#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dul h TRP 7 N 0.00 0.33 -0.48 -1.42 4.06 -2.05 -1.98 115.95 114.40 3dul h TRP 7 Ca 0.00 -0.10 -0.04 0.00 2.06 0.00 0.00 58.89 60.81 3dul h TRP 7 Cb 0.00 -0.07 -0.02 0.00 -1.00 0.00 0.00 29.16 28.07 3dul h TRP 7 CO 0.00 0.70 0.16 1.15 -3.56 0.00 0.00 178.44 176.89 3dul h THR 8 N 0.22 1.22 -0.56 1.49 2.02 -2.02 0.37 112.91 115.65 3dul h THR 8 Ca 0.01 -0.74 -0.00 0.00 0.77 0.00 0.00 66.41 66.44 3dul h THR 8 Cb 0.93 0.80 -0.03 0.00 -1.74 0.00 0.00 68.15 68.11 3dul h THR 8 CO 0.08 0.27 0.34 0.00 0.37 0.00 0.00 175.52 176.57 3dul h ALA 9 N 1.01 0.72 -0.48 6.16 0.00 -1.95 -0.36 119.26 124.36 3dul h ALA 9 Ca 0.16 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 3dul h ALA 9 Cb 0.26 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3dul h ALA 9 CO -0.01 0.21 0.21 0.28 0.00 0.00 0.00 179.25 179.94 3dul h VAL 10 N 0.76 1.20 0.00 0.00 2.07 -1.02 -2.00 116.25 117.26 3dul h VAL 10 Ca 0.20 -0.60 -0.09 0.00 0.82 0.00 0.00 66.70 67.03 3dul h VAL 10 Cb -0.01 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 3dul h VAL 10 CO -0.04 0.23 -0.41 0.44 0.02 0.00 0.00 177.57 177.82 3dul h ASP 11 N 0.63 0.00 0.69 0.57 3.32 -0.55 -1.43 116.42 119.64 3dul h ASP 11 Ca 0.16 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 57.04 3dul h ASP 11 Cb 0.16 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 3dul h ASP 11 CO -0.02 0.41 -0.80 1.56 -1.72 0.00 0.00 179.24 178.67 3dul h GLN 12 N 0.00 0.08 -0.31 3.56 4.20 -0.90 -0.75 115.11 120.99 3dul h GLN 12 Ca -0.00 -0.09 -0.05 0.00 0.06 0.00 0.00 58.65 58.57 3dul h GLN 12 Cb 0.86 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.66 3dul h GLN 12 CO 0.05 0.84 -0.02 -0.92 -0.67 0.00 0.00 178.83 178.12 3dul h TYR 13 N 0.05 0.62 -0.76 2.96 3.20 -1.00 -1.62 116.97 120.42 3dul h TYR 13 Ca -0.02 -0.11 0.02 0.00 3.14 0.00 0.00 58.73 61.76 3dul h TYR 13 Cb 1.41 -0.16 -0.04 0.00 1.54 0.00 0.00 36.73 39.48 3dul h TYR 13 CO 0.01 0.71 0.49 0.28 -1.64 0.00 0.00 178.16 178.01 3dul h VAL 14 N 0.35 1.15 -0.70 1.81 2.07 -1.11 -0.84 116.25 118.98 3dul h VAL 14 Ca 0.09 -0.34 -0.00 0.00 0.82 0.00 0.00 66.70 67.27 3dul h VAL 14 Cb 0.47 0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.29 3dul h VAL 14 CO 0.02 0.18 0.42 -1.28 0.02 0.00 0.00 177.57 176.93 3dul h SER 15 N 0.98 0.83 -0.15 0.57 0.87 -0.89 0.01 113.55 115.77 3dul h SER 15 Ca 0.29 -0.05 -0.11 0.00 -1.23 0.00 0.00 61.79 60.70 3dul h SER 15 Cb -0.04 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 61.69 3dul h SER 15 CO -0.09 0.64 -0.25 0.44 -0.53 0.00 0.00 176.83 177.05 3dul h ASP 16 N 0.96 0.62 0.18 6.23 5.19 -0.20 -1.98 116.42 127.41 3dul h ASP 16 Ca 0.25 -0.22 -0.34 0.00 -0.62 0.00 0.00 57.03 56.10 3dul h ASP 16 Cb -0.03 -0.17 0.01 0.00 0.18 0.00 0.00 39.33 39.32 3dul h ASP 16 CO -0.05 0.85 -1.70 -0.37 -3.12 0.00 0.00 179.24 174.85 3dul h VAL 17 N 0.53 0.95 -0.35 -1.35 -1.51 -0.83 -3.38 116.25 110.31 3dul h VAL 17 Ca 0.07 -2.49 -0.14 0.00 -1.23 0.00 0.00 66.70 62.91 3dul h VAL 17 Cb 0.71 2.76 -0.01 0.00 -2.13 0.00 0.00 31.29 32.62 3dul h VAL 17 CO 0.05 0.84 -0.36 -0.07 -1.23 0.00 0.00 177.57 176.81 3dul h LEU 18 N 0.05 0.86 -8.48 4.19 3.38 -1.08 -3.41 115.31 110.81 3dul h LEU 18 Ca -0.34 -0.37 -0.68 0.00 0.09 0.00 0.00 57.88 56.58 3dul h LEU 18 Cb 2.05 -0.24 -0.24 0.00 0.09 0.00 0.00 40.66 42.32 3dul h LEU 18 CO 0.16 1.13 -0.57 -0.63 0.09 0.00 0.00 178.44 178.62 3dul s ILE 19 N -4.40 4.43 0.25 1.22 1.01 -0.74 -5.07 121.20 117.90 3dul s ILE 19 Ca -0.10 -0.57 -0.31 0.00 0.00 0.00 0.00 60.65 59.67 3dul s ILE 19 Cb 0.12 -3.31 -0.12 0.00 0.01 0.00 0.00 42.46 39.16 3dul s ILE 19 CO 0.86 0.01 1.66 -2.65 0.00 0.00 0.00 174.94 174.82 3dul n PRO 20 N 4.95 2.74 -1.70 2.79 -0.02 -1.26 -4.66 135.00 137.84 3dul n PRO 20 Ca -0.14 0.98 -0.44 0.00 -2.02 0.00 0.00 63.50 61.89 3dul n PRO 20 Cb 0.48 -2.80 -0.04 0.00 -0.02 0.00 0.00 33.50 31.13 3dul n PRO 20 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3dul n LYS 21 N 3.06 2.53 -4.00 -0.52 5.02 -1.26 -4.96 118.16 118.02 3dul n LYS 21 Ca 0.12 0.91 -0.34 0.00 -2.02 0.00 0.00 58.31 56.99 3dul n LYS 21 Cb 0.36 -2.74 -0.15 0.00 -0.02 0.00 0.00 35.03 32.48 3dul n LYS 21 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3dul s ASP 22 N 1.37 4.19 0.29 4.39 2.15 -1.26 -5.00 116.67 122.80 3dul s ASP 22 Ca 0.78 -0.97 0.02 0.00 0.43 0.00 0.00 52.55 52.81 3dul s ASP 22 Cb -0.57 -1.62 0.59 0.00 -0.30 0.00 0.00 42.92 41.03 3dul s ASP 22 CO 0.36 -0.13 1.82 0.77 -0.17 0.00 0.00 175.17 177.82 3dul h SER 23 N 7.95 0.88 0.61 -0.34 4.64 -1.98 0.29 113.55 125.60 3dul h SER 23 Ca -0.31 0.06 -0.03 0.00 -0.47 0.00 0.00 61.79 61.04 3dul h SER 23 Cb 1.10 -0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 63.07 3dul h SER 23 CO 0.56 0.43 -0.34 0.74 -0.87 0.00 0.00 176.83 177.35 3dul h THR 24 N 0.93 0.30 0.00 2.95 2.02 -1.94 -0.84 112.91 116.32 3dul h THR 24 Ca 0.52 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.67 3dul h THR 24 Cb 0.59 0.30 -0.00 0.00 -1.74 0.00 0.00 68.15 67.30 3dul h THR 24 CO -0.30 0.00 -0.14 -0.07 0.37 0.00 0.00 175.52 175.39 3dul h LEU 25 N -0.89 0.00 0.47 2.58 3.38 -1.87 -1.39 115.31 117.59 3dul h LEU 25 Ca -0.08 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 3dul h LEU 25 Cb 0.71 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.46 3dul h LEU 25 CO 0.10 0.14 -0.22 -0.08 0.09 0.00 0.00 178.44 178.46 3dul h GLU 26 N 0.00 -0.60 0.00 1.13 4.81 0.26 -2.31 114.58 117.87 3dul h GLU 26 Ca -0.00 0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 59.16 3dul h GLU 26 Cb 0.37 0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.87 3dul h GLU 26 CO 0.02 -0.38 -0.54 1.05 -0.73 0.00 0.00 179.01 178.42 3dul h GLU 27 N -0.66 0.00 -0.94 1.92 4.11 -0.84 -2.43 114.58 115.74 3dul h GLU 27 Ca -0.06 0.00 0.06 0.00 0.07 0.00 0.00 59.36 59.43 3dul h GLU 27 Cb 0.50 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.68 3dul h GLU 27 CO 0.10 0.54 0.60 0.28 0.07 0.00 0.00 179.01 180.61 3dul h VAL 28 N 0.00 1.08 -0.16 -1.06 2.07 -1.12 0.23 116.25 117.29 3dul h VAL 28 Ca -0.01 -0.38 -0.14 0.00 0.82 0.00 0.00 66.70 66.99 3dul h VAL 28 Cb 0.98 -0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 3dul h VAL 28 CO 0.07 0.20 -0.51 -0.07 0.02 0.00 0.00 177.57 177.28 3dul h LEU 29 N 1.10 0.49 -0.75 2.57 3.38 -1.13 -0.88 115.31 120.09 3dul h LEU 29 Ca 0.41 -0.25 -0.07 0.00 0.09 0.00 0.00 57.88 58.06 3dul h LEU 29 Cb 0.15 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 3dul h LEU 29 CO -0.17 0.91 0.16 1.56 0.09 0.00 0.00 178.44 180.99 3dul h GLN 30 N 0.35 1.11 -0.21 1.13 4.20 -0.65 -0.55 115.11 120.49 3dul h GLN 30 Ca 0.01 -0.27 -0.04 0.00 0.06 0.00 0.00 58.65 58.41 3dul h GLN 30 Cb 1.02 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.65 3dul h GLN 30 CO 0.09 0.98 -0.03 0.28 -0.67 0.00 0.00 178.83 179.49 3dul h VAL 31 N 1.05 1.27 0.00 -0.54 2.07 -0.42 -2.65 116.25 117.04 3dul h VAL 31 Ca 0.22 -0.96 -0.01 0.00 0.82 0.00 0.00 66.70 66.76 3dul h VAL 31 Cb 0.38 1.48 -0.00 0.00 -1.52 0.00 0.00 31.29 31.62 3dul h VAL 31 CO 0.00 0.30 -0.07 0.78 0.02 0.00 0.00 177.57 178.60 3dul h ASN 32 N 0.14 0.00 -0.02 0.57 2.35 -0.91 -1.16 115.58 116.56 3dul h ASN 32 Ca 0.06 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.81 3dul h ASN 32 Cb 0.45 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.82 3dul h ASN 32 CO 0.02 0.07 0.12 0.00 -1.65 0.00 0.00 177.43 175.98 3dul h ALA 33 N 1.93 1.20 -0.10 -0.83 0.00 -0.72 0.20 119.26 120.94 3dul h ALA 33 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3dul h ALA 33 Cb 0.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3dul h ALA 33 CO 0.01 -0.13 0.00 0.00 0.00 0.00 0.00 179.25 179.13 3dul n ALA 34 N -2.06 2.33 1.35 0.00 0.00 -0.46 -4.60 120.51 117.07 3dul n ALA 34 Ca -0.02 -0.79 0.14 0.00 0.00 0.00 0.00 53.44 52.77 3dul n ALA 34 Cb 0.19 -0.26 0.59 0.00 0.00 0.00 0.00 19.45 19.97 3dul n ALA 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dul n ALA 35 N 0.29 2.77 -3.81 0.00 0.00 0.06 -4.95 120.51 114.86 3dul n ALA 35 Ca 0.06 -0.25 -0.25 0.00 0.00 0.00 0.00 53.44 52.99 3dul n ALA 35 Cb 0.26 -1.34 0.01 0.00 0.00 0.00 0.00 19.45 18.38 3dul n ALA 35 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3dul n ASN 36 N -1.05 -1.59 -4.84 0.00 4.13 -1.25 -4.88 115.26 105.78 3dul n ASN 36 Ca 0.13 -0.95 -0.32 0.00 1.68 0.00 0.00 54.58 55.12 3dul n ASN 36 Cb 0.28 -3.45 -0.02 0.00 -1.54 0.00 0.00 39.78 35.05 3dul n ASN 36 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 3dul s LEU 37 N -6.76 3.56 0.65 3.41 1.43 -1.26 -5.01 118.68 114.69 3dul s LEU 37 Ca 0.10 1.58 -0.18 0.00 -1.03 0.00 0.00 54.13 54.60 3dul s LEU 37 Cb -0.03 -4.51 -0.01 0.00 0.03 0.00 0.00 46.19 41.67 3dul s LEU 37 CO 0.86 -0.69 1.21 -2.65 0.23 0.00 0.00 176.35 175.30 3dul n PRO 38 N -1.79 1.00 -1.66 1.29 -0.02 -1.26 -4.83 135.00 127.73 3dul n PRO 38 Ca 0.07 0.40 -0.52 0.00 -2.02 0.00 0.00 63.50 61.42 3dul n PRO 38 Cb 0.54 -2.44 -0.06 0.00 -0.02 0.00 0.00 33.50 31.52 3dul n PRO 38 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3dul n ALA 39 N -1.96 0.09 -3.45 3.55 0.00 -1.26 -4.95 120.51 112.52 3dul n ALA 39 Ca 0.15 0.41 -0.10 0.00 0.00 0.00 0.00 53.44 53.90 3dul n ALA 39 Cb 0.48 -2.27 -0.03 0.00 0.00 0.00 0.00 19.45 17.64 3dul n ALA 39 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 3dul s HIS 40 N 2.38 -0.30 0.22 0.00 -3.43 -1.26 -5.16 115.29 107.75 3dul s HIS 40 Ca 0.90 -0.02 0.05 0.00 -0.80 0.00 0.00 55.06 55.19 3dul s HIS 40 Cb -0.89 0.52 -0.03 0.00 -1.43 0.00 0.00 32.58 30.75 3dul s HIS 40 CO 0.53 -0.95 0.30 0.34 -2.00 0.00 0.00 174.74 172.96 3dul s ASP 41 N -2.83 6.12 -0.18 7.38 2.15 -1.26 -4.97 116.67 123.08 3dul s ASP 41 Ca 0.06 0.01 0.00 0.00 0.43 0.00 0.00 52.55 53.05 3dul s ASP 41 Cb -0.02 -1.75 0.01 0.00 -0.30 0.00 0.00 42.92 40.86 3dul s ASP 41 CO -0.05 -0.04 -0.17 -0.69 -0.17 0.00 0.00 175.17 174.06 3dul s VAL 42 N -1.96 2.39 -0.32 1.11 1.01 -1.26 -4.95 120.40 116.42 3dul s VAL 42 Ca 0.34 -0.84 -0.00 0.00 0.00 0.00 0.00 61.98 61.47 3dul s VAL 42 Cb -0.09 -2.02 0.10 0.00 0.00 0.00 0.00 36.38 34.38 3dul s VAL 42 CO 0.28 0.52 0.11 -0.55 0.00 0.00 0.00 175.10 175.45 3dul s SER 43 N 1.19 4.03 0.33 3.32 0.15 -1.26 -0.47 113.70 120.99 3dul s SER 43 Ca 0.02 -1.74 0.01 0.00 0.70 0.00 0.00 55.95 54.94 3dul s SER 43 Cb -0.14 -0.91 0.56 0.00 -1.71 0.00 0.00 66.02 63.83 3dul s SER 43 CO -0.08 -0.40 1.99 -0.65 1.20 0.00 0.00 173.24 175.30 3dul h PRO 44 N 7.96 0.92 -0.33 5.44 0.11 -1.97 -0.39 132.00 143.74 3dul h PRO 44 Ca -0.12 -0.06 -0.07 0.00 0.11 0.00 0.00 66.00 65.86 3dul h PRO 44 Cb 1.01 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.90 3dul h PRO 44 CO 0.47 0.62 -0.07 1.79 -0.21 0.00 0.00 178.00 180.60 3dul h THR 45 N 0.95 1.22 -0.12 -1.15 1.35 -1.91 0.80 112.91 114.05 3dul h THR 45 Ca 0.25 -0.96 -0.21 0.00 -0.55 0.00 0.00 66.41 64.94 3dul h THR 45 Cb -0.10 1.05 0.01 0.00 -1.73 0.00 0.00 68.15 67.38 3dul h THR 45 CO -0.05 0.32 -0.78 -0.61 -0.25 0.00 0.00 175.52 174.15 3dul h GLN 46 N 0.52 0.65 -0.49 4.72 4.15 -1.61 -1.35 115.11 121.71 3dul h GLN 46 Ca 0.10 -0.54 0.00 0.00 0.77 0.00 0.00 58.65 58.98 3dul h GLN 46 Cb 0.45 0.12 -0.02 0.00 0.21 0.00 0.00 27.48 28.23 3dul h GLN 46 CO 0.02 1.16 0.31 0.78 -1.93 0.00 0.00 178.83 179.17 3dul h GLY 47 N 0.82 0.69 0.99 2.39 0.00 -0.66 0.24 103.07 107.54 3dul h GLY 47 Ca -0.05 -0.27 -0.00 0.00 0.00 0.00 0.00 47.33 47.01 3dul h GLY 47 CO 0.15 0.26 0.31 0.50 0.00 0.00 0.00 176.54 177.76 3dul h LYS 48 N 0.66 0.67 -0.58 4.80 1.79 -0.80 -0.72 116.57 122.38 3dul h LYS 48 Ca 0.18 -0.06 0.08 0.00 -2.18 0.00 0.00 60.65 58.67 3dul h LYS 48 Cb -0.05 -0.14 -0.06 0.00 -1.58 0.00 0.00 32.23 30.40 3dul h LYS 48 CO -0.04 0.48 0.25 0.35 -1.08 0.00 0.00 179.45 179.41 3dul h PHE 49 N 0.67 0.44 -0.16 -1.35 3.57 -0.67 0.11 116.94 119.55 3dul h PHE 49 Ca 0.18 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.70 3dul h PHE 49 Cb -0.03 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.59 3dul h PHE 49 CO -0.03 0.15 0.07 -0.07 -2.23 0.00 0.00 178.31 176.20 3dul h LEU 50 N 0.46 0.22 0.06 0.59 3.38 -0.32 0.03 115.31 119.73 3dul h LEU 50 Ca 0.28 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 3dul h LEU 50 Cb 0.29 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 3dul h LEU 50 CO -0.25 0.30 -0.04 -0.61 0.09 0.00 0.00 178.44 177.93 3dul h GLN 51 N 0.12 -0.09 -0.42 1.13 4.15 -0.51 -1.03 115.11 118.46 3dul h GLN 51 Ca 0.05 0.01 0.03 0.00 0.77 0.00 0.00 58.65 59.51 3dul h GLN 51 Cb 0.15 0.02 -0.03 0.00 0.21 0.00 0.00 27.48 27.83 3dul h GLN 51 CO -0.01 -0.06 0.22 -0.07 -1.93 0.00 0.00 178.83 176.98 3dul h LEU 52 N -0.10 0.33 -0.99 -2.39 3.38 -0.74 -0.87 115.31 113.93 3dul h LEU 52 Ca -0.00 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 3dul h LEU 52 Cb 0.08 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 3dul h LEU 52 CO 0.00 0.24 0.26 0.25 0.09 0.00 0.00 178.44 179.28 3dul h LEU 53 N 0.44 0.90 -0.81 1.67 5.85 -0.83 0.33 115.31 122.86 3dul h LEU 53 Ca 0.17 -0.13 -0.04 0.00 0.84 0.00 0.00 57.88 58.73 3dul h LEU 53 Cb 0.06 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 40.82 3dul h LEU 53 CO -0.11 0.81 0.36 0.58 -0.34 0.00 0.00 178.44 179.75 3dul h VAL 54 N 0.96 1.26 -0.34 1.05 2.07 -0.67 -0.58 116.25 120.00 3dul h VAL 54 Ca 0.22 -0.76 -0.11 0.00 0.82 0.00 0.00 66.70 66.87 3dul h VAL 54 Cb 0.20 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.21 3dul h VAL 54 CO -0.02 0.32 -0.21 1.56 0.02 0.00 0.00 177.57 179.24 3dul h GLN 55 N 1.16 0.74 -0.26 1.57 4.20 -0.07 0.23 115.11 122.69 3dul h GLN 55 Ca 0.28 -0.34 -0.01 0.00 0.06 0.00 0.00 58.65 58.63 3dul h GLN 55 Cb 0.16 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.92 3dul h GLN 55 CO -0.03 0.96 0.13 0.82 -0.67 0.00 0.00 178.83 180.04 3dul h ILE 56 N 0.52 1.14 0.00 2.54 2.04 -0.13 -2.43 117.51 121.19 3dul h ILE 56 Ca 0.07 -0.38 -0.10 0.00 1.00 0.00 0.00 64.86 65.45 3dul h ILE 56 Cb 0.76 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.73 3dul h ILE 56 CO 0.06 0.14 -0.48 -0.61 0.00 0.00 0.00 178.15 177.25 3dul h GLN 57 N 0.30 0.00 -0.73 2.37 4.15 -1.06 -3.47 115.11 116.67 3dul h GLN 57 Ca 0.09 0.00 -0.04 0.00 0.77 0.00 0.00 58.65 59.48 3dul h GLN 57 Cb 0.10 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.79 3dul h GLN 57 CO -0.01 0.48 -0.05 0.41 -1.93 0.00 0.00 178.83 177.73 3dul n GLY 58 N 0.06 0.51 3.76 2.39 0.00 0.74 -4.99 105.19 107.65 3dul n GLY 58 Ca -0.01 -0.73 -0.41 0.00 0.00 0.00 0.00 46.02 44.88 3dul n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dul n ALA 59 N -1.75 2.03 0.00 4.61 0.00 -0.65 -4.93 120.51 119.81 3dul n ALA 59 Ca -0.01 0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.71 3dul n ALA 59 Cb 0.51 -2.38 0.00 0.00 0.00 0.00 0.00 19.45 17.58 3dul n ALA 59 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3dul n ARG 60 N 0.07 1.85 -3.80 0.00 3.00 -1.26 -4.66 116.66 111.87 3dul n ARG 60 Ca 0.04 0.00 -0.30 0.00 -0.00 0.00 0.00 57.85 57.59 3dul n ARG 60 Cb 0.40 -0.85 -0.15 0.00 0.00 0.00 0.00 32.46 31.86 3dul n ARG 60 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.63 178.84 3dul s ASN 61 N -1.47 4.11 -0.02 6.15 2.47 -1.26 -0.60 114.94 124.31 3dul s ASN 61 Ca 0.00 -1.67 0.02 0.00 0.42 0.00 0.00 52.86 51.62 3dul s ASN 61 Cb 0.00 -1.01 -0.03 0.00 -1.45 0.00 0.00 41.25 38.76 3dul s ASN 61 CO 0.00 -0.39 -0.04 -0.63 -3.72 0.00 0.00 177.10 172.32 3dul s ILE 62 N 1.49 3.91 -0.09 -5.21 1.01 0.25 -0.63 121.20 121.92 3dul s ILE 62 Ca 0.09 -0.59 0.04 0.00 0.00 0.00 0.00 60.65 60.18 3dul s ILE 62 Cb -0.18 -2.69 0.00 0.00 0.01 0.00 0.00 42.46 39.61 3dul s ILE 62 CO -0.20 0.46 -0.22 -0.22 0.00 0.00 0.00 174.94 174.75 3dul s LEU 63 N -1.27 2.02 -0.07 2.97 2.96 -0.48 -0.37 118.68 124.43 3dul s LEU 63 Ca 0.16 -0.51 0.04 0.00 -0.22 0.00 0.00 54.13 53.60 3dul s LEU 63 Cb -0.11 -1.31 0.00 0.00 0.50 0.00 0.00 46.19 45.27 3dul s LEU 63 CO 0.06 0.15 -0.20 -0.70 -1.32 0.00 0.00 176.35 174.34 3dul s GLU 64 N 0.34 2.37 -0.34 1.98 2.12 0.28 -0.92 118.70 124.52 3dul s GLU 64 Ca -0.17 -0.72 -0.04 0.00 0.36 0.00 0.00 54.97 54.41 3dul s GLU 64 Cb -0.17 -1.90 0.06 0.00 0.26 0.00 0.00 34.13 32.38 3dul s GLU 64 CO 0.08 0.20 0.08 0.42 -0.54 0.00 0.00 175.26 175.49 3dul s ILE 65 N 0.25 3.31 0.00 -3.70 1.01 -0.02 -0.86 121.20 121.18 3dul s ILE 65 Ca -0.12 -1.45 0.00 0.00 0.00 0.00 0.00 60.65 59.09 3dul s ILE 65 Cb -0.15 -2.97 0.00 0.00 0.01 0.00 0.00 42.46 39.35 3dul s ILE 65 CO 0.05 -0.25 0.00 0.61 0.00 0.00 0.00 174.94 175.35 3dul n GLY 66 N 4.68 0.64 0.28 6.18 0.00 -0.35 -0.87 105.19 115.74 3dul n GLY 66 Ca -0.11 -0.81 0.02 0.00 0.00 0.00 0.00 46.02 45.12 3dul n GLY 66 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3dul h THR 67 N 0.00 0.86 0.00 2.61 2.02 -1.44 -3.44 112.91 113.52 3dul h THR 67 Ca 0.00 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 66.96 3dul h THR 67 Cb 0.00 0.16 0.00 0.00 -1.74 0.00 0.00 68.15 66.57 3dul h THR 67 CO 0.00 0.12 0.00 0.18 0.37 0.00 0.00 175.52 176.19 3dul n LEU 68 N -4.84 0.00 -0.47 2.58 4.77 -1.26 -1.15 117.00 116.63 3dul n LEU 68 Ca 0.12 0.00 0.14 0.00 -0.03 0.00 0.00 56.01 56.24 3dul n LEU 68 Cb 0.28 0.00 0.50 0.00 -2.33 0.00 0.00 43.42 41.87 3dul n LEU 68 CO 0.25 0.00 0.84 0.61 -1.33 0.00 0.00 177.39 177.76 3dul n GLY 69 N 0.00 -0.04 1.31 -0.72 0.00 -1.26 -4.46 105.19 100.02 3dul n GLY 69 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.57 3dul n GLY 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dul n GLY 70 N 1.20 0.75 0.35 -0.02 0.00 -0.30 -4.28 105.19 102.89 3dul n GLY 70 Ca 0.18 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.05 3dul n GLY 70 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3dul h TYR 71 N 0.00 -0.85 0.00 1.61 3.20 -1.92 -0.89 116.97 118.11 3dul h TYR 71 Ca 0.00 0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.80 3dul h TYR 71 Cb 0.00 0.33 -0.01 0.00 1.54 0.00 0.00 36.73 38.59 3dul h TYR 71 CO 0.00 -0.46 -0.37 0.77 -1.64 0.00 0.00 178.16 176.46 3dul h SER 72 N -0.68 0.00 -0.91 -2.11 0.02 -1.93 -2.55 113.55 105.39 3dul h SER 72 Ca -0.02 0.00 0.01 0.00 -0.84 0.00 0.00 61.79 60.93 3dul h SER 72 Cb 0.61 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.10 3dul h SER 72 CO -0.05 0.37 0.59 0.74 -1.14 0.00 0.00 176.83 177.35 3dul h THR 73 N 0.00 1.24 0.11 -2.27 2.02 -1.75 -1.31 112.91 110.95 3dul h THR 73 Ca -0.00 -0.45 -0.01 0.00 0.77 0.00 0.00 66.41 66.73 3dul h THR 73 Cb 0.67 -0.09 0.00 0.00 -1.74 0.00 0.00 68.15 66.99 3dul h THR 73 CO 0.05 0.23 -0.05 0.40 0.37 0.00 0.00 175.52 176.52 3dul h ILE 74 N 1.23 0.93 -0.72 3.11 1.08 -0.76 -0.13 117.51 122.26 3dul h ILE 74 Ca 0.33 -0.12 0.05 0.00 -0.39 0.00 0.00 64.86 64.73 3dul h ILE 74 Cb -0.13 1.01 -0.05 0.00 -3.07 0.00 0.00 36.82 34.58 3dul h ILE 74 CO -0.07 0.03 0.42 -0.50 -0.69 0.00 0.00 178.15 177.34 3dul h TRP 75 N -0.20 0.78 0.01 1.37 4.06 -1.34 -0.56 115.95 120.07 3dul h TRP 75 Ca -0.01 0.03 -0.00 0.00 2.06 0.00 0.00 58.89 60.96 3dul h TRP 75 Cb 0.16 -0.24 0.00 0.00 -1.00 0.00 0.00 29.16 28.07 3dul h TRP 75 CO -0.05 0.39 -0.00 -0.07 -3.56 0.00 0.00 178.44 175.14 3dul h LEU 76 N 0.78 -0.01 -1.79 -4.49 3.38 -1.02 -3.00 115.31 109.16 3dul h LEU 76 Ca 0.31 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 3dul h LEU 76 Cb 0.15 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 3dul h LEU 76 CO -0.17 0.19 -0.06 0.00 0.09 0.00 0.00 178.44 178.49 3dul h ALA 77 N 0.79 1.83 0.00 1.53 0.00 -0.72 0.12 119.26 122.80 3dul h ALA 77 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3dul h ALA 77 Cb 0.20 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3dul h ALA 77 CO 0.00 0.13 0.00 0.00 0.00 0.00 0.00 179.25 179.38 3dul h ARG 78 N 0.05 0.00 0.00 0.00 3.08 -0.97 -2.50 114.38 114.04 3dul h ARG 78 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.06 3dul h ARG 78 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.20 3dul h ARG 78 CO 0.01 0.00 -0.46 0.41 -1.07 0.00 0.00 179.97 178.86 3dul n GLY 79 N -0.35 -1.44 3.70 0.04 0.00 0.03 -4.90 105.19 102.26 3dul n GLY 79 Ca -0.00 -0.22 -0.29 0.00 0.00 0.00 0.00 46.02 45.51 3dul n GLY 79 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dul s LEU 80 N -4.00 1.77 0.00 0.99 1.43 -0.94 -4.17 118.68 113.75 3dul s LEU 80 Ca 0.08 1.18 0.00 0.00 -1.03 0.00 0.00 54.13 54.36 3dul s LEU 80 Cb 0.14 -3.43 0.00 0.00 0.03 0.00 0.00 46.19 42.94 3dul s LEU 80 CO 0.68 -2.95 0.00 -1.54 0.23 0.00 0.00 176.35 172.78 3dul n SER 81 N -4.05 0.00 0.00 2.29 3.41 -1.26 -5.03 113.62 108.97 3dul n SER 81 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.67 3dul n SER 81 Cb 0.57 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.52 3dul n SER 81 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3dul n SER 82 N -0.01 0.00 -2.99 4.04 3.41 -1.26 -4.63 113.62 112.18 3dul n SER 82 Ca 0.00 0.00 -0.39 0.00 -0.26 0.00 0.00 58.87 58.22 3dul n SER 82 Cb 0.00 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 63.98 3dul n SER 82 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3dul n GLY 83 N 0.00 5.64 3.81 5.00 0.00 -1.26 -5.01 105.19 113.38 3dul n GLY 83 Ca 0.00 -2.52 -0.29 0.00 0.00 0.00 0.00 46.02 43.21 3dul n GLY 83 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dul s GLY 84 N -1.33 1.59 0.03 -0.02 0.00 -1.26 -5.03 107.32 101.30 3dul s GLY 84 Ca 0.50 -0.59 -0.11 0.00 0.00 0.00 0.00 44.72 44.51 3dul s GLY 84 CO -0.36 -0.03 0.24 1.09 0.00 0.00 0.00 173.10 174.03 3dul s ARG 85 N -5.38 0.71 -0.09 2.90 1.70 0.23 -4.82 118.95 114.19 3dul s ARG 85 Ca 0.64 -0.51 0.02 0.00 -0.47 0.00 0.00 55.73 55.41 3dul s ARG 85 Cb -0.13 0.30 0.01 0.00 -0.57 0.00 0.00 34.95 34.56 3dul s ARG 85 CO 0.52 -0.21 -0.16 0.08 -1.08 0.00 0.00 175.30 174.46 3dul s VAL 86 N -2.29 1.46 -0.21 4.99 1.01 -0.47 -0.59 120.40 124.31 3dul s VAL 86 Ca -0.07 -0.64 -0.04 0.00 0.00 0.00 0.00 61.98 61.23 3dul s VAL 86 Cb -0.02 -1.32 -0.01 0.00 0.00 0.00 0.00 36.38 35.03 3dul s VAL 86 CO -0.02 0.43 -0.05 -0.69 0.00 0.00 0.00 175.10 174.77 3dul s VAL 87 N 0.78 3.40 -0.03 2.92 1.01 0.50 -1.15 120.40 127.82 3dul s VAL 87 Ca -0.11 -0.49 0.06 0.00 0.00 0.00 0.00 61.98 61.43 3dul s VAL 87 Cb -0.16 -2.53 -0.01 0.00 0.00 0.00 0.00 36.38 33.68 3dul s VAL 87 CO 0.02 0.43 -0.20 0.28 0.00 0.00 0.00 175.10 175.63 3dul s THR 88 N 1.32 1.63 -0.11 3.92 -1.32 -0.10 -0.56 115.64 120.41 3dul s THR 88 Ca 0.04 -0.86 -0.02 0.00 -1.21 0.00 0.00 61.69 59.64 3dul s THR 88 Cb -0.14 -1.36 -0.03 0.00 -1.51 0.00 0.00 72.50 69.45 3dul s THR 88 CO -0.02 0.46 -0.02 -0.76 -2.21 0.00 0.00 174.62 172.07 3dul s LEU 89 N -0.31 3.40 -0.14 9.08 1.43 -0.04 -0.73 118.68 131.37 3dul s LEU 89 Ca 0.03 0.02 -0.07 0.00 -1.03 0.00 0.00 54.13 53.08 3dul s LEU 89 Cb -0.10 -1.79 0.05 0.00 0.03 0.00 0.00 46.19 44.39 3dul s LEU 89 CO 0.01 0.30 0.32 -0.70 0.23 0.00 0.00 176.35 176.51 3dul s GLU 90 N -0.39 0.30 -0.06 1.70 2.12 -0.87 -1.21 118.70 120.30 3dul s GLU 90 Ca 0.07 0.64 -0.26 0.00 0.36 0.00 0.00 54.97 55.78 3dul s GLU 90 Cb -0.12 -0.06 -0.21 0.00 0.26 0.00 0.00 34.13 34.00 3dul s GLU 90 CO 0.02 -0.15 1.08 0.00 -0.54 0.00 0.00 175.26 175.67 3dul h ALA 91 N 7.07 -0.03 -2.33 6.30 0.00 -1.85 -1.72 119.26 126.71 3dul h ALA 91 Ca -0.38 -0.31 -0.53 0.00 0.00 0.00 0.00 54.91 53.69 3dul h ALA 91 Cb 1.17 0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.99 3dul h ALA 91 CO 0.33 -0.20 1.25 0.45 0.00 0.00 0.00 179.25 181.09 3dul s SER 92 N -5.80 6.39 0.13 0.00 0.15 -1.26 -3.46 113.70 109.85 3dul s SER 92 Ca -0.16 2.62 -0.18 0.00 0.70 0.00 0.00 55.95 58.93 3dul s SER 92 Cb 0.00 -2.53 -0.03 0.00 -1.71 0.00 0.00 66.02 61.75 3dul s SER 92 CO 0.65 -1.11 1.75 -0.33 1.20 0.00 0.00 173.24 175.40 3dul h GLU 93 N 10.86 0.41 0.50 5.44 5.08 -1.99 -1.21 114.58 133.67 3dul h GLU 93 Ca -0.49 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 57.82 3dul h GLU 93 Cb 1.24 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.39 3dul h GLU 93 CO 0.94 0.32 -0.37 -0.22 -1.00 0.00 0.00 179.01 178.68 3dul h LYS 94 N 0.38 -0.83 -0.28 2.33 3.64 -1.99 -1.24 116.57 118.58 3dul h LYS 94 Ca 0.11 0.06 -0.00 0.00 -1.27 0.00 0.00 60.65 59.54 3dul h LYS 94 Cb 0.02 0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 3dul h LYS 94 CO -0.02 -0.55 0.17 0.45 -2.27 0.00 0.00 179.45 177.23 3dul h HIS 95 N -0.86 0.36 -0.02 1.91 3.86 -1.88 -1.43 115.15 117.08 3dul h HIS 95 Ca -0.05 0.01 -0.14 0.00 -1.16 0.00 0.00 60.37 59.02 3dul h HIS 95 Cb 0.73 -0.12 -0.02 0.00 1.06 0.00 0.00 27.41 29.06 3dul h HIS 95 CO -0.15 0.24 -0.64 0.00 0.86 0.00 0.00 177.93 178.24 3dul h ALA 96 N 1.81 0.88 -0.39 2.45 0.00 -1.00 -1.44 119.26 121.56 3dul h ALA 96 Ca 0.10 -0.58 -0.14 0.00 0.00 0.00 0.00 54.91 54.30 3dul h ALA 96 Cb -0.02 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3dul h ALA 96 CO -0.02 0.78 -0.31 -0.44 0.00 0.00 0.00 179.25 179.26 3dul h ASP 97 N 0.07 0.90 -0.03 0.00 3.32 -0.17 -0.64 116.42 119.88 3dul h ASP 97 Ca -0.01 -0.38 -0.14 0.00 0.02 0.00 0.00 57.03 56.52 3dul h ASP 97 Cb 1.15 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.44 3dul h ASP 97 CO 0.09 1.14 -0.44 0.40 -1.72 0.00 0.00 179.24 178.71 3dul h ILE 98 N 0.73 1.31 -0.23 0.35 2.04 -1.34 -2.71 117.51 117.66 3dul h ILE 98 Ca 0.08 -1.63 -0.03 0.00 1.00 0.00 0.00 64.86 64.27 3dul h ILE 98 Cb 0.87 1.61 -0.01 0.00 -0.74 0.00 0.00 36.82 38.55 3dul h ILE 98 CO 0.08 0.51 0.02 0.00 0.00 0.00 0.00 178.15 178.77 3dul h ALA 99 N 1.06 0.31 0.00 1.87 0.00 -0.97 -0.99 119.26 120.53 3dul h ALA 99 Ca 0.03 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 3dul h ALA 99 Cb 0.96 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.66 3dul h ALA 99 CO 0.09 0.00 -0.10 0.07 0.00 0.00 0.00 179.25 179.31 3dul h ARG 100 N 0.18 0.00 -0.05 0.00 0.11 -1.08 0.58 114.38 114.12 3dul h ARG 100 Ca 0.07 0.00 -0.20 0.00 0.10 0.00 0.00 59.98 59.94 3dul h ARG 100 Cb 0.35 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.45 3dul h ARG 100 CO 0.01 0.10 -0.76 1.03 0.10 0.00 0.00 179.97 180.44 3dul h SER 101 N 0.00 0.76 -0.55 0.08 0.87 -1.12 -1.67 113.55 111.92 3dul h SER 101 Ca -0.00 -0.70 -0.10 0.00 -1.23 0.00 0.00 61.79 59.76 3dul h SER 101 Cb 0.26 -0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 61.97 3dul h SER 101 CO 0.01 1.35 -0.06 0.78 -0.53 0.00 0.00 176.83 178.39 3dul h ASN 102 N 0.24 1.00 -0.75 6.23 2.35 -0.37 -1.51 115.58 122.78 3dul h ASN 102 Ca -0.08 -0.33 -0.04 0.00 -0.55 0.00 0.00 56.30 55.30 3dul h ASN 102 Cb 1.42 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 39.49 3dul h ASN 102 CO 0.15 1.10 0.33 0.40 -1.65 0.00 0.00 177.43 177.76 3dul h ILE 103 N 0.89 1.25 -0.47 2.81 2.04 -0.95 -2.75 117.51 120.33 3dul h ILE 103 Ca 0.15 -0.75 -0.04 0.00 1.00 0.00 0.00 64.86 65.22 3dul h ILE 103 Cb 0.62 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 3dul h ILE 103 CO 0.04 0.31 0.15 -0.08 0.00 0.00 0.00 178.15 178.57 3dul h GLU 104 N 1.10 0.73 0.00 2.37 4.81 -0.91 -2.00 114.58 120.68 3dul h GLU 104 Ca 0.26 -0.16 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 3dul h GLU 104 Cb 0.17 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.44 3dul h GLU 104 CO -0.03 0.69 0.00 2.89 -0.73 0.00 0.00 179.01 181.84 3dul n ARG 105 N -4.53 0.05 -0.21 1.92 1.85 -0.60 -0.57 116.66 114.55 3dul n ARG 105 Ca 0.01 0.31 0.11 0.00 -1.00 0.00 0.00 57.85 57.28 3dul n ARG 105 Cb 0.19 -1.59 0.25 0.00 -1.05 0.00 0.00 32.46 30.26 3dul n ARG 105 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3dul n ALA 106 N -1.57 2.42 -3.78 2.89 0.00 -0.79 -4.95 120.51 114.74 3dul n ALA 106 Ca 0.03 -0.99 -0.29 0.00 0.00 0.00 0.00 53.44 52.19 3dul n ALA 106 Cb 0.17 -0.92 0.02 0.00 0.00 0.00 0.00 19.45 18.73 3dul n ALA 106 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3dul n ASN 107 N 1.36 -4.69 -0.11 0.00 4.13 0.26 -4.86 115.26 111.35 3dul n ASN 107 Ca 0.20 -0.69 0.05 0.00 1.68 0.00 0.00 54.58 55.81 3dul n ASN 107 Cb 0.57 -3.77 0.08 0.00 -1.54 0.00 0.00 39.78 35.12 3dul n ASN 107 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 3dul n LEU 108 N -4.48 2.28 0.26 3.41 4.77 -0.95 -4.66 117.00 117.64 3dul n LEU 108 Ca 0.03 -2.48 0.14 0.00 -0.03 0.00 0.00 56.01 53.66 3dul n LEU 108 Cb 0.53 -0.21 0.70 0.00 -2.33 0.00 0.00 43.42 42.11 3dul n LEU 108 CO 0.70 0.61 0.95 -0.55 -1.33 0.00 0.00 177.39 177.77 3dul h ASN 109 N 0.20 0.00 0.09 -1.43 7.08 -1.86 -1.89 115.58 117.78 3dul h ASN 109 Ca 0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 3dul h ASN 109 Cb 0.76 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.00 3dul h ASN 109 CO 0.01 0.11 0.00 -0.90 -2.08 0.00 0.00 177.43 174.57 3dul n ASP 110 N -3.39 0.00 0.00 6.14 5.75 -1.26 -3.33 116.55 120.46 3dul n ASP 110 Ca -0.01 -0.86 0.00 0.00 -0.01 0.00 0.00 54.79 53.91 3dul n ASP 110 Cb 0.29 -0.05 0.00 0.00 -1.03 0.00 0.00 41.12 40.33 3dul n ASP 110 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3dul n ARG 111 N -1.05 0.66 -4.96 0.11 1.74 -0.75 -5.06 116.66 107.35 3dul n ARG 111 Ca 0.22 -0.27 -0.26 0.00 -0.77 0.00 0.00 57.85 56.77 3dul n ARG 111 Cb 0.13 -0.73 -0.15 0.00 -1.02 0.00 0.00 32.46 30.69 3dul n ARG 111 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3dul s VAL 112 N -0.17 1.57 -0.17 1.55 1.01 -0.98 -1.37 120.40 121.84 3dul s VAL 112 Ca 0.00 -0.86 0.01 0.00 0.00 0.00 0.00 61.98 61.13 3dul s VAL 112 Cb 0.00 -1.30 0.03 0.00 0.00 0.00 0.00 36.38 35.10 3dul s VAL 112 CO 0.00 0.44 -0.16 -0.70 0.00 0.00 0.00 175.10 174.68 3dul s GLU 113 N -0.48 2.52 -0.35 2.72 2.12 -0.30 -4.84 118.70 120.09 3dul s GLU 113 Ca 0.08 -0.72 -0.13 0.00 0.36 0.00 0.00 54.97 54.56 3dul s GLU 113 Cb -0.08 -2.34 -0.01 0.00 0.26 0.00 0.00 34.13 31.96 3dul s GLU 113 CO -0.01 -0.26 0.25 0.08 -0.54 0.00 0.00 175.26 174.78 3dul s VAL 114 N 1.39 5.25 -0.25 3.70 1.01 -1.26 -0.93 120.40 129.31 3dul s VAL 114 Ca 0.04 -0.31 -0.13 0.00 0.00 0.00 0.00 61.98 61.59 3dul s VAL 114 Cb -0.14 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.46 3dul s VAL 114 CO -0.11 -0.06 0.26 -0.13 0.00 0.00 0.00 175.10 175.06 3dul s ARG 115 N 1.71 4.04 -0.00 2.72 1.81 0.09 -4.98 118.95 124.34 3dul s ARG 115 Ca 0.06 -0.13 -0.10 0.00 -1.72 0.00 0.00 55.73 53.84 3dul s ARG 115 Cb -0.18 -3.61 -0.05 0.00 -0.45 0.00 0.00 34.95 30.67 3dul s ARG 115 CO 0.10 -0.12 0.32 0.99 -0.68 0.00 0.00 175.30 175.91 3dul s THR 116 N 1.58 5.21 0.00 0.02 2.01 -1.26 -2.04 115.64 121.16 3dul s THR 116 Ca 0.11 0.43 0.00 0.00 0.31 0.00 0.00 61.69 62.55 3dul s THR 116 Cb -0.15 -3.60 0.00 0.00 0.01 0.00 0.00 72.50 68.76 3dul s THR 116 CO 0.08 0.45 0.00 0.61 -0.69 0.00 0.00 174.62 175.08 3dul n GLY 117 N 1.42 3.19 3.64 4.40 0.00 -0.64 -4.96 105.19 112.24 3dul n GLY 117 Ca -0.13 -1.84 -0.51 0.00 0.00 0.00 0.00 46.02 43.54 3dul n GLY 117 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3dul n LEU 118 N 0.00 2.34 -0.25 0.99 4.77 -1.26 -3.39 117.00 120.20 3dul n LEU 118 Ca 0.00 1.08 0.05 0.00 -0.03 0.00 0.00 56.01 57.12 3dul n LEU 118 Cb 0.00 -1.26 0.19 0.00 -2.33 0.00 0.00 43.42 40.02 3dul n LEU 118 CO 0.00 -0.63 0.99 0.00 -1.33 0.00 0.00 177.39 176.42 3dul h ALA 119 N 5.94 1.02 -0.82 -1.18 0.00 -1.96 -1.24 119.26 121.03 3dul h ALA 119 Ca -0.47 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 3dul h ALA 119 Cb 1.31 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 19.19 3dul h ALA 119 CO 0.86 -0.26 0.48 -0.07 0.00 0.00 0.00 179.25 180.26 3dul h LEU 120 N 0.38 1.00 -0.31 0.00 3.38 -1.99 0.79 115.31 118.56 3dul h LEU 120 Ca 0.41 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 58.26 3dul h LEU 120 Cb 0.66 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 3dul h LEU 120 CO -0.44 0.78 -0.03 0.44 0.09 0.00 0.00 178.44 179.28 3dul h ASP 121 N 1.14 0.56 -0.65 -0.43 3.32 -1.61 -2.34 116.42 116.41 3dul h ASP 121 Ca 0.29 -0.34 -0.06 0.00 0.02 0.00 0.00 57.03 56.95 3dul h ASP 121 Cb -0.02 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.35 3dul h ASP 121 CO -0.05 0.76 0.20 0.28 -1.72 0.00 0.00 179.24 178.70 3dul h SER 122 N 0.34 0.98 -0.73 6.45 0.02 -1.03 -0.18 113.55 119.41 3dul h SER 122 Ca 0.08 -0.18 -0.02 0.00 -0.84 0.00 0.00 61.79 60.83 3dul h SER 122 Cb 0.49 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.74 3dul h SER 122 CO 0.02 0.92 0.39 -0.07 -1.14 0.00 0.00 176.83 176.95 3dul h LEU 123 N 1.00 0.92 -0.79 5.07 3.38 -0.77 0.89 115.31 125.01 3dul h LEU 123 Ca 0.22 -0.11 -0.11 0.00 0.09 0.00 0.00 57.88 57.97 3dul h LEU 123 Cb 0.31 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3dul h LEU 123 CO -0.01 0.76 -0.25 1.56 0.09 0.00 0.00 178.44 180.60 3dul h GLN 124 N 1.00 0.64 -0.41 1.13 4.20 -0.96 -1.89 115.11 118.82 3dul h GLN 124 Ca 0.25 -0.26 -0.07 0.00 0.06 0.00 0.00 58.65 58.64 3dul h GLN 124 Cb 0.06 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.79 3dul h GLN 124 CO -0.04 0.83 -0.00 1.96 -0.67 0.00 0.00 178.83 180.91 3dul h GLN 125 N 0.56 0.73 -0.86 1.46 4.20 -0.44 -1.34 115.11 119.41 3dul h GLN 125 Ca 0.08 -0.23 -0.01 0.00 0.06 0.00 0.00 58.65 58.54 3dul h GLN 125 Cb 0.72 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 28.39 3dul h GLN 125 CO 0.06 0.81 0.49 0.82 -0.67 0.00 0.00 178.83 180.34 3dul h ILE 126 N 0.56 1.24 -0.30 2.54 2.04 -0.68 -1.82 117.51 121.09 3dul h ILE 126 Ca 0.12 -0.58 -0.09 0.00 1.00 0.00 0.00 64.86 65.31 3dul h ILE 126 Cb 0.48 0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.61 3dul h ILE 126 CO 0.02 0.27 -0.21 -0.08 0.00 0.00 0.00 178.15 178.15 3dul h GLU 127 N 1.20 0.57 -0.07 2.37 4.81 -1.04 -2.28 114.58 120.13 3dul h GLU 127 Ca 0.31 -0.20 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 3dul h GLU 127 Cb -0.01 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.33 3dul h GLU 127 CO -0.05 0.74 0.00 0.09 -0.73 0.00 0.00 179.01 179.06 3dul n ASN 128 N -4.14 0.58 -1.38 1.04 3.02 -0.53 -4.85 115.26 109.01 3dul n ASN 128 Ca 0.00 -1.63 0.00 0.00 -0.03 0.00 0.00 54.58 52.92 3dul n ASN 128 Cb 0.39 -0.05 0.00 0.00 -0.61 0.00 0.00 39.78 39.51 3dul n ASN 128 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3dul n GLU 129 N -0.35 2.44 0.00 3.52 1.02 -0.77 -5.06 120.64 121.44 3dul n GLU 129 Ca 0.12 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.37 3dul n GLU 129 Cb 0.14 0.00 -0.01 0.00 -0.02 0.00 0.00 31.44 31.55 3dul n GLU 129 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3dul n LYS 130 N -0.13 0.46 -1.71 3.49 4.01 -1.26 -4.81 118.16 118.21 3dul n LYS 130 Ca 0.00 -0.37 -0.59 0.00 -0.51 0.00 0.00 58.31 56.85 3dul n LYS 130 Cb 0.00 -1.49 -0.08 0.00 -0.51 0.00 0.00 35.03 32.95 3dul n LYS 130 CO 0.00 0.00 0.00 0.66 -1.11 0.00 0.00 177.40 176.95 3dul n TYR 131 N -0.95 1.98 -0.27 2.13 4.01 -1.26 -4.83 117.16 117.96 3dul n TYR 131 Ca 0.06 0.62 0.00 0.00 -0.16 0.00 0.00 57.90 58.43 3dul n TYR 131 Cb 0.38 -2.42 0.00 0.00 -0.31 0.00 0.00 39.34 36.99 3dul n TYR 131 CO 0.00 0.00 0.00 -1.91 -0.46 0.00 0.00 176.86 174.49 3dul n GLU 132 N 5.06 3.44 -1.65 -0.72 4.07 -1.26 -4.92 120.64 124.67 3dul n GLU 132 Ca 0.27 0.00 -0.44 0.00 -0.06 0.00 0.00 57.16 56.92 3dul n GLU 132 Cb 0.11 0.00 -0.02 0.00 -0.06 0.00 0.00 31.44 31.47 3dul n GLU 132 CO 0.00 0.00 0.00 -0.35 -0.06 0.00 0.00 177.13 176.72 3dul n PRO 133 N 0.00 1.84 -3.34 5.31 -0.05 -1.26 -4.99 135.00 132.51 3dul n PRO 133 Ca 0.00 0.65 -0.38 0.00 -0.05 0.00 0.00 63.50 63.72 3dul n PRO 133 Cb 0.00 -2.21 -0.06 0.00 -0.05 0.00 0.00 33.50 31.18 3dul n PRO 133 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 175.50 175.39 3dul s PHE 134 N -0.58 3.74 -0.09 0.54 0.08 -0.64 -4.93 117.98 116.10 3dul s PHE 134 Ca 0.63 1.16 0.14 0.00 0.12 0.00 0.00 56.93 58.98 3dul s PHE 134 Cb -0.66 -2.42 -0.09 0.00 -0.57 0.00 0.00 43.02 39.28 3dul s PHE 134 CO 0.56 0.56 1.09 -0.44 -0.10 0.00 0.00 175.22 176.88 3dul h ASP 135 N 4.29 0.00 -3.68 1.36 3.32 -1.21 -3.39 116.42 117.11 3dul h ASP 135 Ca -0.50 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.36 3dul h ASP 135 Cb 1.21 0.00 -0.27 0.00 0.22 0.00 0.00 39.33 40.48 3dul h ASP 135 CO 0.64 0.67 -0.50 0.12 -1.72 0.00 0.00 179.24 178.44 3dul s PHE 136 N -2.86 -0.23 -0.04 4.55 2.19 -1.20 -1.65 117.98 118.74 3dul s PHE 136 Ca -0.00 0.56 0.01 0.00 0.33 0.00 0.00 56.93 57.82 3dul s PHE 136 Cb 0.08 0.05 0.02 0.00 -1.31 0.00 0.00 43.02 41.87 3dul s PHE 136 CO 0.79 -0.13 -0.03 0.42 1.83 0.00 0.00 175.22 178.10 3dul s ILE 137 N 0.44 0.43 -0.15 3.12 1.01 0.17 -1.39 121.20 124.82 3dul s ILE 137 Ca -0.03 -0.05 -0.00 0.00 0.00 0.00 0.00 60.65 60.58 3dul s ILE 137 Cb -0.04 -0.48 -0.00 0.00 0.01 0.00 0.00 42.46 41.94 3dul s ILE 137 CO -0.02 0.21 -0.14 0.12 0.00 0.00 0.00 174.94 175.10 3dul s PHE 138 N 1.03 2.79 -0.24 3.97 5.36 -0.10 -0.11 117.98 130.69 3dul s PHE 138 Ca -0.09 -0.99 -0.03 0.00 -0.96 0.00 0.00 56.93 54.86 3dul s PHE 138 Cb -0.14 -1.89 0.01 0.00 -0.34 0.00 0.00 43.02 40.66 3dul s PHE 138 CO -0.01 -0.44 -0.03 0.42 -1.46 0.00 0.00 175.22 173.69 3dul s ILE 139 N 0.79 3.23 -0.45 3.12 1.01 0.60 -0.84 121.20 128.66 3dul s ILE 139 Ca -0.05 -0.75 0.06 0.00 0.00 0.00 0.00 60.65 59.91 3dul s ILE 139 Cb -0.15 -2.57 0.21 0.00 0.01 0.00 0.00 42.46 39.95 3dul s ILE 139 CO 0.00 0.28 0.45 -0.67 0.00 0.00 0.00 174.94 175.01 3dul n ASP 140 N 4.75 0.42 -3.41 3.58 2.03 -0.05 -0.98 116.55 122.90 3dul n ASP 140 Ca -0.17 -2.65 -0.20 0.00 0.52 0.00 0.00 54.79 52.29 3dul n ASP 140 Cb 0.49 -0.61 -0.05 0.00 -0.72 0.00 0.00 41.12 40.23 3dul n ASP 140 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3dul n ALA 141 N 2.08 0.38 -1.05 -1.67 0.00 -1.25 -4.24 120.51 114.75 3dul n ALA 141 Ca 0.26 -1.53 -0.29 0.00 0.00 0.00 0.00 53.44 51.88 3dul n ALA 141 Cb 0.48 0.97 0.20 0.00 0.00 0.00 0.00 19.45 21.10 3dul n ALA 141 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3dul s ASP 142 N -2.86 2.04 0.78 0.00 2.15 -1.26 -4.89 116.67 112.63 3dul s ASP 142 Ca 0.11 1.14 -0.12 0.00 0.43 0.00 0.00 52.55 54.11 3dul s ASP 142 Cb 0.01 -1.77 0.06 0.00 -0.30 0.00 0.00 42.92 40.91 3dul s ASP 142 CO 0.07 -3.49 1.12 -0.75 -0.17 0.00 0.00 175.17 171.96 3dul s LYS 143 N -4.94 2.26 0.00 4.34 2.20 -1.26 -3.22 119.74 119.11 3dul s LYS 143 Ca 0.67 0.40 0.00 0.00 -0.36 0.00 0.00 55.97 56.68 3dul s LYS 143 Cb -0.19 -1.96 0.00 0.00 -1.51 0.00 0.00 37.83 34.18 3dul s LYS 143 CO 0.59 -1.45 0.00 0.94 -0.36 0.00 0.00 175.35 175.07 3dul n GLN 144 N -3.27 0.00 -0.05 4.03 7.27 -1.26 -4.57 117.38 119.52 3dul n GLN 144 Ca 0.07 0.00 -0.02 0.00 0.07 0.00 0.00 57.00 57.12 3dul n GLN 144 Cb 0.58 -1.97 -0.15 0.00 2.41 0.00 0.00 30.24 31.11 3dul n GLN 144 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 3dul n ASN 145 N 0.00 0.13 -0.17 1.69 3.02 -1.20 -4.56 115.26 114.17 3dul n ASN 145 Ca 0.00 0.06 -0.02 0.00 -0.03 0.00 0.00 54.58 54.59 3dul n ASN 145 Cb 0.00 1.18 0.06 0.00 -0.61 0.00 0.00 39.78 40.41 3dul n ASN 145 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 3dul h ASN 146 N 0.00 -0.37 -0.53 6.41 2.35 -1.79 -0.13 115.58 121.52 3dul h ASN 146 Ca -0.32 0.15 0.06 0.00 -0.55 0.00 0.00 56.30 55.64 3dul h ASN 146 Cb 1.76 0.28 -0.05 0.00 0.05 0.00 0.00 38.32 40.36 3dul h ASN 146 CO 0.02 -0.14 0.23 -0.65 -1.65 0.00 0.00 177.43 175.25 3dul h PRO 147 N 0.05 0.42 -0.14 0.81 0.11 -1.93 0.31 132.00 131.63 3dul h PRO 147 Ca 0.26 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.34 3dul h PRO 147 Cb 0.41 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.42 3dul h PRO 147 CO -0.50 0.28 0.04 0.00 -0.21 0.00 0.00 178.00 177.61 3dul h ALA 148 N 1.32 0.18 -0.12 -0.75 0.00 -1.59 -2.40 119.26 115.90 3dul h ALA 148 Ca 0.25 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 3dul h ALA 148 Cb 0.22 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3dul h ALA 148 CO -0.21 -0.19 -0.16 1.88 0.00 0.00 0.00 179.25 180.57 3dul h TYR 149 N 0.03 0.21 -0.03 0.00 0.05 -0.77 -0.83 116.97 115.63 3dul h TYR 149 Ca 0.04 -0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.79 3dul h TYR 149 Cb 0.24 -0.06 -0.00 0.00 1.01 0.00 0.00 36.73 37.92 3dul h TYR 149 CO 0.00 0.35 0.00 0.35 -1.05 0.00 0.00 178.16 177.82 3dul h PHE 150 N 0.19 0.06 -0.79 4.88 3.57 -0.81 0.16 116.94 124.20 3dul h PHE 150 Ca 0.04 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.52 3dul h PHE 150 Cb 0.40 -0.02 -0.04 0.00 2.79 0.00 0.00 35.95 39.08 3dul h PHE 150 CO 0.01 0.35 0.48 0.93 -2.23 0.00 0.00 178.31 177.84 3dul h GLU 151 N -0.24 1.06 -0.12 1.11 4.39 -1.10 -1.22 114.58 118.46 3dul h GLU 151 Ca 0.01 -0.09 -0.13 0.00 0.34 0.00 0.00 59.36 59.49 3dul h GLU 151 Cb 0.32 -0.23 -0.01 0.00 -0.10 0.00 0.00 28.75 28.73 3dul h GLU 151 CO 0.00 0.74 -0.50 -1.49 -1.16 0.00 0.00 179.01 176.60 3dul h TRP 152 N 1.08 0.41 -0.08 4.33 4.06 -1.00 -1.36 115.95 123.39 3dul h TRP 152 Ca 0.28 -0.13 0.00 0.00 2.06 0.00 0.00 58.89 61.10 3dul h TRP 152 Cb -0.05 -0.08 -0.01 0.00 -1.00 0.00 0.00 29.16 28.02 3dul h TRP 152 CO 0.00 0.77 0.05 0.00 -3.56 0.00 0.00 178.44 175.70 3dul h ALA 153 N 1.20 0.10 -0.43 1.49 0.00 0.26 -1.98 119.26 119.91 3dul h ALA 153 Ca 0.01 -0.00 0.04 0.00 0.00 0.00 0.00 54.91 54.96 3dul h ALA 153 Cb 0.98 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.71 3dul h ALA 153 CO 0.08 -0.41 0.21 -0.07 0.00 0.00 0.00 179.25 179.06 3dul h LEU 154 N 0.10 0.30 -1.57 0.00 3.38 -1.13 -2.05 115.31 114.33 3dul h LEU 154 Ca 0.03 0.03 0.12 0.00 0.09 0.00 0.00 57.88 58.15 3dul h LEU 154 Cb -0.00 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 40.67 3dul h LEU 154 CO -0.02 0.21 0.46 0.50 0.09 0.00 0.00 178.44 179.69 3dul h LYS 155 N 0.42 0.44 -0.63 1.13 3.11 -0.84 -1.35 116.57 118.86 3dul h LYS 155 Ca 0.19 -0.03 -0.12 0.00 -2.81 0.00 0.00 60.65 57.88 3dul h LYS 155 Cb 0.11 -0.10 -0.07 0.00 -1.00 0.00 0.00 32.23 31.16 3dul h LYS 155 CO -0.14 0.29 0.14 1.28 -2.81 0.00 0.00 179.45 178.21 3dul n LEU 156 N -4.48 5.72 0.00 5.20 4.77 -0.78 -4.97 117.00 122.47 3dul n LEU 156 Ca 0.12 -3.12 -0.14 0.00 -0.03 0.00 0.00 56.01 52.84 3dul n LEU 156 Cb 0.43 -0.70 0.00 0.00 -2.33 0.00 0.00 43.42 40.82 3dul n LEU 156 CO 0.33 0.75 0.04 -1.20 -1.33 0.00 0.00 177.39 175.98 3dul n SER 157 N 0.05 1.89 -3.90 -1.43 7.64 -0.51 -1.61 113.62 115.75 3dul n SER 157 Ca 0.34 -1.99 -0.09 0.00 1.01 0.00 0.00 58.87 58.14 3dul n SER 157 Cb 1.27 -0.03 -0.06 0.00 -1.01 0.00 0.00 64.21 64.38 3dul n SER 157 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3dul s ARG 158 N -3.19 1.19 0.15 1.43 1.04 -1.26 -4.79 118.95 113.51 3dul s ARG 158 Ca 0.17 -1.09 -0.34 0.00 -1.04 0.00 0.00 55.73 53.43 3dul s ARG 158 Cb -0.01 0.41 -0.13 0.00 -2.04 0.00 0.00 34.95 33.17 3dul s ARG 158 CO 0.11 -0.45 1.63 -2.30 -0.04 0.00 0.00 175.30 174.24 3dul n PRO 159 N -0.23 2.25 0.00 3.89 -0.02 -1.26 -1.48 135.00 138.15 3dul n PRO 159 Ca -0.08 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.21 3dul n PRO 159 Cb 0.63 -2.60 0.00 0.00 -0.02 0.00 0.00 33.50 31.50 3dul n PRO 159 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dul n GLY 160 N 3.58 2.03 3.73 -1.23 0.00 -0.13 -5.00 105.19 108.17 3dul n GLY 160 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 3dul n GLY 160 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3dul n THR 161 N -1.64 1.52 -3.87 2.61 -1.04 -0.55 -4.66 114.28 106.66 3dul n THR 161 Ca 0.00 -0.38 -0.36 0.00 -2.04 0.00 0.00 64.05 61.27 3dul n THR 161 Cb 0.00 -1.79 -0.07 0.00 -1.82 0.00 0.00 70.33 66.65 3dul n THR 161 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3dul s VAL 162 N -0.59 5.32 -0.14 12.58 1.01 -0.66 -1.20 120.40 136.73 3dul s VAL 162 Ca 0.60 0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.73 3dul s VAL 162 Cb -0.53 -3.36 0.02 0.00 0.00 0.00 0.00 36.38 32.50 3dul s VAL 162 CO 0.56 0.54 -0.12 -0.63 0.00 0.00 0.00 175.10 175.45 3dul s ILE 163 N -0.36 1.40 -0.13 2.22 1.01 0.39 -0.66 121.20 125.07 3dul s ILE 163 Ca 0.11 -0.52 -0.01 0.00 0.00 0.00 0.00 60.65 60.23 3dul s ILE 163 Cb -0.12 -1.34 -0.02 0.00 0.01 0.00 0.00 42.46 41.00 3dul s ILE 163 CO 0.01 0.43 -0.12 -0.63 0.00 0.00 0.00 174.94 174.64 3dul s ILE 164 N 1.55 3.18 -0.06 2.92 -1.09 0.85 -0.59 121.20 127.97 3dul s ILE 164 Ca 0.05 -0.62 -0.00 0.00 -2.23 0.00 0.00 60.65 57.85 3dul s ILE 164 Cb -0.13 -2.34 0.03 0.00 -1.58 0.00 0.00 42.46 38.43 3dul s ILE 164 CO -0.10 0.52 -0.02 -0.83 -1.23 0.00 0.00 174.94 173.28 3dul s GLY 165 N 0.32 0.46 0.26 6.18 0.00 -0.62 -0.29 107.32 113.62 3dul s GLY 165 Ca -0.09 -0.09 -0.29 0.00 0.00 0.00 0.00 44.72 44.25 3dul s GLY 165 CO 0.05 0.81 0.96 0.99 0.00 0.00 0.00 173.10 175.91 3dul s ASP 166 N 1.47 7.54 0.00 1.64 1.11 -0.15 -0.67 116.67 127.60 3dul s ASP 166 Ca -0.03 1.97 0.00 0.00 0.18 0.00 0.00 52.55 54.67 3dul s ASP 166 Cb -0.13 -2.61 0.00 0.00 1.07 0.00 0.00 42.92 41.25 3dul s ASP 166 CO -0.03 0.08 0.00 -3.20 1.18 0.00 0.00 175.17 173.20 3dul n ASN 167 N 1.26 0.00 -4.33 0.27 4.05 0.27 -4.78 115.26 112.01 3dul n ASN 167 Ca -0.01 0.00 -0.23 0.00 0.45 0.00 0.00 54.58 54.79 3dul n ASN 167 Cb 0.47 0.00 -0.12 0.00 1.23 0.00 0.00 39.78 41.37 3dul n ASN 167 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 3dul s VAL 168 N 0.09 1.83 -0.09 3.44 1.01 -1.24 -4.94 120.40 120.49 3dul s VAL 168 Ca 0.00 -1.84 -0.19 0.00 0.00 0.00 0.00 61.98 59.95 3dul s VAL 168 Cb 0.00 -1.80 -0.04 0.00 0.00 0.00 0.00 36.38 34.54 3dul s VAL 168 CO 0.00 -0.25 0.52 -0.69 0.00 0.00 0.00 175.10 174.69 3dul s VAL 169 N -1.83 5.13 -1.01 2.92 1.01 -1.26 -0.97 120.40 124.39 3dul s VAL 169 Ca 0.14 1.06 -0.06 0.00 0.00 0.00 0.00 61.98 63.12 3dul s VAL 169 Cb -0.07 -3.86 0.25 0.00 0.00 0.00 0.00 36.38 32.70 3dul s VAL 169 CO 0.06 0.33 0.96 -0.13 0.00 0.00 0.00 175.10 176.32 3dul s ARG 170 N 0.51 3.79 -0.37 2.72 0.52 0.30 -4.87 118.95 121.55 3dul s ARG 170 Ca 0.28 -3.21 -0.03 0.00 -0.52 0.00 0.00 55.73 52.26 3dul s ARG 170 Cb -0.16 -4.30 0.09 0.00 0.52 0.00 0.00 34.95 31.10 3dul s ARG 170 CO 0.12 -1.25 2.55 -0.85 0.02 0.00 0.00 175.30 175.89 3dul n GLU 171 N 2.61 2.14 0.00 3.54 0.28 -1.26 -1.79 120.64 126.16 3dul n GLU 171 Ca 0.22 -1.93 0.00 0.00 -0.16 0.00 0.00 57.16 55.29 3dul n GLU 171 Cb 0.39 -1.93 0.00 0.00 1.43 0.00 0.00 31.44 31.33 3dul n GLU 171 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3dul n GLY 172 N 0.81 2.77 0.15 -1.84 0.00 -1.26 -4.93 105.19 100.88 3dul n GLY 172 Ca 0.41 -0.33 -0.06 0.00 0.00 0.00 0.00 46.02 46.05 3dul n GLY 172 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3dul h GLU 173 N 0.00 -0.35 0.00 1.61 4.22 -2.04 -3.45 114.58 114.57 3dul h GLU 173 Ca 0.00 0.02 -0.10 0.00 0.08 0.00 0.00 59.36 59.36 3dul h GLU 173 Cb 0.00 0.08 0.04 0.00 0.50 0.00 0.00 28.75 29.37 3dul h GLU 173 CO 0.00 -0.23 0.08 0.28 -2.18 0.00 0.00 179.01 176.95 3dul n VAL 174 N -3.14 0.00 -0.29 0.32 0.31 -1.26 -5.18 118.33 109.09 3dul n VAL 174 Ca -0.05 -0.19 0.04 0.00 -0.01 0.00 0.00 64.34 64.13 3dul n VAL 174 Cb 0.14 -1.61 -0.02 0.00 -0.91 0.00 0.00 33.84 31.44 3dul n VAL 174 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 3dul n ILE 175 N -2.64 -0.13 0.00 2.52 5.41 -1.26 -5.03 119.36 118.23 3dul n ILE 175 Ca 0.04 0.16 0.00 0.00 1.00 0.00 0.00 62.75 63.95 3dul n ILE 175 Cb 0.14 -0.26 0.00 0.00 -0.71 0.00 0.00 39.64 38.81 3dul n ILE 175 CO 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 176.55 176.17 3dul n ILE 187 N -2.60 0.00 -0.19 1.39 5.41 -1.26 -5.20 119.36 116.91 3dul n ILE 187 Ca -0.02 0.00 -0.00 0.00 1.00 0.00 0.00 62.75 63.73 3dul n ILE 187 Cb 0.14 0.00 0.08 0.00 -0.71 0.00 0.00 39.64 39.15 3dul n ILE 187 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 176.55 176.63 3dul h ARG 188 N 0.00 0.10 -0.21 0.38 0.11 -2.05 -0.64 114.38 112.08 3dul h ARG 188 Ca 0.00 -0.01 -0.12 0.00 0.10 0.00 0.00 59.98 59.95 3dul h ARG 188 Cb 0.00 -0.02 -0.01 0.00 1.11 0.00 0.00 29.97 31.05 3dul h ARG 188 CO 0.00 0.07 -0.38 0.00 0.10 0.00 0.00 179.97 179.76 3dul h ARG 189 N 0.11 0.47 -0.31 0.08 2.47 -2.05 -2.32 114.38 112.82 3dul h ARG 189 Ca 0.30 -0.22 -0.02 0.00 -1.26 0.00 0.00 59.98 58.77 3dul h ARG 189 Cb 0.47 -0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.78 3dul h ARG 189 CO -0.50 0.78 0.10 0.35 0.56 0.00 0.00 179.97 181.25 3dul h PHE 190 N 0.39 0.50 0.00 3.04 3.57 -1.61 0.17 116.94 123.00 3dul h PHE 190 Ca 0.04 -0.05 -0.05 0.00 3.53 0.00 0.00 57.97 61.44 3dul h PHE 190 Cb 0.84 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.43 3dul h PHE 190 CO 0.03 0.51 -0.22 1.88 -2.23 0.00 0.00 178.31 178.28 3dul h TYR 191 N 0.35 0.00 -0.06 0.41 0.05 -1.19 -1.17 116.97 115.35 3dul h TYR 191 Ca 0.10 0.00 -0.16 0.00 0.05 0.00 0.00 58.73 58.72 3dul h TYR 191 Cb 0.24 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.97 3dul h TYR 191 CO 0.01 0.22 -0.68 0.93 -1.05 0.00 0.00 178.16 177.59 3dul h GLU 192 N 0.00 0.27 0.13 4.88 5.08 -0.83 0.67 114.58 124.77 3dul h GLU 192 Ca -0.00 -0.21 -0.01 0.00 -1.00 0.00 0.00 59.36 58.14 3dul h GLU 192 Cb 0.69 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.98 3dul h GLU 192 CO 0.03 0.85 -0.06 1.25 -1.00 0.00 0.00 179.01 180.07 3dul h LEU 193 N 0.19 -0.14 -0.34 1.33 6.46 0.46 0.16 115.31 123.42 3dul h LEU 193 Ca -0.02 -0.09 0.02 0.00 -0.12 0.00 0.00 57.88 57.68 3dul h LEU 193 Cb 1.22 0.04 -0.03 0.00 -0.73 0.00 0.00 40.66 41.16 3dul h LEU 193 CO 0.11 -0.00 0.18 0.40 -0.62 0.00 0.00 178.44 178.51 3dul h ILE 194 N -0.27 1.01 -0.15 4.05 1.08 -1.09 -0.30 117.51 121.83 3dul h ILE 194 Ca -0.02 -0.13 0.02 0.00 -0.39 0.00 0.00 64.86 64.34 3dul h ILE 194 Cb 0.22 0.60 -0.01 0.00 -3.07 0.00 0.00 36.82 34.56 3dul h ILE 194 CO 0.03 0.07 0.10 0.00 -0.69 0.00 0.00 178.15 177.66 3dul h ALA 195 N 1.17 2.00 -0.15 1.87 0.00 -0.63 0.12 119.26 123.64 3dul h ALA 195 Ca 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3dul h ALA 195 Cb 0.03 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3dul h ALA 195 CO -0.08 -0.02 0.00 0.00 0.00 0.00 0.00 179.25 179.15 3dul n ALA 196 N -2.54 2.51 -3.72 0.00 0.00 0.53 -4.63 120.51 112.66 3dul n ALA 196 Ca -0.00 -0.36 -0.37 0.00 0.00 0.00 0.00 53.44 52.71 3dul n ALA 196 Cb 0.15 -1.08 -0.10 0.00 0.00 0.00 0.00 19.45 18.41 3dul n ALA 196 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3dul s GLU 197 N -1.80 2.26 0.58 0.00 2.56 0.43 -4.97 118.70 117.77 3dul s GLU 197 Ca 0.22 -2.03 0.28 0.00 0.00 0.00 0.00 54.97 53.45 3dul s GLU 197 Cb 0.11 -3.69 1.75 0.00 2.00 0.00 0.00 34.13 34.31 3dul s GLU 197 CO 0.17 -1.12 2.23 -1.35 -0.56 0.00 0.00 175.26 174.62 3dul h PRO 198 N 7.81 0.00 0.00 4.30 0.11 -1.82 -2.85 132.00 139.56 3dul h PRO 198 Ca -0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.00 3dul h PRO 198 Cb 1.02 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.13 3dul h PRO 198 CO 0.73 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 179.06 3dul n ARG 199 N -3.90 0.46 -4.11 1.05 1.74 -1.26 -4.80 116.66 105.84 3dul n ARG 199 Ca -0.02 0.05 -0.10 0.00 -0.77 0.00 0.00 57.85 57.00 3dul n ARG 199 Cb 0.12 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 29.95 3dul n ARG 199 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 3dul s VAL 200 N -2.24 0.51 -0.08 1.55 -7.23 -1.08 -0.37 120.40 111.46 3dul s VAL 200 Ca 0.24 -1.62 0.03 0.00 -1.81 0.00 0.00 61.98 58.82 3dul s VAL 200 Cb 0.13 -1.28 0.01 0.00 0.56 0.00 0.00 36.38 35.80 3dul s VAL 200 CO 0.25 -0.76 -0.18 -0.55 -0.31 0.00 0.00 175.10 173.55 3dul s SER 201 N -2.55 2.38 0.18 4.85 0.15 -0.75 -4.90 113.70 113.06 3dul s SER 201 Ca 0.03 -0.42 -0.07 0.00 0.70 0.00 0.00 55.95 56.20 3dul s SER 201 Cb 0.01 -1.06 -0.02 0.00 -1.71 0.00 0.00 66.02 63.24 3dul s SER 201 CO -0.04 0.10 0.25 0.00 1.20 0.00 0.00 173.24 174.74 3dul s ALA 202 N 0.47 0.32 0.21 5.45 0.00 -1.26 -0.83 121.76 126.11 3dul s ALA 202 Ca -0.16 -1.13 -0.01 0.00 0.00 0.00 0.00 51.96 50.67 3dul s ALA 202 Cb -0.16 0.99 -0.04 0.00 0.00 0.00 0.00 23.12 23.90 3dul s ALA 202 CO 0.06 -0.64 0.16 -0.08 0.00 0.00 0.00 175.76 175.26 3dul s THR 203 N -4.02 0.00 -0.03 0.00 -1.32 -1.26 -5.00 115.64 104.01 3dul s THR 203 Ca 0.23 -1.97 0.06 0.00 -1.21 0.00 0.00 61.69 58.80 3dul s THR 203 Cb 0.04 -2.49 -0.01 0.00 -1.51 0.00 0.00 72.50 68.53 3dul s THR 203 CO 0.04 0.00 -0.21 0.00 -2.21 0.00 0.00 174.62 172.24 3dul s ALA 204 N -4.09 1.77 0.30 11.08 0.00 -1.26 -4.46 121.76 125.11 3dul s ALA 204 Ca 0.38 -0.89 0.03 0.00 0.00 0.00 0.00 51.96 51.49 3dul s ALA 204 Cb 0.06 -0.49 -0.04 0.00 0.00 0.00 0.00 23.12 22.65 3dul s ALA 204 CO 0.13 0.40 0.15 -0.51 0.00 0.00 0.00 175.76 175.93 3dul s LEU 205 N -0.33 1.69 0.06 0.00 1.43 0.17 -5.00 118.68 116.69 3dul s LEU 205 Ca 0.04 -1.54 -0.08 0.00 -1.03 0.00 0.00 54.13 51.52 3dul s LEU 205 Cb -0.10 0.15 -0.00 0.00 0.03 0.00 0.00 46.19 46.27 3dul s LEU 205 CO 0.00 -0.86 0.17 0.00 0.23 0.00 0.00 176.35 175.89 3dul s GLN 206 N -3.84 0.73 0.00 1.70 -2.07 -1.26 -0.90 119.66 114.02 3dul s GLN 206 Ca 0.35 -0.80 -0.11 0.00 -1.82 0.00 0.00 55.36 52.99 3dul s GLN 206 Cb 0.05 0.29 0.01 0.00 -1.09 0.00 0.00 33.01 32.28 3dul s GLN 206 CO 0.17 -0.21 0.21 -0.08 -1.32 0.00 0.00 175.29 174.06 3dul s THR 207 N -3.12 0.08 0.56 3.63 -1.32 -0.79 -4.96 115.64 109.72 3dul s THR 207 Ca -0.01 -0.63 -0.17 0.00 -1.21 0.00 0.00 61.69 59.68 3dul s THR 207 Cb 0.02 -0.56 -0.05 0.00 -1.51 0.00 0.00 72.50 70.40 3dul s THR 207 CO -0.07 -0.34 1.05 0.54 -2.21 0.00 0.00 174.62 173.58 3dul s VAL 208 N -1.50 3.87 0.27 5.08 0.11 -1.26 0.33 120.40 127.30 3dul s VAL 208 Ca -0.13 0.95 0.06 0.00 -2.93 0.00 0.00 61.98 59.93 3dul s VAL 208 Cb -0.06 -3.43 -0.02 0.00 -1.53 0.00 0.00 36.38 31.34 3dul s VAL 208 CO 0.02 -0.46 0.24 0.61 -3.33 0.00 0.00 175.10 172.18 3dul n GLY 209 N -0.86 3.08 0.23 6.54 0.00 0.21 -4.61 105.19 109.79 3dul n GLY 209 Ca 0.09 -1.83 -0.07 0.00 0.00 0.00 0.00 46.02 44.20 3dul n GLY 209 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3dul h SER 210 N 1.64 0.65 -2.03 1.61 4.64 -1.14 -3.24 113.55 115.67 3dul h SER 210 Ca -0.19 -0.08 -0.64 0.00 -0.47 0.00 0.00 61.79 60.40 3dul h SER 210 Cb 0.96 -0.16 -0.38 0.00 -0.31 0.00 0.00 62.40 62.51 3dul h SER 210 CO 0.28 0.54 -0.24 0.29 -0.87 0.00 0.00 176.83 176.84 3dul n LYS 211 N -4.64 3.60 0.00 4.77 5.02 -1.26 -5.01 118.16 120.63 3dul n LYS 211 Ca 0.03 -4.60 0.00 0.00 -2.02 0.00 0.00 58.31 51.71 3dul n LYS 211 Cb 0.08 -2.28 0.00 0.00 -0.02 0.00 0.00 35.03 32.81 3dul n LYS 211 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3dul n GLY 212 N -0.31 -0.82 3.84 0.72 0.00 -1.23 -4.13 105.19 103.26 3dul n GLY 212 Ca 0.38 -2.17 -0.37 0.00 0.00 0.00 0.00 46.02 43.86 3dul n GLY 212 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dul s TYR 213 N 0.00 3.62 -0.28 1.61 1.51 -0.74 0.66 117.35 123.72 3dul s TYR 213 Ca 0.00 0.68 -0.21 0.00 -1.01 0.00 0.00 57.07 56.53 3dul s TYR 213 Cb 0.00 -2.11 -0.01 0.00 -0.11 0.00 0.00 41.96 39.72 3dul s TYR 213 CO 0.00 0.63 0.65 -0.51 -1.11 0.00 0.00 175.55 175.21 3dul s ASP 214 N -0.80 6.56 -0.07 2.29 1.11 0.15 0.11 116.67 126.02 3dul s ASP 214 Ca 0.18 0.60 -0.15 0.00 0.18 0.00 0.00 52.55 53.36 3dul s ASP 214 Cb -0.14 -2.34 -0.05 0.00 1.07 0.00 0.00 42.92 41.46 3dul s ASP 214 CO 0.07 -0.44 0.37 -0.83 1.18 0.00 0.00 175.17 175.52 3dul s GLY 215 N 1.55 2.38 0.09 0.21 0.00 -0.15 -1.88 107.32 109.53 3dul s GLY 215 Ca 0.27 -0.30 -0.16 0.00 0.00 0.00 0.00 44.72 44.52 3dul s GLY 215 CO 0.10 0.29 0.39 -0.11 0.00 0.00 0.00 173.10 173.77 3dul s PHE 216 N -0.39 -0.20 0.00 1.90 -0.71 -0.08 -0.56 117.98 117.94 3dul s PHE 216 Ca 0.22 -0.04 0.00 0.00 -1.04 0.00 0.00 56.93 56.07 3dul s PHE 216 Cb -0.15 0.22 0.00 0.00 -1.21 0.00 0.00 43.02 41.88 3dul s PHE 216 CO 0.10 -0.64 0.00 1.51 -1.34 0.00 0.00 175.22 174.84 3dul n ILE 217 N 0.04 0.00 0.00 -4.49 3.06 0.16 -0.66 119.36 117.47 3dul n ILE 217 Ca -0.17 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.08 3dul n ILE 217 Cb 0.62 -0.89 0.00 0.00 0.54 0.00 0.00 39.64 39.92 3dul n ILE 217 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 3dul n ALA 219 N -3.00 0.00 -3.44 1.51 0.00 0.25 -1.59 120.51 114.24 3dul n ALA 219 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.18 3dul n ALA 219 Cb 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.28 3dul n ALA 219 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3dul s VAL 220 N -2.00 1.33 0.08 0.00 1.01 -0.01 -0.46 120.40 120.34 3dul s VAL 220 Ca 0.00 -0.59 -0.31 0.00 0.00 0.00 0.00 61.98 61.09 3dul s VAL 220 Cb 0.00 -1.20 -0.07 0.00 0.00 0.00 0.00 36.38 35.12 3dul s VAL 220 CO 0.00 0.40 1.29 -0.69 0.00 0.00 0.00 175.10 176.09 3dul s VAL 221 N 0.64 3.71 -2.00 2.92 1.01 -0.34 -1.81 120.40 124.53 3dul s VAL 221 Ca -0.15 1.23 0.25 0.00 0.00 0.00 0.00 61.98 63.31 3dul s VAL 221 Cb -0.16 -3.79 0.71 0.00 0.00 0.00 0.00 36.38 33.14 3dul s VAL 221 CO 0.04 0.09 1.85 0.29 0.00 0.00 0.00 175.10 177.37