#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3iud s PHE 4 N 0.00 2.67 0.44 -1.84 0.40 -1.26 -4.86 117.98 113.53 3iud s PHE 4 Ca 0.00 -1.61 0.11 0.00 -0.60 0.00 0.00 56.93 54.83 3iud s PHE 4 Cb 0.00 -1.84 0.96 0.00 0.51 0.00 0.00 43.02 42.65 3iud s PHE 4 CO 0.00 -0.78 2.03 0.00 0.70 0.00 0.00 175.22 177.17 3iud h ARG 5 N 7.95 0.24 -5.26 0.44 2.47 -1.92 -3.40 114.38 114.90 3iud h ARG 5 Ca -0.41 -0.03 -0.66 0.00 -1.26 0.00 0.00 59.98 57.62 3iud h ARG 5 Cb 1.13 -0.04 -0.27 0.00 -1.65 0.00 0.00 29.97 29.14 3iud h ARG 5 CO 0.59 0.25 -0.75 0.42 0.56 0.00 0.00 179.97 181.04 3iud s ILE 6 N -5.03 3.13 0.16 2.04 -1.09 -1.26 -5.04 121.20 114.10 3iud s ILE 6 Ca -0.06 -0.62 -0.34 0.00 -2.23 0.00 0.00 60.65 57.39 3iud s ILE 6 Cb 0.16 -2.33 -0.14 0.00 -1.58 0.00 0.00 42.46 38.57 3iud s ILE 6 CO 0.71 0.51 1.50 0.00 -1.23 0.00 0.00 174.94 176.43 3iud n ALA 7 N 3.73 0.81 0.27 9.38 0.00 -1.26 -4.85 120.51 128.59 3iud n ALA 7 Ca -0.18 0.46 0.13 0.00 0.00 0.00 0.00 53.44 53.85 3iud n ALA 7 Cb 0.52 -2.28 0.76 0.00 0.00 0.00 0.00 19.45 18.46 3iud n ALA 7 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 3iud h GLN 8 N 5.38 0.00 0.00 0.00 4.20 -1.98 -1.61 115.11 121.10 3iud h GLN 8 Ca -0.45 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.16 3iud h GLN 8 Cb 1.27 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.04 3iud h GLN 8 CO 0.85 0.10 -0.44 0.38 -0.67 0.00 0.00 178.83 179.04 3iud h ASP 9 N 0.00 0.00 0.08 1.46 -0.00 -1.99 -0.77 116.42 115.20 3iud h ASP 9 Ca -0.00 0.00 -0.28 0.00 -0.00 0.00 0.00 57.03 56.75 3iud h ASP 9 Cb 0.27 0.00 0.02 0.00 -0.00 0.00 0.00 39.33 39.62 3iud h ASP 9 CO 0.01 0.44 -1.11 0.58 -0.00 0.00 0.00 179.24 179.16 3iud h VAL 10 N 0.00 1.29 -0.32 4.15 2.07 -1.67 -1.50 116.25 120.27 3iud h VAL 10 Ca -0.00 -2.34 -0.03 0.00 0.82 0.00 0.00 66.70 65.14 3iud h VAL 10 Cb 0.89 2.49 -0.01 0.00 -1.52 0.00 0.00 31.29 33.14 3iud h VAL 10 CO 0.06 0.72 0.09 0.58 0.02 0.00 0.00 177.57 179.03 3iud h VAL 11 N 0.34 1.22 -0.26 2.57 2.07 -1.28 -0.79 116.25 120.11 3iud h VAL 11 Ca -0.15 -0.72 -0.01 0.00 0.82 0.00 0.00 66.70 66.65 3iud h VAL 11 Cb 1.77 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 32.59 3iud h VAL 11 CO 0.21 0.24 0.14 0.00 0.02 0.00 0.00 177.57 178.18 3iud h ALA 12 N 0.92 0.34 0.57 1.67 0.00 -1.18 -2.10 119.26 119.47 3iud h ALA 12 Ca 0.10 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 3iud h ALA 12 Cb 0.28 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3iud h ALA 12 CO -0.00 -0.12 -0.30 -0.09 0.00 0.00 0.00 179.25 178.75 3iud h ARG 13 N 0.30 -0.77 0.00 0.00 2.43 -1.16 -0.30 114.38 114.88 3iud h ARG 13 Ca 0.09 0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 3iud h ARG 13 Cb 0.09 0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.81 3iud h ARG 13 CO -0.01 -0.51 0.00 0.39 -1.51 0.00 0.00 179.97 178.33 3iud n GLU 14 N -5.44 0.08 -0.09 0.20 -0.58 -0.31 -1.50 120.64 112.99 3iud n GLU 14 Ca -0.12 0.26 -0.20 0.00 -0.42 0.00 0.00 57.16 56.67 3iud n GLU 14 Cb 0.33 -1.50 -0.12 0.00 -0.57 0.00 0.00 31.44 29.58 3iud n GLU 14 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 3iud n ASN 15 N -1.37 2.02 0.12 1.62 5.03 -0.79 -4.11 115.26 117.78 3iud n ASN 15 Ca 0.03 0.01 0.03 0.00 0.87 0.00 0.00 54.58 55.52 3iud n ASN 15 Cb 0.08 -0.58 0.41 0.00 -1.02 0.00 0.00 39.78 38.67 3iud n ASN 15 CO 0.00 0.00 0.00 0.44 -1.83 0.00 0.00 177.26 175.87 3iud h ASP 16 N -0.09 0.21 0.81 6.41 3.32 -0.40 0.36 116.42 127.04 3iud h ASP 16 Ca -0.54 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 56.47 3iud h ASP 16 Cb 1.90 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 41.39 3iud h ASP 16 CO -0.07 0.35 0.00 -0.09 -1.72 0.00 0.00 179.24 177.71 3iud h ARG 17 N 0.22 0.00 -0.00 3.56 2.43 -1.44 -3.11 114.38 116.04 3iud h ARG 17 Ca 0.05 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 3iud h ARG 17 Cb 0.33 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.88 3iud h ARG 17 CO 0.02 0.00 -0.06 0.54 -1.51 0.00 0.00 179.97 178.95 3iud n ARG 18 N -2.72 5.43 -0.28 0.20 1.74 -0.53 -4.77 116.66 115.74 3iud n ARG 18 Ca 0.01 -0.09 0.08 0.00 -0.77 0.00 0.00 57.85 57.08 3iud n ARG 18 Cb 0.25 -0.64 0.23 0.00 -1.02 0.00 0.00 32.46 31.28 3iud n ARG 18 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3iud h ALA 19 N 0.24 1.19 0.40 7.54 0.00 -0.26 -1.95 119.26 126.41 3iud h ALA 19 Ca 0.00 0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 3iud h ALA 19 Cb 0.04 0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3iud h ALA 19 CO 0.00 -0.24 -0.19 1.03 0.00 0.00 0.00 179.25 179.85 3iud h SER 20 N 0.44 -0.45 -0.39 0.00 0.87 -1.86 -2.00 113.55 110.16 3iud h SER 20 Ca 0.46 -0.01 0.04 0.00 -1.23 0.00 0.00 61.79 61.05 3iud h SER 20 Cb 0.76 0.12 -0.04 0.00 -0.44 0.00 0.00 62.40 62.80 3iud h SER 20 CO -0.44 -0.29 0.16 0.00 -0.53 0.00 0.00 176.83 175.72 3iud h ALA 21 N 0.02 0.46 -0.96 6.23 0.00 -1.83 -2.32 119.26 120.86 3iud h ALA 21 Ca -0.05 0.03 0.08 0.00 0.00 0.00 0.00 54.91 54.97 3iud h ALA 21 Cb 0.43 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.15 3iud h ALA 21 CO 0.09 -0.23 0.61 1.25 0.00 0.00 0.00 179.25 180.97 3iud h LEU 22 N 0.33 0.95 -0.11 0.00 5.85 -1.29 -0.17 115.31 120.88 3iud h LEU 22 Ca 0.17 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.92 3iud h LEU 22 Cb 0.13 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 3iud h LEU 22 CO -0.16 0.58 0.07 0.50 -0.34 0.00 0.00 178.44 179.09 3iud h LYS 23 N 1.07 0.14 -0.12 1.25 3.64 -0.84 0.31 116.57 122.03 3iud h LYS 23 Ca 0.43 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.83 3iud h LYS 23 Cb 0.25 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.01 3iud h LYS 23 CO -0.20 0.11 -0.06 0.93 -2.27 0.00 0.00 179.45 177.96 3iud h GLU 24 N 0.13 -0.05 -0.49 1.90 4.39 -0.88 -0.78 114.58 118.80 3iud h GLU 24 Ca 0.04 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.69 3iud h GLU 24 Cb 0.00 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.64 3iud h GLU 24 CO -0.01 -0.03 0.11 -0.44 -1.16 0.00 0.00 179.01 177.47 3iud h ASP 25 N -0.05 0.76 -0.24 1.42 3.32 -0.83 -1.86 116.42 118.94 3iud h ASP 25 Ca 0.07 -0.24 -0.02 0.00 0.02 0.00 0.00 57.03 56.86 3iud h ASP 25 Cb 0.15 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 3iud h ASP 25 CO -0.15 0.81 0.09 0.22 -1.72 0.00 0.00 179.24 178.49 3iud h TYR 26 N 0.68 0.38 -0.61 4.55 3.20 -0.19 -1.33 116.97 123.65 3iud h TYR 26 Ca 0.15 -0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.94 3iud h TYR 26 Cb 0.36 -0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.49 3iud h TYR 26 CO 0.02 0.41 0.19 0.93 -1.64 0.00 0.00 178.16 178.07 3iud h GLU 27 N 0.23 0.92 0.04 1.82 5.08 -1.11 0.24 114.58 121.80 3iud h GLU 27 Ca 0.08 -0.18 -0.00 0.00 -1.00 0.00 0.00 59.36 58.26 3iud h GLU 27 Cb 0.21 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.31 3iud h GLU 27 CO -0.00 0.80 -0.02 0.00 -1.00 0.00 0.00 179.01 178.79 3iud h ALA 28 N 1.31 -0.05 -0.51 3.43 0.00 -1.20 -0.69 119.26 121.55 3iud h ALA 28 Ca 0.20 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 54.99 3iud h ALA 28 Cb 0.27 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 3iud h ALA 28 CO -0.01 -0.38 0.34 1.25 0.00 0.00 0.00 179.25 180.45 3iud h LEU 29 N -0.34 0.49 -0.50 0.00 5.85 -1.01 0.16 115.31 119.97 3iud h LEU 29 Ca -0.01 -0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.64 3iud h LEU 29 Cb 0.32 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 3iud h LEU 29 CO 0.01 0.34 0.03 1.23 -0.34 0.00 0.00 178.44 179.70 3iud h GLY 30 N 0.57 0.93 1.15 3.75 0.00 -0.16 -0.71 103.07 108.60 3iud h GLY 30 Ca 0.21 -0.66 -0.11 0.00 0.00 0.00 0.00 47.33 46.76 3iud h GLY 30 CO -0.05 0.61 -0.10 0.00 0.00 0.00 0.00 176.54 177.00 3iud h ALA 31 N 0.94 0.81 -0.38 3.60 0.00 -0.14 -1.12 119.26 122.98 3iud h ALA 31 Ca 0.14 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 3iud h ALA 31 Cb 0.48 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 3iud h ALA 31 CO 0.02 0.66 0.14 -0.97 0.00 0.00 0.00 179.25 179.10 3iud h ASN 32 N 0.89 0.53 0.02 0.00 -0.73 -0.79 -1.72 115.58 113.78 3iud h ASN 32 Ca 0.14 -0.18 -0.12 0.00 1.87 0.00 0.00 56.30 58.01 3iud h ASN 32 Cb 0.65 -0.14 -0.01 0.00 0.27 0.00 0.00 38.32 39.09 3iud h ASN 32 CO 0.05 0.57 -0.38 -0.07 -0.37 0.00 0.00 177.43 177.23 3iud h LEU 33 N 0.46 0.49 -1.14 0.34 3.38 -1.04 -2.53 115.31 115.28 3iud h LEU 33 Ca 0.12 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 3iud h LEU 33 Cb 0.22 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 3iud h LEU 33 CO -0.01 0.83 0.31 0.00 0.09 0.00 0.00 178.44 179.65 3iud h ALA 34 N 1.20 1.33 0.00 1.53 0.00 -0.97 0.41 119.26 122.76 3iud h ALA 34 Ca 0.04 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3iud h ALA 34 Cb 0.84 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.37 3iud h ALA 34 CO 0.07 0.52 0.00 0.54 0.00 0.00 0.00 179.25 180.38 3iud n ARG 35 N -4.34 0.18 -0.28 0.00 1.74 -0.67 -1.88 116.66 111.41 3iud n ARG 35 Ca 0.06 0.41 0.08 0.00 -0.77 0.00 0.00 57.85 57.63 3iud n ARG 35 Cb 0.13 -1.84 0.23 0.00 -1.02 0.00 0.00 32.46 29.96 3iud n ARG 35 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3iud n ARG 36 N -2.18 2.88 -1.71 5.56 1.74 0.11 -4.96 116.66 118.11 3iud n ARG 36 Ca 0.02 -2.34 -0.08 0.00 -0.77 0.00 0.00 57.85 54.69 3iud n ARG 36 Cb 0.22 -1.43 -0.02 0.00 -1.02 0.00 0.00 32.46 30.22 3iud n ARG 36 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3iud n GLY 37 N 0.89 0.49 3.20 -0.13 0.00 -0.33 -5.03 105.19 104.29 3iud n GLY 37 Ca 0.17 -0.63 -0.32 0.00 0.00 0.00 0.00 46.02 45.25 3iud n GLY 37 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3iud s VAL 38 N -2.34 2.03 -0.47 1.61 1.01 0.65 -4.99 120.40 117.91 3iud s VAL 38 Ca 0.00 -0.99 -0.26 0.00 0.00 0.00 0.00 61.98 60.73 3iud s VAL 38 Cb 0.00 -1.76 0.03 0.00 0.00 0.00 0.00 36.38 34.65 3iud s VAL 38 CO 0.00 0.55 0.95 -0.62 0.00 0.00 0.00 175.10 175.98 3iud s ASP 39 N 0.43 6.51 0.53 3.32 -1.08 -1.26 -3.11 116.67 122.00 3iud s ASP 39 Ca -0.17 0.14 0.21 0.00 -0.52 0.00 0.00 52.55 52.21 3iud s ASP 39 Cb -0.18 -2.46 1.35 0.00 -1.46 0.00 0.00 42.92 40.17 3iud s ASP 39 CO 0.07 -1.08 2.08 -0.29 0.52 0.00 0.00 175.17 176.47 3iud h ILE 40 N 6.10 0.86 -0.23 4.11 2.10 -1.92 -1.54 117.51 126.98 3iud h ILE 40 Ca -0.24 0.00 -0.09 0.00 1.08 0.00 0.00 64.86 65.61 3iud h ILE 40 Cb 1.07 0.87 -0.01 0.00 -1.09 0.00 0.00 36.82 37.66 3iud h ILE 40 CO 1.04 0.00 -0.26 -0.33 -1.08 0.00 0.00 178.15 177.52 3iud h GLU 41 N 0.00 0.45 -0.60 2.19 4.39 -1.98 -1.30 114.58 117.72 3iud h GLU 41 Ca 0.12 -0.17 -0.07 0.00 0.34 0.00 0.00 59.36 59.58 3iud h GLU 41 Cb 0.47 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.07 3iud h GLU 41 CO -0.00 0.67 0.10 0.00 -1.16 0.00 0.00 179.01 178.62 3iud h ALA 42 N 1.33 1.04 0.24 3.43 0.00 -1.69 -1.20 119.26 122.41 3iud h ALA 42 Ca 0.06 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 3iud h ALA 42 Cb 0.67 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3iud h ALA 42 CO 0.05 0.62 -0.12 0.28 0.00 0.00 0.00 179.25 180.08 3iud h VAL 43 N 0.92 0.82 -0.59 0.00 2.07 -1.37 -2.55 116.25 115.54 3iud h VAL 43 Ca 0.19 -0.63 0.09 0.00 0.82 0.00 0.00 66.70 67.17 3iud h VAL 43 Cb 0.40 1.17 -0.07 0.00 -1.52 0.00 0.00 31.29 31.26 3iud h VAL 43 CO 0.01 0.13 0.21 0.74 0.02 0.00 0.00 177.57 178.69 3iud h THR 44 N -0.66 0.77 -0.86 2.57 2.02 -1.17 0.90 112.91 116.48 3iud h THR 44 Ca -0.03 -0.13 0.10 0.00 0.77 0.00 0.00 66.41 67.11 3iud h THR 44 Cb 0.46 0.34 -0.07 0.00 -1.74 0.00 0.00 68.15 67.14 3iud h THR 44 CO 0.05 0.07 0.50 0.00 0.37 0.00 0.00 175.52 176.52 3iud h ALA 45 N 1.41 1.23 -0.02 6.16 0.00 -1.19 -0.71 119.26 126.14 3iud h ALA 45 Ca 0.30 0.03 -0.22 0.00 0.00 0.00 0.00 54.91 55.02 3iud h ALA 45 Cb 0.37 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3iud h ALA 45 CO -0.31 0.13 -0.91 0.87 0.00 0.00 0.00 179.25 179.04 3iud h LYS 46 N 0.84 0.45 0.20 0.00 1.57 -0.82 -3.26 116.57 115.55 3iud h LYS 46 Ca 0.41 -0.46 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 3iud h LYS 46 Cb 0.37 0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.80 3iud h LYS 46 CO -0.25 1.11 -0.10 0.28 -0.57 0.00 0.00 179.45 179.93 3iud h VAL 47 N 0.27 0.84 0.00 0.50 2.07 -0.02 -1.91 116.25 118.01 3iud h VAL 47 Ca -0.07 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.26 3iud h VAL 47 Cb 1.53 0.95 0.00 0.00 -1.52 0.00 0.00 31.29 32.26 3iud h VAL 47 CO 0.16 0.04 0.00 -1.84 0.02 0.00 0.00 177.57 175.95 3iud n GLU 48 N -5.17 0.19 0.00 1.57 0.28 -0.35 -0.36 120.64 116.79 3iud n GLU 48 Ca -0.09 0.07 0.09 0.00 -0.16 0.00 0.00 57.16 57.07 3iud n GLU 48 Cb 0.16 -1.50 -0.06 0.00 1.43 0.00 0.00 31.44 31.47 3iud n GLU 48 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 3iud n LYS 49 N -1.09 1.26 -2.88 3.44 5.02 -0.74 -4.94 118.16 118.23 3iud n LYS 49 Ca 0.05 -0.38 -0.41 0.00 -2.02 0.00 0.00 58.31 55.54 3iud n LYS 49 Cb 0.03 -1.35 -0.04 0.00 -0.02 0.00 0.00 35.03 33.65 3iud n LYS 49 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 3iud s PHE 50 N -2.46 3.40 0.10 2.13 5.36 0.51 -5.05 117.98 121.98 3iud s PHE 50 Ca 0.11 1.25 0.08 0.00 -0.96 0.00 0.00 56.93 57.41 3iud s PHE 50 Cb 0.14 -3.03 -0.04 0.00 -0.34 0.00 0.00 43.02 39.76 3iud s PHE 50 CO 0.62 -0.27 -0.21 -0.06 -1.46 0.00 0.00 175.22 173.84 3iud s PHE 51 N 2.27 1.82 -0.01 10.12 0.08 -1.26 -4.76 117.98 126.24 3iud s PHE 51 Ca 0.38 -0.41 0.00 0.00 0.12 0.00 0.00 56.93 57.02 3iud s PHE 51 Cb -0.16 -1.00 0.01 0.00 -0.57 0.00 0.00 43.02 41.30 3iud s PHE 51 CO 0.12 0.21 -0.00 0.54 -0.10 0.00 0.00 175.22 175.99 3iud s VAL 52 N -1.15 0.09 0.51 -0.44 0.11 -0.79 -4.71 120.40 114.03 3iud s VAL 52 Ca 0.07 0.03 -0.17 0.00 -2.93 0.00 0.00 61.98 58.97 3iud s VAL 52 Cb -0.10 -0.13 -0.08 0.00 -1.53 0.00 0.00 36.38 34.54 3iud s VAL 52 CO 0.04 0.07 1.00 0.00 -3.33 0.00 0.00 175.10 172.88 3iud s ALA 53 N 0.41 2.99 -0.08 1.54 0.00 0.06 -4.20 121.76 122.47 3iud s ALA 53 Ca -0.04 0.29 -0.01 0.00 0.00 0.00 0.00 51.96 52.20 3iud s ALA 53 Cb -0.06 -3.15 -0.03 0.00 0.00 0.00 0.00 23.12 19.88 3iud s ALA 53 CO -0.01 -0.29 -0.01 0.08 0.00 0.00 0.00 175.76 175.54 3iud s VAL 54 N -2.47 4.23 -0.12 0.00 1.01 -0.64 -1.47 120.40 120.95 3iud s VAL 54 Ca 0.61 -0.29 -0.26 0.00 0.00 0.00 0.00 61.98 62.04 3iud s VAL 54 Cb -0.11 -2.78 -0.02 0.00 0.00 0.00 0.00 36.38 33.47 3iud s VAL 54 CO 0.28 0.60 0.87 -2.16 0.00 0.00 0.00 175.10 174.69 3iud s PRO 55 N -0.90 4.38 0.29 2.72 0.04 -1.24 -0.23 135.00 140.06 3iud s PRO 55 Ca 0.13 1.13 0.02 0.00 0.04 0.00 0.00 61.00 62.32 3iud s PRO 55 Cb -0.11 -3.53 0.60 0.00 0.04 0.00 0.00 34.50 31.49 3iud s PRO 55 CO 0.02 -0.24 1.82 0.66 0.04 0.00 0.00 177.00 179.31 3iud h SER 56 N 7.13 0.88 0.86 6.66 4.64 -1.73 -0.06 113.55 131.92 3iud h SER 56 Ca -0.33 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 3iud h SER 56 Cb 1.15 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 3iud h SER 56 CO 0.82 0.43 0.00 4.11 -0.87 0.00 0.00 176.83 181.32 3iud h TRP 57 N 0.92 0.00 0.00 4.77 0.09 -1.92 -2.86 115.95 116.95 3iud h TRP 57 Ca 0.52 0.00 0.00 0.00 0.09 0.00 0.00 58.89 59.50 3iud h TRP 57 Cb 0.60 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.84 3iud h TRP 57 CO -0.01 0.00 -0.08 0.41 0.09 0.00 0.00 178.44 178.85 3iud n GLY 58 N 0.12 -1.52 0.27 11.11 0.00 -0.04 -3.34 105.19 111.80 3iud n GLY 58 Ca 0.02 -0.12 0.17 0.00 0.00 0.00 0.00 46.02 46.09 3iud n GLY 58 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3iud h VAL 59 N 0.00 0.06 -1.68 1.61 2.07 -1.55 -3.44 116.25 113.32 3iud h VAL 59 Ca 0.00 -0.57 -0.45 0.00 0.82 0.00 0.00 66.70 66.49 3iud h VAL 59 Cb 0.56 1.53 -0.00 0.00 -1.52 0.00 0.00 31.29 31.87 3iud h VAL 59 CO 0.00 0.02 -0.35 -0.83 0.02 0.00 0.00 177.57 176.44 3iud s GLY 60 N -4.19 1.79 0.16 2.17 0.00 -1.21 -4.56 107.32 101.48 3iud s GLY 60 Ca 0.01 -1.61 -0.30 0.00 0.00 0.00 0.00 44.72 42.82 3iud s GLY 60 CO 0.55 -1.49 1.20 -1.59 0.00 0.00 0.00 173.10 171.78 3iud s THR 61 N -2.28 3.63 0.56 0.90 2.01 -1.26 -4.62 115.64 114.58 3iud s THR 61 Ca 0.47 1.33 0.02 0.00 0.31 0.00 0.00 61.69 63.82 3iud s THR 61 Cb -0.08 -3.85 0.05 0.00 0.01 0.00 0.00 72.50 68.63 3iud s THR 61 CO 0.30 0.19 0.79 -0.83 -0.69 0.00 0.00 174.62 174.39 3iud s GLY 62 N 0.29 1.82 0.35 4.40 0.00 0.68 -4.93 107.32 109.93 3iud s GLY 62 Ca 0.54 -1.43 -0.02 0.00 0.00 0.00 0.00 44.72 43.81 3iud s GLY 62 CO 0.35 -1.11 0.49 -0.32 0.00 0.00 0.00 173.10 172.52 3iud s GLY 63 N -4.47 1.50 0.53 0.20 0.00 -1.26 -4.14 107.32 99.67 3iud s GLY 63 Ca 0.58 -1.52 0.02 0.00 0.00 0.00 0.00 44.72 43.80 3iud s GLY 63 CO 0.39 -0.99 0.11 -0.51 0.00 0.00 0.00 173.10 172.10 3iud s THR 64 N -2.96 1.23 -0.01 0.90 -4.23 -0.18 -4.99 115.64 105.39 3iud s THR 64 Ca 0.30 -1.87 0.31 0.00 -1.18 0.00 0.00 61.69 59.25 3iud s THR 64 Cb -0.01 -2.09 0.33 0.00 1.34 0.00 0.00 72.50 72.07 3iud s THR 64 CO 0.21 0.00 1.93 0.08 -0.54 0.00 0.00 174.62 176.29 3iud h ARG 65 N 1.16 0.00 0.20 3.99 0.11 -2.06 -2.82 114.38 114.96 3iud h ARG 65 Ca -0.42 0.00 -0.34 0.00 0.10 0.00 0.00 59.98 59.32 3iud h ARG 65 Cb 1.32 0.00 0.02 0.00 1.11 0.00 0.00 29.97 32.41 3iud h ARG 65 CO 0.69 0.00 -1.59 0.74 0.10 0.00 0.00 179.97 179.92 3iud h PHE 66 N 0.00 0.76 -1.79 4.08 0.04 -2.06 -3.49 116.94 114.49 3iud h PHE 66 Ca 0.00 -0.56 0.25 0.00 2.80 0.00 0.00 57.97 60.46 3iud h PHE 66 Cb 0.29 -0.03 -0.13 0.00 2.20 0.00 0.00 35.95 38.28 3iud h PHE 66 CO 0.00 1.56 0.69 0.00 -0.60 0.00 0.00 178.31 179.97 3iud s ALA 67 N -2.60 -2.00 -0.06 2.45 0.00 -1.06 -5.14 121.76 113.34 3iud s ALA 67 Ca -0.11 0.76 -0.01 0.00 0.00 0.00 0.00 51.96 52.59 3iud s ALA 67 Cb 0.05 0.35 0.03 0.00 0.00 0.00 0.00 23.12 23.55 3iud s ALA 67 CO 0.89 -0.92 -0.00 0.50 0.00 0.00 0.00 175.76 176.23 3iud s ARG 68 N -2.74 0.56 -0.78 0.00 3.52 -1.26 -1.01 118.95 117.24 3iud s ARG 68 Ca 0.12 0.09 0.02 0.00 -0.13 0.00 0.00 55.73 55.82 3iud s ARG 68 Cb 0.01 -0.85 0.19 0.00 -1.56 0.00 0.00 34.95 32.74 3iud s ARG 68 CO -0.03 -0.25 0.61 -0.06 -0.81 0.00 0.00 175.30 174.76 3iud s PHE 69 N 1.69 3.70 0.62 5.12 0.08 -1.26 -5.06 117.98 122.86 3iud s PHE 69 Ca 0.00 -3.18 -0.19 0.00 0.12 0.00 0.00 56.93 53.69 3iud s PHE 69 Cb -0.13 -2.97 -0.02 0.00 -0.57 0.00 0.00 43.02 39.33 3iud s PHE 69 CO -0.04 -0.65 1.29 -1.25 -0.10 0.00 0.00 175.22 174.47 3iud s PRO 70 N -1.31 2.72 0.00 0.24 0.04 -1.26 -4.94 135.00 130.49 3iud s PRO 70 Ca 0.25 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.34 3iud s PRO 70 Cb -0.07 -1.92 0.00 0.00 0.04 0.00 0.00 34.50 32.55 3iud s PRO 70 CO -0.14 -1.47 0.00 0.41 0.04 0.00 0.00 177.00 175.85 3iud n GLY 71 N 0.80 1.71 3.86 0.56 0.00 -1.26 -5.09 105.19 105.77 3iud n GLY 71 Ca 0.15 -2.09 -0.31 0.00 0.00 0.00 0.00 46.02 43.76 3iud n GLY 71 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3iud s THR 72 N 0.89 4.60 -1.37 2.61 -4.23 -1.26 -4.14 115.64 112.74 3iud s THR 72 Ca 0.00 0.99 -0.03 0.00 -1.18 0.00 0.00 61.69 61.47 3iud s THR 72 Cb 0.00 -3.79 0.00 0.00 1.34 0.00 0.00 72.50 70.06 3iud s THR 72 CO 0.00 -0.96 0.40 0.61 -0.54 0.00 0.00 174.62 174.13 3iud n GLY 73 N -2.27 -0.34 3.76 3.99 0.00 -1.26 -4.82 105.19 104.23 3iud n GLY 73 Ca 0.06 -0.04 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 3iud n GLY 73 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3iud s GLU 74 N -5.38 4.25 0.24 1.61 0.41 -1.26 -4.76 118.70 113.81 3iud s GLU 74 Ca 0.20 2.34 -0.30 0.00 -0.41 0.00 0.00 54.97 56.81 3iud s GLU 74 Cb -0.09 -3.07 -0.10 0.00 -1.78 0.00 0.00 34.13 29.09 3iud s GLU 74 CO 0.25 -0.40 1.40 -1.25 -0.49 0.00 0.00 175.26 174.76 3iud s PRO 75 N -0.95 4.31 0.18 0.39 0.04 -1.26 -4.83 135.00 132.88 3iud s PRO 75 Ca 0.56 2.23 0.09 0.00 0.04 0.00 0.00 61.00 63.92 3iud s PRO 75 Cb -0.43 -3.13 -0.01 0.00 0.04 0.00 0.00 34.50 30.98 3iud s PRO 75 CO 0.49 -0.36 1.40 0.00 0.04 0.00 0.00 177.00 178.56 3iud h ARG 76 N 4.99 0.00 0.00 4.56 3.08 -1.93 -3.48 114.38 121.60 3iud h ARG 76 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.59 3iud h ARG 76 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.27 3iud h ARG 76 CO 0.77 0.84 0.00 0.41 -1.07 0.00 0.00 179.97 180.92 3iud n GLY 77 N 1.00 2.97 0.28 0.04 0.00 -1.26 -5.02 105.19 103.21 3iud n GLY 77 Ca -0.00 -0.87 -0.07 0.00 0.00 0.00 0.00 46.02 45.07 3iud n GLY 77 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3iud h ILE 78 N 0.22 1.24 -0.71 -0.61 6.09 -1.90 -1.80 117.51 120.04 3iud h ILE 78 Ca 0.00 -0.74 -0.05 0.00 -1.37 0.00 0.00 64.86 62.70 3iud h ILE 78 Cb 0.00 0.51 -0.03 0.00 0.47 0.00 0.00 36.82 37.77 3iud h ILE 78 CO 0.00 0.29 0.25 -0.26 -3.07 0.00 0.00 178.15 175.36 3iud h PHE 79 N 0.91 1.09 -0.51 2.19 0.04 -1.96 -0.23 116.94 118.46 3iud h PHE 79 Ca 0.22 -0.09 -0.09 0.00 2.80 0.00 0.00 57.97 60.81 3iud h PHE 79 Cb 0.20 -0.32 -0.02 0.00 2.20 0.00 0.00 35.95 38.01 3iud h PHE 79 CO 0.01 0.85 -0.03 -0.44 -0.60 0.00 0.00 178.31 178.10 3iud h ASP 80 N 1.03 0.91 -0.43 2.17 3.32 -1.92 -2.47 116.42 119.04 3iud h ASP 80 Ca 0.23 -0.32 -0.01 0.00 0.02 0.00 0.00 57.03 56.96 3iud h ASP 80 Cb 0.24 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.52 3iud h ASP 80 CO -0.01 1.01 0.25 0.11 -1.72 0.00 0.00 179.24 178.88 3iud h LYS 81 N 0.79 0.62 -0.32 3.56 1.57 -0.74 -1.98 116.57 120.07 3iud h LYS 81 Ca 0.14 -0.05 -0.16 0.00 -1.87 0.00 0.00 60.65 58.71 3iud h LYS 81 Cb 0.56 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.74 3iud h LYS 81 CO 0.03 0.45 -0.43 -0.07 -0.57 0.00 0.00 179.45 178.86 3iud h LEU 82 N 0.63 0.87 -1.47 2.94 3.38 -0.84 -1.45 115.31 119.38 3iud h LEU 82 Ca 0.16 -0.42 -0.02 0.00 0.09 0.00 0.00 57.88 57.69 3iud h LEU 82 Cb 0.01 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 3iud h LEU 82 CO -0.03 1.18 0.09 0.44 0.09 0.00 0.00 178.44 180.21 3iud h ASP 83 N 0.65 0.39 0.73 -0.43 3.32 -0.91 0.26 116.42 120.44 3iud h ASP 83 Ca 0.04 -0.04 -0.24 0.00 0.02 0.00 0.00 57.03 56.81 3iud h ASP 83 Cb 1.00 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.44 3iud h ASP 83 CO 0.10 0.39 -1.10 0.44 -1.72 0.00 0.00 179.24 177.35 3iud h ASP 84 N 0.43 0.27 0.29 6.45 3.32 -1.24 -3.11 116.42 122.84 3iud h ASP 84 Ca 0.10 -0.27 -0.07 0.00 0.02 0.00 0.00 57.03 56.81 3iud h ASP 84 Cb 0.15 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 3iud h ASP 84 CO -0.01 1.19 -0.33 0.00 -1.72 0.00 0.00 179.24 178.38 3iud h ALA 86 N 1.62 1.51 0.06 0.00 0.00 -0.89 -1.14 119.26 120.42 3iud h ALA 86 Ca 0.01 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 3iud h ALA 86 Cb 0.61 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.27 3iud h ALA 86 CO 0.04 0.36 -0.03 0.28 0.00 0.00 0.00 179.25 179.90 3iud h VAL 87 N 0.41 1.20 -0.49 0.00 2.07 -1.41 0.26 116.25 118.29 3iud h VAL 87 Ca 0.09 -0.97 0.10 0.00 0.82 0.00 0.00 66.70 66.75 3iud h VAL 87 Cb 0.25 1.83 -0.10 0.00 -1.52 0.00 0.00 31.29 31.75 3iud h VAL 87 CO 0.00 0.24 -0.16 0.40 0.02 0.00 0.00 177.57 178.07 3iud h ILE 88 N -0.52 0.44 -0.00 4.57 2.04 -1.20 -0.34 117.51 122.49 3iud h ILE 88 Ca -0.01 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.85 3iud h ILE 88 Cb 0.46 0.44 -0.00 0.00 -0.74 0.00 0.00 36.82 36.98 3iud h ILE 88 CO 0.01 0.00 0.00 -0.61 0.00 0.00 0.00 178.15 177.55 3iud h GLN 89 N -0.04 0.00 -0.98 2.37 5.75 -1.17 -1.72 115.11 119.32 3iud h GLN 89 Ca 0.24 -0.00 0.15 0.00 -0.15 0.00 0.00 58.65 58.88 3iud h GLN 89 Cb 0.41 -0.00 -0.09 0.00 1.07 0.00 0.00 27.48 28.86 3iud h GLN 89 CO -0.53 0.22 0.59 0.37 -2.65 0.00 0.00 178.83 176.84 3iud h GLN 90 N -0.22 0.83 0.14 1.69 4.15 0.35 0.66 115.11 122.71 3iud h GLN 90 Ca 0.00 -0.05 -0.33 0.00 0.77 0.00 0.00 58.65 59.04 3iud h GLN 90 Cb 0.22 -0.19 -0.00 0.00 0.21 0.00 0.00 27.48 27.72 3iud h GLN 90 CO -0.00 0.55 -1.66 -0.07 -1.93 0.00 0.00 178.83 175.72 3iud h LEU 91 N 0.85 0.48 0.00 -2.39 3.38 -1.07 -3.35 115.31 113.21 3iud h LEU 91 Ca 0.52 -0.71 -0.17 0.00 0.09 0.00 0.00 57.88 57.61 3iud h LEU 91 Cb 0.66 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 3iud h LEU 91 CO -0.32 1.60 -1.96 0.35 0.09 0.00 0.00 178.44 178.20 3iud n THR 92 N -3.50 0.80 -1.47 0.22 -2.24 -0.65 -0.56 114.28 106.88 3iud n THR 92 Ca -0.21 -0.68 -0.16 0.00 -2.27 0.00 0.00 64.05 60.74 3iud n THR 92 Cb 1.06 -0.35 -0.07 0.00 -2.10 0.00 0.00 70.33 68.87 3iud n THR 92 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3iud n ARG 93 N -2.60 -1.45 -0.08 -0.78 5.12 0.23 -4.74 116.66 112.37 3iud n ARG 93 Ca -0.16 1.06 0.04 0.00 -1.93 0.00 0.00 57.85 56.87 3iud n ARG 93 Cb 0.84 -5.40 0.08 0.00 -1.16 0.00 0.00 32.46 26.82 3iud n ARG 93 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3iud n ALA 94 N 1.30 2.25 -3.12 7.54 0.00 -1.26 -4.75 120.51 122.46 3iud n ALA 94 Ca -0.16 -0.91 -0.19 0.00 0.00 0.00 0.00 53.44 52.18 3iud n ALA 94 Cb 0.61 -0.28 -0.03 0.00 0.00 0.00 0.00 19.45 19.75 3iud n ALA 94 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3iud n THR 95 N 0.27 0.49 0.28 0.00 -2.24 -1.26 -1.88 114.28 109.94 3iud n THR 95 Ca 0.07 -4.72 0.11 0.00 -2.27 0.00 0.00 64.05 57.23 3iud n THR 95 Cb 0.31 -0.45 0.51 0.00 -2.10 0.00 0.00 70.33 68.60 3iud n THR 95 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 3iud n PRO 96 N 0.17 0.16 -4.34 -0.78 -0.04 -1.26 -4.48 135.00 124.42 3iud n PRO 96 Ca 0.26 0.51 -0.26 0.00 -0.04 0.00 0.00 63.50 63.97 3iud n PRO 96 Cb 0.62 -1.88 -0.13 0.00 -0.04 0.00 0.00 33.50 32.07 3iud n PRO 96 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 3iud s ASN 97 N -4.07 2.96 -0.03 3.54 0.01 -1.26 0.34 114.94 116.44 3iud s ASN 97 Ca 0.01 -0.74 0.07 0.00 -0.71 0.00 0.00 52.86 51.49 3iud s ASN 97 Cb 0.08 -0.18 -0.02 0.00 0.41 0.00 0.00 41.25 41.54 3iud s ASN 97 CO 0.29 0.11 -0.23 -0.69 -1.51 0.00 0.00 177.10 175.07 3iud s VAL 98 N -1.21 1.84 -0.21 1.60 1.01 0.08 -1.61 120.40 121.90 3iud s VAL 98 Ca 0.11 -0.99 -0.13 0.00 0.00 0.00 0.00 61.98 60.98 3iud s VAL 98 Cb -0.10 -1.54 -0.05 0.00 0.00 0.00 0.00 36.38 34.70 3iud s VAL 98 CO 0.06 0.52 0.26 -0.44 0.00 0.00 0.00 175.10 175.50 3iud s SER 99 N -0.44 6.29 0.17 3.32 0.01 0.69 -0.79 113.70 122.95 3iud s SER 99 Ca 0.06 0.33 -0.07 0.00 1.31 0.00 0.00 55.95 57.58 3iud s SER 99 Cb -0.10 -2.16 -0.06 0.00 0.21 0.00 0.00 66.02 63.91 3iud s SER 99 CO 0.00 0.04 0.45 -0.76 0.41 0.00 0.00 173.24 173.38 3iud s LEU 100 N 0.96 4.24 -0.11 2.44 1.02 -1.25 -1.81 118.68 124.16 3iud s LEU 100 Ca 0.13 0.75 0.03 0.00 0.02 0.00 0.00 54.13 55.06 3iud s LEU 100 Cb -0.14 -3.42 0.01 0.00 0.02 0.00 0.00 46.19 42.66 3iud s LEU 100 CO 0.05 0.02 -0.22 -2.28 0.02 0.00 0.00 176.35 173.94 3iud s HIS 101 N -1.69 2.47 -0.02 0.29 2.46 -1.26 -1.51 115.29 116.03 3iud s HIS 101 Ca 0.43 -1.10 0.04 0.00 0.47 0.00 0.00 55.06 54.89 3iud s HIS 101 Cb -0.12 -1.68 -0.03 0.00 -0.13 0.00 0.00 32.58 30.62 3iud s HIS 101 CO 0.23 -0.48 -0.11 0.42 -2.47 0.00 0.00 174.74 172.32 3iud s ILE 102 N 0.57 3.30 -1.87 0.89 1.09 -0.63 -0.44 121.20 124.12 3iud s ILE 102 Ca -0.14 -0.78 0.31 0.00 -1.10 0.00 0.00 60.65 58.93 3iud s ILE 102 Cb -0.17 -2.37 0.70 0.00 -1.06 0.00 0.00 42.46 39.57 3iud s ILE 102 CO 0.04 0.48 2.07 -0.81 -0.10 0.00 0.00 174.94 176.63 3iud n PRO 103 N 1.91 0.89 -0.27 2.79 -0.04 -1.26 -2.40 135.00 136.63 3iud n PRO 103 Ca -0.16 -0.15 0.06 0.00 -0.04 0.00 0.00 63.50 63.20 3iud n PRO 103 Cb 0.52 -1.50 0.16 0.00 -0.04 0.00 0.00 33.50 32.65 3iud n PRO 103 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 3iud h TRP 104 N 0.36 -0.09 -0.69 0.54 6.55 -1.94 -0.28 115.95 120.40 3iud h TRP 104 Ca 0.00 0.06 0.00 0.00 0.95 0.00 0.00 58.89 59.90 3iud h TRP 104 Cb 0.18 0.17 0.00 0.00 -0.86 0.00 0.00 29.16 28.65 3iud h TRP 104 CO 0.00 -0.27 0.00 -0.25 -1.05 0.00 0.00 178.44 176.87 3iud n ASP 105 N -5.38 4.33 -4.66 -3.49 8.00 0.41 -4.78 116.55 110.97 3iud n ASP 105 Ca 0.14 -2.22 -0.46 0.00 0.71 0.00 0.00 54.79 52.96 3iud n ASP 105 Cb 0.49 -0.54 -0.04 0.00 -0.02 0.00 0.00 41.12 41.02 3iud n ASP 105 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 3iud n LYS 106 N 1.38 2.02 -3.62 -1.24 4.81 -0.12 -4.90 118.16 116.49 3iud n LYS 106 Ca 0.25 0.72 0.02 0.00 -0.87 0.00 0.00 58.31 58.44 3iud n LYS 106 Cb 0.75 -2.44 -0.00 0.00 0.02 0.00 0.00 35.03 33.36 3iud n LYS 106 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3iud s ALA 107 N 0.49 -2.30 -0.46 3.14 0.00 -1.26 -5.02 121.76 116.35 3iud s ALA 107 Ca 0.75 0.72 -0.31 0.00 0.00 0.00 0.00 51.96 53.12 3iud s ALA 107 Cb -0.69 0.36 -0.11 0.00 0.00 0.00 0.00 23.12 22.68 3iud s ALA 107 CO 0.43 -1.06 2.33 -3.47 0.00 0.00 0.00 175.76 173.99 3iud n ASP 108 N -0.52 2.06 -0.33 0.00 2.03 -1.26 -4.79 116.55 113.74 3iud n ASP 108 Ca -0.08 0.11 0.12 0.00 0.52 0.00 0.00 54.79 55.45 3iud n ASP 108 Cb 0.63 -1.34 0.30 0.00 -0.72 0.00 0.00 41.12 40.00 3iud n ASP 108 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 3iud h PRO 109 N 14.59 0.64 -0.97 -0.67 0.11 -1.95 0.69 132.00 144.44 3iud h PRO 109 Ca -0.25 -0.04 0.11 0.00 0.11 0.00 0.00 66.00 65.94 3iud h PRO 109 Cb 1.30 -0.14 -0.08 0.00 0.11 0.00 0.00 31.00 32.18 3iud h PRO 109 CO 1.10 0.42 0.62 0.87 -0.21 0.00 0.00 178.00 180.81 3iud h LYS 110 N 0.66 0.94 -0.00 1.05 1.57 -1.86 -0.28 116.57 118.65 3iud h LYS 110 Ca 0.56 -0.06 -0.05 0.00 -1.87 0.00 0.00 60.65 59.23 3iud h LYS 110 Cb 0.90 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 33.00 3iud h LYS 110 CO -0.41 0.62 -0.20 0.93 -0.57 0.00 0.00 179.45 179.82 3iud h GLU 111 N 0.97 0.14 -0.64 3.15 5.08 -1.28 -2.64 114.58 119.36 3iud h GLU 111 Ca 0.47 -0.15 0.12 0.00 -1.00 0.00 0.00 59.36 58.81 3iud h GLU 111 Cb 0.47 0.04 -0.12 0.00 0.50 0.00 0.00 28.75 29.64 3iud h GLU 111 CO -0.23 0.90 -0.25 -0.07 -1.00 0.00 0.00 179.01 178.35 3iud h LEU 112 N -0.56 -0.88 -0.04 1.33 3.38 -0.70 0.46 115.31 118.29 3iud h LEU 112 Ca -0.02 0.22 0.03 0.00 0.09 0.00 0.00 57.88 58.19 3iud h LEU 112 Cb 0.97 0.49 -0.04 0.00 0.09 0.00 0.00 40.66 42.17 3iud h LEU 112 CO 0.04 -0.26 -0.18 0.50 0.09 0.00 0.00 178.44 178.63 3iud h LYS 113 N -0.08 -0.26 -0.26 1.13 1.63 -1.12 0.51 116.57 118.12 3iud h LYS 113 Ca 0.28 0.02 0.06 0.00 -0.85 0.00 0.00 60.65 60.16 3iud h LYS 113 Cb 0.53 0.06 -0.07 0.00 -0.60 0.00 0.00 32.23 32.14 3iud h LYS 113 CO -0.69 -0.17 -0.24 0.00 -3.45 0.00 0.00 179.45 174.90 3iud h ALA 114 N 0.69 -0.11 -0.72 5.00 0.00 -0.36 0.19 119.26 123.94 3iud h ALA 114 Ca 0.07 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 3iud h ALA 114 Cb 0.36 0.51 -0.03 0.00 0.00 0.00 0.00 17.79 18.63 3iud h ALA 114 CO -0.20 -0.66 0.34 -0.09 0.00 0.00 0.00 179.25 178.64 3iud h ARG 115 N -0.24 1.03 0.08 0.00 9.65 0.31 -0.95 114.38 124.26 3iud h ARG 115 Ca 0.14 -0.14 -0.00 0.00 -1.10 0.00 0.00 59.98 58.87 3iud h ARG 115 Cb 0.46 -0.19 0.00 0.00 -1.39 0.00 0.00 29.97 28.85 3iud h ARG 115 CO -0.40 0.80 -0.04 0.78 2.80 0.00 0.00 179.97 183.91 3iud h GLY 116 N 1.08 -0.11 1.75 2.80 0.00 0.15 -0.37 103.07 108.37 3iud h GLY 116 Ca 0.25 0.04 -0.05 0.00 0.00 0.00 0.00 47.33 47.57 3iud h GLY 116 CO -0.03 -0.04 -0.10 -0.55 0.00 0.00 0.00 176.54 175.82 3iud h ASP 117 N -0.15 0.29 -0.03 0.19 3.32 -0.43 0.22 116.42 119.84 3iud h ASP 117 Ca -0.01 -0.06 -0.12 0.00 0.02 0.00 0.00 57.03 56.86 3iud h ASP 117 Cb 0.12 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 3iud h ASP 117 CO 0.02 0.43 -0.38 0.00 -1.72 0.00 0.00 179.24 177.59 3iud h ALA 118 N 1.61 0.91 -0.01 3.45 0.00 -0.80 -2.96 119.26 121.45 3iud h ALA 118 Ca 0.06 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3iud h ALA 118 Cb 0.36 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3iud h ALA 118 CO 0.02 0.63 -0.03 1.28 0.00 0.00 0.00 179.25 181.14 3iud n LEU 119 N -4.04 1.47 -0.88 0.00 4.77 -0.18 -3.42 117.00 114.72 3iud n LEU 119 Ca -0.01 -0.48 -0.07 0.00 -0.03 0.00 0.00 56.01 55.41 3iud n LEU 119 Cb 0.49 -0.02 -0.00 0.00 -2.33 0.00 0.00 43.42 41.57 3iud n LEU 119 CO 0.44 0.25 -0.08 0.61 -1.33 0.00 0.00 177.39 177.28 3iud n GLY 120 N 1.20 0.10 3.51 -0.72 0.00 -0.43 -4.87 105.19 103.98 3iud n GLY 120 Ca 0.18 -0.57 -0.26 0.00 0.00 0.00 0.00 46.02 45.37 3iud n GLY 120 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3iud s LEU 121 N -2.15 2.74 0.00 0.99 1.43 0.65 -4.89 118.68 117.45 3iud s LEU 121 Ca 0.02 -0.76 0.00 0.00 -1.03 0.00 0.00 54.13 52.36 3iud s LEU 121 Cb -0.01 -1.40 -0.00 0.00 0.03 0.00 0.00 46.19 44.81 3iud s LEU 121 CO 0.02 0.09 0.02 0.61 0.23 0.00 0.00 176.35 177.32 3iud n GLY 122 N -0.05 3.61 3.14 -3.19 0.00 0.15 -3.97 105.19 104.88 3iud n GLY 122 Ca -0.10 -2.32 -0.30 0.00 0.00 0.00 0.00 46.02 43.30 3iud n GLY 122 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3iud s PHE 123 N -2.64 2.22 0.00 1.61 0.08 -1.26 -0.74 117.98 117.24 3iud s PHE 123 Ca 0.02 -0.95 0.00 0.00 0.12 0.00 0.00 56.93 56.13 3iud s PHE 123 Cb 0.00 -1.52 0.00 0.00 -0.57 0.00 0.00 43.02 40.93 3iud s PHE 123 CO 0.02 -0.42 0.00 -3.47 -0.10 0.00 0.00 175.22 171.25 3iud n ASP 124 N 3.77 0.00 -4.48 1.36 2.03 0.03 -4.32 116.55 114.95 3iud n ASP 124 Ca -0.20 -0.17 -0.43 0.00 0.52 0.00 0.00 54.79 54.51 3iud n ASP 124 Cb 0.52 0.00 -0.00 0.00 -0.72 0.00 0.00 41.12 40.92 3iud n ASP 124 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3iud n ALA 125 N -3.00 -1.35 -2.01 -1.67 0.00 -1.26 -4.62 120.51 106.60 3iud n ALA 125 Ca 0.00 0.25 -0.35 0.00 0.00 0.00 0.00 53.44 53.34 3iud n ALA 125 Cb 0.00 -1.81 -0.06 0.00 0.00 0.00 0.00 19.45 17.57 3iud n ALA 125 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3iud s MET 126 N -1.52 4.25 -0.15 0.00 -1.94 0.20 -3.78 119.30 116.35 3iud s MET 126 Ca 0.62 0.94 0.01 0.00 -1.71 0.00 0.00 55.69 55.56 3iud s MET 126 Cb -0.66 -2.65 0.01 0.00 2.01 0.00 0.00 34.83 33.54 3iud s MET 126 CO 0.58 0.25 -0.19 -0.80 -0.01 0.00 0.00 175.02 174.85 3iud s ASN 127 N -1.88 3.28 0.40 3.03 0.01 -0.57 0.24 114.94 119.45 3iud s ASN 127 Ca 0.50 -0.57 -0.04 0.00 -0.71 0.00 0.00 52.86 52.03 3iud s ASN 127 Cb -0.14 -1.49 -0.04 0.00 0.41 0.00 0.00 41.25 39.99 3iud s ASN 127 CO 0.19 0.06 0.67 -0.94 -1.51 0.00 0.00 177.10 175.58 3iud s SER 128 N 0.93 6.34 -0.32 -1.22 1.04 -1.09 -1.60 113.70 117.79 3iud s SER 128 Ca -0.04 0.78 -0.01 0.00 0.48 0.00 0.00 55.95 57.17 3iud s SER 128 Cb -0.15 -2.18 0.10 0.00 0.10 0.00 0.00 66.02 63.90 3iud s SER 128 CO -0.04 -0.40 0.12 0.21 0.98 0.00 0.00 173.24 174.11 3iud s ASN 129 N -3.77 3.93 -0.14 7.02 3.84 -1.01 -4.67 114.94 120.14 3iud s ASN 129 Ca 0.45 -1.71 0.15 0.00 0.21 0.00 0.00 52.86 51.97 3iud s ASN 129 Cb -0.10 -0.82 0.40 0.00 -0.55 0.00 0.00 41.25 40.18 3iud s ASN 129 CO 0.38 -0.40 1.20 0.35 -2.79 0.00 0.00 177.10 175.83 3iud n THR 130 N 4.75 1.55 0.09 -5.21 -2.24 -1.26 -4.61 114.28 107.36 3iud n THR 130 Ca -0.01 -2.51 0.06 0.00 -2.27 0.00 0.00 64.05 59.32 3iud n THR 130 Cb 0.41 0.11 0.13 0.00 -2.10 0.00 0.00 70.33 68.88 3iud n THR 130 CO 0.00 0.00 0.00 2.22 -0.57 0.00 0.00 175.07 176.72 3iud n PHE 131 N -0.68 0.32 -3.67 4.78 1.16 -1.26 -4.62 117.46 113.50 3iud n PHE 131 Ca 0.15 -0.30 -0.15 0.00 -1.87 0.00 0.00 57.45 55.28 3iud n PHE 131 Cb 0.81 -0.01 -0.08 0.00 -1.61 0.00 0.00 39.48 38.59 3iud n PHE 131 CO 0.00 0.00 0.00 -1.54 -1.87 0.00 0.00 176.76 173.35 3iud s SER 132 N -1.03 -0.41 0.25 5.98 1.04 -1.26 -4.94 113.70 113.32 3iud s SER 132 Ca 0.22 0.44 -0.21 0.00 0.48 0.00 0.00 55.95 56.88 3iud s SER 132 Cb 0.13 0.49 -0.09 0.00 0.10 0.00 0.00 66.02 66.65 3iud s SER 132 CO 0.17 -0.47 0.78 -1.81 0.98 0.00 0.00 173.24 172.90 3iud s ASP 133 N -1.06 7.14 0.23 7.02 1.01 -1.26 -4.88 116.67 124.86 3iud s ASP 133 Ca -0.11 1.53 0.08 0.00 0.71 0.00 0.00 52.55 54.76 3iud s ASP 133 Cb -0.03 -2.46 -0.04 0.00 1.01 0.00 0.00 42.92 41.40 3iud s ASP 133 CO 0.06 0.01 0.08 0.00 0.21 0.00 0.00 175.17 175.53 3iud s ALA 134 N -1.54 3.37 0.06 5.23 0.00 -1.26 -5.05 121.76 122.57 3iud s ALA 134 Ca 0.45 -1.45 -0.35 0.00 0.00 0.00 0.00 51.96 50.60 3iud s ALA 134 Cb -0.17 -1.08 -0.14 0.00 0.00 0.00 0.00 23.12 21.73 3iud s ALA 134 CO 0.22 0.34 1.61 -2.30 0.00 0.00 0.00 175.76 175.63 3iud n PRO 135 N -0.74 1.89 0.00 0.00 -0.02 -1.26 -1.28 135.00 133.59 3iud n PRO 135 Ca -0.08 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 3iud n PRO 135 Cb 0.57 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 3iud n PRO 135 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3iud n GLY 136 N 3.53 2.76 3.57 -1.23 0.00 -1.26 -4.99 105.19 107.56 3iud n GLY 136 Ca 0.19 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.74 3iud n GLY 136 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3iud n GLN 137 N -2.00 1.12 0.08 1.61 7.27 -0.41 -4.90 117.38 120.14 3iud n GLN 137 Ca 0.00 0.40 -0.15 0.00 0.07 0.00 0.00 57.00 57.32 3iud n GLN 137 Cb 0.00 -1.81 -0.14 0.00 2.41 0.00 0.00 30.24 30.70 3iud n GLN 137 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3iud h ALA 138 N 2.72 0.23 -3.24 1.69 0.00 -1.94 -3.45 119.26 115.26 3iud h ALA 138 Ca -0.41 -1.01 -0.61 0.00 0.00 0.00 0.00 54.91 52.87 3iud h ALA 138 Cb 1.35 0.13 -0.34 0.00 0.00 0.00 0.00 17.79 18.93 3iud h ALA 138 CO 0.66 1.11 -0.85 -1.01 0.00 0.00 0.00 179.25 179.16 3iud s HIS 139 N -2.64 2.19 0.42 0.00 3.76 -1.26 -5.12 115.29 112.63 3iud s HIS 139 Ca -0.06 -1.06 -0.24 0.00 -0.15 0.00 0.00 55.06 53.55 3iud s HIS 139 Cb 0.07 -1.54 -0.08 0.00 1.11 0.00 0.00 32.58 32.14 3iud s HIS 139 CO 0.86 -0.52 1.14 0.45 -0.85 0.00 0.00 174.74 175.82 3iud s SER 140 N 0.94 6.46 -0.19 1.40 0.15 -1.26 -4.94 113.70 116.26 3iud s SER 140 Ca -0.07 2.28 0.12 0.00 0.70 0.00 0.00 55.95 58.98 3iud s SER 140 Cb -0.15 -2.61 0.69 0.00 -1.71 0.00 0.00 66.02 62.25 3iud s SER 140 CO -0.02 -0.71 1.55 -1.22 1.20 0.00 0.00 173.24 174.05 3iud n TYR 141 N -0.11 1.74 -0.16 3.44 4.01 -1.26 -4.53 117.16 120.28 3iud n TYR 141 Ca 0.05 -0.61 -0.04 0.00 -0.16 0.00 0.00 57.90 57.15 3iud n TYR 141 Cb 0.47 -0.44 0.06 0.00 -0.31 0.00 0.00 39.34 39.12 3iud n TYR 141 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 3iud h LYS 142 N 3.39 0.40 -0.79 -0.72 3.64 -1.94 -1.93 116.57 118.62 3iud h LYS 142 Ca 0.00 -0.02 -0.30 0.00 -1.27 0.00 0.00 60.65 59.06 3iud h LYS 142 Cb 1.73 -0.09 -0.18 0.00 -0.41 0.00 0.00 32.23 33.28 3iud h LYS 142 CO 0.41 0.26 0.36 0.66 -2.27 0.00 0.00 179.45 178.87 3iud n TYR 143 N -4.95 2.56 0.00 1.91 4.01 -1.26 -5.03 117.16 114.39 3iud n TYR 143 Ca 0.05 -1.41 0.00 0.00 -0.16 0.00 0.00 57.90 56.38 3iud n TYR 143 Cb 0.17 -0.75 0.00 0.00 -0.31 0.00 0.00 39.34 38.45 3iud n TYR 143 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3iud n GLY 144 N -0.50 0.63 0.00 2.72 0.00 -0.73 -4.59 105.19 102.74 3iud n GLY 144 Ca 0.46 -2.32 0.00 0.00 0.00 0.00 0.00 46.02 44.16 3iud n GLY 144 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3iud n SER 145 N 0.00 0.00 0.25 1.61 3.41 -1.26 -4.14 113.62 113.49 3iud n SER 145 Ca 0.00 0.00 0.10 0.00 -0.26 0.00 0.00 58.87 58.71 3iud n SER 145 Cb 0.00 0.00 0.64 0.00 -0.26 0.00 0.00 64.21 64.59 3iud n SER 145 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3iud h LEU 146 N 0.00 0.00 -2.91 1.04 3.38 -1.87 -2.55 115.31 112.40 3iud h LEU 146 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3iud h LEU 146 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3iud h LEU 146 CO 0.00 0.15 0.00 -1.54 0.09 0.00 0.00 178.44 177.14 3iud n SER 147 N -3.83 3.00 -4.67 -0.43 3.41 -1.26 -3.93 113.62 105.90 3iud n SER 147 Ca -0.02 -2.07 -0.38 0.00 -0.26 0.00 0.00 58.87 56.15 3iud n SER 147 Cb 0.25 -0.25 0.05 0.00 -0.26 0.00 0.00 64.21 64.00 3iud n SER 147 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 3iud n HIS 148 N 0.45 1.43 0.23 7.33 -0.00 -0.96 -4.80 115.22 118.91 3iud n HIS 148 Ca 0.12 0.44 0.10 0.00 -0.00 0.00 0.00 57.72 58.38 3iud n HIS 148 Cb 0.46 -2.22 0.54 0.00 -0.00 0.00 0.00 29.99 28.76 3iud n HIS 148 CO 0.00 0.00 0.00 1.79 -0.00 0.00 0.00 176.34 178.13 3iud h THR 149 N 0.71 0.60 -3.31 3.57 1.35 -1.90 -3.43 112.91 110.49 3iud h THR 149 Ca -0.49 -0.96 -0.59 0.00 -0.55 0.00 0.00 66.41 63.81 3iud h THR 149 Cb 1.35 1.64 -0.09 0.00 -1.73 0.00 0.00 68.15 69.31 3iud h THR 149 CO 0.53 0.20 0.42 0.21 -0.25 0.00 0.00 175.52 176.63 3iud s ASN 150 N -6.21 6.81 0.14 5.36 2.47 -1.26 -4.97 114.94 117.29 3iud s ASN 150 Ca -0.01 1.01 -0.19 0.00 0.42 0.00 0.00 52.86 54.09 3iud s ASN 150 Cb 0.11 -2.42 0.02 0.00 -1.45 0.00 0.00 41.25 37.51 3iud s ASN 150 CO 0.62 -0.48 1.69 0.00 -3.72 0.00 0.00 177.10 175.22 3iud h ALA 151 N 7.65 0.19 -0.82 1.71 0.00 -1.99 -1.46 119.26 124.54 3iud h ALA 151 Ca -0.24 0.11 0.14 0.00 0.00 0.00 0.00 54.91 54.91 3iud h ALA 151 Cb 1.10 0.21 -0.06 0.00 0.00 0.00 0.00 17.79 19.04 3iud h ALA 151 CO 0.85 -0.46 0.54 0.00 0.00 0.00 0.00 179.25 180.18 3iud h ALA 152 N 1.28 1.94 -0.24 0.00 0.00 -1.97 0.10 119.26 120.37 3iud h ALA 152 Ca 0.13 0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.89 3iud h ALA 152 Cb 0.20 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3iud h ALA 152 CO -0.28 -0.15 -0.47 1.15 0.00 0.00 0.00 179.25 179.50 3iud h THR 153 N 0.58 1.30 -0.47 0.00 2.02 -1.67 -2.15 112.91 112.53 3iud h THR 153 Ca 0.40 -1.67 -0.05 0.00 0.77 0.00 0.00 66.41 65.86 3iud h THR 153 Cb 0.73 1.77 -0.02 0.00 -1.74 0.00 0.00 68.15 68.89 3iud h THR 153 CO -0.16 0.53 0.11 0.03 0.37 0.00 0.00 175.52 176.40 3iud h ARG 154 N 0.46 0.75 -0.70 6.66 3.08 -0.23 -1.98 114.38 122.41 3iud h ARG 154 Ca 0.01 -0.18 0.04 0.00 0.07 0.00 0.00 59.98 59.92 3iud h ARG 154 Cb 1.07 -0.10 -0.05 0.00 0.08 0.00 0.00 29.97 30.98 3iud h ARG 154 CO 0.10 0.74 0.43 0.00 -1.07 0.00 0.00 179.97 180.17 3iud h ALA 155 N 0.98 0.92 -0.72 0.04 0.00 -0.85 0.15 119.26 119.78 3iud h ALA 155 Ca 0.15 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.05 3iud h ALA 155 Cb 0.32 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 3iud h ALA 155 CO 0.00 0.18 0.47 0.37 0.00 0.00 0.00 179.25 180.27 3iud h GLN 156 N 0.83 0.93 -0.40 0.00 4.15 -1.09 0.60 115.11 120.11 3iud h GLN 156 Ca 0.29 -0.06 -0.01 0.00 0.77 0.00 0.00 58.65 59.64 3iud h GLN 156 Cb 0.06 -0.21 -0.02 0.00 0.21 0.00 0.00 27.48 27.52 3iud h GLN 156 CO -0.13 0.61 0.20 0.00 -1.93 0.00 0.00 178.83 177.59 3iud h ALA 157 N 1.27 0.52 0.16 3.38 0.00 -0.58 -1.52 119.26 122.49 3iud h ALA 157 Ca 0.27 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.08 3iud h ALA 157 Cb -0.09 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 3iud h ALA 157 CO -0.07 0.07 -0.17 0.28 0.00 0.00 0.00 179.25 179.36 3iud h VAL 158 N 0.51 0.62 -0.98 0.00 2.07 -0.41 -2.25 116.25 115.81 3iud h VAL 158 Ca 0.14 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.78 3iud h VAL 158 Cb 0.10 0.62 -0.08 0.00 -1.52 0.00 0.00 31.29 30.41 3iud h VAL 158 CO -0.02 0.00 0.61 -0.08 0.02 0.00 0.00 177.57 178.10 3iud h GLU 159 N -0.37 0.93 -0.84 1.57 4.57 -0.73 -1.11 114.58 118.60 3iud h GLU 159 Ca 0.01 -0.06 0.01 0.00 -1.18 0.00 0.00 59.36 58.14 3iud h GLU 159 Cb 0.36 -0.21 -0.04 0.00 -0.16 0.00 0.00 28.75 28.69 3iud h GLU 159 CO -0.05 0.62 0.56 1.25 -1.18 0.00 0.00 179.01 180.21 3iud h HIS 160 N 0.96 1.06 -0.52 0.92 2.76 -0.80 -0.70 115.15 118.84 3iud h HIS 160 Ca 0.48 0.03 -0.09 0.00 -2.20 0.00 0.00 60.37 58.58 3iud h HIS 160 Cb 0.47 -0.36 -0.02 0.00 1.55 0.00 0.00 27.41 29.05 3iud h HIS 160 CO -0.01 0.67 -0.05 -0.91 -1.30 0.00 0.00 177.93 176.32 3iud h ASN 161 N 1.14 0.90 -0.38 3.26 2.35 -0.68 -1.32 115.58 120.85 3iud h ASN 161 Ca 0.31 -0.26 -0.07 0.00 -0.55 0.00 0.00 56.30 55.73 3iud h ASN 161 Cb -0.13 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 37.98 3iud h ASN 161 CO -0.07 0.99 -0.00 -0.07 -1.65 0.00 0.00 177.43 176.63 3iud h LEU 162 N 0.84 0.74 -0.66 1.61 3.38 -0.66 -1.28 115.31 119.27 3iud h LEU 162 Ca 0.15 -0.17 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 3iud h LEU 162 Cb 0.57 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 3iud h LEU 162 CO 0.03 0.80 0.17 -0.08 0.09 0.00 0.00 178.44 179.46 3iud h GLU 163 N 0.72 1.05 -1.00 1.13 4.81 -0.86 -1.06 114.58 119.37 3iud h GLU 163 Ca 0.14 -0.25 0.08 0.00 -0.13 0.00 0.00 59.36 59.21 3iud h GLU 163 Cb 0.44 -0.14 -0.07 0.00 0.63 0.00 0.00 28.75 29.61 3iud h GLU 163 CO 0.02 0.94 0.64 0.00 -0.73 0.00 0.00 179.01 179.87 3iud h ILE 165 N 1.11 1.27 -0.24 0.00 2.04 -0.53 -1.82 117.51 119.33 3iud h ILE 165 Ca 0.45 -1.35 -0.00 0.00 1.00 0.00 0.00 64.86 64.96 3iud h ILE 165 Cb 0.28 1.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.45 3iud h ILE 165 CO -0.21 0.47 0.15 -0.33 0.00 0.00 0.00 178.15 178.23 3iud h GLU 166 N 0.84 0.33 0.03 2.37 4.39 0.10 -0.29 114.58 122.34 3iud h GLU 166 Ca 0.11 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.79 3iud h GLU 166 Cb 0.76 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.33 3iud h GLU 166 CO 0.06 0.26 -0.04 0.82 -1.16 0.00 0.00 179.01 178.95 3iud h ILE 167 N 0.30 0.90 -0.43 3.13 2.04 -1.11 -2.78 117.51 119.56 3iud h ILE 167 Ca 0.09 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.97 3iud h ILE 167 Cb 0.01 0.90 -0.02 0.00 -0.74 0.00 0.00 36.82 36.97 3iud h ILE 167 CO -0.02 0.00 0.29 1.23 0.00 0.00 0.00 178.15 179.65 3iud h GLY 168 N -0.09 0.55 1.79 5.37 0.00 -1.12 -1.57 103.07 108.01 3iud h GLY 168 Ca 0.01 -0.20 -0.09 0.00 0.00 0.00 0.00 47.33 47.05 3iud h GLY 168 CO -0.02 0.18 -0.34 0.50 0.00 0.00 0.00 176.54 176.85 3iud h LYS 169 N 0.50 0.24 0.00 4.80 1.57 -0.78 0.32 116.57 123.21 3iud h LYS 169 Ca 0.17 -0.10 -0.02 0.00 -1.87 0.00 0.00 60.65 58.83 3iud h LYS 169 Cb 0.07 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.37 3iud h LYS 169 CO -0.04 0.56 -0.10 0.00 -0.57 0.00 0.00 179.45 179.29 3iud h ALA 170 N 1.44 0.99 -0.01 3.86 0.00 -1.07 -3.20 119.26 121.26 3iud h ALA 170 Ca 0.03 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3iud h ALA 170 Cb 0.71 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.48 3iud h ALA 170 CO 0.05 0.13 -0.30 0.44 0.00 0.00 0.00 179.25 179.57 3iud n ILE 171 N -3.20 0.00 -0.13 0.00 -5.35 -1.06 -4.78 119.36 104.85 3iud n ILE 171 Ca 0.01 -0.35 0.00 0.00 -0.27 0.00 0.00 62.75 62.14 3iud n ILE 171 Cb 0.42 1.18 0.00 0.00 -1.74 0.00 0.00 39.64 39.49 3iud n ILE 171 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3iud n GLY 172 N 1.09 0.92 3.81 3.28 0.00 -0.78 -4.63 105.19 108.88 3iud n GLY 172 Ca 0.06 -0.10 -0.33 0.00 0.00 0.00 0.00 46.02 45.65 3iud n GLY 172 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3iud s SER 173 N -2.09 6.42 -0.06 1.61 0.15 0.11 -4.78 113.70 115.05 3iud s SER 173 Ca 0.00 1.81 0.09 0.00 0.70 0.00 0.00 55.95 58.55 3iud s SER 173 Cb 0.00 -2.54 0.14 0.00 -1.71 0.00 0.00 66.02 61.91 3iud s SER 173 CO 0.00 -0.73 1.06 0.29 1.20 0.00 0.00 173.24 175.07 3iud n LYS 174 N -1.16 0.66 -3.58 5.44 4.76 -1.26 -4.50 118.16 118.52 3iud n LYS 174 Ca 0.08 -1.76 -0.12 0.00 -2.87 0.00 0.00 58.31 53.64 3iud n LYS 174 Cb 0.53 -0.99 -0.06 0.00 -1.84 0.00 0.00 35.03 32.67 3iud n LYS 174 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3iud s ALA 175 N -1.40 -1.89 -0.10 7.82 0.00 -1.26 -2.11 121.76 122.83 3iud s ALA 175 Ca 0.15 1.63 0.01 0.00 0.00 0.00 0.00 51.96 53.75 3iud s ALA 175 Cb 0.13 -0.74 -0.02 0.00 0.00 0.00 0.00 23.12 22.50 3iud s ALA 175 CO 0.01 -0.31 -0.13 -1.17 0.00 0.00 0.00 175.76 174.16 3iud s LEU 176 N -0.70 2.75 -0.17 0.00 2.96 -0.55 0.60 118.68 123.58 3iud s LEU 176 Ca -0.03 -0.27 -0.02 0.00 -0.22 0.00 0.00 54.13 53.59 3iud s LEU 176 Cb -0.02 -1.60 -0.02 0.00 0.50 0.00 0.00 46.19 45.06 3iud s LEU 176 CO 0.02 0.23 -0.07 -0.89 -1.32 0.00 0.00 176.35 174.32 3iud s THR 177 N -0.06 3.39 -0.27 3.68 2.01 0.14 -0.44 115.64 124.09 3iud s THR 177 Ca -0.02 -0.52 -0.02 0.00 0.31 0.00 0.00 61.69 61.44 3iud s THR 177 Cb -0.14 -2.49 0.04 0.00 0.01 0.00 0.00 72.50 69.92 3iud s THR 177 CO 0.04 0.48 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.72 3iud s VAL 178 N 0.79 2.93 -0.10 3.82 1.01 0.98 -2.66 120.40 127.16 3iud s VAL 178 Ca -0.03 -1.19 -0.00 0.00 0.00 0.00 0.00 61.98 60.76 3iud s VAL 178 Cb -0.15 -2.58 0.02 0.00 0.00 0.00 0.00 36.38 33.67 3iud s VAL 178 CO 0.02 0.05 -0.07 0.86 0.00 0.00 0.00 175.10 175.96 3iud s TRP 179 N 1.29 1.38 0.24 5.22 -0.00 -1.26 -2.16 118.94 123.65 3iud s TRP 179 Ca -0.02 -0.65 0.09 0.00 -0.00 0.00 0.00 56.10 55.52 3iud s TRP 179 Cb -0.18 -1.16 -0.05 0.00 -0.00 0.00 0.00 33.47 32.08 3iud s TRP 179 CO -0.03 -0.46 -0.16 0.96 -0.00 0.00 0.00 176.95 177.26 3iud s ILE 180 N 1.61 2.00 -1.78 5.86 -4.36 -1.26 -4.71 121.20 118.56 3iud s ILE 180 Ca 0.03 -2.27 0.26 0.00 -0.26 0.00 0.00 60.65 58.40 3iud s ILE 180 Cb -0.13 -2.18 0.25 0.00 1.25 0.00 0.00 42.46 41.66 3iud s ILE 180 CO -0.07 -0.50 1.53 0.61 0.24 0.00 0.00 174.94 176.76 3iud n GLY 181 N -0.49 -0.56 2.84 6.27 0.00 -1.26 -4.94 105.19 107.04 3iud n GLY 181 Ca -0.07 -0.42 -0.49 0.00 0.00 0.00 0.00 46.02 45.04 3iud n GLY 181 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3iud n ASP 182 N -0.60 0.41 0.00 1.61 9.92 -1.26 -4.15 116.55 122.48 3iud n ASP 182 Ca 0.12 0.92 0.00 0.00 -0.53 0.00 0.00 54.79 55.30 3iud n ASP 182 Cb 0.36 -0.71 0.00 0.00 -0.64 0.00 0.00 41.12 40.13 3iud n ASP 182 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3iud n GLY 183 N 2.03 -0.61 3.17 0.44 0.00 -1.26 -1.61 105.19 107.35 3iud n GLY 183 Ca 0.19 -0.63 -0.08 0.00 0.00 0.00 0.00 46.02 45.50 3iud n GLY 183 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3iud s SER 184 N -4.00 0.27 0.00 1.61 1.04 0.28 -4.90 113.70 108.00 3iud s SER 184 Ca 0.00 -0.85 0.08 0.00 0.48 0.00 0.00 55.95 55.66 3iud s SER 184 Cb 0.00 0.29 -0.01 0.00 0.10 0.00 0.00 66.02 66.39 3iud s SER 184 CO 0.00 -0.69 0.52 0.59 0.98 0.00 0.00 173.24 174.64 3iud n ASN 185 N -0.01 0.97 -3.92 7.02 3.02 -1.26 -1.52 115.26 119.56 3iud n ASN 185 Ca -0.13 -0.98 -0.13 0.00 -0.03 0.00 0.00 54.58 53.30 3iud n ASN 185 Cb 0.62 0.55 -0.14 0.00 -0.61 0.00 0.00 39.78 40.20 3iud n ASN 185 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3iud s PHE 186 N -1.27 0.21 0.36 3.10 0.08 -1.26 -4.52 117.98 114.69 3iud s PHE 186 Ca 0.06 -0.08 -0.28 0.00 0.12 0.00 0.00 56.93 56.75 3iud s PHE 186 Cb 0.06 -0.14 -0.11 0.00 -0.57 0.00 0.00 43.02 42.27 3iud s PHE 186 CO 0.22 -0.02 1.43 -2.14 -0.10 0.00 0.00 175.22 174.61 3iud s PRO 187 N -0.18 4.19 0.00 0.24 0.02 -1.26 -1.84 135.00 136.17 3iud s PRO 187 Ca -0.00 2.45 0.00 0.00 0.02 0.00 0.00 61.00 63.47 3iud s PRO 187 Cb -0.02 -3.00 0.00 0.00 0.02 0.00 0.00 34.50 31.50 3iud s PRO 187 CO -0.00 -0.42 0.00 0.41 -0.33 0.00 0.00 177.00 176.66 3iud n GLY 188 N 0.57 3.15 0.35 0.52 0.00 -1.26 -4.85 105.19 103.67 3iud n GLY 188 Ca 0.01 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.04 3iud n GLY 188 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3iud h GLN 189 N 1.61 1.09 -6.63 1.61 4.15 -1.80 -3.42 115.11 111.72 3iud h GLN 189 Ca 0.00 -0.07 -0.64 0.00 0.77 0.00 0.00 58.65 58.71 3iud h GLN 189 Cb 0.00 -0.25 -0.21 0.00 0.21 0.00 0.00 27.48 27.23 3iud h GLN 189 CO 0.00 0.72 -0.85 -1.12 -1.93 0.00 0.00 178.83 175.65 3iud s SER 190 N -5.88 3.09 -0.44 -0.69 0.01 -1.26 -5.09 113.70 103.45 3iud s SER 190 Ca -0.13 -0.75 -0.19 0.00 1.31 0.00 0.00 55.95 56.20 3iud s SER 190 Cb 0.19 -0.20 0.03 0.00 0.21 0.00 0.00 66.02 66.25 3iud s SER 190 CO 0.81 0.13 0.53 0.21 0.41 0.00 0.00 173.24 175.33 3iud s ASN 191 N -2.11 6.24 0.13 2.44 3.84 -1.26 -4.96 114.94 119.25 3iud s ASN 191 Ca 0.13 -0.62 -0.30 0.00 0.21 0.00 0.00 52.86 52.28 3iud s ASN 191 Cb -0.10 -2.26 -0.09 0.00 -0.55 0.00 0.00 41.25 38.25 3iud s ASN 191 CO 0.06 -0.69 1.50 -0.26 -2.79 0.00 0.00 177.10 174.91 3iud h PHE 192 N 8.82 -1.64 -0.36 0.43 0.04 -1.98 -0.46 116.94 121.79 3iud h PHE 192 Ca -0.26 0.09 0.03 0.00 2.80 0.00 0.00 57.97 60.63 3iud h PHE 192 Cb 1.10 0.79 -0.03 0.00 2.20 0.00 0.00 35.95 40.01 3iud h PHE 192 CO 0.67 -0.41 0.17 1.15 -0.60 0.00 0.00 178.31 179.30 3iud h THR 193 N -0.22 0.97 -0.51 -1.55 2.02 -1.99 -2.13 112.91 109.49 3iud h THR 193 Ca 0.10 -0.12 -0.07 0.00 0.77 0.00 0.00 66.41 67.09 3iud h THR 193 Cb 0.48 0.58 -0.02 0.00 -1.74 0.00 0.00 68.15 67.45 3iud h THR 193 CO -0.67 0.06 0.06 0.03 0.37 0.00 0.00 175.52 175.37 3iud h ARG 194 N 0.36 0.87 -0.79 6.66 3.08 -1.90 -0.65 114.38 122.00 3iud h ARG 194 Ca 0.15 -0.25 -0.01 0.00 0.07 0.00 0.00 59.98 59.95 3iud h ARG 194 Cb 0.07 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 29.99 3iud h ARG 194 CO -0.11 0.87 0.46 0.00 -1.07 0.00 0.00 179.97 180.12 3iud h ALA 195 N 0.96 1.34 -0.43 0.04 0.00 -0.95 0.92 119.26 121.13 3iud h ALA 195 Ca 0.15 -0.10 -0.14 0.00 0.00 0.00 0.00 54.91 54.82 3iud h ALA 195 Cb 0.44 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3iud h ALA 195 CO 0.02 0.57 -0.30 0.35 0.00 0.00 0.00 179.25 179.89 3iud h PHE 196 N 1.09 1.10 -0.51 0.00 3.57 -1.10 -1.27 116.94 119.81 3iud h PHE 196 Ca 0.28 -0.29 -0.05 0.00 3.53 0.00 0.00 57.97 61.44 3iud h PHE 196 Cb -0.03 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 38.44 3iud h PHE 196 CO 0.00 1.11 0.10 0.93 -2.23 0.00 0.00 178.31 178.23 3iud h GLU 197 N 0.79 0.79 -0.52 1.11 5.08 -0.33 0.11 114.58 121.61 3iud h GLU 197 Ca 0.09 -0.17 -0.09 0.00 -1.00 0.00 0.00 59.36 58.19 3iud h GLU 197 Cb 0.87 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.99 3iud h GLU 197 CO 0.08 0.73 -0.02 0.00 -1.00 0.00 0.00 179.01 178.80 3iud h ARG 198 N 0.76 0.94 0.17 2.33 3.08 -0.54 -2.12 114.38 119.01 3iud h ARG 198 Ca 0.17 -0.31 -0.01 0.00 0.07 0.00 0.00 59.98 59.90 3iud h ARG 198 Cb 0.31 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.28 3iud h ARG 198 CO 0.00 0.97 -0.08 -0.92 -1.07 0.00 0.00 179.97 178.86 3iud h TYR 199 N 0.81 -0.22 -0.79 3.04 5.03 -0.48 -1.94 116.97 122.42 3iud h TYR 199 Ca 0.15 -0.01 0.09 0.00 2.58 0.00 0.00 58.73 61.54 3iud h TYR 199 Cb 0.55 0.07 -0.07 0.00 1.55 0.00 0.00 36.73 38.84 3iud h TYR 199 CO 0.04 -0.09 0.45 -0.07 -1.32 0.00 0.00 178.16 177.17 3iud h LEU 200 N -0.29 0.64 -0.75 2.82 3.38 -0.74 0.02 115.31 120.39 3iud h LEU 200 Ca -0.02 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 3iud h LEU 200 Cb 0.22 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 3iud h LEU 200 CO 0.04 0.37 0.36 -1.28 0.09 0.00 0.00 178.44 178.03 3iud h SER 201 N 0.76 0.97 -0.24 -0.43 0.87 -1.18 0.08 113.55 114.39 3iud h SER 201 Ca 0.38 -0.13 -0.08 0.00 -1.23 0.00 0.00 61.79 60.72 3iud h SER 201 Cb 0.33 -0.25 -0.00 0.00 -0.44 0.00 0.00 62.40 62.03 3iud h SER 201 CO -0.24 0.83 -0.17 0.00 -0.53 0.00 0.00 176.83 176.72 3iud h ALA 202 N 1.18 0.34 -0.34 6.23 0.00 -0.58 -2.83 119.26 123.26 3iud h ALA 202 Ca 0.26 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 3iud h ALA 202 Cb 0.11 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 3iud h ALA 202 CO -0.03 0.25 0.20 0.52 0.00 0.00 0.00 179.25 180.18 3iud h MET 203 N 0.24 0.46 -0.83 0.00 2.07 -0.81 -1.33 114.93 114.74 3iud h MET 203 Ca 0.05 -0.04 -0.04 0.00 -2.07 0.00 0.00 59.70 57.60 3iud h MET 203 Cb 0.70 -0.10 -0.04 0.00 -1.87 0.00 0.00 31.60 30.30 3iud h MET 203 CO 0.05 0.33 0.37 0.00 1.07 0.00 0.00 176.91 178.73 3iud h ALA 204 N 1.75 1.10 -0.44 6.32 0.00 -0.78 0.29 119.26 127.49 3iud h ALA 204 Ca 0.12 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 3iud h ALA 204 Cb -0.00 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 3iud h ALA 204 CO -0.02 0.66 -0.02 0.93 0.00 0.00 0.00 179.25 180.81 3iud h GLU 205 N 1.19 0.79 -0.56 0.00 5.08 -1.03 -0.72 114.58 119.32 3iud h GLU 205 Ca 0.28 -0.26 -0.02 0.00 -1.00 0.00 0.00 59.36 58.36 3iud h GLU 205 Cb 0.15 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.31 3iud h GLU 205 CO -0.03 0.86 0.26 0.82 -1.00 0.00 0.00 179.01 179.92 3iud h ILE 206 N 0.63 1.21 -0.83 3.13 2.04 -1.03 -2.04 117.51 120.62 3iud h ILE 206 Ca 0.12 -0.61 0.04 0.00 1.00 0.00 0.00 64.86 65.42 3iud h ILE 206 Cb 0.52 0.57 -0.05 0.00 -0.74 0.00 0.00 36.82 37.11 3iud h ILE 206 CO 0.03 0.24 0.52 0.22 0.00 0.00 0.00 178.15 179.16 3iud h TYR 207 N 0.76 0.97 -0.84 1.37 5.03 -0.74 -1.33 116.97 122.20 3iud h TYR 207 Ca 0.19 0.03 0.13 0.00 2.58 0.00 0.00 58.73 61.65 3iud h TYR 207 Cb 0.14 -0.32 -0.06 0.00 1.55 0.00 0.00 36.73 38.04 3iud h TYR 207 CO 0.00 0.53 0.54 -0.22 -1.32 0.00 0.00 178.16 177.70 3iud h LYS 208 N 0.99 0.65 -0.64 1.82 3.64 -0.40 0.00 116.57 122.64 3iud h LYS 208 Ca 0.34 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.69 3iud h LYS 208 Cb 0.08 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.75 3iud h LYS 208 CO -0.14 0.43 0.00 0.41 -2.27 0.00 0.00 179.45 177.88 3iud n GLY 209 N -1.45 2.30 3.76 5.01 0.00 -0.54 -4.92 105.19 109.34 3iud n GLY 209 Ca 0.15 -0.72 -0.39 0.00 0.00 0.00 0.00 46.02 45.07 3iud n GLY 209 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3iud s LEU 210 N -1.62 4.43 0.85 0.99 2.96 -0.02 -5.05 118.68 121.22 3iud s LEU 210 Ca 0.43 1.26 -0.11 0.00 -0.22 0.00 0.00 54.13 55.49 3iud s LEU 210 Cb 0.28 -3.03 0.11 0.00 0.50 0.00 0.00 46.19 44.04 3iud s LEU 210 CO 0.21 0.07 1.15 -2.84 -1.32 0.00 0.00 176.35 173.62 3iud s PRO 211 N -0.12 1.47 0.00 0.98 0.02 -1.26 -4.90 135.00 131.18 3iud s PRO 211 Ca 0.34 1.55 0.30 0.00 0.02 0.00 0.00 61.00 63.21 3iud s PRO 211 Cb -0.19 -1.78 1.74 0.00 0.02 0.00 0.00 34.50 34.29 3iud s PRO 211 CO 0.19 -2.30 2.13 -0.25 -0.33 0.00 0.00 177.00 176.44 3iud n ASP 212 N -3.77 0.18 -0.36 2.53 10.43 -1.26 -2.70 116.55 121.61 3iud n ASP 212 Ca 0.12 -1.10 0.10 0.00 2.57 0.00 0.00 54.79 56.48 3iud n ASP 212 Cb 0.52 -0.00 0.18 0.00 1.84 0.00 0.00 41.12 43.66 3iud n ASP 212 CO 0.00 0.00 0.00 -0.90 -1.07 0.00 0.00 177.20 175.23 3iud n ASP 213 N -0.84 2.88 -4.43 -2.24 5.75 -1.26 -5.01 116.55 111.40 3iud n ASP 213 Ca 0.23 -3.07 -0.23 0.00 -0.01 0.00 0.00 54.79 51.70 3iud n ASP 213 Cb 0.13 -0.47 -0.10 0.00 -1.03 0.00 0.00 41.12 39.65 3iud n ASP 213 CO 0.00 0.00 0.00 0.26 -0.11 0.00 0.00 177.20 177.35 3iud s TRP 214 N -2.87 2.15 0.14 2.11 0.52 -1.10 -4.87 118.94 115.03 3iud s TRP 214 Ca 0.36 -0.39 0.11 0.00 0.02 0.00 0.00 56.10 56.20 3iud s TRP 214 Cb 0.30 -0.98 -0.04 0.00 -1.15 0.00 0.00 33.47 31.60 3iud s TRP 214 CO 0.05 0.58 -0.26 0.15 0.02 0.00 0.00 176.95 177.49 3iud s LYS 215 N -3.30 1.44 -0.26 4.98 1.02 -0.90 -4.85 119.74 117.87 3iud s LYS 215 Ca 0.26 -1.37 -0.02 0.00 0.02 0.00 0.00 55.97 54.86 3iud s LYS 215 Cb -0.05 -1.90 0.03 0.00 -0.52 0.00 0.00 37.83 35.39 3iud s LYS 215 CO 0.12 0.44 -0.04 -1.17 -0.92 0.00 0.00 175.35 173.78 3iud s LEU 216 N -2.16 3.35 -0.24 3.17 2.96 0.14 -1.48 118.68 124.43 3iud s LEU 216 Ca 0.15 -0.91 -0.08 0.00 -0.22 0.00 0.00 54.13 53.07 3iud s LEU 216 Cb -0.10 -1.69 -0.04 0.00 0.50 0.00 0.00 46.19 44.86 3iud s LEU 216 CO 0.07 -0.15 0.10 -0.36 -1.32 0.00 0.00 176.35 174.68 3iud s PHE 217 N 1.33 3.16 0.00 5.38 0.08 0.41 -0.60 117.98 127.74 3iud s PHE 217 Ca -0.00 -0.15 -0.01 0.00 0.12 0.00 0.00 56.93 56.88 3iud s PHE 217 Cb -0.17 -2.23 -0.04 0.00 -0.57 0.00 0.00 43.02 40.01 3iud s PHE 217 CO -0.03 -0.17 0.13 -1.54 -0.10 0.00 0.00 175.22 173.50 3iud s SER 218 N 1.31 5.97 -0.14 1.36 1.04 -0.78 -0.01 113.70 122.44 3iud s SER 218 Ca 0.06 0.22 0.00 0.00 0.48 0.00 0.00 55.95 56.71 3iud s SER 218 Cb -0.15 -1.78 0.02 0.00 0.10 0.00 0.00 66.02 64.22 3iud s SER 218 CO 0.05 0.26 -0.12 -0.70 0.98 0.00 0.00 173.24 173.70 3iud s GLU 219 N -1.89 2.06 0.55 4.02 2.12 -0.92 -0.67 118.70 123.97 3iud s GLU 219 Ca 0.25 -0.49 -0.09 0.00 0.36 0.00 0.00 54.97 55.01 3iud s GLU 219 Cb -0.12 -1.98 -0.04 0.00 0.26 0.00 0.00 34.13 32.25 3iud s GLU 219 CO 0.17 -0.26 0.92 -3.38 -0.54 0.00 0.00 175.26 172.17 3iud s HIS 220 N 1.55 3.59 -0.28 5.30 -3.43 -1.25 -4.73 115.29 116.04 3iud s HIS 220 Ca 0.05 1.10 -0.20 0.00 -0.80 0.00 0.00 55.06 55.21 3iud s HIS 220 Cb -0.13 -2.55 0.09 0.00 -1.43 0.00 0.00 32.58 28.56 3iud s HIS 220 CO -0.10 -0.49 0.76 0.21 -2.00 0.00 0.00 174.74 173.12 3iud s LYS 221 N -4.91 0.69 0.15 -0.38 2.20 -0.38 -4.72 119.74 112.40 3iud s LYS 221 Ca 0.52 1.03 -0.12 0.00 -0.36 0.00 0.00 55.97 57.04 3iud s LYS 221 Cb -0.11 0.23 0.01 0.00 -1.51 0.00 0.00 37.83 36.45 3iud s LYS 221 CO 0.49 -0.12 1.58 1.98 -0.36 0.00 0.00 175.35 178.92 3iud h MET 222 N 6.01 0.88 -2.42 4.03 1.85 -1.27 -3.32 114.93 120.70 3iud h MET 222 Ca -0.29 -0.31 0.14 0.00 -0.61 0.00 0.00 59.70 58.63 3iud h MET 222 Cb 1.20 -0.07 -0.10 0.00 0.43 0.00 0.00 31.60 33.06 3iud h MET 222 CO 0.13 0.95 0.45 1.52 -0.40 0.00 0.00 176.91 179.55 3iud s TYR 223 N -4.92 -0.22 0.00 1.39 1.13 -1.26 -4.50 117.35 108.97 3iud s TYR 223 Ca -0.12 -0.05 0.00 0.00 -1.41 0.00 0.00 57.07 55.49 3iud s TYR 223 Cb 0.12 0.61 0.00 0.00 -1.10 0.00 0.00 41.96 41.59 3iud s TYR 223 CO 0.83 -0.79 0.00 -1.91 -2.51 0.00 0.00 175.55 171.17 3iud n GLU 224 N -0.41 0.00 0.00 -3.49 2.13 -1.26 -4.81 120.64 112.81 3iud n GLU 224 Ca -0.07 0.49 0.08 0.00 0.66 0.00 0.00 57.16 58.32 3iud n GLU 224 Cb 0.61 -0.08 0.37 0.00 0.27 0.00 0.00 31.44 32.62 3iud n GLU 224 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 3iud n PRO 225 N 0.05 0.03 -2.90 5.31 -0.04 -1.26 -4.95 135.00 131.24 3iud n PRO 225 Ca 0.00 0.20 -0.41 0.00 -0.04 0.00 0.00 63.50 63.25 3iud n PRO 225 Cb 0.00 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 31.92 3iud n PRO 225 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3iud s ALA 226 N -2.95 3.37 -0.22 0.55 0.00 -1.26 -4.97 121.76 116.29 3iud s ALA 226 Ca 0.09 0.19 0.16 0.00 0.00 0.00 0.00 51.96 52.40 3iud s ALA 226 Cb 0.11 -3.16 0.58 0.00 0.00 0.00 0.00 23.12 20.65 3iud s ALA 226 CO 0.31 -0.36 1.48 1.19 0.00 0.00 0.00 175.76 178.37 3iud n PHE 227 N 4.42 1.14 0.00 0.00 3.72 -1.20 -4.54 117.46 121.01 3iud n PHE 227 Ca 0.03 -0.84 0.00 0.00 -0.05 0.00 0.00 57.45 56.59 3iud n PHE 227 Cb 0.50 -0.34 0.00 0.00 -0.94 0.00 0.00 39.48 38.70 3iud n PHE 227 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 176.76 177.69 3iud n TYR 228 N -0.27 0.00 -3.74 1.38 9.36 -0.57 -4.90 117.16 118.41 3iud n TYR 228 Ca 0.22 0.00 -0.12 0.00 3.32 0.00 0.00 57.90 61.32 3iud n TYR 228 Cb 0.94 0.29 -0.07 0.00 -0.63 0.00 0.00 39.34 39.87 3iud n TYR 228 CO 0.00 0.00 0.00 -1.54 0.22 0.00 0.00 176.86 175.54 3iud s SER 229 N -4.63 -0.16 -0.03 2.98 1.04 -0.83 -4.98 113.70 107.08 3iud s SER 229 Ca 0.00 -0.13 0.01 0.00 0.48 0.00 0.00 55.95 56.31 3iud s SER 229 Cb 0.00 0.37 0.02 0.00 0.10 0.00 0.00 66.02 66.50 3iud s SER 229 CO 0.00 -0.61 -0.03 -0.89 0.98 0.00 0.00 173.24 172.69 3iud s THR 230 N -2.41 0.39 0.09 2.02 2.01 -1.26 -0.56 115.64 115.92 3iud s THR 230 Ca -0.06 -0.08 -0.29 0.00 0.31 0.00 0.00 61.69 61.57 3iud s THR 230 Cb -0.01 -0.42 -0.12 0.00 0.01 0.00 0.00 72.50 71.96 3iud s THR 230 CO -0.02 0.17 1.46 0.58 -0.69 0.00 0.00 174.62 176.12 3iud h VAL 231 N 5.92 0.00 -2.42 3.82 2.07 -1.63 -2.58 116.25 121.43 3iud h VAL 231 Ca -0.38 0.00 -0.78 0.00 0.82 0.00 0.00 66.70 66.36 3iud h VAL 231 Cb 1.16 0.00 -0.22 0.00 -1.52 0.00 0.00 31.29 30.70 3iud h VAL 231 CO 0.48 0.00 1.21 0.52 0.02 0.00 0.00 177.57 179.81 3iud n VAL 232 N -4.97 4.73 0.08 2.57 0.31 -1.26 -4.79 118.33 114.99 3iud n VAL 232 Ca -0.07 -5.17 -0.05 0.00 -0.01 0.00 0.00 64.34 59.04 3iud n VAL 232 Cb 0.34 -2.32 -0.04 0.00 -0.91 0.00 0.00 33.84 30.91 3iud n VAL 232 CO 0.00 0.00 0.00 0.06 -1.32 0.00 0.00 176.83 175.57 3iud h GLN 233 N 6.01 0.00 -3.87 5.55 -0.00 -1.56 -0.99 115.11 120.26 3iud h GLN 233 Ca 0.28 0.00 -0.17 0.00 -0.00 0.00 0.00 58.65 58.76 3iud h GLN 233 Cb 0.70 0.00 -0.08 0.00 -0.00 0.00 0.00 27.48 28.11 3iud h GLN 233 CO 1.36 0.89 -0.14 0.16 -0.00 0.00 0.00 178.83 181.10 3iud s ASP 234 N -6.74 0.44 0.55 0.06 1.47 -1.26 -2.41 116.67 108.78 3iud s ASP 234 Ca 0.00 -1.25 0.28 0.00 1.18 0.00 0.00 52.55 52.76 3iud s ASP 234 Cb 0.11 0.64 1.60 0.00 -0.34 0.00 0.00 42.92 44.93 3iud s ASP 234 CO 0.80 -1.26 2.16 4.11 0.68 0.00 0.00 175.17 181.66 3iud h TRP 235 N 2.17 0.00 -0.05 2.11 5.08 -1.94 -0.84 115.95 122.48 3iud h TRP 235 Ca -0.28 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 59.68 3iud h TRP 235 Cb 1.24 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.40 3iud h TRP 235 CO 1.04 0.07 0.01 0.78 -1.28 0.00 0.00 178.44 179.06 3iud h GLY 236 N 0.43 0.08 1.18 11.11 0.00 -1.99 0.20 103.07 114.09 3iud h GLY 236 Ca -0.00 -0.05 -0.09 0.00 0.00 0.00 0.00 47.33 47.18 3iud h GLY 236 CO 0.01 0.05 0.00 -0.84 0.00 0.00 0.00 176.54 175.76 3iud h THR 237 N -0.16 1.26 -0.88 4.70 2.02 -1.81 -2.55 112.91 115.49 3iud h THR 237 Ca 0.01 -1.11 0.01 0.00 0.77 0.00 0.00 66.41 66.09 3iud h THR 237 Cb 0.26 0.82 -0.04 0.00 -1.74 0.00 0.00 68.15 67.45 3iud h THR 237 CO 0.00 0.40 0.58 -1.13 0.37 0.00 0.00 175.52 175.75 3iud h ASN 238 N 0.91 1.00 -0.41 4.18 -0.73 -0.87 -1.27 115.58 118.38 3iud h ASN 238 Ca 0.17 -0.02 -0.07 0.00 1.87 0.00 0.00 56.30 58.24 3iud h ASN 238 Cb 0.53 -0.25 -0.01 0.00 0.27 0.00 0.00 38.32 38.85 3iud h ASN 238 CO 0.03 0.72 -0.01 0.22 -0.37 0.00 0.00 177.43 178.02 3iud h TYR 239 N 1.18 0.80 -0.90 0.67 3.20 -0.33 -1.58 116.97 120.02 3iud h TYR 239 Ca 0.33 -0.14 0.06 0.00 3.14 0.00 0.00 58.73 62.12 3iud h TYR 239 Cb -0.12 -0.21 -0.06 0.00 1.54 0.00 0.00 36.73 37.88 3iud h TYR 239 CO -0.00 0.81 0.57 -0.07 -1.64 0.00 0.00 178.16 177.82 3iud h LEU 240 N 0.57 0.90 -0.09 2.82 3.38 -0.96 0.14 115.31 122.06 3iud h LEU 240 Ca 0.12 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 3iud h LEU 240 Cb 0.49 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 3iud h LEU 240 CO 0.02 0.58 0.03 0.40 0.09 0.00 0.00 178.44 179.56 3iud h ILE 241 N 1.03 1.16 -0.47 1.22 2.04 -0.95 -1.49 117.51 120.04 3iud h ILE 241 Ca 0.39 -0.47 -0.05 0.00 1.00 0.00 0.00 64.86 65.73 3iud h ILE 241 Cb 0.16 1.31 -0.02 0.00 -0.74 0.00 0.00 36.82 37.53 3iud h ILE 241 CO -0.17 0.14 0.10 0.00 0.00 0.00 0.00 178.15 178.22 3iud h ALA 242 N 0.86 0.62 -0.46 1.87 0.00 -0.89 -0.72 119.26 120.54 3iud h ALA 242 Ca 0.03 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 3iud h ALA 242 Cb 0.19 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3iud h ALA 242 CO -0.00 0.32 0.16 0.37 0.00 0.00 0.00 179.25 180.10 3iud h GLN 243 N 0.64 0.71 0.15 0.00 5.75 -0.97 -2.77 115.11 118.62 3iud h GLN 243 Ca 0.15 -0.15 -0.01 0.00 -0.15 0.00 0.00 58.65 58.49 3iud h GLN 243 Cb 0.35 -0.11 0.00 0.00 1.07 0.00 0.00 27.48 28.79 3iud h GLN 243 CO 0.00 0.67 -0.07 1.15 -2.65 0.00 0.00 178.83 177.93 3iud h THR 244 N 0.61 0.90 -0.21 2.39 2.02 -1.13 -3.30 112.91 114.19 3iud h THR 244 Ca 0.15 -0.24 0.02 0.00 0.77 0.00 0.00 66.41 67.11 3iud h THR 244 Cb 0.25 1.06 -0.02 0.00 -1.74 0.00 0.00 68.15 67.69 3iud h THR 244 CO -0.01 0.06 0.06 -0.07 0.37 0.00 0.00 175.52 175.93 3iud h LEU 245 N -0.32 0.06 0.00 2.58 3.38 -1.10 -3.49 115.31 116.42 3iud h LEU 245 Ca -0.02 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3iud h LEU 245 Cb 0.25 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.02 3iud h LEU 245 CO 0.03 0.07 0.00 0.61 0.09 0.00 0.00 178.44 179.24 3iud n GLY 246 N -1.17 0.20 0.37 0.83 0.00 -1.05 -4.93 105.19 99.43 3iud n GLY 246 Ca -0.02 -1.81 0.09 0.00 0.00 0.00 0.00 46.02 44.27 3iud n GLY 246 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3iud h PRO 247 N 4.82 0.87 -0.00 1.61 0.11 -1.90 -2.07 132.00 135.45 3iud h PRO 247 Ca 0.00 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.06 3iud h PRO 247 Cb 0.00 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 30.91 3iud h PRO 247 CO 0.00 0.58 -0.01 1.63 -0.21 0.00 0.00 178.00 179.99 3iud n LYS 248 N -4.60 0.82 -3.84 1.05 5.02 -1.26 -4.77 118.16 110.58 3iud n LYS 248 Ca 0.18 -0.04 -0.35 0.00 -2.02 0.00 0.00 58.31 56.08 3iud n LYS 248 Cb 0.39 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.80 3iud n LYS 248 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3iud s ALA 249 N -2.21 3.49 0.17 7.82 0.00 -0.78 0.23 121.76 130.48 3iud s ALA 249 Ca 0.40 -0.81 -0.01 0.00 0.00 0.00 0.00 51.96 51.55 3iud s ALA 249 Cb 0.21 -2.09 -0.04 0.00 0.00 0.00 0.00 23.12 21.21 3iud s ALA 249 CO 0.40 0.02 0.09 -0.65 0.00 0.00 0.00 175.76 175.62 3iud s GLN 250 N 0.66 1.07 0.10 0.00 -0.21 0.23 -4.75 119.66 116.76 3iud s GLN 250 Ca 0.05 -1.54 -0.14 0.00 0.02 0.00 0.00 55.36 53.76 3iud s GLN 250 Cb -0.13 0.20 -0.06 0.00 1.00 0.00 0.00 33.01 34.02 3iud s GLN 250 CO 0.01 -0.31 0.49 0.00 -2.12 0.00 0.00 175.29 173.37 3iud s LEU 252 N -1.74 2.67 -0.32 0.00 0.20 0.16 0.41 118.68 120.06 3iud s LEU 252 Ca 0.34 -0.39 -0.10 0.00 0.69 0.00 0.00 54.13 54.66 3iud s LEU 252 Cb -0.15 -1.62 -0.00 0.00 -0.43 0.00 0.00 46.19 43.98 3iud s LEU 252 CO 0.18 0.09 0.17 -0.69 -0.29 0.00 0.00 176.35 175.81 3iud s VAL 253 N 0.79 4.69 -0.37 1.68 1.01 -0.64 -3.94 120.40 123.62 3iud s VAL 253 Ca -0.04 -0.45 -0.13 0.00 0.00 0.00 0.00 61.98 61.36 3iud s VAL 253 Cb -0.15 -3.42 0.01 0.00 0.00 0.00 0.00 36.38 32.82 3iud s VAL 253 CO 0.01 0.02 0.25 -0.62 0.00 0.00 0.00 175.10 174.76 3iud s ASP 254 N 1.62 5.97 0.35 3.32 -1.08 -1.26 -1.90 116.67 123.70 3iud s ASP 254 Ca 0.04 -0.71 0.15 0.00 -0.52 0.00 0.00 52.55 51.52 3iud s ASP 254 Cb -0.17 -2.11 1.18 0.00 -1.46 0.00 0.00 42.92 40.35 3iud s ASP 254 CO 0.07 -0.34 1.58 -0.07 0.52 0.00 0.00 175.17 176.93 3iud h LEU 255 N 8.52 0.11 -0.73 -1.34 3.38 -1.81 0.38 115.31 123.81 3iud h LEU 255 Ca -0.29 0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3iud h LEU 255 Cb 1.13 0.33 0.00 0.00 0.09 0.00 0.00 40.66 42.21 3iud h LEU 255 CO 0.67 -0.41 0.00 0.61 0.09 0.00 0.00 178.44 179.41 3iud n GLY 256 N -1.33 -0.18 2.11 0.83 0.00 -1.26 -4.29 105.19 101.08 3iud n GLY 256 Ca 0.34 -0.34 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 3iud n GLY 256 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3iud n HIS 257 N -0.08 2.61 -4.31 1.61 8.25 0.12 -3.62 115.22 119.81 3iud n HIS 257 Ca 0.17 -2.25 -0.20 0.00 -0.26 0.00 0.00 57.72 55.18 3iud n HIS 257 Cb 0.26 -1.10 -0.11 0.00 1.12 0.00 0.00 29.99 30.15 3iud n HIS 257 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 3iud s HIS 258 N -2.98 1.67 0.92 4.41 3.76 -1.26 -2.73 115.29 119.08 3iud s HIS 258 Ca 0.51 -0.51 -0.10 0.00 -0.15 0.00 0.00 55.06 54.80 3iud s HIS 258 Cb 0.41 -0.84 0.15 0.00 1.11 0.00 0.00 32.58 33.41 3iud s HIS 258 CO 0.03 0.27 1.15 0.00 -0.85 0.00 0.00 174.74 175.34 3iud s ALA 259 N -2.22 1.44 0.42 -1.40 0.00 -1.26 -4.91 121.76 113.83 3iud s ALA 259 Ca 0.15 0.58 -0.26 0.00 0.00 0.00 0.00 51.96 52.43 3iud s ALA 259 Cb -0.05 -3.45 -0.10 0.00 0.00 0.00 0.00 23.12 19.53 3iud s ALA 259 CO 0.05 -2.78 1.39 -2.30 0.00 0.00 0.00 175.76 172.12 3iud n PRO 260 N -4.25 2.26 -1.19 0.00 -0.02 -1.26 -2.58 135.00 127.96 3iud n PRO 260 Ca 0.12 0.80 -0.07 0.00 -2.02 0.00 0.00 63.50 62.33 3iud n PRO 260 Cb 0.52 -2.55 -0.03 0.00 -0.02 0.00 0.00 33.50 31.42 3iud n PRO 260 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3iud n ASN 261 N 0.15 -5.33 -4.77 2.55 3.02 -1.26 -4.97 115.26 104.66 3iud n ASN 261 Ca 0.05 0.17 -0.40 0.00 -0.03 0.00 0.00 54.58 54.36 3iud n ASN 261 Cb 0.40 -3.42 -0.01 0.00 -0.61 0.00 0.00 39.78 36.14 3iud n ASN 261 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3iud s THR 262 N -1.74 2.61 -0.76 3.41 2.01 -1.06 -4.93 115.64 115.18 3iud s THR 262 Ca 0.00 0.58 -0.20 0.00 0.31 0.00 0.00 61.69 62.38 3iud s THR 262 Cb 0.00 -3.35 0.11 0.00 0.01 0.00 0.00 72.50 69.26 3iud s THR 262 CO 0.00 0.11 0.97 0.21 -0.69 0.00 0.00 174.62 175.21 3iud s ASN 263 N -0.60 6.37 0.17 3.53 3.84 -1.26 -4.88 114.94 122.11 3iud s ASN 263 Ca 0.54 -1.55 -0.09 0.00 0.21 0.00 0.00 52.86 51.97 3iud s ASN 263 Cb -0.39 -2.38 0.04 0.00 -0.55 0.00 0.00 41.25 37.97 3iud s ASN 263 CO 0.51 -1.20 1.55 0.40 -2.79 0.00 0.00 177.10 175.58 3iud h ILE 264 N 5.86 1.27 -0.86 -5.21 2.04 -1.97 -2.97 117.51 115.67 3iud h ILE 264 Ca -0.10 -1.42 0.07 0.00 1.00 0.00 0.00 64.86 64.41 3iud h ILE 264 Cb 1.05 1.20 -0.06 0.00 -0.74 0.00 0.00 36.82 38.28 3iud h ILE 264 CO 1.12 0.48 0.56 1.05 0.00 0.00 0.00 178.15 181.36 3iud h GLU 265 N 0.79 0.92 -0.12 2.37 9.09 -1.90 -0.44 114.58 125.29 3iud h GLU 265 Ca 0.10 -0.06 -0.00 0.00 0.05 0.00 0.00 59.36 59.45 3iud h GLU 265 Cb 0.83 -0.21 -0.01 0.00 -1.65 0.00 0.00 28.75 27.71 3iud h GLU 265 CO 0.07 0.61 0.07 1.98 0.05 0.00 0.00 179.01 181.79 3iud h MET 266 N 0.94 0.17 -0.73 1.06 4.05 -1.92 -1.18 114.93 117.32 3iud h MET 266 Ca 0.37 -0.02 0.10 0.00 -0.28 0.00 0.00 59.70 59.88 3iud h MET 266 Cb 0.23 -0.03 -0.08 0.00 -0.80 0.00 0.00 31.60 30.92 3iud h MET 266 CO -0.14 0.18 0.35 0.82 0.23 0.00 0.00 176.91 178.35 3iud h ILE 267 N 0.11 0.81 -0.86 1.77 2.04 -1.17 -0.59 117.51 119.62 3iud h ILE 267 Ca 0.04 -0.20 0.06 0.00 1.00 0.00 0.00 64.86 65.76 3iud h ILE 267 Cb 0.06 0.18 -0.06 0.00 -0.74 0.00 0.00 36.82 36.26 3iud h ILE 267 CO -0.01 0.11 0.54 0.58 0.00 0.00 0.00 178.15 179.37 3iud h VAL 268 N 0.58 1.06 -0.32 1.67 2.07 -0.56 -2.09 116.25 118.65 3iud h VAL 268 Ca 0.37 -0.34 -0.07 0.00 0.82 0.00 0.00 66.70 67.48 3iud h VAL 268 Cb 0.43 -0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.17 3iud h VAL 268 CO -0.30 0.18 -0.06 0.00 0.02 0.00 0.00 177.57 177.42 3iud h ALA 269 N 1.40 0.44 -0.22 1.67 0.00 0.05 -2.54 119.26 120.06 3iud h ALA 269 Ca 0.37 -0.28 0.04 0.00 0.00 0.00 0.00 54.91 55.04 3iud h ALA 269 Cb 0.15 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 3iud h ALA 269 CO -0.17 0.25 -0.01 0.00 0.00 0.00 0.00 179.25 179.33 3iud h ARG 270 N 0.38 0.05 -0.79 0.00 2.47 -0.82 -0.42 114.38 115.26 3iud h ARG 270 Ca 0.08 -0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.79 3iud h ARG 270 Cb 0.54 -0.01 -0.04 0.00 -1.65 0.00 0.00 29.97 28.81 3iud h ARG 270 CO 0.03 0.04 0.44 -0.07 0.56 0.00 0.00 179.97 180.97 3iud h LEU 271 N 0.05 0.97 -0.36 3.04 3.38 -1.39 -2.00 115.31 119.01 3iud h LEU 271 Ca 0.10 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 3iud h LEU 271 Cb 0.13 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 3iud h LEU 271 CO -0.18 0.77 0.08 0.40 0.09 0.00 0.00 178.44 179.60 3iud h ILE 272 N 1.10 1.23 -0.59 1.22 2.04 -0.98 0.22 117.51 121.75 3iud h ILE 272 Ca 0.28 -0.78 0.07 0.00 1.00 0.00 0.00 64.86 65.43 3iud h ILE 272 Cb 0.01 1.05 -0.04 0.00 -0.74 0.00 0.00 36.82 37.10 3iud h ILE 272 CO -0.05 0.26 0.39 -0.61 0.00 0.00 0.00 178.15 178.15 3iud h GLN 273 N 0.43 0.53 -0.71 2.37 4.15 -0.57 -1.56 115.11 119.74 3iud h GLN 273 Ca 0.11 -0.03 -0.38 0.00 0.77 0.00 0.00 58.65 59.12 3iud h GLN 273 Cb 0.31 -0.12 -0.22 0.00 0.21 0.00 0.00 27.48 27.66 3iud h GLN 273 CO 0.00 0.35 0.32 1.19 -1.93 0.00 0.00 178.83 178.76 3iud n PHE 274 N -4.48 2.20 -4.38 3.99 3.72 -0.80 -4.95 117.46 112.77 3iud n PHE 274 Ca 0.08 -1.79 -0.38 0.00 -0.05 0.00 0.00 57.45 55.31 3iud n PHE 274 Cb 0.25 -0.76 -0.06 0.00 -0.94 0.00 0.00 39.48 37.97 3iud n PHE 274 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3iud n GLY 275 N -1.13 -0.37 0.12 1.37 0.00 -0.59 -4.83 105.19 99.76 3iud n GLY 275 Ca 0.48 0.11 0.04 0.00 0.00 0.00 0.00 46.02 46.65 3iud n GLY 275 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3iud n LYS 276 N -4.25 1.34 -2.87 1.61 4.76 0.72 -4.95 118.16 114.52 3iud n LYS 276 Ca 0.02 -1.63 -0.43 0.00 -2.87 0.00 0.00 58.31 53.40 3iud n LYS 276 Cb 0.51 -1.01 -0.03 0.00 -1.84 0.00 0.00 35.03 32.66 3iud n LYS 276 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 3iud s LEU 277 N -1.32 4.58 0.13 -0.35 2.96 -1.17 -0.64 118.68 122.87 3iud s LEU 277 Ca 0.11 -1.35 -0.06 0.00 -0.22 0.00 0.00 54.13 52.61 3iud s LEU 277 Cb 0.10 -2.42 -0.10 0.00 0.50 0.00 0.00 46.19 44.28 3iud s LEU 277 CO 0.01 -1.32 1.31 1.23 -1.32 0.00 0.00 176.35 176.26 3iud h GLY 278 N 11.08 0.53 0.00 7.98 0.00 -0.32 -3.43 103.07 118.91 3iud h GLY 278 Ca -0.13 -0.89 0.00 0.00 0.00 0.00 0.00 47.33 46.31 3iud h GLY 278 CO 1.17 0.79 0.00 0.61 0.00 0.00 0.00 176.54 179.11 3iud n GLY 279 N 0.89 -1.36 3.25 4.60 0.00 -1.09 -1.58 105.19 109.91 3iud n GLY 279 Ca -0.07 -0.99 -0.20 0.00 0.00 0.00 0.00 46.02 44.76 3iud n GLY 279 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3iud s PHE 280 N -2.88 1.53 -0.31 1.61 0.08 -0.24 -1.62 117.98 116.14 3iud s PHE 280 Ca 0.00 -0.47 0.02 0.00 0.12 0.00 0.00 56.93 56.59 3iud s PHE 280 Cb 0.00 -0.82 0.09 0.00 -0.57 0.00 0.00 43.02 41.72 3iud s PHE 280 CO 0.00 0.16 0.05 -1.01 -0.10 0.00 0.00 175.22 174.32 3iud s HIS 281 N -1.56 2.71 0.29 0.36 3.76 -0.80 -0.41 115.29 119.63 3iud s HIS 281 Ca 0.06 -2.28 -0.24 0.00 -0.15 0.00 0.00 55.06 52.45 3iud s HIS 281 Cb -0.08 -2.21 -0.09 0.00 1.11 0.00 0.00 32.58 31.31 3iud s HIS 281 CO 0.04 -0.89 0.87 -0.06 -0.85 0.00 0.00 174.74 173.84 3iud s PHE 282 N 1.27 3.68 0.00 1.40 0.08 0.11 -2.66 117.98 121.86 3iud s PHE 282 Ca 0.08 1.65 0.00 0.00 0.12 0.00 0.00 56.93 58.77 3iud s PHE 282 Cb -0.18 -2.82 0.00 0.00 -0.57 0.00 0.00 43.02 39.45 3iud s PHE 282 CO -0.15 0.25 0.00 0.27 -0.10 0.00 0.00 175.22 175.50 3iud n ASN 283 N 0.61 0.00 -4.52 1.36 0.23 -1.26 -2.05 115.26 109.63 3iud n ASN 283 Ca 0.00 0.00 -0.24 0.00 -0.53 0.00 0.00 54.58 53.81 3iud n ASN 283 Cb 0.50 0.00 -0.11 0.00 -2.08 0.00 0.00 39.78 38.10 3iud n ASN 283 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 3iud s ASP 284 N 0.00 3.16 0.01 0.53 -1.08 0.11 -4.65 116.67 114.75 3iud s ASP 284 Ca 0.00 -1.31 -0.29 0.00 -0.52 0.00 0.00 52.55 50.43 3iud s ASP 284 Cb 0.00 -0.25 0.10 0.00 -1.46 0.00 0.00 42.92 41.31 3iud s ASP 284 CO 0.00 -0.44 0.96 -0.94 0.52 0.00 0.00 175.17 175.27 3iud s SER 285 N -3.57 -0.28 0.00 -0.34 1.04 -1.26 -1.29 113.70 108.00 3iud s SER 285 Ca 0.34 -0.10 0.00 0.00 0.48 0.00 0.00 55.95 56.67 3iud s SER 285 Cb 0.07 0.37 0.00 0.00 0.10 0.00 0.00 66.02 66.56 3iud s SER 285 CO 0.16 -0.62 0.00 1.17 0.98 0.00 0.00 173.24 174.93 3iud n LYS 286 N -0.29 1.27 -0.01 4.02 4.81 -1.26 -4.75 118.16 121.95 3iud n LYS 286 Ca -0.07 0.00 -0.03 0.00 -0.87 0.00 0.00 58.31 57.34 3iud n LYS 286 Cb 0.61 -0.74 -0.01 0.00 0.02 0.00 0.00 35.03 34.91 3iud n LYS 286 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 3iud n TYR 287 N -1.50 0.00 0.00 5.64 4.01 -1.26 -5.08 117.16 118.97 3iud n TYR 287 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 3iud n TYR 287 Cb 0.24 -0.16 0.00 0.00 -0.31 0.00 0.00 39.34 39.12 3iud n TYR 287 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3iud n GLY 288 N 2.65 5.10 2.76 2.72 0.00 -1.26 -4.91 105.19 112.26 3iud n GLY 288 Ca -0.04 -1.02 -0.42 0.00 0.00 0.00 0.00 46.02 44.54 3iud n GLY 288 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3iud n ASP 289 N 0.00 5.59 0.22 1.61 2.03 -1.24 -4.72 116.55 120.04 3iud n ASP 289 Ca 0.00 -3.07 0.15 0.00 0.52 0.00 0.00 54.79 52.39 3iud n ASP 289 Cb 0.00 -1.48 0.74 0.00 -0.72 0.00 0.00 41.12 39.66 3iud n ASP 289 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 3iud h ASP 290 N 5.54 0.00 -6.70 1.67 3.32 -1.85 -3.46 116.42 114.94 3iud h ASP 290 Ca 0.48 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.99 3iud h ASP 290 Cb 0.56 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 39.94 3iud h ASP 290 CO 1.64 0.00 -0.85 0.47 -1.72 0.00 0.00 179.24 178.78 3iud n ASP 291 N -2.60 -2.66 -4.92 6.45 8.00 -1.23 -4.76 116.55 114.83 3iud n ASP 291 Ca -0.01 -1.01 -0.27 0.00 0.71 0.00 0.00 54.79 54.21 3iud n ASP 291 Cb 0.13 -2.81 0.07 0.00 -0.02 0.00 0.00 41.12 38.49 3iud n ASP 291 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3iud s LEU 292 N -7.22 2.81 0.27 0.64 1.43 -0.41 -1.04 118.68 115.16 3iud s LEU 292 Ca 0.58 0.60 -0.30 0.00 -1.03 0.00 0.00 54.13 53.98 3iud s LEU 292 Cb -0.31 -3.25 -0.13 0.00 0.03 0.00 0.00 46.19 42.53 3iud s LEU 292 CO 0.92 -1.57 1.48 0.47 0.23 0.00 0.00 176.35 177.87 3iud n ASP 293 N -2.96 3.21 -4.70 2.29 9.92 -1.26 -0.71 116.55 122.34 3iud n ASP 293 Ca 0.07 1.15 -0.41 0.00 -0.53 0.00 0.00 54.79 55.07 3iud n ASP 293 Cb 0.60 -1.50 0.01 0.00 -0.64 0.00 0.00 41.12 39.59 3iud n ASP 293 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3iud n ALA 294 N 1.88 1.25 -0.49 2.24 0.00 -1.26 -2.06 120.51 122.07 3iud n ALA 294 Ca 0.10 0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.81 3iud n ALA 294 Cb 0.34 -2.26 0.00 0.00 0.00 0.00 0.00 19.45 17.53 3iud n ALA 294 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3iud n GLY 295 N 0.82 0.86 0.19 0.00 0.00 -1.26 -4.78 105.19 101.02 3iud n GLY 295 Ca 0.06 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.13 3iud n GLY 295 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iud h ALA 296 N 0.00 1.14 0.00 4.61 0.00 -1.78 -3.28 119.26 119.94 3iud h ALA 296 Ca 0.00 -0.35 -0.24 0.00 0.00 0.00 0.00 54.91 54.32 3iud h ALA 296 Cb 0.00 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 3iud h ALA 296 CO 0.00 0.48 -1.72 -0.89 0.00 0.00 0.00 179.25 177.12 3iud n ILE 297 N -3.75 0.98 -3.57 0.00 2.08 -1.26 -4.90 119.36 108.94 3iud n ILE 297 Ca -0.01 -0.16 -0.27 0.00 0.56 0.00 0.00 62.75 62.87 3iud n ILE 297 Cb 0.47 -1.77 -0.10 0.00 -0.75 0.00 0.00 39.64 37.48 3iud n ILE 297 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 3iud n GLU 298 N -3.79 1.14 0.05 0.38 1.02 -1.26 -4.95 120.64 113.22 3iud n GLU 298 Ca -0.29 -3.85 0.05 0.00 -0.02 0.00 0.00 57.16 53.05 3iud n GLU 298 Cb 0.67 -1.92 0.46 0.00 -0.02 0.00 0.00 31.44 30.63 3iud n GLU 298 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 3iud h PRO 299 N 5.19 0.44 -0.61 3.49 0.13 -1.91 -2.52 132.00 136.22 3iud h PRO 299 Ca 0.19 -0.03 -0.10 0.00 -0.87 0.00 0.00 66.00 65.19 3iud h PRO 299 Cb 0.82 -0.10 -0.02 0.00 0.13 0.00 0.00 31.00 31.83 3iud h PRO 299 CO 0.57 0.30 -0.02 -0.92 -0.23 0.00 0.00 178.00 177.70 3iud h TYR 300 N 0.45 1.18 -0.86 1.56 3.20 -1.92 -2.14 116.97 118.44 3iud h TYR 300 Ca 0.12 -0.21 0.04 0.00 3.14 0.00 0.00 58.73 61.82 3iud h TYR 300 Cb -0.04 -0.31 -0.05 0.00 1.54 0.00 0.00 36.73 37.87 3iud h TYR 300 CO 0.00 1.04 0.55 -0.09 -1.64 0.00 0.00 178.16 178.02 3iud h ARG 301 N 0.98 1.01 -0.61 1.82 2.43 -1.88 0.32 114.38 118.45 3iud h ARG 301 Ca 0.17 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.27 3iud h ARG 301 Cb 0.58 -0.23 -0.03 0.00 -0.42 0.00 0.00 29.97 29.87 3iud h ARG 301 CO 0.03 0.67 0.34 1.25 -1.51 0.00 0.00 179.97 180.75 3iud h LEU 302 N 1.04 0.76 -0.73 3.80 5.85 -1.28 -0.75 115.31 124.00 3iud h LEU 302 Ca 0.35 -0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.96 3iud h LEU 302 Cb 0.06 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.86 3iud h LEU 302 CO -0.13 0.63 0.37 0.15 -0.34 0.00 0.00 178.44 179.12 3iud h PHE 303 N 0.83 1.03 -0.46 1.25 3.57 -0.70 -2.25 116.94 120.20 3iud h PHE 303 Ca 0.22 -0.04 -0.07 0.00 3.53 0.00 0.00 57.97 61.61 3iud h PHE 303 Cb 0.04 -0.32 -0.02 0.00 2.79 0.00 0.00 35.95 38.43 3iud h PHE 303 CO -0.01 0.74 -0.00 -0.07 -2.23 0.00 0.00 178.31 176.74 3iud h LEU 304 N 1.01 0.72 -0.54 0.59 3.38 -0.26 0.23 115.31 120.44 3iud h LEU 304 Ca 0.25 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 3iud h LEU 304 Cb 0.08 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 3iud h LEU 304 CO -0.04 0.79 0.23 0.58 0.09 0.00 0.00 178.44 180.09 3iud h VAL 305 N 0.70 1.21 0.00 1.22 2.07 -0.88 -2.34 116.25 118.23 3iud h VAL 305 Ca 0.14 -0.65 -0.09 0.00 0.82 0.00 0.00 66.70 66.91 3iud h VAL 305 Cb 0.44 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 3iud h VAL 305 CO 0.02 0.25 -0.45 -0.26 0.02 0.00 0.00 177.57 177.15 3iud h PHE 306 N 0.73 0.00 -0.92 1.57 0.04 -0.88 -2.71 116.94 114.76 3iud h PHE 306 Ca 0.18 0.00 0.01 0.00 2.80 0.00 0.00 57.97 60.96 3iud h PHE 306 Cb 0.18 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.28 3iud h PHE 306 CO 0.00 0.45 0.61 -0.97 -0.60 0.00 0.00 178.31 177.81 3iud h ASN 307 N 0.00 1.06 -0.30 2.17 -1.24 -0.03 0.64 115.58 117.88 3iud h ASN 307 Ca -0.00 -0.03 -0.08 0.00 0.71 0.00 0.00 56.30 56.90 3iud h ASN 307 Cb 0.86 -0.26 -0.02 0.00 0.73 0.00 0.00 38.32 39.63 3iud h ASN 307 CO 0.06 0.76 -0.09 -0.33 -1.29 0.00 0.00 177.43 176.54 3iud h GLU 308 N 1.25 0.71 -0.10 6.67 4.39 -1.17 0.80 114.58 127.11 3iud h GLU 308 Ca 0.34 -0.22 -0.03 0.00 0.34 0.00 0.00 59.36 59.79 3iud h GLU 308 Cb -0.13 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 28.44 3iud h GLU 308 CO -0.08 0.78 -0.06 -0.07 -1.16 0.00 0.00 179.01 178.43 3iud h LEU 309 N 0.65 0.23 -0.99 1.33 3.38 -1.10 -1.40 115.31 117.41 3iud h LEU 309 Ca 0.12 -0.42 -0.06 0.00 0.09 0.00 0.00 57.88 57.60 3iud h LEU 309 Cb 0.54 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 3iud h LEU 309 CO 0.03 0.60 0.05 0.58 0.09 0.00 0.00 178.44 179.79 3iud h VAL 310 N -0.14 1.23 -0.27 1.22 2.07 -0.80 -2.61 116.25 116.95 3iud h VAL 310 Ca 0.02 -0.91 -0.11 0.00 0.82 0.00 0.00 66.70 66.52 3iud h VAL 310 Cb 0.52 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 3iud h VAL 310 CO 0.02 0.33 -0.31 -0.78 0.02 0.00 0.00 177.57 176.84 3iud h ASP 311 N 0.74 0.57 -0.92 0.57 3.58 -0.78 -2.21 116.42 117.98 3iud h ASP 311 Ca 0.15 -0.22 0.08 0.00 0.42 0.00 0.00 57.03 57.47 3iud h ASP 311 Cb 0.38 -0.16 -0.06 0.00 1.72 0.00 0.00 39.33 41.20 3iud h ASP 311 CO 0.01 0.85 0.59 0.00 -2.88 0.00 0.00 179.24 177.82 3iud h ALA 312 N 1.18 1.56 -0.15 -0.78 0.00 -0.86 0.42 119.26 120.64 3iud h ALA 312 Ca 0.06 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 3iud h ALA 312 Cb 0.78 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 3iud h ALA 312 CO 0.06 0.27 -0.20 1.49 0.00 0.00 0.00 179.25 180.87 3iud h GLU 313 N 0.97 0.40 -0.09 0.00 4.81 -1.38 -1.31 114.58 117.99 3iud h GLU 313 Ca 0.42 -0.23 0.03 0.00 -0.13 0.00 0.00 59.36 59.44 3iud h GLU 313 Cb 0.32 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.71 3iud h GLU 313 CO -0.17 0.81 0.07 0.00 -0.73 0.00 0.00 179.01 178.98 3iud h ALA 314 N 0.58 2.01 -0.00 2.92 0.00 -0.71 0.11 119.26 124.17 3iud h ALA 314 Ca 0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3iud h ALA 314 Cb 0.76 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.56 3iud h ALA 314 CO 0.05 -0.11 -0.05 0.54 0.00 0.00 0.00 179.25 179.68 3iud n ARG 315 N -4.40 0.85 -0.80 0.00 1.74 0.05 -4.91 116.66 109.20 3iud n ARG 315 Ca -0.01 -0.22 0.00 0.00 -0.77 0.00 0.00 57.85 56.85 3iud n ARG 315 Cb 0.18 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.12 3iud n ARG 315 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3iud n GLY 316 N 1.19 0.52 3.75 -0.13 0.00 0.39 -5.01 105.19 105.89 3iud n GLY 316 Ca 0.18 -0.76 -0.41 0.00 0.00 0.00 0.00 46.02 45.02 3iud n GLY 316 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3iud s VAL 317 N -2.00 2.30 0.20 1.61 1.01 -0.50 -4.99 120.40 118.03 3iud s VAL 317 Ca 0.00 0.25 0.09 0.00 0.00 0.00 0.00 61.98 62.31 3iud s VAL 317 Cb 0.00 -3.16 -0.04 0.00 0.00 0.00 0.00 36.38 33.18 3iud s VAL 317 CO 0.00 0.04 -0.04 -0.54 0.00 0.00 0.00 175.10 174.56 3iud s LYS 318 N -0.47 2.23 0.00 2.72 3.01 -1.26 -4.57 119.74 121.40 3iud s LYS 318 Ca 0.62 -1.26 0.00 0.00 -1.01 0.00 0.00 55.97 54.32 3iud s LYS 318 Cb -0.45 -2.22 0.00 0.00 -1.01 0.00 0.00 37.83 34.14 3iud s LYS 318 CO 0.46 0.42 0.00 0.41 0.51 0.00 0.00 175.35 177.16 3iud n GLY 319 N -0.25 0.38 3.56 -3.33 0.00 -1.26 -4.97 105.19 99.31 3iud n GLY 319 Ca -0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 3iud n GLY 319 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3iud s PHE 320 N -1.79 2.59 -0.39 1.61 5.36 -1.26 -4.92 117.98 119.18 3iud s PHE 320 Ca 0.00 0.18 0.08 0.00 -0.96 0.00 0.00 56.93 56.23 3iud s PHE 320 Cb 0.00 -4.43 0.25 0.00 -0.34 0.00 0.00 43.02 38.50 3iud s PHE 320 CO 0.00 -1.63 0.53 0.72 -1.46 0.00 0.00 175.22 173.38 3iud n HIS 321 N 8.36 -0.49 -1.60 10.12 8.25 -1.26 -5.10 115.22 133.50 3iud n HIS 321 Ca 0.05 -3.49 -0.40 0.00 -0.26 0.00 0.00 57.72 53.62 3iud n HIS 321 Cb 0.48 -0.27 0.03 0.00 1.12 0.00 0.00 29.99 31.35 3iud n HIS 321 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 3iud n PRO 322 N 1.44 1.13 -3.40 -0.41 -0.02 -1.26 -4.96 135.00 127.51 3iud n PRO 322 Ca 0.21 0.42 -0.41 0.00 -2.02 0.00 0.00 63.50 61.69 3iud n PRO 322 Cb 0.53 -2.06 -0.09 0.00 -0.02 0.00 0.00 33.50 31.86 3iud n PRO 322 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3iud s ALA 323 N -1.40 3.48 -0.16 3.55 0.00 -0.61 -4.95 121.76 121.67 3iud s ALA 323 Ca 0.68 -1.32 -0.15 0.00 0.00 0.00 0.00 51.96 51.17 3iud s ALA 323 Cb -0.49 -2.86 -0.04 0.00 0.00 0.00 0.00 23.12 19.72 3iud s ALA 323 CO 0.53 -1.20 0.33 -1.01 0.00 0.00 0.00 175.76 174.41 3iud s HIS 324 N 2.00 3.46 0.01 0.00 3.76 -1.26 -1.08 115.29 122.17 3iud s HIS 324 Ca 0.11 0.64 -0.00 0.00 -0.15 0.00 0.00 55.06 55.65 3iud s HIS 324 Cb -0.17 -2.39 -0.01 0.00 1.11 0.00 0.00 32.58 31.11 3iud s HIS 324 CO 0.12 0.19 -0.01 -1.64 -0.85 0.00 0.00 174.74 172.55 3iud s MET 325 N 0.60 0.23 -0.22 1.40 -1.94 0.45 -0.76 119.30 119.06 3iud s MET 325 Ca 0.18 -0.42 -0.11 0.00 -1.71 0.00 0.00 55.69 53.63 3iud s MET 325 Cb -0.13 0.08 -0.05 0.00 2.01 0.00 0.00 34.83 36.74 3iud s MET 325 CO 0.05 -0.04 0.16 0.42 -0.01 0.00 0.00 175.02 175.60 3iud s ILE 326 N -1.04 5.38 -0.40 2.53 1.01 -0.54 0.05 121.20 128.19 3iud s ILE 326 Ca -0.11 0.21 0.02 0.00 0.00 0.00 0.00 60.65 60.76 3iud s ILE 326 Cb -0.07 -3.50 0.12 0.00 0.01 0.00 0.00 42.46 39.02 3iud s ILE 326 CO -0.01 0.39 0.18 -0.62 0.00 0.00 0.00 174.94 174.88 3iud s ASP 327 N 0.72 3.91 0.10 3.58 -1.08 -0.87 -3.62 116.67 119.41 3iud s ASP 327 Ca 0.08 -2.34 0.03 0.00 -0.52 0.00 0.00 52.55 49.80 3iud s ASP 327 Cb -0.12 -1.09 -0.04 0.00 -1.46 0.00 0.00 42.92 40.21 3iud s ASP 327 CO 0.02 -0.32 -0.08 -1.10 0.52 0.00 0.00 175.17 174.21 3iud s GLN 328 N 0.70 0.85 -0.15 4.34 -0.21 -1.26 -4.62 119.66 119.31 3iud s GLN 328 Ca 0.15 -1.27 0.02 0.00 0.02 0.00 0.00 55.36 54.28 3iud s GLN 328 Cb -0.22 -0.36 0.01 0.00 1.00 0.00 0.00 33.01 33.44 3iud s GLN 328 CO -0.07 0.03 -0.21 0.45 -2.12 0.00 0.00 175.29 173.37 3iud s SER 329 N -2.81 3.07 -0.45 5.90 0.15 -0.21 -4.58 113.70 114.77 3iud s SER 329 Ca 0.09 -0.60 -0.08 0.00 0.70 0.00 0.00 55.95 56.06 3iud s SER 329 Cb 0.02 -1.43 0.11 0.00 -1.71 0.00 0.00 66.02 63.01 3iud s SER 329 CO -0.02 0.05 0.30 -1.00 1.20 0.00 0.00 173.24 173.77 3iud s HIS 330 N 0.96 3.45 -0.20 3.44 0.09 -1.26 -4.61 115.29 117.15 3iud s HIS 330 Ca -0.04 -1.94 0.22 0.00 -0.00 0.00 0.00 55.06 53.30 3iud s HIS 330 Cb -0.15 -3.34 -0.17 0.00 -0.00 0.00 0.00 32.58 28.93 3iud s HIS 330 CO -0.05 -0.97 0.76 0.09 -0.00 0.00 0.00 174.74 174.57 3iud n ASN 331 N 4.84 0.41 -1.05 1.40 3.02 -1.26 -0.23 115.26 122.38 3iud n ASN 331 Ca -0.07 0.07 0.04 0.00 -0.03 0.00 0.00 54.58 54.58 3iud n ASN 331 Cb 0.41 1.27 0.05 0.00 -0.61 0.00 0.00 39.78 40.90 3iud n ASN 331 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 3iud n VAL 332 N -2.35 0.45 -4.05 2.41 0.24 -1.26 -4.73 118.33 109.03 3iud n VAL 332 Ca -0.02 -1.19 -0.10 0.00 -2.04 0.00 0.00 64.34 61.00 3iud n VAL 332 Cb 0.54 0.62 -0.06 0.00 -1.47 0.00 0.00 33.84 33.47 3iud n VAL 332 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 3iud s THR 333 N -0.66 0.00 -0.25 3.34 -4.23 -1.26 -5.10 115.64 107.48 3iud s THR 333 Ca 0.27 -1.57 -0.29 0.00 -1.18 0.00 0.00 61.69 58.92 3iud s THR 333 Cb 0.29 -2.29 -0.02 0.00 1.34 0.00 0.00 72.50 71.83 3iud s THR 333 CO -0.10 0.00 1.52 -0.62 -0.54 0.00 0.00 174.62 174.88 3iud s ASP 334 N -3.06 6.45 0.26 3.99 -1.08 -1.26 -4.89 116.67 117.09 3iud s ASP 334 Ca 0.27 1.47 -0.05 0.00 -0.52 0.00 0.00 52.55 53.72 3iud s ASP 334 Cb 0.01 -2.53 0.52 0.00 -1.46 0.00 0.00 42.92 39.46 3iud s ASP 334 CO 0.10 -1.22 1.62 -0.65 0.52 0.00 0.00 175.17 175.54 3iud h PRO 335 N 10.34 0.08 -0.86 4.34 0.11 -1.86 -0.09 132.00 144.06 3iud h PRO 335 Ca -0.31 -0.01 0.04 0.00 0.11 0.00 0.00 66.00 65.83 3iud h PRO 335 Cb 1.14 -0.02 -0.05 0.00 0.11 0.00 0.00 31.00 32.17 3iud h PRO 335 CO 1.01 0.06 0.55 0.82 -0.21 0.00 0.00 178.00 180.23 3iud h ILE 336 N 0.09 1.12 -0.24 4.15 2.04 -1.85 -1.38 117.51 121.44 3iud h ILE 336 Ca 0.47 -0.36 -0.12 0.00 1.00 0.00 0.00 64.86 65.84 3iud h ILE 336 Cb 0.86 -0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 3iud h ILE 336 CO -0.74 0.19 -0.36 -0.33 0.00 0.00 0.00 178.15 176.92 3iud h GLU 337 N 1.06 0.53 -0.07 2.37 5.08 -1.43 -1.66 114.58 120.46 3iud h GLU 337 Ca 0.35 -0.25 -0.02 0.00 -1.00 0.00 0.00 59.36 58.45 3iud h GLU 337 Cb 0.04 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.28 3iud h GLU 337 CO -0.13 0.81 -0.02 0.77 -1.00 0.00 0.00 179.01 179.44 3iud h SER 338 N 0.44 0.14 -0.47 1.42 0.02 -0.86 -1.93 113.55 112.31 3iud h SER 338 Ca 0.05 -0.38 -0.01 0.00 -0.84 0.00 0.00 61.79 60.61 3iud h SER 338 Cb 0.83 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 63.31 3iud h SER 338 CO 0.07 0.48 0.26 -0.07 -1.14 0.00 0.00 176.83 176.44 3iud h LEU 339 N -0.21 0.61 0.27 5.07 3.38 -1.25 0.41 115.31 123.60 3iud h LEU 339 Ca 0.02 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 3iud h LEU 339 Cb 0.42 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.02 3iud h LEU 339 CO 0.01 0.51 -0.13 0.40 0.09 0.00 0.00 178.44 179.31 3iud h ILE 340 N 0.70 0.74 0.00 1.22 2.04 -1.10 0.14 117.51 121.24 3iud h ILE 340 Ca 0.18 -0.03 -0.11 0.00 1.00 0.00 0.00 64.86 65.89 3iud h ILE 340 Cb 0.04 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 3iud h ILE 340 CO -0.03 0.01 -0.54 0.78 0.00 0.00 0.00 178.15 178.36 3iud h ASN 341 N -0.38 0.00 -0.03 1.72 2.35 -0.93 -1.95 115.58 116.35 3iud h ASN 341 Ca -0.04 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.70 3iud h ASN 341 Cb 0.29 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.66 3iud h ASN 341 CO 0.06 0.54 -0.02 0.28 -1.65 0.00 0.00 177.43 176.65 3iud h SER 342 N 0.00 0.07 -0.99 5.81 0.02 -0.05 0.24 113.55 118.66 3iud h SER 342 Ca -0.01 -0.43 0.13 0.00 -0.84 0.00 0.00 61.79 60.65 3iud h SER 342 Cb 1.12 -0.02 -0.09 0.00 0.14 0.00 0.00 62.40 63.55 3iud h SER 342 CO 0.07 0.48 0.61 0.00 -1.14 0.00 0.00 176.83 176.85 3iud h ALA 343 N 0.59 1.51 -0.20 3.77 0.00 -0.67 -1.27 119.26 122.98 3iud h ALA 343 Ca 0.01 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3iud h ALA 343 Cb 0.46 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3iud h ALA 343 CO 0.01 0.16 0.00 -0.91 0.00 0.00 0.00 179.25 178.50 3iud h ASN 344 N 0.93 0.34 -0.16 0.00 -0.26 -0.97 -2.74 115.58 112.72 3iud h ASN 344 Ca 0.50 -0.30 0.02 0.00 -0.56 0.00 0.00 56.30 55.97 3iud h ASN 344 Cb 0.56 -0.09 -0.01 0.00 -1.06 0.00 0.00 38.32 37.72 3iud h ASN 344 CO -0.29 0.56 0.11 -0.33 -1.06 0.00 0.00 177.43 176.42 3iud h GLU 345 N 0.11 0.10 -0.16 0.81 4.39 0.56 0.10 114.58 120.49 3iud h GLU 345 Ca 0.06 -0.01 -0.19 0.00 0.34 0.00 0.00 59.36 59.56 3iud h GLU 345 Cb 0.38 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.01 3iud h GLU 345 CO 0.01 0.07 -0.68 0.82 -1.16 0.00 0.00 179.01 178.07 3iud h ILE 346 N 0.11 1.32 -0.06 3.13 2.04 -1.15 -1.88 117.51 121.01 3iud h ILE 346 Ca 0.07 -1.95 -0.14 0.00 1.00 0.00 0.00 64.86 63.85 3iud h ILE 346 Cb 0.14 1.92 -0.01 0.00 -0.74 0.00 0.00 36.82 38.13 3iud h ILE 346 CO -0.01 0.61 -0.57 0.03 0.00 0.00 0.00 178.15 178.20 3iud h ARG 347 N 0.45 0.19 -0.22 2.37 3.08 -0.97 -2.35 114.38 116.93 3iud h ARG 347 Ca -0.02 -0.13 -0.01 0.00 0.07 0.00 0.00 59.98 59.89 3iud h ARG 347 Cb 1.27 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.33 3iud h ARG 347 CO 0.13 0.71 0.09 -0.09 -1.07 0.00 0.00 179.97 179.74 3iud h ARG 348 N 0.15 0.33 -0.49 0.04 2.43 -0.84 -0.88 114.38 115.11 3iud h ARG 348 Ca -0.00 -0.06 -0.06 0.00 -0.81 0.00 0.00 59.98 59.04 3iud h ARG 348 Cb 1.06 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.53 3iud h ARG 348 CO 0.09 0.39 0.04 0.00 -1.51 0.00 0.00 179.97 178.98 3iud h ALA 349 N 0.92 1.16 -0.41 2.80 0.00 -1.27 -2.15 119.26 120.32 3iud h ALA 349 Ca 0.07 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 3iud h ALA 349 Cb 0.19 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 3iud h ALA 349 CO -0.01 0.55 0.07 -0.92 0.00 0.00 0.00 179.25 178.95 3iud h TYR 350 N 0.75 0.71 -0.56 0.00 3.20 -1.17 -2.37 116.97 117.53 3iud h TYR 350 Ca 0.15 -0.10 -0.06 0.00 3.14 0.00 0.00 58.73 61.86 3iud h TYR 350 Cb 0.39 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.44 3iud h TYR 350 CO 0.02 0.70 0.11 0.00 -1.64 0.00 0.00 178.16 177.35 3iud h ALA 351 N 0.93 0.74 -0.26 1.82 0.00 -0.95 -1.61 119.26 119.95 3iud h ALA 351 Ca 0.12 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 3iud h ALA 351 Cb 0.37 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3iud h ALA 351 CO 0.01 0.47 -0.20 1.96 0.00 0.00 0.00 179.25 181.49 3iud h GLN 352 N 0.81 0.46 -0.13 0.00 4.20 -1.37 -2.36 115.11 116.72 3iud h GLN 352 Ca 0.17 -0.15 -0.12 0.00 0.06 0.00 0.00 58.65 58.61 3iud h GLN 352 Cb 0.38 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.11 3iud h GLN 352 CO 0.01 0.64 -0.44 0.00 -0.67 0.00 0.00 178.83 178.37 3iud h ALA 353 N 1.38 1.02 0.00 3.87 0.00 -1.19 -1.99 119.26 122.34 3iud h ALA 353 Ca 0.07 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.54 3iud h ALA 353 Cb 0.58 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.28 3iud h ALA 353 CO 0.04 0.62 0.00 -0.07 0.00 0.00 0.00 179.25 179.84 3iud h LEU 354 N 0.25 0.00 0.00 0.00 3.38 -0.78 -2.68 115.31 115.49 3iud h LEU 354 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3iud h LEU 354 Cb 0.87 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.62 3iud h LEU 354 CO 0.07 0.00 -0.17 -0.07 0.09 0.00 0.00 178.44 178.36 3iud h LEU 355 N 0.00 0.00 -9.74 1.67 3.38 -1.00 -3.47 115.31 106.15 3iud h LEU 355 Ca 0.00 -0.05 -0.55 0.00 0.09 0.00 0.00 57.88 57.37 3iud h LEU 355 Cb 0.45 0.00 0.09 0.00 0.09 0.00 0.00 40.66 41.29 3iud h LEU 355 CO 0.00 0.02 0.74 0.52 0.09 0.00 0.00 178.44 179.81 3iud n VAL 356 N -2.37 1.21 -2.86 1.22 0.31 -1.01 -4.85 118.33 109.98 3iud n VAL 356 Ca 0.05 -0.30 -0.43 0.00 -0.01 0.00 0.00 64.34 63.64 3iud n VAL 356 Cb 0.45 -1.76 -0.03 0.00 -0.91 0.00 0.00 33.84 31.59 3iud n VAL 356 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3iud s ASP 357 N 0.28 6.44 0.23 4.52 -1.08 -1.26 -4.89 116.67 120.91 3iud s ASP 357 Ca 0.63 -1.57 -0.07 0.00 -0.52 0.00 0.00 52.55 51.02 3iud s ASP 357 Cb -0.55 -2.43 0.20 0.00 -1.46 0.00 0.00 42.92 38.68 3iud s ASP 357 CO 0.52 -1.26 1.85 0.03 0.52 0.00 0.00 175.17 176.82 3iud h ARG 358 N 9.23 1.25 0.21 4.34 2.47 -1.97 0.29 114.38 130.20 3iud h ARG 358 Ca -0.01 -0.15 0.00 0.00 -1.26 0.00 0.00 59.98 58.56 3iud h ARG 358 Cb 1.04 -0.24 -0.01 0.00 -1.65 0.00 0.00 29.97 29.11 3iud h ARG 358 CO 1.17 0.92 -0.18 0.00 0.56 0.00 0.00 179.97 182.44 3iud h ALA 359 N 1.26 -0.39 -0.04 0.04 0.00 -1.99 0.48 119.26 118.63 3iud h ALA 359 Ca 0.31 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.16 3iud h ALA 359 Cb 0.04 0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 3iud h ALA 359 CO -0.05 -0.74 0.02 0.00 0.00 0.00 0.00 179.25 178.49 3iud h ALA 360 N 0.34 0.05 -0.67 0.00 0.00 -1.94 -0.96 119.26 116.07 3iud h ALA 360 Ca -0.01 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 54.96 3iud h ALA 360 Cb 0.37 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.09 3iud h ALA 360 CO -0.03 -0.44 0.34 1.25 0.00 0.00 0.00 179.25 180.37 3iud h LEU 361 N 0.02 0.47 -0.69 0.00 5.85 -0.71 -0.71 115.31 119.53 3iud h LEU 361 Ca 0.01 0.05 0.03 0.00 0.84 0.00 0.00 57.88 58.81 3iud h LEU 361 Cb 0.02 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 40.97 3iud h LEU 361 CO -0.00 0.29 0.44 -1.28 -0.34 0.00 0.00 178.44 177.54 3iud h SER 362 N 0.61 0.72 -0.65 1.25 0.87 0.37 -1.42 113.55 115.30 3iud h SER 362 Ca 0.31 -0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.87 3iud h SER 362 Cb 0.27 -0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 62.04 3iud h SER 362 CO -0.23 0.50 0.39 1.23 -0.53 0.00 0.00 176.83 178.20 3iud h GLY 363 N 0.86 0.94 2.00 5.77 0.00 0.20 -1.98 103.07 110.87 3iud h GLY 363 Ca 0.28 -0.39 -0.08 0.00 0.00 0.00 0.00 47.33 47.13 3iud h GLY 363 CO -0.10 0.38 -0.36 -0.97 0.00 0.00 0.00 176.54 175.49 3iud h TYR 364 N 0.88 0.00 -0.21 5.60 0.05 -0.91 -2.12 116.97 120.26 3iud h TYR 364 Ca 0.23 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.92 3iud h TYR 364 Cb -0.02 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.71 3iud h TYR 364 CO -0.02 0.36 -0.25 1.96 -1.05 0.00 0.00 178.16 179.17 3iud h GLN 365 N 0.00 0.54 -0.60 4.88 4.20 -0.85 0.15 115.11 123.43 3iud h GLN 365 Ca -0.00 -0.30 -0.06 0.00 0.06 0.00 0.00 58.65 58.34 3iud h GLN 365 Cb 0.85 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.63 3iud h GLN 365 CO 0.05 0.89 0.13 0.93 -0.67 0.00 0.00 178.83 180.16 3iud h GLU 366 N 0.21 0.95 -0.11 1.46 4.39 -1.22 -2.24 114.58 118.02 3iud h GLU 366 Ca 0.03 -0.22 0.00 0.00 0.34 0.00 0.00 59.36 59.51 3iud h GLU 366 Cb 0.82 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 29.33 3iud h GLU 366 CO 0.06 0.86 0.00 -0.25 -1.16 0.00 0.00 179.01 178.52 3iud n ASP 367 N -4.25 1.02 -3.91 1.42 8.00 -0.81 -4.91 116.55 113.11 3iud n ASP 367 Ca 0.04 -1.65 -0.29 0.00 0.71 0.00 0.00 54.79 53.60 3iud n ASP 367 Cb 0.25 -0.07 0.02 0.00 -0.02 0.00 0.00 41.12 41.30 3iud n ASP 367 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3iud n ASN 368 N -0.09 -4.23 -4.29 -2.24 4.13 -0.74 -4.87 115.26 102.93 3iud n ASN 368 Ca 0.14 -0.80 -0.44 0.00 1.68 0.00 0.00 54.58 55.16 3iud n ASN 368 Cb 0.22 -3.83 0.00 0.00 -1.54 0.00 0.00 39.78 34.63 3iud n ASN 368 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 3iud n ASP 369 N -2.86 5.53 -0.29 6.41 -0.08 0.46 -4.86 116.55 120.86 3iud n ASP 369 Ca -0.00 -3.08 0.13 0.00 -1.51 0.00 0.00 54.79 50.32 3iud n ASP 369 Cb 0.54 -1.43 0.37 0.00 2.34 0.00 0.00 41.12 42.95 3iud n ASP 369 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3iud h ALA 370 N 6.54 1.82 0.51 -1.67 0.00 -1.90 -1.60 119.26 122.97 3iud h ALA 370 Ca 0.24 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.15 3iud h ALA 370 Cb 0.82 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.50 3iud h ALA 370 CO 1.18 -0.09 -0.25 1.25 0.00 0.00 0.00 179.25 181.34 3iud h LEU 371 N 0.70 -0.58 -1.67 0.00 5.85 -1.96 -1.92 115.31 115.73 3iud h LEU 371 Ca 0.48 -0.05 -0.04 0.00 0.84 0.00 0.00 57.88 59.11 3iud h LEU 371 Cb 0.79 0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.96 3iud h LEU 371 CO -0.24 -0.29 -0.18 0.24 -0.34 0.00 0.00 178.44 177.64 3iud h MET 372 N -0.88 0.00 0.19 1.25 2.86 -1.93 0.62 114.93 117.04 3iud h MET 372 Ca -0.07 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 3iud h MET 372 Cb 0.60 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.26 3iud h MET 372 CO 0.12 0.18 -0.09 0.00 1.06 0.00 0.00 176.91 178.17 3iud h ALA 373 N 1.82 -0.26 -0.46 6.32 0.00 -1.17 0.98 119.26 126.49 3iud h ALA 373 Ca -0.00 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 3iud h ALA 373 Cb 0.45 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 3iud h ALA 373 CO 0.02 -0.48 -0.02 0.00 0.00 0.00 0.00 179.25 178.77 3iud h THR 374 N -0.59 1.24 -0.62 0.00 1.03 -1.13 -2.39 112.91 110.45 3iud h THR 374 Ca -0.03 -1.03 -0.04 0.00 -0.01 0.00 0.00 66.41 65.30 3iud h THR 374 Cb 0.44 0.92 -0.03 0.00 -1.07 0.00 0.00 68.15 68.41 3iud h THR 374 CO 0.04 0.36 0.20 -0.08 -0.01 0.00 0.00 175.52 176.04 3iud h GLU 375 N 0.72 0.93 -0.73 0.00 4.57 -0.75 -0.26 114.58 119.06 3iud h GLU 375 Ca 0.14 -0.17 -0.04 0.00 -1.18 0.00 0.00 59.36 58.11 3iud h GLU 375 Cb 0.48 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 28.88 3iud h GLU 375 CO 0.02 0.79 0.30 1.15 -1.18 0.00 0.00 179.01 180.10 3iud h THR 376 N 0.90 1.24 -0.41 0.32 2.02 -0.31 0.37 112.91 117.04 3iud h THR 376 Ca 0.21 -0.75 -0.06 0.00 0.77 0.00 0.00 66.41 66.57 3iud h THR 376 Cb 0.24 0.36 -0.01 0.00 -1.74 0.00 0.00 68.15 67.00 3iud h THR 376 CO -0.01 0.31 0.00 -0.07 0.37 0.00 0.00 175.52 176.12 3iud h LEU 377 N 1.06 0.71 -0.91 2.58 4.07 -0.97 -3.17 115.31 118.68 3iud h LEU 377 Ca 0.25 -0.30 -0.06 0.00 0.08 0.00 0.00 57.88 57.84 3iud h LEU 377 Cb 0.18 -0.19 -0.02 0.00 1.08 0.00 0.00 40.66 41.71 3iud h LEU 377 CO -0.02 0.84 0.08 0.11 -1.08 0.00 0.00 178.44 178.37 3iud h LYS 378 N 0.56 0.89 0.00 1.13 1.79 -0.42 -2.19 116.57 118.33 3iud h LYS 378 Ca 0.12 -0.21 -0.00 0.00 -2.18 0.00 0.00 60.65 58.38 3iud h LYS 378 Cb 0.47 -0.12 -0.00 0.00 -1.58 0.00 0.00 32.23 31.01 3iud h LYS 378 CO 0.02 0.83 -0.00 0.00 -1.08 0.00 0.00 179.45 179.22 3iud h ARG 379 N 0.84 0.00 0.00 3.15 3.08 -0.91 0.35 114.38 120.89 3iud h ARG 379 Ca 0.17 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.17 3iud h ARG 379 Cb 0.38 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.42 3iud h ARG 379 CO 0.01 0.00 -0.41 0.00 -1.07 0.00 0.00 179.97 178.50 3iud h ALA 380 N 2.00 0.07 -0.77 0.04 0.00 -1.52 -3.33 119.26 115.76 3iud h ALA 380 Ca -0.00 -0.56 0.07 0.00 0.00 0.00 0.00 54.91 54.42 3iud h ALA 380 Cb 0.00 0.28 -0.05 0.00 0.00 0.00 0.00 17.79 18.02 3iud h ALA 380 CO 0.00 0.27 0.50 -0.92 0.00 0.00 0.00 179.25 179.10 3iud h TYR 381 N -1.00 0.82 0.00 0.00 3.20 -0.88 -1.57 116.97 117.54 3iud h TYR 381 Ca -0.09 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.80 3iud h TYR 381 Cb 0.74 -0.27 -0.00 0.00 1.54 0.00 0.00 36.73 38.74 3iud h TYR 381 CO 0.07 0.43 -0.02 0.00 -1.64 0.00 0.00 178.16 177.01 3iud h ARG 382 N 0.81 0.00 -6.35 1.82 3.08 -0.49 -3.44 114.38 109.82 3iud h ARG 382 Ca 0.33 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 59.84 3iud h ARG 382 Cb 0.26 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.31 3iud h ARG 382 CO -0.11 0.02 1.09 0.99 -1.07 0.00 0.00 179.97 180.88 3iud s THR 383 N -3.57 3.27 -0.57 2.04 2.01 -0.59 -4.92 115.64 113.31 3iud s THR 383 Ca 0.02 0.47 -0.28 0.00 0.31 0.00 0.00 61.69 62.22 3iud s THR 383 Cb 0.08 -3.31 0.02 0.00 0.01 0.00 0.00 72.50 69.31 3iud s THR 383 CO 0.58 -0.03 1.30 -0.62 -0.69 0.00 0.00 174.62 175.16 3iud s ASP 384 N 3.27 6.29 -0.04 3.53 2.15 -1.26 -4.86 116.67 125.76 3iud s ASP 384 Ca 0.77 0.19 0.16 0.00 0.43 0.00 0.00 52.55 54.10 3iud s ASP 384 Cb -0.38 -2.55 0.52 0.00 -0.30 0.00 0.00 42.92 40.22 3iud s ASP 384 CO 0.33 -1.59 1.42 1.33 -0.17 0.00 0.00 175.17 176.49 3iud n VAL 385 N 6.76 1.03 -0.36 1.11 0.24 -1.26 -4.48 118.33 121.37 3iud n VAL 385 Ca 0.10 -0.82 0.07 0.00 -2.04 0.00 0.00 64.34 61.66 3iud n VAL 385 Cb 0.49 0.23 0.24 0.00 -1.47 0.00 0.00 33.84 33.33 3iud n VAL 385 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 3iud h GLU 386 N 3.24 0.96 -0.66 7.34 4.57 -1.98 -1.26 114.58 126.80 3iud h GLU 386 Ca 0.00 -0.06 0.02 0.00 -1.18 0.00 0.00 59.36 58.15 3iud h GLU 386 Cb 0.94 -0.22 -0.04 0.00 -0.16 0.00 0.00 28.75 29.27 3iud h GLU 386 CO 0.08 0.64 0.44 -1.35 -1.18 0.00 0.00 179.01 177.63 3iud h PRO 387 N 0.99 0.80 -0.34 0.92 0.11 -1.92 -0.34 132.00 132.22 3iud h PRO 387 Ca 0.50 -0.05 -0.09 0.00 0.11 0.00 0.00 66.00 66.47 3iud h PRO 387 Cb 0.49 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.41 3iud h PRO 387 CO -0.27 0.53 -0.15 0.82 -0.21 0.00 0.00 178.00 178.72 3iud h ILE 388 N 0.82 1.29 -0.44 4.15 2.04 -1.58 -1.30 117.51 122.48 3iud h ILE 388 Ca 0.26 -1.26 -0.01 0.00 1.00 0.00 0.00 64.86 64.85 3iud h ILE 388 Cb 0.01 1.37 -0.02 0.00 -0.74 0.00 0.00 36.82 37.44 3iud h ILE 388 CO -0.07 0.41 0.24 -0.07 0.00 0.00 0.00 178.15 178.67 3iud h LEU 389 N 0.49 0.55 -0.49 1.44 4.07 -0.89 -0.41 115.31 120.08 3iud h LEU 389 Ca 0.08 -0.09 -0.07 0.00 0.08 0.00 0.00 57.88 57.88 3iud h LEU 389 Cb 0.69 -0.14 -0.02 0.00 1.08 0.00 0.00 40.66 42.27 3iud h LEU 389 CO 0.05 0.49 0.03 0.00 -1.08 0.00 0.00 178.44 177.92 3iud h ALA 390 N 1.09 0.65 -0.44 1.53 0.00 -1.04 -2.30 119.26 118.74 3iud h ALA 390 Ca 0.15 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 3iud h ALA 390 Cb 0.06 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3iud h ALA 390 CO -0.02 0.43 0.07 1.49 0.00 0.00 0.00 179.25 181.21 3iud h GLU 391 N 0.70 0.73 -0.19 0.00 4.57 -1.06 -0.63 114.58 118.70 3iud h GLU 391 Ca 0.14 -0.20 0.05 0.00 -1.18 0.00 0.00 59.36 58.17 3iud h GLU 391 Cb 0.47 -0.09 -0.05 0.00 -0.16 0.00 0.00 28.75 28.92 3iud h GLU 391 CO 0.02 0.76 -0.10 0.00 -1.18 0.00 0.00 179.01 178.51 3iud h ALA 392 N 0.94 0.05 -0.49 2.92 0.00 -0.98 0.20 119.26 121.91 3iud h ALA 392 Ca 0.13 0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.15 3iud h ALA 392 Cb 0.38 0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 3iud h ALA 392 CO 0.01 -0.53 0.27 0.00 0.00 0.00 0.00 179.25 179.00 3iud h ARG 393 N -0.09 0.52 -0.25 0.00 3.08 -1.24 -2.37 114.38 114.03 3iud h ARG 393 Ca 0.11 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.12 3iud h ARG 393 Cb 0.24 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 3iud h ARG 393 CO -0.24 0.34 0.16 -0.09 -1.07 0.00 0.00 179.97 179.07 3iud h ARG 394 N 0.54 0.34 0.00 0.04 2.43 -0.03 0.64 114.38 118.33 3iud h ARG 394 Ca 0.21 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.35 3iud h ARG 394 Cb 0.07 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 3iud h ARG 394 CO -0.12 0.27 0.00 0.54 -1.51 0.00 0.00 179.97 179.15 3iud n ARG 395 N -4.88 0.18 -0.23 0.20 1.74 0.59 -3.09 116.66 111.16 3iud n ARG 395 Ca -0.02 0.51 0.09 0.00 -0.77 0.00 0.00 57.85 57.66 3iud n ARG 395 Cb 0.05 -1.92 0.19 0.00 -1.02 0.00 0.00 32.46 29.75 3iud n ARG 395 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3iud n THR 396 N -2.28 2.05 -0.43 0.55 -2.24 -0.90 -4.97 114.28 106.07 3iud n THR 396 Ca 0.01 -2.17 0.00 0.00 -2.27 0.00 0.00 64.05 59.61 3iud n THR 396 Cb 0.16 -0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.14 3iud n THR 396 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3iud n GLY 397 N -1.10 0.73 0.00 3.38 0.00 -1.06 -4.96 105.19 102.18 3iud n GLY 397 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 3iud n GLY 397 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3iud n GLY 398 N -2.10 0.74 3.59 -0.02 0.00 0.22 -4.78 105.19 102.84 3iud n GLY 398 Ca 0.00 -1.94 -0.34 0.00 0.00 0.00 0.00 46.02 43.74 3iud n GLY 398 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iud s ALA 399 N -2.79 3.10 0.19 4.61 0.00 0.27 -4.28 121.76 122.85 3iud s ALA 399 Ca 0.00 -0.83 -0.12 0.00 0.00 0.00 0.00 51.96 51.01 3iud s ALA 399 Cb 0.00 -1.44 0.19 0.00 0.00 0.00 0.00 23.12 21.88 3iud s ALA 399 CO 0.00 0.45 1.76 0.28 0.00 0.00 0.00 175.76 178.25 3iud h VAL 400 N 4.54 0.86 -3.29 0.00 2.07 -1.86 -3.27 116.25 115.29 3iud h VAL 400 Ca -0.43 -0.15 -0.63 0.00 0.82 0.00 0.00 66.70 66.31 3iud h VAL 400 Cb 1.18 0.39 -0.41 0.00 -1.52 0.00 0.00 31.29 30.94 3iud h VAL 400 CO 0.57 0.08 -0.67 -0.62 0.02 0.00 0.00 177.57 176.94 3iud s ASP 401 N -5.43 4.15 0.07 0.57 -1.08 -1.26 -4.68 116.67 109.01 3iud s ASP 401 Ca -0.13 -2.79 -0.19 0.00 -0.52 0.00 0.00 52.55 48.93 3iud s ASP 401 Cb 0.15 -1.44 -0.07 0.00 -1.46 0.00 0.00 42.92 40.11 3iud s ASP 401 CO 0.74 -0.26 1.31 -0.65 0.52 0.00 0.00 175.17 176.82 3iud h PRO 402 N 6.71 -0.26 -0.85 4.34 0.11 -1.87 -0.29 132.00 139.90 3iud h PRO 402 Ca -0.06 0.02 0.09 0.00 0.11 0.00 0.00 66.00 66.16 3iud h PRO 402 Cb 0.92 0.06 -0.07 0.00 0.11 0.00 0.00 31.00 32.02 3iud h PRO 402 CO 0.61 -0.17 0.50 0.28 -0.21 0.00 0.00 178.00 179.00 3iud h VAL 403 N -0.27 0.95 -0.39 3.15 2.07 -1.94 0.17 116.25 119.99 3iud h VAL 403 Ca 0.03 -0.29 -0.00 0.00 0.82 0.00 0.00 66.70 67.25 3iud h VAL 403 Cb 0.35 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.12 3iud h VAL 403 CO -0.29 0.16 0.24 0.00 0.02 0.00 0.00 177.57 177.69 3iud h ALA 404 N 1.45 0.50 -0.26 1.67 0.00 -1.91 -1.11 119.26 119.59 3iud h ALA 404 Ca 0.40 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 55.17 3iud h ALA 404 Cb 0.31 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3iud h ALA 404 CO -0.23 -0.01 -0.18 1.15 0.00 0.00 0.00 179.25 179.99 3iud h THR 405 N 0.51 1.24 -0.26 0.00 2.02 -0.30 -1.55 112.91 114.57 3iud h THR 405 Ca 0.14 -1.10 -0.02 0.00 0.77 0.00 0.00 66.41 66.20 3iud h THR 405 Cb 0.00 1.24 -0.01 0.00 -1.74 0.00 0.00 68.15 67.64 3iud h THR 405 CO -0.03 0.35 0.07 0.22 0.37 0.00 0.00 175.52 176.51 3iud h TYR 406 N 0.42 0.43 -0.41 3.16 3.20 -0.13 -2.27 116.97 121.37 3iud h TYR 406 Ca 0.07 -0.05 -0.09 0.00 3.14 0.00 0.00 58.73 61.80 3iud h TYR 406 Cb 0.55 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.69 3iud h TYR 406 CO 0.02 0.48 -0.10 0.00 -1.64 0.00 0.00 178.16 176.92 3iud h ARG 407 N 0.25 0.78 0.00 1.82 3.08 -1.05 -2.84 114.38 116.43 3iud h ARG 407 Ca 0.08 -0.30 -0.01 0.00 0.07 0.00 0.00 59.98 59.83 3iud h ARG 407 Cb 0.26 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.27 3iud h ARG 407 CO -0.00 0.91 -0.03 0.00 -1.07 0.00 0.00 179.97 179.78 3iud h ALA 408 N 0.85 1.46 0.00 0.04 0.00 -1.21 -0.81 119.26 119.59 3iud h ALA 408 Ca 0.10 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3iud h ALA 408 Cb 0.62 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.41 3iud h ALA 408 CO 0.04 0.04 0.00 0.66 0.00 0.00 0.00 179.25 179.99 3iud h SER 409 N 0.00 0.00 -0.60 0.00 4.64 -1.15 -3.47 113.55 112.96 3iud h SER 409 Ca -0.00 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.06 3iud h SER 409 Cb 0.08 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.07 3iud h SER 409 CO 0.00 0.00 -0.24 0.61 -0.87 0.00 0.00 176.83 176.34 3iud n GLY 410 N 1.14 1.34 0.28 -0.77 0.00 -0.31 -4.91 105.19 101.95 3iud n GLY 410 Ca 0.05 -0.33 -0.06 0.00 0.00 0.00 0.00 46.02 45.68 3iud n GLY 410 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3iud h TYR 411 N 0.00 -0.61 -0.45 1.61 3.20 -1.82 -1.84 116.97 117.07 3iud h TYR 411 Ca -0.26 0.05 0.09 0.00 3.14 0.00 0.00 58.73 61.75 3iud h TYR 411 Cb 0.89 0.33 -0.08 0.00 1.54 0.00 0.00 36.73 39.42 3iud h TYR 411 CO 0.40 -0.31 -0.03 -0.09 -1.64 0.00 0.00 178.16 176.49 3iud h ARG 412 N -0.15 0.08 -0.83 1.82 9.65 -1.91 -0.89 114.38 122.15 3iud h ARG 412 Ca 0.20 -0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 59.06 3iud h ARG 412 Cb 0.47 -0.02 -0.04 0.00 -1.39 0.00 0.00 29.97 28.99 3iud h ARG 412 CO -0.52 0.05 0.45 0.00 2.80 0.00 0.00 179.97 182.75 3iud h ALA 413 N 1.41 1.22 0.66 2.80 0.00 -1.84 -1.72 119.26 121.79 3iud h ALA 413 Ca 0.22 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 3iud h ALA 413 Cb 0.33 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3iud h ALA 413 CO -0.40 0.63 -0.49 -0.09 0.00 0.00 0.00 179.25 178.90 3iud h ARG 414 N 1.17 -1.07 0.00 0.00 2.43 -0.39 -1.51 114.38 115.01 3iud h ARG 414 Ca 0.29 0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.54 3iud h ARG 414 Cb 0.04 0.24 0.00 0.00 -0.42 0.00 0.00 29.97 29.83 3iud h ARG 414 CO -0.05 -0.71 0.00 -0.39 -1.51 0.00 0.00 179.97 177.31 3iud h VAL 415 N -1.11 0.00 0.00 0.20 -1.51 -1.19 0.44 116.25 113.07 3iud h VAL 415 Ca -0.09 -0.21 -0.10 0.00 -1.23 0.00 0.00 66.70 65.07 3iud h VAL 415 Cb 0.92 1.11 -0.01 0.00 -2.13 0.00 0.00 31.29 31.18 3iud h VAL 415 CO 0.03 0.00 -0.50 0.00 -1.23 0.00 0.00 177.57 175.87 3iud h ALA 416 N 2.03 0.85 0.00 5.19 0.00 -0.73 0.13 119.26 126.73 3iud h ALA 416 Ca 0.00 -0.45 -0.09 0.00 0.00 0.00 0.00 54.91 54.37 3iud h ALA 416 Cb 0.23 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3iud h ALA 416 CO 0.00 0.62 -0.78 0.00 0.00 0.00 0.00 179.25 179.09 3iud h ALA 417 N 1.50 0.69 0.00 0.00 0.00 0.07 -3.33 119.26 118.19 3iud h ALA 417 Ca -0.00 -0.41 -0.12 0.00 0.00 0.00 0.00 54.91 54.37 3iud h ALA 417 Cb 1.13 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 3iud h ALA 417 CO 0.06 0.50 -1.40 0.39 0.00 0.00 0.00 179.25 178.80 3iud n GLU 418 N -3.01 0.62 -4.18 0.00 1.02 -0.70 -4.94 120.64 109.45 3iud n GLU 418 Ca -0.01 0.15 -0.27 0.00 -0.02 0.00 0.00 57.16 57.00 3iud n GLU 418 Cb 0.70 -1.77 -0.08 0.00 -0.02 0.00 0.00 31.44 30.27 3iud n GLU 418 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3iud s ARG 419 N -3.08 2.47 1.21 3.49 0.52 0.43 -5.08 118.95 118.92 3iud s ARG 419 Ca -0.03 -1.04 -0.18 0.00 -0.52 0.00 0.00 55.73 53.96 3iud s ARG 419 Cb 0.09 -2.41 0.24 0.00 0.52 0.00 0.00 34.95 33.39 3iud s ARG 419 CO 0.81 0.47 0.53 -2.30 0.02 0.00 0.00 175.30 174.84 3iud n PRO 420 N -0.03 -2.93 0.00 3.54 -0.02 -1.26 -4.78 135.00 129.52 3iud n PRO 420 Ca -0.10 -0.85 0.07 0.00 -2.02 0.00 0.00 63.50 60.60 3iud n PRO 420 Cb 0.55 -1.79 0.06 0.00 -0.02 0.00 0.00 33.50 32.29 3iud n PRO 420 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48