 1ur2 n LYS 146 Cb 0.82 -2.06 0.00 0.00 0.02 0.00 0.00 35.03 33.81 1ur2 n LYS 146 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ur2 n GLY 147 N 3.10 2.96 0.13 3.14 0.00 -1.26 -4.75 105.19 108.51 1ur2 n GLY 147 Ca 0.21 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.02 1ur2 n GLY 147 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ur2 n LYS 148 N -2.00 0.69 -3.04 1.61 5.02 0.50 -4.81 118.16 116.12 1ur2 n LYS 148 Ca 0.00 0.33 -0.40 0.00 -2.02 0.00 0.00 58.31 56.22 1ur2 n LYS 148 Cb 0.00 -1.69 -0.05 0.00 -0.02 0.00 0.00 35.03 33.27 1ur2 n LYS 148 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1ur2 s LEU 149 N -7.22 4.22 0.33 -0.35 1.43 -0.89 -4.64 118.68 111.56 1ur2 s LEU 149 Ca -0.26 1.05 0.17 0.00 -1.03 0.00 0.00 54.13 54.07 1ur2 s LEU 149 Cb 0.07 -3.04 0.22 0.00 0.03 0.00 0.00 46.19 43.47 1ur2 s LEU 149 CO 0.69 -0.23 1.52 0.00 0.23 0.00 0.00 176.35 178.57 1ur2 h ALA 150 N 7.13 0.77 -2.54 4.21 0.00 -1.41 -3.45 119.26 123.97 1ur2 h ALA 150 Ca -0.35 -0.35 -0.10 0.00 0.00 0.00 0.00 54.91 54.10 1ur2 h ALA 150 Cb 1.16 -0.06 -0.16 0.00 0.00 0.00 0.00 17.79 18.73 1ur2 h ALA 150 CO 0.78 0.48 -0.41 0.00 0.00 0.00 0.00 179.25 180.10 1ur2 s ALA 151 N -3.09 -0.24 -0.03 0.00 0.00 -1.13 -1.05 121.76 116.22 1ur2 s ALA 151 Ca 0.04 -0.47 0.02 0.00 0.00 0.00 0.00 51.96 51.55 1ur2 s ALA 151 Cb 0.08 0.35 0.01 0.00 0.00 0.00 0.00 23.12 23.55 1ur2 s ALA 151 CO 0.72 -0.41 -0.07 -1.58 0.00 0.00 0.00 175.76 174.42 1ur2 s TRP 152 N -3.07 0.83 -0.72 0.00 0.52 -0.33 -0.46 118.94 115.70 1ur2 s TRP 152 Ca -0.01 -0.20 -0.27 0.00 0.02 0.00 0.00 56.10 55.64 1ur2 s TRP 152 Cb 0.01 -0.61 0.01 0.00 -1.15 0.00 0.00 33.47 31.73 1ur2 s TRP 152 CO -0.07 -0.10 1.50 -0.51 0.02 0.00 0.00 176.95 177.79 1ur2 s ASP 153 N 0.28 5.86 -0.07 2.95 1.01 -0.09 -0.93 116.67 125.69 1ur2 s ASP 153 Ca -0.04 -0.26 -0.26 0.00 0.71 0.00 0.00 52.55 52.70 1ur2 s ASP 153 Cb -0.09 -2.55 -0.24 0.00 1.01 0.00 0.00 42.92 41.06 1ur2 s ASP 153 CO 0.00 -2.02 1.00 0.58 0.21 0.00 0.00 175.17 174.94 1ur2 h VAL 154 N 6.39 1.59 -4.07 -1.27 2.07 -1.44 -1.38 116.25 118.14 1ur2 h VAL 154 Ca -0.23 -1.92 -0.50 0.00 0.82 0.00 0.00 66.70 64.87 1ur2 h VAL 154 Cb 1.08 2.84 -0.30 0.00 -1.52 0.00 0.00 31.29 33.39 1ur2 h VAL 154 CO 1.27 0.51 -0.81 -0.69 0.02 0.00 0.00 177.57 177.87 1ur2 s VAL 155 N -3.07 1.14 -0.10 2.57 1.01 -1.23 -0.96 120.40 119.75 1ur2 s VAL 155 Ca -0.17 -0.59 0.04 0.00 0.00 0.00 0.00 61.98 61.26 1ur2 s VAL 155 Cb -0.00 -0.97 -0.00 0.00 0.00 0.00 0.00 36.38 35.41 1ur2 s VAL 155 CO 0.72 0.33 -0.24 0.21 0.00 0.00 0.00 175.10 176.12 1ur2 s ASN 156 N -0.15 3.12 -1.05 3.32 2.47 -0.81 -2.04 114.94 119.80 1ur2 s ASN 156 Ca 0.02 -0.55 -0.02 0.00 0.42 0.00 0.00 52.86 52.72 1ur2 s ASN 156 Cb -0.07 -1.41 -0.03 0.00 -1.45 0.00 0.00 41.25 38.29 1ur2 s ASN 156 CO 0.00 0.16 0.89 -0.62 -3.72 0.00 0.00 177.10 173.82 1ur2 n GLU 157 N 3.51 -4.49 0.00 0.43 1.02 0.18 -4.57 120.64 116.72 1ur2 n GLU 157 Ca -0.19 0.79 0.11 0.00 -0.02 0.00 0.00 57.16 57.86 1ur2 n GLU 157 Cb 0.53 -5.57 0.12 0.00 -0.02 0.00 0.00 31.44 26.50 1ur2 n GLU 157 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ur2 n ALA 158 N -3.57 3.83 -2.76 0.62 0.00 -1.26 -4.81 120.51 112.55 1ur2 n ALA 158 Ca -0.19 -0.42 -0.35 0.00 0.00 0.00 0.00 53.44 52.48 1ur2 n ALA 158 Cb 0.64 -1.01 -0.09 0.00 0.00 0.00 0.00 19.45 18.99 1ur2 n ALA 158 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1ur2 s VAL 159 N -3.03 5.12 0.87 0.00 1.01 -1.26 -0.35 120.40 122.76 1ur2 s VAL 159 Ca 0.09 0.09 -0.12 0.00 0.00 0.00 0.00 61.98 62.04 1ur2 s VAL 159 Cb 0.17 -3.34 0.11 0.00 0.00 0.00 0.00 36.38 33.32 1ur2 s VAL 159 CO 0.76 0.43 1.11 -0.83 0.00 0.00 0.00 175.10 176.56 1ur2 s GLY 160 N 0.51 1.60 0.51 4.51 0.00 0.10 -4.60 107.32 109.95 1ur2 s GLY 160 Ca 0.06 -0.29 0.19 0.00 0.00 0.00 0.00 44.72 44.68 1ur2 s GLY 160 CO 0.00 0.20 2.11 -0.55 0.00 0.00 0.00 173.10 174.86 1ur2 h ASP 161 N -1.36 0.00 -0.06 1.64 3.32 -1.96 -1.48 116.42 116.52 1ur2 h ASP 161 Ca -0.49 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.56 1ur2 h ASP 161 Cb 1.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.84 1ur2 h ASP 161 CO 0.59 0.08 0.00 -0.90 -1.72 0.00 0.00 179.24 177.29 1ur2 n ASP 162 N -4.25 0.44 0.00 6.45 5.75 -1.26 -4.91 116.55 118.78 1ur2 n ASP 162 Ca -0.03 -1.71 0.00 0.00 -0.01 0.00 0.00 54.79 53.04 1ur2 n ASP 162 Cb 0.16 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.21 1ur2 n ASP 162 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1ur2 n LEU 163 N -0.39 0.29 -4.97 -2.12 4.77 -0.56 -5.01 117.00 109.02 1ur2 n LEU 163 Ca 0.10 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.86 1ur2 n LEU 163 Cb 0.11 -0.58 0.04 0.00 -2.33 0.00 0.00 43.42 40.65 1ur2 n LEU 163 CO 0.07 -0.18 0.38 -0.54 -1.33 0.00 0.00 177.39 175.79 1ur2 s LYS 164 N -0.36 2.54 0.29 3.23 1.02 -1.26 -4.83 119.74 120.37 1ur2 s LYS 164 Ca 0.00 -0.75 -0.30 0.00 0.02 0.00 0.00 55.97 54.95 1ur2 s LYS 164 Cb 0.00 -2.47 -0.13 0.00 -0.52 0.00 0.00 37.83 34.71 1ur2 s LYS 164 CO 0.00 -0.73 1.40 -1.33 -0.92 0.00 0.00 175.35 173.77 1ur2 n MET 165 N -2.36 2.21 -1.79 1.68 2.81 -1.26 0.00 117.12 118.41 1ur2 n MET 165 Ca 0.08 0.78 -0.41 0.00 -1.81 0.00 0.00 57.70 56.34 1ur2 n MET 165 Cb 0.60 -2.44 -0.01 0.00 -0.71 0.00 0.00 33.22 30.65 1ur2 n MET 165 CO 0.00 0.00 0.00 0.50 1.51 0.00 0.00 175.97 177.98 1ur2 s ARG 166 N -1.03 4.12 -0.48 0.03 3.52 0.53 -4.43 118.95 121.22 1ur2 s ARG 166 Ca 0.62 2.57 -0.05 0.00 -0.13 0.00 0.00 55.73 58.74 1ur2 s ARG 166 Cb -0.59 -3.02 -0.06 0.00 -1.56 0.00 0.00 34.95 29.72 1ur2 s ARG 166 CO 0.55 -0.61 3.06 -3.47 -0.81 0.00 0.00 175.30 174.01 1ur2 n ASP 167 N 1.98 6.39 -4.91 -2.12 2.03 -1.26 -4.69 116.55 113.96 1ur2 n ASP 167 Ca 0.07 -2.88 -0.28 0.00 0.52 0.00 0.00 54.79 52.22 1ur2 n ASP 167 Cb 0.38 -1.34 0.07 0.00 -0.72 0.00 0.00 41.12 39.50 1ur2 n ASP 167 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1ur2 s SER 168 N 1.10 4.89 0.24 1.67 1.04 -1.26 -4.84 113.70 116.53 1ur2 s SER 168 Ca 0.62 0.69 -0.06 0.00 0.48 0.00 0.00 55.95 57.68 1ur2 s SER 168 Cb 0.32 -1.35 0.28 0.00 0.10 0.00 0.00 66.02 65.37 1ur2 s SER 168 CO -0.12 -1.61 1.89 0.45 0.98 0.00 0.00 173.24 174.83 1ur2 h HIS 169 N -0.72 1.09 -0.38 5.02 -0.00 -1.94 0.15 115.15 118.37 1ur2 h HIS 169 Ca -0.45 0.03 0.08 0.00 -0.00 0.00 0.00 60.37 60.03 1ur2 h HIS 169 Cb 1.31 -0.36 -0.09 0.00 -0.00 0.00 0.00 27.41 28.27 1ur2 h HIS 169 CO 0.37 0.63 -0.21 -1.49 -0.00 0.00 0.00 177.93 177.22 1ur2 h TRP 170 N 1.13 -0.54 -0.15 2.45 4.06 -1.95 -0.99 115.95 119.97 1ur2 h TRP 170 Ca 0.36 0.05 -0.16 0.00 2.06 0.00 0.00 58.89 61.19 1ur2 h TRP 170 Cb -0.00 0.30 0.01 0.00 -1.00 0.00 0.00 29.16 28.46 1ur2 h TRP 170 CO -0.02 -0.29 -0.53 -0.92 -3.56 0.00 0.00 178.44 173.13 1ur2 h TYR 171 N -0.15 0.81 -0.96 0.49 3.20 -1.71 -0.88 116.97 117.77 1ur2 h TYR 171 Ca 0.19 -0.34 0.01 0.00 3.14 0.00 0.00 58.73 61.73 1ur2 h TYR 171 Cb 0.44 -0.13 -0.05 0.00 1.54 0.00 0.00 36.73 38.53 1ur2 h TYR 171 CO -0.44 1.12 0.64 0.87 -1.64 0.00 0.00 178.16 178.71 1ur2 h LYS 172 N 0.27 1.26 0.07 1.82 1.57 -0.83 0.39 116.57 121.11 1ur2 h LYS 172 Ca -0.02 -0.08 -0.17 0.00 -1.87 0.00 0.00 60.65 58.51 1ur2 h LYS 172 Cb 1.16 -0.28 0.02 0.00 0.08 0.00 0.00 32.23 33.20 1ur2 h LYS 172 CO 0.11 0.83 -0.71 0.82 -0.57 0.00 0.00 179.45 179.93 1ur2 h ILE 173 N 1.30 1.47 0.00 1.86 2.04 -1.17 -3.41 117.51 119.60 1ur2 h ILE 173 Ca 0.35 -2.31 0.00 0.00 1.00 0.00 0.00 64.86 63.90 1ur2 h ILE 173 Cb -0.14 2.91 0.00 0.00 -0.74 0.00 0.00 36.82 38.85 1ur2 h ILE 173 CO -0.08 0.66 -1.47 0.23 0.00 0.00 0.00 178.15 177.50 1ur2 n MET 174 N -4.17 0.79 0.00 2.37 2.81 -0.34 -4.55 117.12 114.03 1ur2 n MET 174 Ca -0.12 -0.11 0.00 0.00 -1.81 0.00 0.00 57.70 55.66 1ur2 n MET 174 Cb 0.75 -1.30 0.00 0.00 -0.71 0.00 0.00 33.22 31.96 1ur2 n MET 174 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ur2 n GLY 175 N 1.63 -0.16 0.00 3.03 0.00 0.12 -3.66 105.19 106.16 1ur2 n GLY 175 Ca -0.02 -1.04 0.07 0.00 0.00 0.00 0.00 46.02 45.03 1ur2 n GLY 175 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1ur2 n ASP 176 N -1.70 0.00 0.24 1.61 5.68 -1.26 -1.60 116.55 119.52 1ur2 n ASP 176 Ca 0.00 0.42 0.17 0.00 -0.50 0.00 0.00 54.79 54.88 1ur2 n ASP 176 Cb 0.00 -0.46 0.87 0.00 -1.14 0.00 0.00 41.12 40.39 1ur2 n ASP 176 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 1ur2 h ASP 177 N 0.00 0.00 -0.45 -1.12 3.32 -1.97 -1.20 116.42 114.99 1ur2 h ASP 177 Ca 0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 1ur2 h ASP 177 Cb 0.21 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.74 1ur2 h ASP 177 CO 0.00 0.00 0.28 2.19 -1.72 0.00 0.00 179.24 179.99 1ur2 h PHE 178 N 0.00 0.59 0.00 4.55 -0.00 -1.48 0.88 116.94 121.48 1ur2 h PHE 178 Ca 0.06 0.01 -0.02 0.00 -0.00 0.00 0.00 57.97 58.02 1ur2 h PHE 178 Cb 0.38 -0.20 -0.00 0.00 -0.00 0.00 0.00 35.95 36.13 1ur2 h PHE 178 CO 0.00 0.39 -0.14 0.82 -0.00 0.00 0.00 178.31 179.39 1ur2 h ILE 179 N 0.63 1.01 -0.55 0.88 2.04 -1.47 -3.02 117.51 117.04 1ur2 h ILE 179 Ca 0.17 -1.80 0.11 0.00 1.00 0.00 0.00 64.86 64.33 1ur2 h ILE 179 Cb -0.03 1.96 -0.08 0.00 -0.74 0.00 0.00 36.82 37.92 1ur2 h ILE 179 CO -0.03 0.34 0.06 0.22 0.00 0.00 0.00 178.15 178.74 1ur2 h TYR 180 N -1.00 0.08 -0.21 1.37 3.20 -1.35 -2.19 116.97 116.87 1ur2 h TYR 180 Ca -0.03 0.04 -0.15 0.00 3.14 0.00 0.00 58.73 61.73 1ur2 h TYR 180 Cb 0.66 0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.97 1ur2 h TYR 180 CO 0.14 -0.07 -0.47 -0.91 -1.64 0.00 0.00 178.16 175.20 1ur2 h ASN 181 N 0.19 0.59 -0.13 -2.11 -0.26 -0.97 -2.02 115.58 110.87 1ur2 h ASN 181 Ca 0.28 -0.29 -0.00 0.00 -0.56 0.00 0.00 56.30 55.73 1ur2 h ASN 181 Cb 0.43 -0.17 -0.01 0.00 -1.06 0.00 0.00 38.32 37.51 1ur2 h ASN 181 CO -0.41 0.98 0.08 0.00 -1.06 0.00 0.00 177.43 177.01 1ur2 h ALA 182 N 1.04 0.17 -0.41 -0.83 0.00 -1.28 0.34 119.26 118.30 1ur2 h ALA 182 Ca 0.02 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1ur2 h ALA 182 Cb 0.99 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 1ur2 h ALA 182 CO 0.09 -0.32 0.13 0.74 0.00 0.00 0.00 179.25 179.89 1ur2 h PHE 183 N 0.15 0.66 -0.32 0.00 -1.00 -1.40 -0.79 116.94 114.24 1ur2 h PHE 183 Ca 0.05 -0.06 0.03 0.00 2.81 0.00 0.00 57.97 60.79 1ur2 h PHE 183 Cb 0.02 -0.19 -0.03 0.00 3.61 0.00 0.00 35.95 39.36 1ur2 h PHE 183 CO -0.06 0.60 0.14 1.15 -1.61 0.00 0.00 178.31 178.54 1ur2 h THR 184 N 0.52 0.96 -0.04 -1.55 2.02 -1.16 -0.42 112.91 113.25 1ur2 h THR 184 Ca 0.13 -0.10 -0.00 0.00 0.77 0.00 0.00 66.41 67.21 1ur2 h THR 184 Cb 0.25 0.63 -0.00 0.00 -1.74 0.00 0.00 68.15 67.29 1ur2 h THR 184 CO -0.01 0.06 0.02 -0.07 0.37 0.00 0.00 175.52 175.89 1ur2 h LEU 185 N 0.30 0.04 -0.98 2.58 3.38 -0.86 -1.56 115.31 118.22 1ur2 h LEU 185 Ca 0.14 -0.09 0.06 0.00 0.09 0.00 0.00 57.88 58.08 1ur2 h LEU 185 Cb 0.07 -0.01 -0.07 0.00 0.09 0.00 0.00 40.66 40.74 1ur2 h LEU 185 CO -0.11 0.13 0.63 0.00 0.09 0.00 0.00 178.44 179.18 1ur2 h ALA 186 N 0.92 1.35 -0.30 1.53 0.00 -0.93 -0.82 119.26 121.01 1ur2 h ALA 186 Ca 0.01 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 1ur2 h ALA 186 Cb 0.09 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1ur2 h ALA 186 CO -0.00 0.43 -0.19 -0.97 0.00 0.00 0.00 179.25 178.52 1ur2 h ASN 187 N 1.15 0.53 0.02 0.00 -0.00 -0.83 -0.26 115.58 116.19 1ur2 h ASN 187 Ca 0.42 -0.16 -0.15 0.00 -0.00 0.00 0.00 56.30 56.41 1ur2 h ASN 187 Cb 0.15 -0.14 -0.01 0.00 -0.00 0.00 0.00 38.32 38.32 1ur2 h ASN 187 CO -0.17 0.73 -0.50 -0.33 -0.00 0.00 0.00 177.43 177.16 1ur2 h GLU 188 N 0.48 0.54 0.14 6.67 5.08 -0.49 -2.61 114.58 124.39 1ur2 h GLU 188 Ca 0.08 -0.32 -0.22 0.00 -1.00 0.00 0.00 59.36 57.90 1ur2 h GLU 188 Cb 0.60 0.03 0.02 0.00 0.50 0.00 0.00 28.75 29.90 1ur2 h GLU 188 CO 0.04 0.92 -0.94 0.28 -1.00 0.00 0.00 179.01 178.31 1ur2 h VAL 189 N 0.43 1.44 -2.78 3.13 2.07 -0.88 -3.40 116.25 116.26 1ur2 h VAL 189 Ca 0.02 -2.49 -0.60 0.00 0.82 0.00 0.00 66.70 64.45 1ur2 h VAL 189 Cb 1.03 3.03 -0.40 0.00 -1.52 0.00 0.00 31.29 33.44 1ur2 h VAL 189 CO 0.09 0.72 -0.80 -0.62 0.02 0.00 0.00 177.57 176.99 1ur2 s ASP 190 N -7.09 3.18 0.62 0.57 -1.08 -0.14 -4.81 116.67 107.92 1ur2 s ASP 190 Ca -0.12 -2.67 0.37 0.00 -0.52 0.00 0.00 52.55 49.61 1ur2 s ASP 190 Cb 0.02 -0.80 2.01 0.00 -1.46 0.00 0.00 42.92 42.69 1ur2 s ASP 190 CO 0.86 -0.25 2.13 -0.65 0.52 0.00 0.00 175.17 177.78 1ur2 h PRO 191 N 6.53 0.00 0.00 4.34 0.11 -1.68 -1.84 132.00 139.47 1ur2 h PRO 191 Ca 0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.18 1ur2 h PRO 191 Cb 0.92 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.03 1ur2 h PRO 191 CO 0.42 0.00 -0.72 1.63 -0.21 0.00 0.00 178.00 179.12 1ur2 n LYS 192 N -2.89 0.30 -2.07 1.05 5.02 -1.26 -4.93 118.16 113.37 1ur2 n LYS 192 Ca -0.02 0.07 -0.40 0.00 -2.02 0.00 0.00 58.31 55.93 1ur2 n LYS 192 Cb 0.16 -1.67 -0.01 0.00 -0.02 0.00 0.00 35.03 33.49 1ur2 n LYS 192 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ur2 s ALA 193 N -3.18 3.38 -0.43 7.82 0.00 -0.69 -4.95 121.76 123.71 1ur2 s ALA 193 Ca 0.05 1.26 -0.26 0.00 0.00 0.00 0.00 51.96 53.02 1ur2 s ALA 193 Cb 0.13 -3.49 0.02 0.00 0.00 0.00 0.00 23.12 19.79 1ur2 s ALA 193 CO 0.74 -0.75 0.92 -1.58 0.00 0.00 0.00 175.76 175.10 1ur2 s HIS 194 N -1.20 2.97 -0.15 0.00 2.46 -0.21 -4.93 115.29 114.23 1ur2 s HIS 194 Ca 0.53 0.51 -0.14 0.00 0.47 0.00 0.00 55.06 56.43 1ur2 s HIS 194 Cb -0.39 -3.86 -0.05 0.00 -0.13 0.00 0.00 32.58 28.16 1ur2 s HIS 194 CO 0.51 -1.00 0.32 -0.51 -2.47 0.00 0.00 174.74 171.59 1ur2 s LEU 195 N 3.66 4.25 0.08 8.88 1.43 -1.26 -1.19 118.68 134.53 1ur2 s LEU 195 Ca 0.37 0.56 0.08 0.00 -1.03 0.00 0.00 54.13 54.11 1ur2 s LEU 195 Cb -0.11 -2.42 -0.03 0.00 0.03 0.00 0.00 46.19 43.66 1ur2 s LEU 195 CO 0.24 0.09 -0.21 -0.04 0.23 0.00 0.00 176.35 176.66 1ur2 s MET 196 N 0.45 1.21 -0.16 1.70 -1.94 -0.10 -0.94 119.30 119.53 1ur2 s MET 196 Ca 0.18 -1.08 -0.08 0.00 -1.71 0.00 0.00 55.69 53.00 1ur2 s MET 196 Cb -0.13 -1.43 -0.04 0.00 2.01 0.00 0.00 34.83 35.24 1ur2 s MET 196 CO 0.05 0.34 0.10 -0.47 -0.01 0.00 0.00 175.02 175.03 1ur2 s TYR 197 N -1.03 3.40 -0.03 -0.03 5.04 -1.02 -1.12 117.35 122.56 1ur2 s TYR 197 Ca 0.07 0.31 0.04 0.00 -2.44 0.00 0.00 57.07 55.05 1ur2 s TYR 197 Cb -0.10 -2.03 -0.01 0.00 0.35 0.00 0.00 41.96 40.18 1ur2 s TYR 197 CO 0.03 0.42 -0.16 1.21 -1.34 0.00 0.00 175.55 175.72 1ur2 s ASN 198 N -0.21 1.93 0.13 4.32 2.47 -0.86 0.22 114.94 122.93 1ur2 s ASN 198 Ca 0.09 -0.31 -0.24 0.00 0.42 0.00 0.00 52.86 52.83 1ur2 s ASN 198 Cb -0.12 -0.40 0.07 0.00 -1.45 0.00 0.00 41.25 39.35 1ur2 s ASN 198 CO 0.01 0.16 0.63 -0.62 -3.72 0.00 0.00 177.10 173.56 1ur2 s ASP 199 N -0.11 -0.57 0.15 -4.21 -1.08 -0.76 -0.65 116.67 109.44 1ur2 s ASP 199 Ca 0.00 0.08 0.03 0.00 -0.52 0.00 0.00 52.55 52.14 1ur2 s ASP 199 Cb -0.09 0.58 -0.04 0.00 -1.46 0.00 0.00 42.92 41.91 1ur2 s ASP 199 CO 0.01 -0.91 0.26 -0.72 0.52 0.00 0.00 175.17 174.33 1ur2 s TYR 200 N -3.42 3.43 0.00 -5.34 1.13 -1.26 -1.35 117.35 110.54 1ur2 s TYR 200 Ca -0.00 0.10 0.00 0.00 -1.41 0.00 0.00 57.07 55.76 1ur2 s TYR 200 Cb -0.01 -1.64 0.00 0.00 -1.10 0.00 0.00 41.96 39.21 1ur2 s TYR 200 CO -0.10 0.52 0.00 0.09 -2.51 0.00 0.00 175.55 173.54 1ur2 n ASN 201 N -0.51 -4.24 0.00 -0.18 3.02 -1.26 -4.82 115.26 107.27 1ur2 n ASN 201 Ca -0.07 0.00 0.12 0.00 -0.03 0.00 0.00 54.58 54.60 1ur2 n ASN 201 Cb 0.54 -2.34 0.70 0.00 -0.61 0.00 0.00 39.78 38.06 1ur2 n ASN 201 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 1ur2 n ILE 202 N -2.30 0.00 0.38 2.41 -5.35 -1.26 -1.92 119.36 111.33 1ur2 n ILE 202 Ca 0.00 0.00 0.13 0.00 -0.27 0.00 0.00 62.75 62.61 1ur2 n ILE 202 Cb 0.28 -0.37 0.53 0.00 -1.74 0.00 0.00 39.64 38.33 1ur2 n ILE 202 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 1ur2 h GLU 203 N 0.00 0.00 -6.05 6.28 3.07 -1.90 -3.37 114.58 112.61 1ur2 h GLU 203 Ca 0.00 0.00 -0.66 0.00 -0.50 0.00 0.00 59.36 58.20 1ur2 h GLU 203 Cb 0.00 0.00 -0.11 0.00 -0.84 0.00 0.00 28.75 27.80 1ur2 h GLU 203 CO 0.00 0.00 -0.59 1.03 -1.40 0.00 0.00 179.01 178.05 1ur2 s ARG 204 N -3.38 2.98 0.26 2.33 0.52 -0.81 -3.71 118.95 117.15 1ur2 s ARG 204 Ca 0.04 -0.53 -0.31 0.00 -0.52 0.00 0.00 55.73 54.42 1ur2 s ARG 204 Cb 0.09 -2.80 -0.12 0.00 0.52 0.00 0.00 34.95 32.63 1ur2 s ARG 204 CO 0.45 0.64 1.52 2.41 0.02 0.00 0.00 175.30 180.34 1ur2 n THR 205 N 1.21 0.91 0.00 0.02 -1.04 -1.26 -1.13 114.28 112.98 1ur2 n THR 205 Ca -0.13 -0.23 0.00 0.00 -2.04 0.00 0.00 64.05 61.65 1ur2 n THR 205 Cb 0.53 -1.74 0.00 0.00 -1.82 0.00 0.00 70.33 67.30 1ur2 n THR 205 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ur2 n GLY 206 N 2.29 2.32 0.21 3.41 0.00 -1.26 -4.69 105.19 107.47 1ur2 n GLY 206 Ca 0.10 -0.69 0.01 0.00 0.00 0.00 0.00 46.02 45.44 1ur2 n GLY 206 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1ur2 h LYS 207 N 0.00 0.21 0.05 1.61 3.64 -1.81 -1.93 116.57 118.33 1ur2 h LYS 207 Ca 0.00 -0.07 0.03 0.00 -1.27 0.00 0.00 60.65 59.34 1ur2 h LYS 207 Cb 0.00 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 31.76 1ur2 h LYS 207 CO 0.00 0.48 -0.35 -0.09 -2.27 0.00 0.00 179.45 177.22 1ur2 h ARG 208 N 0.19 -0.51 -0.14 1.90 2.43 -1.30 -1.80 114.38 115.15 1ur2 h ARG 208 Ca 0.03 0.03 -0.14 0.00 -0.81 0.00 0.00 59.98 59.09 1ur2 h ARG 208 Cb 0.60 0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.25 1ur2 h ARG 208 CO 0.04 -0.34 -0.52 0.93 -1.51 0.00 0.00 179.97 178.57 1ur2 h GLU 209 N -0.53 0.38 -0.91 0.20 3.07 -1.73 -0.70 114.58 114.36 1ur2 h GLU 209 Ca 0.05 -0.23 -0.02 0.00 -0.50 0.00 0.00 59.36 58.66 1ur2 h GLU 209 Cb 0.59 0.02 -0.04 0.00 -0.84 0.00 0.00 28.75 28.48 1ur2 h GLU 209 CO -0.25 0.81 0.50 0.00 -1.40 0.00 0.00 179.01 178.67 1ur2 h ALA 210 N 1.14 1.16 -0.23 3.43 0.00 -1.33 -1.26 119.26 122.18 1ur2 h ALA 210 Ca 0.01 -0.13 -0.11 0.00 0.00 0.00 0.00 54.91 54.68 1ur2 h ALA 210 Cb 1.02 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 1ur2 h ALA 210 CO 0.09 0.67 -0.27 1.15 0.00 0.00 0.00 179.25 180.89 1ur2 h THR 211 N 1.27 1.32 -0.65 0.00 2.02 -0.76 -1.90 112.91 114.21 1ur2 h THR 211 Ca 0.32 -1.45 0.10 0.00 0.77 0.00 0.00 66.41 66.15 1ur2 h THR 211 Cb 0.03 1.73 -0.08 0.00 -1.74 0.00 0.00 68.15 68.09 1ur2 h THR 211 CO -0.05 0.45 0.26 0.58 0.37 0.00 0.00 175.52 177.13 1ur2 h VAL 212 N 0.28 0.75 -0.34 3.16 2.07 -0.98 -0.96 116.25 120.23 1ur2 h VAL 212 Ca 0.03 -0.15 -0.08 0.00 0.82 0.00 0.00 66.70 67.32 1ur2 h VAL 212 Cb 0.84 0.28 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 1ur2 h VAL 212 CO 0.06 0.08 -0.12 -0.08 0.02 0.00 0.00 177.57 177.54 1ur2 h GLU 213 N 0.44 0.69 -0.13 1.57 4.81 -1.01 -0.01 114.58 120.93 1ur2 h GLU 213 Ca 0.34 -0.28 0.01 0.00 -0.13 0.00 0.00 59.36 59.30 1ur2 h GLU 213 Cb 0.43 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.76 1ur2 h GLU 213 CO -0.32 0.87 0.03 1.98 -0.73 0.00 0.00 179.01 180.83 1ur2 h MET 214 N 0.47 0.08 -0.50 1.92 4.05 -1.11 -2.42 114.93 117.42 1ur2 h MET 214 Ca 0.08 -0.01 -0.09 0.00 -0.28 0.00 0.00 59.70 59.40 1ur2 h MET 214 Cb 0.63 -0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 31.40 1ur2 h MET 214 CO 0.04 0.06 -0.06 0.82 0.23 0.00 0.00 176.91 178.00 1ur2 h ILE 215 N 0.09 1.27 -0.48 1.77 1.08 -1.07 -2.11 117.51 118.05 1ur2 h ILE 215 Ca 0.06 -1.17 0.09 0.00 -0.39 0.00 0.00 64.86 63.45 1ur2 h ILE 215 Cb 0.04 1.02 -0.08 0.00 -3.07 0.00 0.00 36.82 34.74 1ur2 h ILE 215 CO -0.07 0.41 0.03 -0.33 -0.69 0.00 0.00 178.15 177.49 1ur2 h GLU 216 N 0.77 0.14 -0.46 2.37 5.08 -0.90 0.94 114.58 122.53 1ur2 h GLU 216 Ca 0.13 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.45 1ur2 h GLU 216 Cb 0.60 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.79 1ur2 h GLU 216 CO 0.04 0.09 0.15 -0.09 -1.00 0.00 0.00 179.01 178.20 1ur2 h ARG 217 N 0.14 0.70 -0.40 2.33 2.43 -1.30 -2.13 114.38 116.15 1ur2 h ARG 217 Ca 0.24 -0.15 -0.10 0.00 -0.81 0.00 0.00 59.98 59.17 1ur2 h ARG 217 Cb 0.36 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.79 1ur2 h ARG 217 CO -0.38 0.67 -0.17 -0.07 -1.51 0.00 0.00 179.97 178.50 1ur2 h LEU 218 N 0.60 0.76 -0.64 3.80 3.38 -0.95 -2.49 115.31 119.76 1ur2 h LEU 218 Ca 0.15 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1ur2 h LEU 218 Cb 0.25 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 1ur2 h LEU 218 CO -0.01 0.93 0.42 1.56 0.09 0.00 0.00 178.44 181.43 1ur2 h GLN 219 N 0.67 0.85 0.00 1.13 4.20 -0.54 -1.77 115.11 119.65 1ur2 h GLN 219 Ca 0.10 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.76 1ur2 h GLN 219 Cb 0.66 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 28.25 1ur2 h GLN 219 CO 0.05 0.57 0.00 1.57 -0.67 0.00 0.00 178.83 180.35 1ur2 h LYS 220 N 0.87 0.00 0.00 1.46 5.09 -1.24 0.32 116.57 123.07 1ur2 h LYS 220 Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.97 1ur2 h LYS 220 Cb -0.09 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.24 1ur2 h LYS 220 CO -0.05 0.00 0.00 0.54 -2.09 0.00 0.00 179.45 177.85 1ur2 n ARG 221 N -2.88 0.08 -0.56 0.07 1.74 -0.84 -4.90 116.66 109.36 1ur2 n ARG 221 Ca 0.02 0.19 0.00 0.00 -0.77 0.00 0.00 57.85 57.29 1ur2 n ARG 221 Cb 0.36 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.30 1ur2 n ARG 221 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ur2 n GLY 222 N 0.21 0.68 3.72 -0.13 0.00 0.11 -5.03 105.19 104.75 1ur2 n GLY 222 Ca 0.05 -0.37 -0.42 0.00 0.00 0.00 0.00 46.02 45.29 1ur2 n GLY 222 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1ur2 s MET 223 N -0.84 4.22 -0.08 1.61 1.75 -0.73 -4.93 119.30 120.30 1ur2 s MET 223 Ca 0.00 2.34 -0.30 0.00 -1.25 0.00 0.00 55.69 56.48 1ur2 s MET 223 Cb 0.00 -3.16 -0.03 0.00 2.84 0.00 0.00 34.83 34.48 1ur2 s MET 223 CO 0.00 -0.59 1.30 -1.25 -0.65 0.00 0.00 175.02 173.83 1ur2 s PRO 224 N 1.07 4.28 -0.23 4.11 0.04 -1.26 -4.67 135.00 138.34 1ur2 s PRO 224 Ca 0.69 1.77 -0.15 0.00 0.04 0.00 0.00 61.00 63.35 1ur2 s PRO 224 Cb -0.43 -3.66 0.07 0.00 0.04 0.00 0.00 34.50 30.51 1ur2 s PRO 224 CO 0.32 -0.59 0.57 -1.50 0.04 0.00 0.00 177.00 175.83 1ur2 s ILE 225 N 2.82 -0.01 -0.04 0.56 2.07 -1.26 -4.74 121.20 120.59 1ur2 s ILE 225 Ca 0.58 0.03 0.05 0.00 -1.41 0.00 0.00 60.65 59.91 1ur2 s ILE 225 Cb -0.26 -0.82 -0.08 0.00 0.13 0.00 0.00 42.46 41.44 1ur2 s ILE 225 CO 0.21 0.01 0.05 1.41 -1.91 0.00 0.00 174.94 174.71 1ur2 n HIS 226 N 3.84 0.00 -4.02 3.50 8.25 -0.11 -4.98 115.22 121.70 1ur2 n HIS 226 Ca -0.19 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.18 1ur2 n HIS 226 Cb 0.57 -0.24 -0.09 0.00 1.12 0.00 0.00 29.99 31.36 1ur2 n HIS 226 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1ur2 s GLY 227 N -3.40 0.49 -0.13 -1.41 0.00 -0.43 -1.79 107.32 100.66 1ur2 s GLY 227 Ca -0.03 -1.06 -0.02 0.00 0.00 0.00 0.00 44.72 43.61 1ur2 s GLY 227 CO 0.24 -1.12 0.00 -2.27 0.00 0.00 0.00 173.10 169.95 1ur2 s LEU 228 N -2.94 0.96 -0.32 0.66 1.98 0.44 -2.43 118.68 117.04 1ur2 s LEU 228 Ca 0.12 -0.43 -0.15 0.00 -2.89 0.00 0.00 54.13 50.79 1ur2 s LEU 228 Cb 0.06 -0.58 -0.02 0.00 0.66 0.00 0.00 46.19 46.31 1ur2 s LEU 228 CO -0.06 -0.22 0.35 -0.83 -1.89 0.00 0.00 176.35 173.69 1ur2 s GLY 229 N 1.87 1.90 -0.28 7.98 0.00 0.13 -1.12 107.32 117.79 1ur2 s GLY 229 Ca 0.02 -1.09 -0.15 0.00 0.00 0.00 0.00 44.72 43.51 1ur2 s GLY 229 CO -0.07 0.95 0.37 -0.42 0.00 0.00 0.00 173.10 173.94 1ur2 s ILE 230 N 2.01 5.17 0.20 0.90 1.01 0.60 -1.82 121.20 129.27 1ur2 s ILE 230 Ca 0.12 0.46 -0.09 0.00 0.00 0.00 0.00 60.65 61.14 1ur2 s ILE 230 Cb -0.16 -3.72 0.14 0.00 0.01 0.00 0.00 42.46 38.72 1ur2 s ILE 230 CO 0.11 0.10 1.79 1.56 0.00 0.00 0.00 174.94 178.50 1ur2 h GLN 231 N 8.24 1.07 -3.63 2.79 4.20 -1.50 -1.47 115.11 124.82 1ur2 h GLN 231 Ca -0.31 -0.17 -0.23 0.00 0.06 0.00 0.00 58.65 58.00 1ur2 h GLN 231 Cb 1.16 -0.19 0.07 0.00 0.30 0.00 0.00 27.48 28.82 1ur2 h GLN 231 CO 0.65 0.85 -0.39 0.41 -0.67 0.00 0.00 178.83 179.69 1ur2 n GLY 232 N -0.95 0.07 3.54 3.46 0.00 -1.26 -0.07 105.19 109.97 1ur2 n GLY 232 Ca 0.06 -0.16 -0.41 0.00 0.00 0.00 0.00 46.02 45.51 1ur2 n GLY 232 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ur2 s HIS 233 N -3.14 2.51 0.16 1.61 3.76 -1.26 -2.50 115.29 116.43 1ur2 s HIS 233 Ca 0.31 -0.61 0.02 0.00 -0.15 0.00 0.00 55.06 54.64 1ur2 s HIS 233 Cb -0.14 -4.61 -0.04 0.00 1.11 0.00 0.00 32.58 28.90 1ur2 s HIS 233 CO 0.39 -1.93 0.29 -0.51 -0.85 0.00 0.00 174.74 172.13 1ur2 s LEU 234 N 4.97 4.33 0.52 0.89 1.43 -0.43 -4.91 118.68 125.47 1ur2 s LEU 234 Ca 0.40 0.18 -0.02 0.00 -1.03 0.00 0.00 54.13 53.66 1ur2 s LEU 234 Cb -0.04 -2.92 0.01 0.00 0.03 0.00 0.00 46.19 43.26 1ur2 s LEU 234 CO -0.00 0.04 0.77 -0.83 0.23 0.00 0.00 176.35 176.56 1ur2 s GLY 235 N -3.26 1.61 0.49 -3.19 0.00 0.67 -0.57 107.32 103.08 1ur2 s GLY 235 Ca 0.35 -0.96 0.14 0.00 0.00 0.00 0.00 44.72 44.24 1ur2 s GLY 235 CO 0.29 -0.73 2.12 1.19 0.00 0.00 0.00 173.10 175.96 1ur2 h ILE 236 N 0.14 1.03 0.00 0.90 6.09 -1.70 -3.33 117.51 120.63 1ur2 h ILE 236 Ca -0.45 -0.05 -0.28 0.00 -1.37 0.00 0.00 64.86 62.71 1ur2 h ILE 236 Cb 1.26 0.86 -0.04 0.00 0.47 0.00 0.00 36.82 39.37 1ur2 h ILE 236 CO 0.58 0.03 -1.89 0.47 -3.07 0.00 0.00 178.15 174.27 1ur2 n ASP 237 N -4.52 1.32 -4.68 2.19 8.00 -1.26 -4.88 116.55 112.71 1ur2 n ASP 237 Ca -0.01 0.23 -0.29 0.00 0.71 0.00 0.00 54.79 55.42 1ur2 n ASP 237 Cb 0.09 -0.54 -0.08 0.00 -0.02 0.00 0.00 41.12 40.57 1ur2 n ASP 237 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1ur2 s THR 238 N -2.36 3.97 0.67 -3.53 -4.23 -1.25 -4.29 115.64 104.62 1ur2 s THR 238 Ca -0.25 -1.07 -0.10 0.00 -1.18 0.00 0.00 61.69 59.09 1ur2 s THR 238 Cb 0.09 -2.91 0.00 0.00 1.34 0.00 0.00 72.50 71.02 1ur2 s THR 238 CO 0.32 0.08 1.05 -2.16 -0.54 0.00 0.00 174.62 173.36 1ur2 s PRO 239 N -2.43 3.01 0.59 3.99 0.04 -1.26 -0.23 135.00 138.70 1ur2 s PRO 239 Ca 0.26 0.44 -0.17 0.00 0.04 0.00 0.00 61.00 61.57 1ur2 s PRO 239 Cb -0.11 -2.08 -0.04 0.00 0.04 0.00 0.00 34.50 32.31 1ur2 s PRO 239 CO 0.18 -0.88 1.10 -1.25 0.04 0.00 0.00 177.00 176.19 1ur2 s PRO 240 N -5.26 3.19 0.32 0.56 0.04 -1.26 -4.92 135.00 127.68 1ur2 s PRO 240 Ca 0.57 1.42 0.08 0.00 0.04 0.00 0.00 61.00 63.11 1ur2 s PRO 240 Cb -0.11 -2.00 0.82 0.00 0.04 0.00 0.00 34.50 33.25 1ur2 s PRO 240 CO 0.51 -0.94 1.78 0.82 0.04 0.00 0.00 177.00 179.21 1ur2 h ILE 241 N 0.65 0.67 -0.52 0.56 1.08 -1.97 -1.30 117.51 116.68 1ur2 h ILE 241 Ca -0.48 -0.23 0.01 0.00 -0.39 0.00 0.00 64.86 63.77 1ur2 h ILE 241 Cb 1.24 -0.07 -0.03 0.00 -3.07 0.00 0.00 36.82 34.90 1ur2 h ILE 241 CO 0.56 0.12 0.35 0.00 -0.69 0.00 0.00 178.15 178.49 1ur2 h ALA 242 N 1.65 1.66 -0.20 1.87 0.00 -1.99 0.76 119.26 123.00 1ur2 h ALA 242 Ca 0.58 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 55.36 1ur2 h ALA 242 Cb 1.01 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 1ur2 h ALA 242 CO -0.36 0.31 -0.24 0.93 0.00 0.00 0.00 179.25 179.89 1ur2 h GLU 243 N 0.68 0.52 -0.71 0.00 4.39 -1.52 -2.55 114.58 115.39 1ur2 h GLU 243 Ca 0.20 -0.29 -0.05 0.00 0.34 0.00 0.00 59.36 59.56 1ur2 h GLU 243 Cb -0.04 0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 28.60 1ur2 h GLU 243 CO -0.04 0.88 0.25 0.82 -1.16 0.00 0.00 179.01 179.75 1ur2 h ILE 244 N 0.19 1.25 -0.29 3.13 2.04 -1.17 -2.48 117.51 120.18 1ur2 h ILE 244 Ca 0.03 -0.84 0.00 0.00 1.00 0.00 0.00 64.86 65.05 1ur2 h ILE 244 Cb 0.80 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 37.31 1ur2 h ILE 244 CO 0.06 0.33 0.19 -0.08 0.00 0.00 0.00 178.15 178.65 1ur2 h GLU 245 N 1.05 0.37 -0.97 2.37 4.81 -0.85 -1.40 114.58 119.95 1ur2 h GLU 245 Ca 0.23 -0.02 0.12 0.00 -0.13 0.00 0.00 59.36 59.57 1ur2 h GLU 245 Cb 0.26 -0.08 -0.08 0.00 0.63 0.00 0.00 28.75 29.47 1ur2 h GLU 245 CO -0.01 0.25 0.62 0.87 -0.73 0.00 0.00 179.01 180.00 1ur2 h LYS 246 N 0.38 0.90 -0.39 1.92 1.57 -1.02 -2.01 116.57 117.92 1ur2 h LYS 246 Ca 0.11 -0.05 -0.11 0.00 -1.87 0.00 0.00 60.65 58.72 1ur2 h LYS 246 Cb -0.04 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.06 1ur2 h LYS 246 CO -0.03 0.59 -0.18 0.77 -0.57 0.00 0.00 179.45 180.03 1ur2 h SER 247 N 0.92 0.83 -0.31 0.86 0.02 -1.03 -0.49 113.55 114.36 1ur2 h SER 247 Ca 0.48 -0.40 0.01 0.00 -0.84 0.00 0.00 61.79 61.04 1ur2 h SER 247 Cb 0.54 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.83 1ur2 h SER 247 CO -0.25 1.05 0.18 0.40 -1.14 0.00 0.00 176.83 177.07 1ur2 h ILE 248 N 0.61 1.03 -0.40 3.27 2.04 -0.76 -0.98 117.51 122.32 1ur2 h ILE 248 Ca 0.09 -0.12 -0.04 0.00 1.00 0.00 0.00 64.86 65.78 1ur2 h ILE 248 Cb 0.74 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 37.43 1ur2 h ILE 248 CO 0.06 0.07 0.10 0.40 0.00 0.00 0.00 178.15 178.78 1ur2 h ILE 249 N 0.36 1.23 -0.41 -0.67 2.04 -1.31 -1.56 117.51 117.19 1ur2 h ILE 249 Ca 0.12 -0.77 -0.06 0.00 1.00 0.00 0.00 64.86 65.15 1ur2 h ILE 249 Cb 0.01 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 37.04 1ur2 h ILE 249 CO -0.06 0.27 0.02 0.00 0.00 0.00 0.00 178.15 178.38 1ur2 h ALA 250 N 0.95 0.55 -0.01 1.87 0.00 -0.85 -2.22 119.26 119.56 1ur2 h ALA 250 Ca 0.13 -0.25 -0.17 0.00 0.00 0.00 0.00 54.91 54.62 1ur2 h ALA 250 Cb 0.30 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1ur2 h ALA 250 CO 0.00 0.31 -0.78 0.74 0.00 0.00 0.00 179.25 179.52 1ur2 h PHE 251 N 0.55 0.13 -0.22 0.00 0.04 -1.17 -2.78 116.94 113.50 1ur2 h PHE 251 Ca 0.12 -0.07 -0.05 0.00 2.80 0.00 0.00 57.97 60.77 1ur2 h PHE 251 Cb 0.45 -0.02 -0.01 0.00 2.20 0.00 0.00 35.95 38.57 1ur2 h PHE 251 CO 0.03 0.84 -0.08 0.00 -0.60 0.00 0.00 178.31 178.50 1ur2 h ALA 252 N 1.14 1.47 0.00 2.45 0.00 -1.17 -2.30 119.26 120.84 1ur2 h ALA 252 Ca -0.02 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1ur2 h ALA 252 Cb 1.38 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1ur2 h ALA 252 CO 0.11 0.38 0.00 0.87 0.00 0.00 0.00 179.25 180.61 1ur2 h LYS 253 N 0.32 0.00 -0.01 0.00 1.57 -1.11 -0.80 116.57 116.55 1ur2 h LYS 253 Ca 0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1ur2 h LYS 253 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.66 1ur2 h LYS 253 CO 0.02 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.18 1ur2 n LEU 254 N -2.40 0.10 -0.82 2.94 4.77 -0.87 -4.88 117.00 115.84 1ur2 n LEU 254 Ca 0.01 -0.04 -0.06 0.00 -0.03 0.00 0.00 56.01 55.89 1ur2 n LEU 254 Cb 0.20 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 1ur2 n LEU 254 CO 0.19 0.02 -0.03 0.61 -1.33 0.00 0.00 177.39 176.85 1ur2 n GLY 255 N 0.89 0.26 3.35 -0.72 0.00 -0.31 -5.03 105.19 103.64 1ur2 n GLY 255 Ca 0.18 -0.59 -0.31 0.00 0.00 0.00 0.00 46.02 45.30 1ur2 n GLY 255 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ur2 s LEU 256 N -1.89 2.21 0.22 0.99 1.43 -1.24 -4.95 118.68 115.45 1ur2 s LEU 256 Ca 0.04 -0.52 -0.30 0.00 -1.03 0.00 0.00 54.13 52.32 1ur2 s LEU 256 Cb -0.02 -1.34 -0.09 0.00 0.03 0.00 0.00 46.19 44.78 1ur2 s LEU 256 CO 0.05 0.28 1.16 -0.13 0.23 0.00 0.00 176.35 177.95 1ur2 s ARG 257 N -1.06 4.54 -0.16 1.70 1.81 -0.74 -4.30 118.95 120.73 1ur2 s ARG 257 Ca 0.12 1.85 -0.12 0.00 -1.72 0.00 0.00 55.73 55.86 1ur2 s ARG 257 Cb -0.10 -3.22 -0.05 0.00 -0.45 0.00 0.00 34.95 31.13 1ur2 s ARG 257 CO 0.01 0.01 0.22 0.08 -0.68 0.00 0.00 175.30 174.95 1ur2 s VAL 258 N -0.46 5.35 -0.02 3.52 1.01 -0.60 -0.42 120.40 128.78 1ur2 s VAL 258 Ca 0.50 0.39 0.06 0.00 0.00 0.00 0.00 61.98 62.94 1ur2 s VAL 258 Cb -0.32 -3.55 -0.02 0.00 0.00 0.00 0.00 36.38 32.49 1ur2 s VAL 258 CO 0.39 0.44 -0.21 -1.00 0.00 0.00 0.00 175.10 174.72 1ur2 s HIS 259 N 0.20 1.87 -0.28 5.22 3.76 -0.28 -0.75 115.29 125.03 1ur2 s HIS 259 Ca 0.14 -0.35 -0.13 0.00 -0.15 0.00 0.00 55.06 54.56 1ur2 s HIS 259 Cb -0.12 -1.21 -0.04 0.00 1.11 0.00 0.00 32.58 32.32 1ur2 s HIS 259 CO 0.02 -0.03 0.27 -0.06 -0.85 0.00 0.00 174.74 174.08 1ur2 s PHE 260 N -0.49 3.23 -0.05 1.40 0.40 -0.19 -0.29 117.98 121.99 1ur2 s PHE 260 Ca 0.08 0.24 0.10 0.00 -0.60 0.00 0.00 56.93 56.75 1ur2 s PHE 260 Cb -0.08 -2.46 -0.15 0.00 0.51 0.00 0.00 43.02 40.84 1ur2 s PHE 260 CO -0.01 -0.19 0.15 0.25 0.70 0.00 0.00 175.22 176.13 1ur2 n THR 261 N 5.08 0.31 -2.75 0.64 -2.24 -0.55 0.07 114.28 114.84 1ur2 n THR 261 Ca -0.12 -0.34 -0.04 0.00 -2.27 0.00 0.00 64.05 61.29 1ur2 n THR 261 Cb 0.51 -0.18 0.06 0.00 -2.10 0.00 0.00 70.33 68.63 1ur2 n THR 261 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1ur2 n SER 262 N -2.10 0.71 -4.74 3.42 7.64 0.89 -4.56 113.62 114.88 1ur2 n SER 262 Ca -0.08 -2.30 -0.42 0.00 1.01 0.00 0.00 58.87 57.08 1ur2 n SER 262 Cb 0.53 -0.16 -0.02 0.00 -1.01 0.00 0.00 64.21 63.54 1ur2 n SER 262 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1ur2 s LEU 263 N -3.60 4.37 0.12 -3.43 1.43 -0.03 -4.04 118.68 113.50 1ur2 s LEU 263 Ca 0.24 2.69 -0.25 0.00 -1.03 0.00 0.00 54.13 55.77 1ur2 s LEU 263 Cb 0.39 -3.61 0.07 0.00 0.03 0.00 0.00 46.19 43.07 1ur2 s LEU 263 CO -0.04 -0.78 0.81 1.51 0.23 0.00 0.00 176.35 178.09 1ur2 s ASP 264 N 0.65 -0.35 -0.20 2.29 1.47 -1.04 -0.73 116.67 118.75 1ur2 s ASP 264 Ca 0.64 -0.19 -0.00 0.00 1.18 0.00 0.00 52.55 54.18 1ur2 s ASP 264 Cb -0.43 0.51 0.05 0.00 -0.34 0.00 0.00 42.92 42.71 1ur2 s ASP 264 CO 0.40 -0.88 -0.05 -0.69 0.68 0.00 0.00 175.17 174.63 1ur2 s VAL 265 N -3.43 1.29 -0.34 2.11 1.01 -0.93 -1.32 120.40 118.80 1ur2 s VAL 265 Ca 0.07 -0.93 -0.29 0.00 0.00 0.00 0.00 61.98 60.83 1ur2 s VAL 265 Cb -0.02 -1.53 0.02 0.00 0.00 0.00 0.00 36.38 34.85 1ur2 s VAL 265 CO -0.05 -0.01 1.09 -0.62 0.00 0.00 0.00 175.10 175.52 1ur2 s ASP 266 N 1.53 6.89 0.00 3.32 -1.08 0.27 -4.07 116.67 123.52 1ur2 s ASP 266 Ca -0.03 0.99 0.23 0.00 -0.52 0.00 0.00 52.55 53.22 1ur2 s ASP 266 Cb -0.17 -2.54 0.47 0.00 -1.46 0.00 0.00 42.92 39.21 1ur2 s ASP 266 CO -0.07 -0.93 1.43 1.33 0.52 0.00 0.00 175.17 177.44 1ur2 n VAL 267 N 6.00 0.51 -3.96 1.11 0.24 -1.26 -1.91 118.33 119.06 1ur2 n VAL 267 Ca 0.12 -0.72 -0.26 0.00 -2.04 0.00 0.00 64.34 61.44 1ur2 n VAL 267 Cb 0.47 0.89 -0.03 0.00 -1.47 0.00 0.00 33.84 33.70 1ur2 n VAL 267 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1ur2 s LEU 268 N -1.46 4.29 0.05 1.34 1.43 -1.26 -5.01 118.68 118.06 1ur2 s LEU 268 Ca 0.39 0.14 -0.37 0.00 -1.03 0.00 0.00 54.13 53.25 1ur2 s LEU 268 Cb 0.22 -2.86 -0.17 0.00 0.03 0.00 0.00 46.19 43.41 1ur2 s LEU 268 CO 0.31 0.05 1.33 -2.65 0.23 0.00 0.00 176.35 175.62 1ur2 n PRO 269 N -0.58 0.98 -2.95 1.29 -0.02 -1.26 -4.90 135.00 127.57 1ur2 n PRO 269 Ca -0.07 0.36 -0.38 0.00 -2.02 0.00 0.00 63.50 61.38 1ur2 n PRO 269 Cb 0.54 -1.98 -0.06 0.00 -0.02 0.00 0.00 33.50 31.98 1ur2 n PRO 269 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1ur2 s SER 270 N 0.60 7.34 -0.08 2.55 0.15 -1.26 -4.97 113.70 118.04 1ur2 s SER 270 Ca 0.86 1.67 0.13 0.00 0.70 0.00 0.00 55.95 59.31 1ur2 s SER 270 Cb -1.01 -2.51 0.39 0.00 -1.71 0.00 0.00 66.02 61.18 1ur2 s SER 270 CO 0.49 0.12 1.31 1.33 1.20 0.00 0.00 173.24 177.70 1ur2 n VAL 271 N 1.22 1.55 0.99 4.45 0.24 -1.26 -4.68 118.33 120.84 1ur2 n VAL 271 Ca -0.03 -1.38 0.13 0.00 -2.04 0.00 0.00 64.34 61.02 1ur2 n VAL 271 Cb 0.49 0.18 0.47 0.00 -1.47 0.00 0.00 33.84 33.51 1ur2 n VAL 271 CO 0.00 0.00 0.00 0.79 -2.14 0.00 0.00 176.83 175.48 1ur2 n TRP 272 N 0.03 0.02 -2.71 6.34 5.03 -1.26 -4.15 117.44 120.74 1ur2 n TRP 272 Ca 0.15 0.01 -0.04 0.00 3.03 0.00 0.00 57.50 60.64 1ur2 n TRP 272 Cb 0.62 -0.42 0.04 0.00 -1.03 0.00 0.00 31.31 30.52 1ur2 n TRP 272 CO 0.00 0.00 0.00 0.39 -0.03 0.00 0.00 177.69 178.05 1ur2 n GLU 273 N -1.52 1.95 -3.33 -0.99 -0.58 -1.26 -5.11 120.64 109.80 1ur2 n GLU 273 Ca 0.06 -3.59 -0.25 0.00 -0.42 0.00 0.00 57.16 52.96 1ur2 n GLU 273 Cb 0.34 -1.67 -0.02 0.00 -0.57 0.00 0.00 31.44 29.52 1ur2 n GLU 273 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1ur2 s LEU 274 N -3.71 4.00 0.85 -4.62 1.43 -1.26 -5.07 118.68 110.30 1ur2 s LEU 274 Ca 0.30 0.53 -0.12 0.00 -1.03 0.00 0.00 54.13 53.82 1ur2 s LEU 274 Cb 0.35 -3.39 0.09 0.00 0.03 0.00 0.00 46.19 43.27 1ur2 s LEU 274 CO -0.02 -0.29 1.10 -2.65 0.23 0.00 0.00 176.35 174.72 1ur2 n PRO 275 N -1.61 -0.04 -0.01 1.29 -0.02 -1.26 -4.87 135.00 128.48 1ur2 n PRO 275 Ca -0.04 0.06 0.06 0.00 -2.02 0.00 0.00 63.50 61.57 1ur2 n PRO 275 Cb 0.56 -2.35 0.45 0.00 -0.02 0.00 0.00 33.50 32.13 1ur2 n PRO 275 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 1ur2 h VAL 276 N -1.23 1.05 -0.15 -1.45 3.04 -2.01 -1.04 116.25 114.46 1ur2 h VAL 276 Ca -0.45 -0.17 0.04 0.00 -1.01 0.00 0.00 66.70 65.11 1ur2 h VAL 276 Cb 1.29 0.51 -0.01 0.00 -2.01 0.00 0.00 31.29 31.08 1ur2 h VAL 276 CO 0.43 0.09 0.15 0.00 -1.01 0.00 0.00 177.57 177.24 1ur2 h ALA 277 N 1.75 1.83 -0.40 3.17 0.00 -2.06 -1.88 119.26 121.66 1ur2 h ALA 277 Ca 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1ur2 h ALA 277 Cb 0.08 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1ur2 h ALA 277 CO -0.04 -0.23 0.00 0.39 0.00 0.00 0.00 179.25 179.37 1ur2 n GLU 278 N -3.94 2.47 -0.05 0.00 1.02 -0.40 -4.66 120.64 115.09 1ur2 n GLU 278 Ca 0.01 -2.23 0.13 0.00 -0.02 0.00 0.00 57.16 55.05 1ur2 n GLU 278 Cb 0.27 -1.51 0.54 0.00 -0.02 0.00 0.00 31.44 30.72 1ur2 n GLU 278 CO 0.00 0.00 0.00 -0.24 1.18 0.00 0.00 177.13 178.07 1ur2 h VAL 279 N 4.31 0.87 0.05 2.62 3.04 -1.36 0.84 116.25 126.61 1ur2 h VAL 279 Ca 0.00 -0.11 -0.38 0.00 -1.01 0.00 0.00 66.70 65.21 1ur2 h VAL 279 Cb 0.95 0.54 -0.05 0.00 -2.01 0.00 0.00 31.29 30.72 1ur2 h VAL 279 CO 0.00 0.06 -2.24 -1.54 -1.01 0.00 0.00 177.57 172.84 1ur2 n SER 280 N -4.46 2.02 0.13 3.17 3.41 -1.26 -4.42 113.62 112.22 1ur2 n SER 280 Ca 0.09 0.07 0.13 0.00 -0.26 0.00 0.00 58.87 58.89 1ur2 n SER 280 Cb 0.40 -0.65 0.46 0.00 -0.26 0.00 0.00 64.21 64.16 1ur2 n SER 280 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 1ur2 h THR 281 N -0.13 0.00 0.00 6.66 1.35 -1.76 -3.27 112.91 115.75 1ur2 h THR 281 Ca -0.52 -0.38 -0.00 0.00 -0.55 0.00 0.00 66.41 64.95 1ur2 h THR 281 Cb 1.88 1.25 -0.00 0.00 -1.73 0.00 0.00 68.15 69.55 1ur2 h THR 281 CO -0.07 0.00 -0.01 0.08 -0.25 0.00 0.00 175.52 175.27 1ur2 h ARG 282 N 0.00 0.00 -0.01 4.72 0.11 -1.05 0.04 114.38 118.19 1ur2 h ARG 282 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1ur2 h ARG 282 Cb 0.55 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.63 1ur2 h ARG 282 CO 0.00 0.01 -0.05 1.19 0.10 0.00 0.00 179.97 181.23 1ur2 n PHE 283 N -3.19 0.00 -2.87 4.08 3.72 -1.23 -4.88 117.46 113.08 1ur2 n PHE 283 Ca -0.02 0.00 -0.35 0.00 -0.05 0.00 0.00 57.45 57.03 1ur2 n PHE 283 Cb 0.15 -0.05 -0.07 0.00 -0.94 0.00 0.00 39.48 38.58 1ur2 n PHE 283 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 1ur2 s GLU 284 N -2.14 4.35 0.08 -1.08 0.41 -0.00 -4.47 118.70 115.85 1ur2 s GLU 284 Ca 0.37 1.12 -0.31 0.00 -0.41 0.00 0.00 54.97 55.75 1ur2 s GLU 284 Cb 0.21 -2.54 -0.07 0.00 -1.78 0.00 0.00 34.13 29.95 1ur2 s GLU 284 CO 0.39 0.16 1.33 -0.47 -0.49 0.00 0.00 175.26 176.18 1ur2 s TYR 285 N -1.86 3.24 -0.01 1.61 5.04 -1.26 -4.99 117.35 119.12 1ur2 s TYR 285 Ca 0.54 1.04 0.01 0.00 -2.44 0.00 0.00 57.07 56.23 1ur2 s TYR 285 Cb -0.14 -3.59 0.00 0.00 0.35 0.00 0.00 41.96 38.58 1ur2 s TYR 285 CO 0.19 -2.03 -0.04 0.15 -1.34 0.00 0.00 175.55 172.48 1ur2 s LYS 286 N 1.31 0.42 0.30 4.97 1.02 -1.26 -5.06 119.74 121.43 1ur2 s LYS 286 Ca 0.62 -0.12 0.05 0.00 0.02 0.00 0.00 55.97 56.54 1ur2 s LYS 286 Cb -0.33 -0.44 0.73 0.00 -0.52 0.00 0.00 37.83 37.26 1ur2 s LYS 286 CO 0.29 0.04 1.74 -1.35 -0.92 0.00 0.00 175.35 175.16 1ur2 h PRO 287 N 6.37 0.60 0.00 -1.68 0.11 -1.95 -1.46 132.00 133.99 1ur2 h PRO 287 Ca -0.31 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1ur2 h PRO 287 Cb 1.18 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1ur2 h PRO 287 CO 0.50 0.39 0.00 0.93 -0.21 0.00 0.00 178.00 179.61 1ur2 h GLU 288 N 0.61 0.00 -0.01 1.05 3.07 -2.01 -1.00 114.58 116.29 1ur2 h GLU 288 Ca 0.57 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.43 1ur2 h GLU 288 Cb 0.96 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.87 1ur2 h GLU 288 CO -0.43 0.00 -0.06 0.54 -1.40 0.00 0.00 179.01 177.66 1ur2 n ARG 289 N -2.96 1.31 -3.19 2.33 1.74 -0.55 -4.34 116.66 110.99 1ur2 n ARG 289 Ca 0.00 -0.66 -0.23 0.00 -0.77 0.00 0.00 57.85 56.19 1ur2 n ARG 289 Cb 0.26 -1.49 -0.05 0.00 -1.02 0.00 0.00 32.46 30.16 1ur2 n ARG 289 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1ur2 n ASP 290 N -0.27 1.76 -0.04 0.55 2.03 -0.38 -4.24 116.55 115.97 1ur2 n ASP 290 Ca 0.18 -3.10 0.14 0.00 0.52 0.00 0.00 54.79 52.53 1ur2 n ASP 290 Cb 0.31 -0.62 0.63 0.00 -0.72 0.00 0.00 41.12 40.72 1ur2 n ASP 290 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1ur2 n PRO 291 N 0.66 0.36 -1.47 -0.67 -0.04 -1.25 -4.13 135.00 128.46 1ur2 n PRO 291 Ca 0.26 -0.07 -0.13 0.00 -0.04 0.00 0.00 63.50 63.52 1ur2 n PRO 291 Cb 0.53 -1.50 0.09 0.00 -0.04 0.00 0.00 33.50 32.58 1ur2 n PRO 291 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1ur2 n TYR 292 N -1.26 1.70 0.25 0.54 4.01 -1.26 -4.77 117.16 116.37 1ur2 n TYR 292 Ca 0.12 -1.95 0.11 0.00 -0.16 0.00 0.00 57.90 56.02 1ur2 n TYR 292 Cb 0.28 -0.31 0.68 0.00 -0.31 0.00 0.00 39.34 39.68 1ur2 n TYR 292 CO 0.00 0.00 0.00 1.79 -0.46 0.00 0.00 176.86 178.19 1ur2 h THR 293 N 1.72 0.67 -0.00 -0.72 1.35 -1.86 -1.97 112.91 112.09 1ur2 h THR 293 Ca 0.23 -0.58 0.00 0.00 -0.55 0.00 0.00 66.41 65.51 1ur2 h THR 293 Cb 1.33 1.36 0.00 0.00 -1.73 0.00 0.00 68.15 69.12 1ur2 h THR 293 CO 0.47 0.14 -0.21 0.29 -0.25 0.00 0.00 175.52 175.96 1ur2 n LYS 294 N -3.74 0.59 0.00 4.72 5.02 -1.26 -5.02 118.16 118.47 1ur2 n LYS 294 Ca -0.02 -0.27 0.00 0.00 -2.02 0.00 0.00 58.31 56.00 1ur2 n LYS 294 Cb 0.25 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.76 1ur2 n LYS 294 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ur2 n GLY 295 N 1.35 4.43 3.61 0.72 0.00 -0.74 -5.07 105.19 109.49 1ur2 n GLY 295 Ca 0.12 -1.47 -0.40 0.00 0.00 0.00 0.00 46.02 44.27 1ur2 n GLY 295 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ur2 s LEU 296 N 0.00 4.06 0.64 0.99 2.96 -1.26 -4.69 118.68 121.38 1ur2 s LEU 296 Ca 0.00 0.44 -0.17 0.00 -0.22 0.00 0.00 54.13 54.17 1ur2 s LEU 296 Cb 0.00 -2.60 -0.01 0.00 0.50 0.00 0.00 46.19 44.08 1ur2 s LEU 296 CO 0.00 -0.27 1.20 -2.16 -1.32 0.00 0.00 176.35 173.80 1ur2 s PRO 297 N 2.25 2.71 0.35 0.98 0.04 -1.26 -4.72 135.00 135.35 1ur2 s PRO 297 Ca 0.19 1.75 0.11 0.00 0.04 0.00 0.00 61.00 63.10 1ur2 s PRO 297 Cb -0.16 -1.90 0.90 0.00 0.04 0.00 0.00 34.50 33.38 1ur2 s PRO 297 CO 0.10 -1.39 1.78 0.37 0.04 0.00 0.00 177.00 177.90 1ur2 h GLN 298 N 0.44 0.58 -0.27 4.56 5.75 -1.98 0.44 115.11 124.63 1ur2 h GLN 298 Ca -0.49 -0.03 -0.05 0.00 -0.15 0.00 0.00 58.65 57.92 1ur2 h GLN 298 Cb 1.29 -0.13 -0.02 0.00 1.07 0.00 0.00 27.48 29.69 1ur2 h GLN 298 CO 0.53 0.38 -0.06 1.05 -2.65 0.00 0.00 178.83 178.09 1ur2 h GLU 299 N 0.60 0.43 0.04 1.69 -0.00 -2.00 0.34 114.58 115.68 1ur2 h GLU 299 Ca 0.57 -0.10 -0.23 0.00 -0.00 0.00 0.00 59.36 59.60 1ur2 h GLU 299 Cb 1.12 -0.06 -0.00 0.00 -0.00 0.00 0.00 28.75 29.81 1ur2 h GLU 299 CO -0.34 0.50 -1.03 0.52 -0.00 0.00 0.00 179.01 178.67 1ur2 h MET 300 N 0.41 0.29 -0.85 1.06 2.86 -1.31 -2.58 114.93 114.82 1ur2 h MET 300 Ca 0.09 -0.37 0.09 0.00 -2.06 0.00 0.00 59.70 57.44 1ur2 h MET 300 Cb 0.37 0.12 -0.07 0.00 0.06 0.00 0.00 31.60 32.08 1ur2 h MET 300 CO 0.02 1.10 0.50 1.96 1.06 0.00 0.00 176.91 181.55 1ur2 h GLN 301 N 0.14 0.83 -0.42 1.72 1.08 -0.49 0.69 115.11 118.66 1ur2 h GLN 301 Ca -0.09 -0.05 -0.00 0.00 -1.45 0.00 0.00 58.65 57.06 1ur2 h GLN 301 Cb 1.69 -0.19 -0.02 0.00 -0.05 0.00 0.00 27.48 28.92 1ur2 h GLN 301 CO 0.17 0.55 0.25 -0.44 -0.95 0.00 0.00 178.83 178.41 1ur2 h ASP 302 N 0.86 0.51 -0.51 1.46 3.32 -0.85 0.08 116.42 121.30 1ur2 h ASP 302 Ca 0.40 -0.07 -0.10 0.00 0.02 0.00 0.00 57.03 57.28 1ur2 h ASP 302 Cb 0.31 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.72 1ur2 h ASP 302 CO -0.23 0.43 -0.08 0.11 -1.72 0.00 0.00 179.24 177.76 1ur2 h LYS 303 N 0.56 0.94 -0.56 3.56 1.57 -1.00 -0.98 116.57 120.66 1ur2 h LYS 303 Ca 0.15 -0.34 -0.05 0.00 -1.87 0.00 0.00 60.65 58.54 1ur2 h LYS 303 Cb 0.02 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 1ur2 h LYS 303 CO -0.03 1.00 0.16 1.25 -0.57 0.00 0.00 179.45 181.27 1ur2 h LEU 304 N 0.80 0.82 -0.44 2.94 5.85 -0.72 -0.90 115.31 123.67 1ur2 h LEU 304 Ca 0.13 -0.22 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 1ur2 h LEU 304 Cb 0.62 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.42 1ur2 h LEU 304 CO 0.04 0.82 0.24 0.00 -0.34 0.00 0.00 178.44 179.20 1ur2 h ALA 305 N 1.03 0.57 -0.76 1.25 0.00 -0.71 -1.21 119.26 119.43 1ur2 h ALA 305 Ca 0.18 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1ur2 h ALA 305 Cb 0.30 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 1ur2 h ALA 305 CO -0.00 0.09 0.28 -0.22 0.00 0.00 0.00 179.25 179.40 1ur2 h LYS 306 N 0.58 1.16 -0.25 0.00 1.63 -1.05 -0.19 116.57 118.45 1ur2 h LYS 306 Ca 0.16 -0.22 -0.02 0.00 -0.85 0.00 0.00 60.65 59.72 1ur2 h LYS 306 Cb 0.06 -0.18 -0.01 0.00 -0.60 0.00 0.00 32.23 31.50 1ur2 h LYS 306 CO -0.02 0.96 0.10 -0.09 -3.45 0.00 0.00 179.45 176.94 1ur2 h ARG 307 N 1.12 0.38 -0.72 1.90 9.65 -0.82 -0.12 114.38 125.77 1ur2 h ARG 307 Ca 0.25 -0.07 -0.05 0.00 -1.10 0.00 0.00 59.98 59.01 1ur2 h ARG 307 Cb 0.25 -0.06 -0.03 0.00 -1.39 0.00 0.00 29.97 28.74 1ur2 h ARG 307 CO -0.02 0.42 0.25 1.88 2.80 0.00 0.00 179.97 185.30 1ur2 h TYR 308 N 0.25 1.12 -0.31 2.20 0.05 -1.09 -1.90 116.97 117.29 1ur2 h TYR 308 Ca 0.08 -0.09 -0.01 0.00 0.05 0.00 0.00 58.73 58.76 1ur2 h TYR 308 Cb 0.18 -0.33 -0.01 0.00 1.01 0.00 0.00 36.73 37.58 1ur2 h TYR 308 CO -0.01 0.87 0.17 1.49 -1.05 0.00 0.00 178.16 179.63 1ur2 h GLU 309 N 1.06 0.44 -0.61 4.88 4.81 -0.75 -0.44 114.58 123.96 1ur2 h GLU 309 Ca 0.24 -0.05 0.07 0.00 -0.13 0.00 0.00 59.36 59.48 1ur2 h GLU 309 Cb 0.26 -0.08 -0.06 0.00 0.63 0.00 0.00 28.75 29.49 1ur2 h GLU 309 CO -0.01 0.38 0.30 -0.44 -0.73 0.00 0.00 179.01 178.50 1ur2 h ASP 310 N 0.38 0.39 -0.23 1.04 3.32 -0.84 -0.21 116.42 120.28 1ur2 h ASP 310 Ca 0.11 0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.18 1ur2 h ASP 310 Cb 0.07 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 1ur2 h ASP 310 CO -0.02 0.25 0.03 0.25 -1.72 0.00 0.00 179.24 178.04 1ur2 h LEU 311 N 0.54 0.37 -0.76 1.55 5.85 -0.84 -2.58 115.31 119.44 1ur2 h LEU 311 Ca 0.29 -0.26 -0.08 0.00 0.84 0.00 0.00 57.88 58.66 1ur2 h LEU 311 Cb 0.26 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 1ur2 h LEU 311 CO -0.22 0.54 -0.38 -0.26 -0.34 0.00 0.00 178.44 177.77 1ur2 h PHE 312 N 0.19 0.00 -0.46 1.25 -1.00 -0.85 -1.54 116.94 114.53 1ur2 h PHE 312 Ca 0.07 0.00 0.03 0.00 2.81 0.00 0.00 57.97 60.88 1ur2 h PHE 312 Cb 0.33 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 39.86 1ur2 h PHE 312 CO 0.02 0.38 0.26 0.87 -1.61 0.00 0.00 178.31 178.23 1ur2 h LYS 313 N 0.00 0.50 -0.50 1.51 1.57 -0.89 0.42 116.57 119.18 1ur2 h LYS 313 Ca -0.00 -0.03 0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1ur2 h LYS 313 Cb 0.98 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 33.15 1ur2 h LYS 313 CO 0.05 0.33 0.31 1.25 -0.57 0.00 0.00 179.45 180.82 1ur2 h LEU 314 N 0.52 0.52 -0.63 2.94 5.85 -1.03 -0.96 115.31 122.52 1ur2 h LEU 314 Ca 0.19 -0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.89 1ur2 h LEU 314 Cb 0.05 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 40.94 1ur2 h LEU 314 CO -0.10 0.37 0.31 -0.26 -0.34 0.00 0.00 178.44 178.41 1ur2 h PHE 315 N 0.63 0.91 -0.52 1.25 0.04 -0.86 -1.95 116.94 116.43 1ur2 h PHE 315 Ca 0.20 -0.04 -0.00 0.00 2.80 0.00 0.00 57.97 60.92 1ur2 h PHE 315 Cb -0.02 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 37.83 1ur2 h PHE 315 CO -0.06 0.68 0.30 0.82 -0.60 0.00 0.00 178.31 179.46 1ur2 h ILE 316 N 0.87 1.16 -0.98 -0.55 2.04 -0.69 -0.24 117.51 119.11 1ur2 h ILE 316 Ca 0.22 -0.38 0.12 0.00 1.00 0.00 0.00 64.86 65.81 1ur2 h ILE 316 Cb 0.11 0.48 -0.08 0.00 -0.74 0.00 0.00 36.82 36.59 1ur2 h ILE 316 CO -0.03 0.17 0.62 0.50 0.00 0.00 0.00 178.15 179.42 1ur2 h LYS 317 N 0.70 0.94 -0.65 2.37 3.64 -0.67 -2.10 116.57 120.81 1ur2 h LYS 317 Ca 0.19 -0.06 -0.37 0.00 -1.27 0.00 0.00 60.65 59.13 1ur2 h LYS 317 Cb 0.01 -0.21 -0.22 0.00 -0.41 0.00 0.00 32.23 31.40 1ur2 h LYS 317 CO -0.03 0.62 0.16 0.72 -2.27 0.00 0.00 179.45 178.65 1ur2 n HIS 318 N -4.60 2.06 0.27 1.91 8.25 -0.78 -4.72 115.22 117.61 1ur2 n HIS 318 Ca 0.18 -1.94 0.11 0.00 -0.26 0.00 0.00 57.72 55.81 1ur2 n HIS 318 Cb 0.35 -0.73 0.72 0.00 1.12 0.00 0.00 29.99 31.46 1ur2 n HIS 318 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1ur2 h SER 319 N 1.26 0.00 0.11 0.41 4.64 -0.33 -0.15 113.55 119.50 1ur2 h SER 319 Ca 0.40 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.71 1ur2 h SER 319 Cb 1.84 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.93 1ur2 h SER 319 CO 0.78 0.06 -0.03 -2.24 -0.87 0.00 0.00 176.83 174.53 1ur2 h ASP 320 N 0.00 0.00 0.17 4.97 2.03 -1.84 -2.81 116.42 118.94 1ur2 h ASP 320 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1ur2 h ASP 320 Cb 0.13 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.63 1ur2 h ASP 320 CO 0.01 0.03 -1.41 0.29 -1.03 0.00 0.00 179.24 177.13 1ur2 n LYS 321 N -3.67 0.38 -4.58 4.15 5.02 -0.08 -4.96 118.16 114.42 1ur2 n LYS 321 Ca -0.03 -0.08 -0.33 0.00 -2.02 0.00 0.00 58.31 55.86 1ur2 n LYS 321 Cb 0.12 -1.55 -0.14 0.00 -0.02 0.00 0.00 35.03 33.44 1ur2 n LYS 321 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1ur2 s ILE 322 N -3.28 3.03 -0.19 -0.18 1.01 -1.06 -1.56 121.20 118.97 1ur2 s ILE 322 Ca -0.00 -0.65 0.21 0.00 0.00 0.00 0.00 60.65 60.21 1ur2 s ILE 322 Cb 0.14 -2.29 -0.07 0.00 0.01 0.00 0.00 42.46 40.25 1ur2 s ILE 322 CO 0.86 0.51 0.92 0.47 0.00 0.00 0.00 174.94 177.70 1ur2 n ASP 323 N 3.83 0.75 -3.60 3.58 9.92 0.07 -4.63 116.55 126.47 1ur2 n ASP 323 Ca -0.18 0.30 -0.10 0.00 -0.53 0.00 0.00 54.79 54.28 1ur2 n ASP 323 Cb 0.52 0.55 -0.06 0.00 -0.64 0.00 0.00 41.12 41.49 1ur2 n ASP 323 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 1ur2 s ARG 324 N -3.27 0.55 -0.25 -1.24 3.52 -1.26 -1.58 118.95 115.42 1ur2 s ARG 324 Ca -0.02 0.34 -0.01 0.00 -0.13 0.00 0.00 55.73 55.92 1ur2 s ARG 324 Cb 0.10 0.26 0.07 0.00 -1.56 0.00 0.00 34.95 33.82 1ur2 s ARG 324 CO 0.81 -0.13 0.03 0.00 -0.81 0.00 0.00 175.30 175.20 1ur2 s ALA 325 N -0.50 1.56 -0.14 6.12 0.00 -0.24 -1.02 121.76 127.54 1ur2 s ALA 325 Ca 0.01 -1.29 -0.05 0.00 0.00 0.00 0.00 51.96 50.63 1ur2 s ALA 325 Cb -0.03 -1.43 -0.04 0.00 0.00 0.00 0.00 23.12 21.63 1ur2 s ALA 325 CO -0.02 -1.36 0.02 0.99 0.00 0.00 0.00 175.76 175.40 1ur2 s THR 326 N 1.59 4.48 0.10 0.00 2.01 0.11 -1.16 115.64 122.77 1ur2 s THR 326 Ca 0.01 -0.16 -0.12 0.00 0.31 0.00 0.00 61.69 61.73 1ur2 s THR 326 Cb -0.18 -2.96 -0.06 0.00 0.01 0.00 0.00 72.50 69.31 1ur2 s THR 326 CO -0.13 0.53 0.46 -0.36 -0.69 0.00 0.00 174.62 174.43 1ur2 s PHE 327 N -0.12 3.60 -1.37 4.92 0.40 -0.42 -0.85 117.98 124.13 1ur2 s PHE 327 Ca 0.05 0.91 -0.08 0.00 -0.60 0.00 0.00 56.93 57.22 1ur2 s PHE 327 Cb -0.12 -2.25 0.09 0.00 0.51 0.00 0.00 43.02 41.25 1ur2 s PHE 327 CO 0.02 0.49 2.33 1.87 0.70 0.00 0.00 175.22 180.62 1ur2 n TRP 328 N 0.90 2.72 0.00 0.36 -0.00 0.09 -1.22 117.44 120.29 1ur2 n TRP 328 Ca -0.07 -2.87 0.00 0.00 -0.00 0.00 0.00 57.50 54.56 1ur2 n TRP 328 Cb 0.52 -2.03 0.00 0.00 -0.00 0.00 0.00 31.31 29.80 1ur2 n TRP 328 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1ur2 n GLY 329 N 2.49 3.29 0.11 5.87 0.00 -1.23 -4.62 105.19 111.09 1ur2 n GLY 329 Ca 0.58 -1.84 -0.17 0.00 0.00 0.00 0.00 46.02 44.58 1ur2 n GLY 329 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ur2 n VAL 330 N -1.55 1.50 -4.34 1.61 0.31 -1.26 -4.60 118.33 110.01 1ur2 n VAL 330 Ca 0.00 -0.06 -0.19 0.00 -0.01 0.00 0.00 64.34 64.08 1ur2 n VAL 330 Cb 0.00 -2.16 -0.10 0.00 -0.91 0.00 0.00 33.84 30.67 1ur2 n VAL 330 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1ur2 s SER 331 N -6.55 2.58 0.50 4.52 1.04 -1.26 -3.60 113.70 110.92 1ur2 s SER 331 Ca -0.31 -0.97 0.14 0.00 0.48 0.00 0.00 55.95 55.29 1ur2 s SER 331 Cb 0.08 -0.14 1.19 0.00 0.10 0.00 0.00 66.02 67.25 1ur2 s SER 331 CO 0.44 -0.14 2.13 0.44 0.98 0.00 0.00 173.24 177.10 1ur2 h ASP 332 N 2.75 0.09 -0.08 7.02 3.32 -1.27 -1.41 116.42 126.84 1ur2 h ASP 332 Ca -0.39 -0.00 0.02 0.00 0.02 0.00 0.00 57.03 56.68 1ur2 h ASP 332 Cb 1.22 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 40.74 1ur2 h ASP 332 CO 0.59 0.06 0.06 -2.24 -1.72 0.00 0.00 179.24 175.99 1ur2 h ASP 333 N 0.11 0.00 -0.01 6.45 2.03 -1.86 -2.65 116.42 120.49 1ur2 h ASP 333 Ca 0.03 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.33 1ur2 h ASP 333 Cb -0.01 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.49 1ur2 h ASP 333 CO -0.01 0.00 -0.07 0.00 -1.03 0.00 0.00 179.24 178.13 1ur2 n ALA 334 N -2.56 2.65 -1.95 4.15 0.00 -0.53 -4.99 120.51 117.28 1ur2 n ALA 334 Ca -0.01 -0.63 -0.41 0.00 0.00 0.00 0.00 53.44 52.39 1ur2 n ALA 334 Cb 0.17 -0.89 -0.03 0.00 0.00 0.00 0.00 19.45 18.71 1ur2 n ALA 334 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1ur2 s SER 335 N -2.08 6.84 0.50 0.00 0.15 -1.00 -4.89 113.70 113.22 1ur2 s SER 335 Ca 0.28 2.48 0.34 0.00 0.70 0.00 0.00 55.95 59.75 1ur2 s SER 335 Cb 0.20 -2.62 1.76 0.00 -1.71 0.00 0.00 66.02 63.66 1ur2 s SER 335 CO 0.35 -0.56 2.03 4.11 1.20 0.00 0.00 173.24 180.37 1ur2 h TRP 336 N 5.13 0.00 0.00 3.44 5.08 -1.92 -2.16 115.95 125.53 1ur2 h TRP 336 Ca -0.45 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.52 1ur2 h TRP 336 Cb 1.22 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.38 1ur2 h TRP 336 CO 0.61 0.00 0.00 1.28 -1.28 0.00 0.00 178.44 179.05 1ur2 n LEU 337 N -2.72 0.11 0.14 0.11 4.77 -1.26 -1.45 117.00 116.69 1ur2 n LEU 337 Ca -0.02 0.51 0.02 0.00 -0.03 0.00 0.00 56.01 56.50 1ur2 n LEU 337 Cb 0.10 -0.49 0.38 0.00 -2.33 0.00 0.00 43.42 41.08 1ur2 n LEU 337 CO 0.17 -0.10 0.84 0.78 -1.33 0.00 0.00 177.39 177.75 1ur2 h ASN 338 N 0.00 0.16 -0.01 -1.43 2.35 -1.64 -3.31 115.58 111.70 1ur2 h ASN 338 Ca 0.00 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 1ur2 h ASN 338 Cb 0.45 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.78 1ur2 h ASN 338 CO 0.00 0.38 -0.11 0.61 -1.65 0.00 0.00 177.43 176.65 1ur2 n GLY 339 N -0.77 -0.31 2.89 2.83 0.00 -0.80 -0.56 105.19 108.48 1ur2 n GLY 339 Ca -0.01 -0.25 -0.19 0.00 0.00 0.00 0.00 46.02 45.57 1ur2 n GLY 339 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1ur2 s PHE 340 N -1.06 0.64 -2.52 1.61 5.36 -0.53 -3.27 117.98 118.22 1ur2 s PHE 340 Ca 0.08 -0.15 0.28 0.00 -0.96 0.00 0.00 56.93 56.18 1ur2 s PHE 340 Cb 0.07 -0.57 0.96 0.00 -0.34 0.00 0.00 43.02 43.14 1ur2 s PHE 340 CO 0.18 -0.15 1.69 -0.35 -1.46 0.00 0.00 175.22 175.13 1ur2 n PRO 341 N 3.88 1.69 -4.61 10.12 -0.04 -1.26 -4.34 135.00 140.44 1ur2 n PRO 341 Ca -0.24 -1.03 -0.33 0.00 -0.04 0.00 0.00 63.50 61.86 1ur2 n PRO 341 Cb 0.52 -1.48 -0.15 0.00 -0.04 0.00 0.00 33.50 32.35 1ur2 n PRO 341 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1ur2 s ILE 342 N -2.02 2.81 0.36 0.52 1.01 -1.25 -4.81 121.20 117.81 1ur2 s ILE 342 Ca 0.37 -0.73 -0.27 0.00 0.00 0.00 0.00 60.65 60.01 1ur2 s ILE 342 Cb 0.21 -2.18 -0.10 0.00 0.01 0.00 0.00 42.46 40.40 1ur2 s ILE 342 CO 0.34 0.52 1.27 -2.16 0.00 0.00 0.00 174.94 174.90 1ur2 s PRO 343 N 0.67 4.23 -0.03 2.79 0.04 -1.20 -3.89 135.00 137.61 1ur2 s PRO 343 Ca -0.07 2.11 0.00 0.00 0.04 0.00 0.00 61.00 63.08 1ur2 s PRO 343 Cb -0.16 -2.93 0.00 0.00 0.04 0.00 0.00 34.50 31.45 1ur2 s PRO 343 CO 0.02 -0.26 0.00 0.41 0.04 0.00 0.00 177.00 177.21 1ur2 n GLY 344 N 0.77 0.40 3.92 0.56 0.00 -1.14 -4.79 105.19 104.91 1ur2 n GLY 344 Ca 0.02 -1.07 -0.26 0.00 0.00 0.00 0.00 46.02 44.70 1ur2 n GLY 344 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ur2 s ARG 345 N -2.15 2.74 -0.43 1.61 0.52 0.28 -5.04 118.95 116.47 1ur2 s ARG 345 Ca 0.00 -0.06 -0.04 0.00 -0.52 0.00 0.00 55.73 55.12 1ur2 s ARG 345 Cb 0.00 -2.24 0.12 0.00 0.52 0.00 0.00 34.95 33.35 1ur2 s ARG 345 CO 0.00 -0.84 0.24 0.99 0.02 0.00 0.00 175.30 175.71 1ur2 s THR 346 N -3.06 3.42 0.42 0.02 2.01 -1.26 -4.60 115.64 112.59 1ur2 s THR 346 Ca 0.56 -2.09 0.08 0.00 0.31 0.00 0.00 61.69 60.54 1ur2 s THR 346 Cb -0.11 -3.33 -0.01 0.00 0.01 0.00 0.00 72.50 69.07 1ur2 s THR 346 CO 0.45 -0.72 0.45 0.21 -0.69 0.00 0.00 174.62 174.33 1ur2 s ASN 347 N 1.84 5.27 -0.37 3.53 3.84 -1.26 -4.73 114.94 123.06 1ur2 s ASN 347 Ca 0.09 -0.63 0.12 0.00 0.21 0.00 0.00 52.86 52.65 1ur2 s ASN 347 Cb -0.23 -0.60 0.36 0.00 -0.55 0.00 0.00 41.25 40.24 1ur2 s ASN 347 CO -0.04 -0.70 0.80 -1.22 -2.79 0.00 0.00 177.10 173.15 1ur2 n TYR 348 N -1.66 0.08 0.89 0.43 4.02 -1.26 -4.88 117.16 114.77 1ur2 n TYR 348 Ca 0.05 -3.53 0.12 0.00 -0.01 0.00 0.00 57.90 54.54 1ur2 n TYR 348 Cb 0.61 -0.24 0.27 0.00 -0.02 0.00 0.00 39.34 39.96 1ur2 n TYR 348 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 176.86 173.55 1ur2 n PRO 349 N 0.22 0.08 -2.99 -0.72 -0.02 -1.26 -4.81 135.00 125.51 1ur2 n PRO 349 Ca 0.21 0.02 -0.13 0.00 -2.02 0.00 0.00 63.50 61.58 1ur2 n PRO 349 Cb 0.69 -1.55 -0.02 0.00 -0.02 0.00 0.00 33.50 32.60 1ur2 n PRO 349 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1ur2 n LEU 350 N -1.66 0.00 0.09 2.45 4.77 -1.26 -2.18 117.00 119.21 1ur2 n LEU 350 Ca 0.05 -1.26 0.12 0.00 -0.03 0.00 0.00 56.01 54.89 1ur2 n LEU 350 Cb 0.36 0.12 0.13 0.00 -2.33 0.00 0.00 43.42 41.70 1ur2 n LEU 350 CO 0.34 -0.21 0.31 -0.07 -1.33 0.00 0.00 177.39 176.44 1ur2 h LEU 351 N 0.00 0.00 -8.57 2.23 3.38 -1.91 -3.46 115.31 106.98 1ur2 h LEU 351 Ca -0.17 -0.11 -0.68 0.00 0.09 0.00 0.00 57.88 57.01 1ur2 h LEU 351 Cb 0.51 0.00 -0.30 0.00 0.09 0.00 0.00 40.66 40.96 1ur2 h LEU 351 CO 0.27 0.06 -0.88 -0.36 0.09 0.00 0.00 178.44 177.62 1ur2 s PHE 352 N -3.23 2.24 0.59 1.13 0.08 -1.24 -0.96 117.98 116.59 1ur2 s PHE 352 Ca 0.04 -0.43 -0.08 0.00 0.12 0.00 0.00 56.93 56.59 1ur2 s PHE 352 Cb 0.11 -1.44 0.13 0.00 -0.57 0.00 0.00 43.02 41.25 1ur2 s PHE 352 CO 0.73 -0.04 0.80 -0.40 -0.10 0.00 0.00 175.22 176.21 1ur2 n ASP 353 N 2.48 0.32 0.00 1.36 5.68 -0.11 -1.09 116.55 125.18 1ur2 n ASP 353 Ca -0.16 -1.45 0.06 0.00 -0.50 0.00 0.00 54.79 52.74 1ur2 n ASP 353 Cb 0.51 -0.59 0.25 0.00 -1.14 0.00 0.00 41.12 40.15 1ur2 n ASP 353 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1ur2 n ARG 354 N -2.64 0.00 -0.48 0.11 1.74 -1.26 -0.85 116.66 113.28 1ur2 n ARG 354 Ca 0.11 0.30 0.08 0.00 -0.77 0.00 0.00 57.85 57.57 1ur2 n ARG 354 Cb 0.38 -1.50 0.29 0.00 -1.02 0.00 0.00 32.46 30.61 1ur2 n ARG 354 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1ur2 n LYS 355 N -1.50 3.36 -1.40 5.56 5.02 -1.26 -4.87 118.16 123.08 1ur2 n LYS 355 Ca 0.03 -2.68 -0.14 0.00 -2.02 0.00 0.00 58.31 53.50 1ur2 n LYS 355 Cb 0.13 -1.73 -0.06 0.00 -0.02 0.00 0.00 35.03 33.35 1ur2 n LYS 355 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1ur2 n LEU 356 N 0.65 -0.91 -4.82 -0.35 4.77 -0.03 -5.01 117.00 111.30 1ur2 n LEU 356 Ca 0.22 0.34 -0.37 0.00 -0.03 0.00 0.00 56.01 56.16 1ur2 n LEU 356 Cb 0.78 -2.21 -0.06 0.00 -2.33 0.00 0.00 43.42 39.60 1ur2 n LEU 356 CO 0.18 -0.80 0.26 -1.10 -1.33 0.00 0.00 177.39 174.61 1ur2 s GLN 357 N -3.09 4.11 0.27 3.23 -1.52 -1.26 -4.73 119.66 116.67 1ur2 s GLN 357 Ca 0.00 0.64 -0.30 0.00 -1.95 0.00 0.00 55.36 53.75 1ur2 s GLN 357 Cb 0.00 -3.09 -0.11 0.00 -0.22 0.00 0.00 33.01 29.59 1ur2 s GLN 357 CO 0.00 0.56 1.54 -1.25 -0.25 0.00 0.00 175.29 175.89 1ur2 s PRO 358 N -1.50 4.18 0.63 2.91 0.04 -1.26 -0.93 135.00 139.06 1ur2 s PRO 358 Ca 0.33 2.47 -0.06 0.00 0.04 0.00 0.00 61.00 63.77 1ur2 s PRO 358 Cb -0.17 -3.06 0.02 0.00 0.04 0.00 0.00 34.50 31.33 1ur2 s PRO 358 CO 0.19 -0.55 0.94 0.15 0.04 0.00 0.00 177.00 177.77 1ur2 s LYS 359 N -0.36 2.74 0.29 4.56 1.02 -0.13 -4.87 119.74 122.99 1ur2 s LYS 359 Ca 0.62 -0.03 0.04 0.00 0.02 0.00 0.00 55.97 56.62 1ur2 s LYS 359 Cb -0.45 -2.23 0.68 0.00 -0.52 0.00 0.00 37.83 35.31 1ur2 s LYS 359 CO 0.45 -0.86 1.77 -0.44 -0.92 0.00 0.00 175.35 175.36 1ur2 h ASP 360 N -0.32 0.70 -0.98 2.83 3.32 -1.89 -0.18 116.42 119.90 1ur2 h ASP 360 Ca -0.45 0.10 0.16 0.00 0.02 0.00 0.00 57.03 56.86 1ur2 h ASP 360 Cb 1.27 -0.02 -0.09 0.00 0.22 0.00 0.00 39.33 40.71 1ur2 h ASP 360 CO 0.61 0.25 0.62 0.00 -1.72 0.00 0.00 179.24 179.00 1ur2 h ALA 361 N 1.63 1.67 -0.27 3.45 0.00 -1.87 -1.88 119.26 121.99 1ur2 h ALA 361 Ca 0.55 0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.53 1ur2 h ALA 361 Cb 0.84 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 1ur2 h ALA 361 CO -0.38 0.02 0.07 -0.92 0.00 0.00 0.00 179.25 178.04 1ur2 h TYR 362 N 0.82 0.13 -0.38 0.00 3.20 -1.25 -1.63 116.97 117.86 1ur2 h TYR 362 Ca 0.52 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 62.33 1ur2 h TYR 362 Cb 0.74 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.97 1ur2 h TYR 362 CO -0.00 0.05 -0.07 0.74 -1.64 0.00 0.00 178.16 177.23 1ur2 h PHE 363 N 0.18 0.68 -0.71 -3.82 0.04 -1.37 -1.39 116.94 110.55 1ur2 h PHE 363 Ca 0.12 -0.10 -0.05 0.00 2.80 0.00 0.00 57.97 60.74 1ur2 h PHE 363 Cb 0.11 -0.18 -0.03 0.00 2.20 0.00 0.00 35.95 38.04 1ur2 h PHE 363 CO -0.15 0.69 0.26 0.00 -0.60 0.00 0.00 178.31 178.52 1ur2 h ARG 364 N 0.59 1.08 -0.69 1.51 2.47 -1.15 -1.34 114.38 116.85 1ur2 h ARG 364 Ca 0.11 -0.21 -0.04 0.00 -1.26 0.00 0.00 59.98 58.58 1ur2 h ARG 364 Cb 0.48 -0.17 -0.03 0.00 -1.65 0.00 0.00 29.97 28.60 1ur2 h ARG 364 CO 0.03 0.91 0.29 -0.07 0.56 0.00 0.00 179.97 181.68 1ur2 h LEU 365 N 1.03 0.95 -0.47 3.04 4.07 -0.78 -2.26 115.31 120.89 1ur2 h LEU 365 Ca 0.23 -0.16 -0.05 0.00 0.08 0.00 0.00 57.88 57.98 1ur2 h LEU 365 Cb 0.25 -0.25 -0.02 0.00 1.08 0.00 0.00 40.66 41.72 1ur2 h LEU 365 CO -0.01 0.85 0.11 -0.07 -1.08 0.00 0.00 178.44 178.24 1ur2 h LEU 366 N 0.98 0.71 -1.03 1.67 3.38 -0.96 -3.07 115.31 116.99 1ur2 h LEU 366 Ca 0.23 -0.23 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 1ur2 h LEU 366 Cb 0.19 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1ur2 h LEU 366 CO -0.02 0.75 -0.27 0.44 0.09 0.00 0.00 178.44 179.44 1ur2 h ASP 367 N 0.63 0.00 -0.73 -0.43 3.32 -1.08 -0.57 116.42 117.55 1ur2 h ASP 367 Ca 0.15 0.00 0.13 0.00 0.02 0.00 0.00 57.03 57.33 1ur2 h ASP 367 Cb 0.32 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.83 1ur2 h ASP 367 CO 0.00 0.27 0.49 -0.07 -1.72 0.00 0.00 179.24 178.21 1ur2 h LEU 368 N 0.00 0.43 0.09 1.55 3.38 -1.31 -1.89 115.31 117.56 1ur2 h LEU 368 Ca -0.00 0.02 -0.35 0.00 0.09 0.00 0.00 57.88 57.64 1ur2 h LEU 368 Cb 0.80 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.45 1ur2 h LEU 368 CO 0.03 0.24 -1.95 0.29 0.09 0.00 0.00 178.44 177.14 1ur2 n LYS 369 N -4.48 0.71 -0.20 1.13 4.76 -0.80 -3.23 118.16 116.04 1ur2 n LYS 369 Ca 0.13 0.30 0.06 0.00 -2.87 0.00 0.00 58.31 55.94 1ur2 n LYS 369 Cb 0.47 -1.69 0.34 0.00 -1.84 0.00 0.00 35.03 32.31 1ur2 n LYS 369 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1ur2 h ARG 370 N -0.15 0.76 -0.54 1.97 3.08 -1.04 -2.70 114.38 115.76 1ur2 h ARG 370 Ca -0.44 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.56 1ur2 h ARG 370 Cb 1.88 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 31.76 1ur2 h ARG 370 CO 0.00 0.51 0.00 1.28 -1.07 0.00 0.00 179.97 180.69 1ur2 n LEU 371 N -4.48 3.62 -4.76 3.04 4.77 -0.72 -5.00 117.00 113.47 1ur2 n LEU 371 Ca 0.11 -2.10 -0.41 0.00 -0.03 0.00 0.00 56.01 53.58 1ur2 n LEU 371 Cb 0.24 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 40.93 1ur2 n LEU 371 CO 0.33 0.85 1.08 1.21 -1.33 0.00 0.00 177.39 179.53 1ur2 n GLU 372 N 1.01 2.51 -3.60 3.23 2.13 -1.02 -4.99 120.64 119.91 1ur2 n GLU 372 Ca 0.19 0.88 -0.37 0.00 0.66 0.00 0.00 57.16 58.52 1ur2 n GLU 372 Cb 0.59 -2.61 -0.10 0.00 0.27 0.00 0.00 31.44 29.59 1ur2 n GLU 372 CO 0.00 0.00 0.00 -1.01 -0.41 0.00 0.00 177.13 175.71 1ur2 s HIS 373 N -1.13 3.28 0.19 4.31 3.76 -1.26 -5.07 115.29 119.36 1ur2 s HIS 373 Ca 0.55 0.21 0.06 0.00 -0.15 0.00 0.00 55.06 55.74 1ur2 s HIS 373 Cb -0.49 -2.35 -0.05 0.00 1.11 0.00 0.00 32.58 30.81 1ur2 s HIS 373 CO 0.63 -0.05 -0.12 -1.01 -0.85 0.00 0.00 174.74 173.34 1ur2 s HIS 374 N 1.42 1.54 -2.49 1.40 0.09 -1.26 -5.27 115.29 110.72 1ur2 s HIS 374 Ca 0.08 -0.66 0.28 0.00 -0.00 0.00 0.00 55.06 54.76 1ur2 s HIS 374 Cb -0.15 -0.75 1.07 0.00 -0.00 0.00 0.00 32.58 32.75 1ur2 s HIS 374 CO 0.08 0.24 1.76 -2.39 -0.00 0.00 0.00 174.74 174.42