#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tri s LYS 3 N 0.00 4.58 1.06 4.33 1.02 -1.26 -5.00 119.74 124.47 1tri s LYS 3 Ca 0.00 1.24 -0.12 0.00 0.02 0.00 0.00 55.97 57.11 1tri s LYS 3 Cb 0.00 -3.38 0.20 0.00 -0.52 0.00 0.00 37.83 34.13 1tri s LYS 3 CO 0.00 0.22 0.92 -0.35 -0.92 0.00 0.00 175.35 175.22 1tri n PRO 4 N 2.92 -1.49 -1.69 -1.68 -0.05 -1.26 -4.82 135.00 126.92 1tri n PRO 4 Ca 0.00 -0.39 -0.44 0.00 -0.05 0.00 0.00 63.50 62.62 1tri n PRO 4 Cb 0.50 -2.17 -0.04 0.00 -0.05 0.00 0.00 33.50 31.74 1tri n PRO 4 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 175.50 176.39 1tri n GLN 5 N -4.17 2.53 -1.37 0.54 7.27 -1.26 -4.94 117.38 115.98 1tri n GLN 5 Ca 0.06 0.92 -0.31 0.00 0.07 0.00 0.00 57.00 57.74 1tri n GLN 5 Cb 0.54 -2.77 0.08 0.00 2.41 0.00 0.00 30.24 30.50 1tri n GLN 5 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 1tri s PRO 6 N 2.20 2.42 -0.06 3.69 0.04 -1.26 -4.89 135.00 137.14 1tri s PRO 6 Ca 0.82 1.17 0.03 0.00 0.04 0.00 0.00 61.00 63.05 1tri s PRO 6 Cb -0.57 -1.92 0.01 0.00 0.04 0.00 0.00 34.50 32.06 1tri s PRO 6 CO 0.39 -1.52 -0.13 0.42 0.04 0.00 0.00 177.00 176.21 1tri s ILE 7 N -2.85 1.14 -0.31 0.56 1.01 -1.12 -1.16 121.20 118.48 1tri s ILE 7 Ca 0.61 -0.50 0.03 0.00 0.00 0.00 0.00 60.65 60.80 1tri s ILE 7 Cb -0.17 -1.03 0.09 0.00 0.01 0.00 0.00 42.46 41.35 1tri s ILE 7 CO 0.54 0.35 -0.01 0.00 0.00 0.00 0.00 174.94 175.83 1tri s ALA 8 N 0.53 2.72 -0.16 9.38 0.00 -0.86 -1.80 121.76 131.57 1tri s ALA 8 Ca -0.12 -2.22 -0.10 0.00 0.00 0.00 0.00 51.96 49.52 1tri s ALA 8 Cb -0.15 -1.81 -0.05 0.00 0.00 0.00 0.00 23.12 21.11 1tri s ALA 8 CO 0.03 -1.51 0.17 0.00 0.00 0.00 0.00 175.76 174.45 1tri s ALA 9 N 1.01 3.74 -0.27 0.00 0.00 0.58 -2.27 121.76 124.54 1tri s ALA 9 Ca 0.04 -0.62 -0.15 0.00 0.00 0.00 0.00 51.96 51.23 1tri s ALA 9 Cb -0.19 -2.15 -0.03 0.00 0.00 0.00 0.00 23.12 20.75 1tri s ALA 9 CO -0.07 0.31 0.39 0.00 0.00 0.00 0.00 175.76 176.39 1tri s ALA 10 N -0.14 3.56 -0.67 0.00 0.00 0.11 0.12 121.76 124.75 1tri s ALA 10 Ca 0.12 -0.82 -0.14 0.00 0.00 0.00 0.00 51.96 51.13 1tri s ALA 10 Cb -0.12 -2.74 0.17 0.00 0.00 0.00 0.00 23.12 20.43 1tri s ALA 10 CO 0.01 -0.70 0.60 1.21 0.00 0.00 0.00 175.76 176.89 1tri s ASN 11 N 1.64 6.35 1.14 0.00 2.47 0.89 -0.82 114.94 126.60 1tri s ASN 11 Ca 0.16 -2.26 -0.15 0.00 0.42 0.00 0.00 52.86 51.02 1tri s ASN 11 Cb -0.16 -2.17 0.22 0.00 -1.45 0.00 0.00 41.25 37.69 1tri s ASN 11 CO 0.10 -0.69 0.89 0.79 -3.72 0.00 0.00 177.10 174.47 1tri n TRP 12 N 4.55 -3.78 0.00 0.43 8.01 0.35 -4.33 117.44 122.67 1tri n TRP 12 Ca 0.00 -0.80 0.00 0.00 -1.31 0.00 0.00 57.50 55.39 1tri n TRP 12 Cb 0.43 -0.85 0.00 0.00 -2.01 0.00 0.00 31.31 28.88 1tri n TRP 12 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1tri n GLY 16 N -2.67 -0.74 3.81 6.99 0.00 -1.26 -4.40 105.19 106.91 1tri n GLY 16 Ca 0.12 -0.36 -0.32 0.00 0.00 0.00 0.00 46.02 45.46 1tri n GLY 16 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1tri s SER 17 N -4.00 5.59 0.14 1.61 1.04 -1.26 -4.92 113.70 111.90 1tri s SER 17 Ca 0.00 1.76 -0.18 0.00 0.48 0.00 0.00 55.95 58.01 1tri s SER 17 Cb 0.00 -2.52 -0.02 0.00 0.10 0.00 0.00 66.02 63.58 1tri s SER 17 CO 0.00 -1.30 1.78 -0.61 0.98 0.00 0.00 173.24 174.09 1tri h GLN 18 N 0.00 0.32 -0.51 4.02 5.75 -2.05 -2.22 115.11 120.43 1tri h GLN 18 Ca -0.46 -0.02 0.06 0.00 -0.15 0.00 0.00 58.65 58.09 1tri h GLN 18 Cb 1.22 -0.07 -0.09 0.00 1.07 0.00 0.00 27.48 29.60 1tri h GLN 18 CO 0.57 0.21 -0.52 1.96 -2.65 0.00 0.00 178.83 178.39 1tri h GLN 19 N 0.33 -0.31 -0.57 1.69 4.20 -1.98 0.77 115.11 119.24 1tri h GLN 19 Ca 0.11 0.02 0.04 0.00 0.06 0.00 0.00 58.65 58.88 1tri h GLN 19 Cb 0.01 0.07 -0.04 0.00 0.30 0.00 0.00 27.48 27.81 1tri h GLN 19 CO -0.06 -0.20 0.32 0.66 -0.67 0.00 0.00 178.83 178.88 1tri h SER 20 N -0.32 0.49 -0.60 1.46 4.64 -1.87 -0.31 113.55 117.05 1tri h SER 20 Ca 0.11 0.02 -0.05 0.00 -0.47 0.00 0.00 61.79 61.40 1tri h SER 20 Cb 0.57 -0.08 -0.03 0.00 -0.31 0.00 0.00 62.40 62.55 1tri h SER 20 CO -0.65 0.33 0.18 -0.07 -0.87 0.00 0.00 176.83 175.76 1tri h LEU 21 N 0.62 0.90 -0.89 5.97 3.38 -0.62 -1.55 115.31 123.12 1tri h LEU 21 Ca 0.24 -0.16 -0.09 0.00 0.09 0.00 0.00 57.88 57.96 1tri h LEU 21 Cb 0.10 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 1tri h LEU 21 CO -0.14 0.85 -0.13 0.28 0.09 0.00 0.00 178.44 179.40 1tri h SER 22 N 0.93 0.67 0.44 -0.43 0.02 0.18 0.23 113.55 115.59 1tri h SER 22 Ca 0.21 -0.20 -0.08 0.00 -0.84 0.00 0.00 61.79 60.88 1tri h SER 22 Cb 0.29 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 1tri h SER 22 CO -0.01 0.82 -0.40 -0.33 -1.14 0.00 0.00 176.83 175.77 1tri h GLU 23 N 0.62 0.00 0.04 3.45 5.08 -0.64 -0.65 114.58 122.48 1tri h GLU 23 Ca 0.11 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1tri h GLU 23 Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 1tri h GLU 23 CO 0.04 0.40 -0.02 -0.07 -1.00 0.00 0.00 179.01 178.36 1tri h LEU 24 N 0.00 -0.04 -1.40 1.33 3.38 -0.02 -0.14 115.31 118.41 1tri h LEU 24 Ca -0.00 -0.37 0.11 0.00 0.09 0.00 0.00 57.88 57.71 1tri h LEU 24 Cb 0.73 0.01 -0.05 0.00 0.09 0.00 0.00 40.66 41.44 1tri h LEU 24 CO 0.05 0.35 0.51 0.40 0.09 0.00 0.00 178.44 179.85 1tri h ILE 25 N -0.45 0.90 -0.40 1.22 2.04 -0.45 0.92 117.51 121.29 1tri h ILE 25 Ca -0.01 -0.22 -0.06 0.00 1.00 0.00 0.00 64.86 65.57 1tri h ILE 25 Cb 0.41 0.20 -0.02 0.00 -0.74 0.00 0.00 36.82 36.68 1tri h ILE 25 CO 0.01 0.12 0.03 0.44 0.00 0.00 0.00 178.15 178.74 1tri h ASP 26 N 0.65 0.68 0.37 1.72 3.32 -0.84 0.98 116.42 123.30 1tri h ASP 26 Ca 0.37 -0.29 -0.02 0.00 0.02 0.00 0.00 57.03 57.11 1tri h ASP 26 Cb 0.56 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.93 1tri h ASP 26 CO -0.14 0.80 -0.19 0.25 -1.72 0.00 0.00 179.24 178.24 1tri h LEU 27 N 0.53 -0.45 -0.39 1.55 6.46 0.69 -2.51 115.31 121.20 1tri h LEU 27 Ca 0.12 0.02 0.07 0.00 -0.12 0.00 0.00 57.88 57.96 1tri h LEU 27 Cb 0.44 0.12 -0.06 0.00 -0.73 0.00 0.00 40.66 40.43 1tri h LEU 27 CO 0.02 -0.32 0.03 -0.26 -0.62 0.00 0.00 178.44 177.29 1tri h PHE 28 N -0.52 0.04 -0.06 1.25 0.04 0.14 -1.00 116.94 116.84 1tri h PHE 28 Ca -0.05 0.03 0.02 0.00 2.80 0.00 0.00 57.97 60.76 1tri h PHE 28 Cb 0.40 0.04 -0.00 0.00 2.20 0.00 0.00 35.95 38.59 1tri h PHE 28 CO -0.06 -0.04 0.11 -0.91 -0.60 0.00 0.00 178.31 176.81 1tri h ASN 29 N 0.15 0.00 -0.22 2.17 2.35 -0.76 0.68 115.58 119.94 1tri h ASN 29 Ca 0.19 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 1tri h ASN 29 Cb 0.25 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.62 1tri h ASN 29 CO -0.29 0.00 0.00 -1.54 -1.65 0.00 0.00 177.43 173.95 1tri n SER 30 N -3.44 2.90 -4.80 5.81 3.41 -0.39 -4.81 113.62 112.30 1tri n SER 30 Ca -0.01 -1.91 -0.39 0.00 -0.26 0.00 0.00 58.87 56.30 1tri n SER 30 Cb 0.19 -0.13 -0.06 0.00 -0.26 0.00 0.00 64.21 63.95 1tri n SER 30 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1tri s THR 31 N -1.73 4.58 -0.22 6.66 2.01 0.23 -5.02 115.64 122.14 1tri s THR 31 Ca 0.35 1.40 -0.14 0.00 0.31 0.00 0.00 61.69 63.61 1tri s THR 31 Cb 0.21 -3.98 -0.04 0.00 0.01 0.00 0.00 72.50 68.69 1tri s THR 31 CO 0.31 0.49 0.31 -0.55 -0.69 0.00 0.00 174.62 174.49 1tri s SER 32 N -1.21 6.31 -0.39 3.53 0.15 -1.26 -5.05 113.70 115.78 1tri s SER 32 Ca 0.33 0.36 0.01 0.00 0.70 0.00 0.00 55.95 57.35 1tri s SER 32 Cb -0.20 -2.18 0.11 0.00 -1.71 0.00 0.00 66.02 62.03 1tri s SER 32 CO 0.22 -0.02 0.14 -0.63 1.20 0.00 0.00 173.24 174.15 1tri s ILE 33 N 1.23 2.77 -0.17 6.45 1.01 -1.26 -5.03 121.20 126.19 1tri s ILE 33 Ca 0.15 -2.32 0.01 0.00 0.00 0.00 0.00 60.65 58.49 1tri s ILE 33 Cb -0.14 -2.96 0.24 0.00 0.01 0.00 0.00 42.46 39.61 1tri s ILE 33 CO 0.07 -0.66 1.38 0.59 0.00 0.00 0.00 174.94 176.32 1tri n ASN 34 N 4.28 3.48 -3.75 3.58 3.02 -1.26 -4.85 115.26 119.76 1tri n ASN 34 Ca 0.02 -2.61 -0.09 0.00 -0.03 0.00 0.00 54.58 51.86 1tri n ASN 34 Cb 0.41 -0.66 -0.03 0.00 -0.61 0.00 0.00 39.78 38.89 1tri n ASN 34 CO 0.00 0.00 0.00 -1.38 -2.62 0.00 0.00 177.26 173.26 1tri s HIS 35 N -1.22 -0.13 -0.26 3.10 -3.43 -1.26 -5.10 115.29 106.99 1tri s HIS 35 Ca 0.21 -0.22 -0.29 0.00 -0.80 0.00 0.00 55.06 53.96 1tri s HIS 35 Cb 0.18 0.44 -0.01 0.00 -1.43 0.00 0.00 32.58 31.76 1tri s HIS 35 CO 0.04 -0.97 1.33 0.34 -2.00 0.00 0.00 174.74 173.47 1tri s ASP 36 N -2.88 6.71 -0.03 7.38 2.15 -1.26 -4.94 116.67 123.79 1tri s ASP 36 Ca 0.10 1.38 -0.29 0.00 0.43 0.00 0.00 52.55 54.17 1tri s ASP 36 Cb -0.02 -2.54 0.09 0.00 -0.30 0.00 0.00 42.92 40.16 1tri s ASP 36 CO -0.01 -1.02 0.80 0.54 -0.17 0.00 0.00 175.17 175.31 1tri s VAL 37 N 4.24 0.00 -0.19 1.11 0.11 -1.26 -4.53 120.40 119.88 1tri s VAL 37 Ca 0.58 0.00 0.01 0.00 -2.93 0.00 0.00 61.98 59.64 1tri s VAL 37 Cb -0.19 -1.00 0.03 0.00 -1.53 0.00 0.00 36.38 33.69 1tri s VAL 37 CO 0.22 0.00 -0.14 -1.58 -3.33 0.00 0.00 175.10 170.27 1tri s GLN 38 N -2.04 2.39 0.08 1.54 2.00 -0.31 -4.94 119.66 118.39 1tri s GLN 38 Ca -0.03 -0.81 -0.07 0.00 -2.00 0.00 0.00 55.36 52.45 1tri s GLN 38 Cb -0.01 -2.42 -0.05 0.00 0.80 0.00 0.00 33.01 31.33 1tri s GLN 38 CO -0.00 -0.33 0.35 0.00 -0.50 0.00 0.00 175.29 174.81 1tri s VAL 40 N -1.46 0.35 -0.39 0.00 1.01 -0.96 -0.27 120.40 118.68 1tri s VAL 40 Ca 0.34 -0.45 0.03 0.00 0.00 0.00 0.00 61.98 61.91 1tri s VAL 40 Cb -0.13 -0.35 0.11 0.00 0.00 0.00 0.00 36.38 36.01 1tri s VAL 40 CO 0.20 -0.07 0.13 -0.69 0.00 0.00 0.00 175.10 174.67 1tri s VAL 41 N -0.51 2.04 0.02 2.92 1.01 0.21 -0.71 120.40 125.37 1tri s VAL 41 Ca -0.03 -2.46 -0.26 0.00 0.00 0.00 0.00 61.98 59.23 1tri s VAL 41 Cb -0.04 -2.48 -0.05 0.00 0.00 0.00 0.00 36.38 33.81 1tri s VAL 41 CO -0.00 -0.69 0.81 0.00 0.00 0.00 0.00 175.10 175.21 1tri s ALA 42 N 0.66 3.31 0.22 5.51 0.00 -0.00 -2.17 121.76 129.29 1tri s ALA 42 Ca 0.13 0.32 -0.14 0.00 0.00 0.00 0.00 51.96 52.27 1tri s ALA 42 Cb -0.21 -3.08 0.01 0.00 0.00 0.00 0.00 23.12 19.84 1tri s ALA 42 CO -0.08 -0.04 0.48 -1.54 0.00 0.00 0.00 175.76 174.58 1tri s SER 43 N 0.35 -0.13 0.76 0.00 1.04 -0.86 -0.50 113.70 114.35 1tri s SER 43 Ca 0.42 -0.76 -0.12 0.00 0.48 0.00 0.00 55.95 55.96 1tri s SER 43 Cb -0.20 0.57 0.05 0.00 0.10 0.00 0.00 66.02 66.54 1tri s SER 43 CO 0.23 -1.09 1.12 0.42 0.98 0.00 0.00 173.24 174.90 1tri s THR 44 N -3.96 2.97 0.18 2.02 -4.23 -1.26 -3.44 115.64 107.92 1tri s THR 44 Ca 0.17 0.37 -0.18 0.00 -1.18 0.00 0.00 61.69 60.87 1tri s THR 44 Cb -0.01 -2.81 0.13 0.00 1.34 0.00 0.00 72.50 71.16 1tri s THR 44 CO 0.04 -0.35 1.62 -0.26 -0.54 0.00 0.00 174.62 175.13 1tri h PHE 45 N -0.79 -0.55 -0.33 3.99 0.04 -1.96 -2.15 116.94 115.20 1tri h PHE 45 Ca -0.45 0.05 0.09 0.00 2.80 0.00 0.00 57.97 60.47 1tri h PHE 45 Cb 1.25 0.31 -0.01 0.00 2.20 0.00 0.00 35.95 39.70 1tri h PHE 45 CO 0.54 -0.30 0.41 -0.24 -0.60 0.00 0.00 178.31 178.13 1tri h VAL 46 N -0.12 0.31 -0.32 -0.55 3.04 -2.04 0.38 116.25 116.95 1tri h VAL 46 Ca 0.22 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.91 1tri h VAL 46 Cb 0.46 0.66 0.00 0.00 -2.01 0.00 0.00 31.29 30.40 1tri h VAL 46 CO -0.55 0.00 0.00 1.41 -1.01 0.00 0.00 177.57 177.42 1tri n HIS 47 N -3.57 0.41 -0.10 3.17 8.25 -0.81 -4.48 115.22 118.09 1tri n HIS 47 Ca 0.05 -0.20 -0.13 0.00 -0.26 0.00 0.00 57.72 57.18 1tri n HIS 47 Cb 0.56 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.63 1tri n HIS 47 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1tri h LEU 48 N 3.79 0.69 -0.53 2.41 3.38 -0.28 -2.04 115.31 122.73 1tri h LEU 48 Ca 0.00 -0.44 0.06 0.00 0.09 0.00 0.00 57.88 57.59 1tri h LEU 48 Cb 0.83 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 41.34 1tri h LEU 48 CO 0.00 0.98 0.24 0.00 0.09 0.00 0.00 178.44 179.75 1tri h ALA 49 N 0.73 0.68 0.56 1.53 0.00 -1.79 -2.21 119.26 118.76 1tri h ALA 49 Ca 0.06 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1tri h ALA 49 Cb 0.75 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.53 1tri h ALA 49 CO 0.06 -0.13 -0.27 1.98 0.00 0.00 0.00 179.25 180.89 1tri h MET 50 N 0.46 -0.72 -0.83 0.00 1.85 -1.86 0.48 114.93 114.31 1tri h MET 50 Ca 0.25 0.05 0.05 0.00 -0.61 0.00 0.00 59.70 59.44 1tri h MET 50 Cb 0.21 0.16 -0.05 0.00 0.43 0.00 0.00 31.60 32.36 1tri h MET 50 CO -0.21 -0.42 0.55 1.15 -0.40 0.00 0.00 176.91 177.57 1tri h THR 51 N -0.93 1.08 -0.36 -0.77 2.02 -1.30 0.88 112.91 113.55 1tri h THR 51 Ca -0.08 -0.33 -0.10 0.00 0.77 0.00 0.00 66.41 66.67 1tri h THR 51 Cb 0.63 0.03 -0.02 0.00 -1.74 0.00 0.00 68.15 67.06 1tri h THR 51 CO 0.13 0.18 -0.20 0.50 0.37 0.00 0.00 175.52 176.49 1tri h LYS 52 N 0.97 0.67 0.01 6.66 3.64 -1.32 0.31 116.57 127.51 1tri h LYS 52 Ca 0.35 -0.25 -0.19 0.00 -1.27 0.00 0.00 60.65 59.28 1tri h LYS 52 Cb 0.14 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 1tri h LYS 52 CO -0.12 0.83 -0.88 0.93 -2.27 0.00 0.00 179.45 177.94 1tri h GLU 53 N 0.60 0.10 0.09 1.90 3.07 0.16 -3.38 114.58 117.12 1tri h GLU 53 Ca 0.09 -0.12 -0.36 0.00 -0.50 0.00 0.00 59.36 58.47 1tri h GLU 53 Cb 0.67 0.04 -0.03 0.00 -0.84 0.00 0.00 28.75 28.58 1tri h GLU 53 CO 0.05 0.92 -2.04 0.54 -1.40 0.00 0.00 179.01 177.08 1tri n ARG 54 N -3.59 0.72 -1.68 2.33 1.74 0.15 -4.88 116.66 111.46 1tri n ARG 54 Ca -0.02 0.27 -0.47 0.00 -0.77 0.00 0.00 57.85 56.86 1tri n ARG 54 Cb 0.82 -1.67 -0.04 0.00 -1.02 0.00 0.00 32.46 30.55 1tri n ARG 54 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 1tri n LEU 55 N -3.54 3.42 0.00 0.55 0.00 0.11 -4.82 117.00 112.71 1tri n LEU 55 Ca -0.35 1.01 0.00 0.00 0.00 0.00 0.00 56.01 56.67 1tri n LEU 55 Cb 1.00 -1.41 0.00 0.00 0.00 0.00 0.00 43.42 43.01 1tri n LEU 55 CO 0.37 -0.10 -0.36 -1.20 0.00 0.00 0.00 177.39 176.09 1tri n SER 56 N 5.48 3.64 -4.67 1.96 7.64 -1.26 -4.92 113.62 121.49 1tri n SER 56 Ca 0.20 -0.08 -0.48 0.00 1.01 0.00 0.00 58.87 59.51 1tri n SER 56 Cb 0.30 0.90 -0.05 0.00 -1.01 0.00 0.00 64.21 64.35 1tri n SER 56 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 1tri n HIS 57 N -1.26 2.25 -0.34 1.43 -0.00 -1.26 -4.87 115.22 111.17 1tri n HIS 57 Ca 0.00 0.16 0.13 0.00 -0.00 0.00 0.00 57.72 58.01 1tri n HIS 57 Cb 0.00 -2.59 0.34 0.00 -0.00 0.00 0.00 29.99 27.74 1tri n HIS 57 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1tri h PRO 58 N 7.67 0.72 -0.13 1.57 0.13 -1.97 -1.56 132.00 138.44 1tri h PRO 58 Ca -0.47 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1tri h PRO 58 Cb 1.27 -0.16 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1tri h PRO 58 CO 0.92 0.47 0.00 1.63 -0.23 0.00 0.00 178.00 180.79 1tri n LYS 59 N -4.70 1.35 -4.22 0.86 5.02 -1.26 -4.89 118.16 110.32 1tri n LYS 59 Ca 0.22 -0.53 -0.29 0.00 -2.02 0.00 0.00 58.31 55.69 1tri n LYS 59 Cb 0.56 -1.20 -0.09 0.00 -0.02 0.00 0.00 35.03 34.28 1tri n LYS 59 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1tri s PHE 60 N -1.83 2.76 0.17 2.13 0.40 -0.59 -0.33 117.98 120.69 1tri s PHE 60 Ca 0.17 -0.15 0.02 0.00 -0.60 0.00 0.00 56.93 56.38 1tri s PHE 60 Cb 0.09 -1.43 -0.05 0.00 0.51 0.00 0.00 43.02 42.14 1tri s PHE 60 CO 0.13 0.45 -0.02 0.14 0.70 0.00 0.00 175.22 176.62 1tri s VAL 61 N -1.30 0.76 0.18 -0.44 -7.23 0.63 -4.89 120.40 108.11 1tri s VAL 61 Ca 0.23 -1.99 0.10 0.00 -1.81 0.00 0.00 61.98 58.51 1tri s VAL 61 Cb -0.11 -2.06 -0.04 0.00 0.56 0.00 0.00 36.38 34.73 1tri s VAL 61 CO 0.15 -0.54 -0.17 0.27 -0.31 0.00 0.00 175.10 174.50 1tri s ILE 62 N -3.60 2.78 0.09 -0.62 -4.36 -1.26 0.63 121.20 114.86 1tri s ILE 62 Ca 0.22 -1.83 -0.14 0.00 -0.26 0.00 0.00 60.65 58.65 1tri s ILE 62 Cb 0.06 -2.35 0.02 0.00 1.25 0.00 0.00 42.46 41.43 1tri s ILE 62 CO 0.03 -0.10 0.32 0.00 0.24 0.00 0.00 174.94 175.42 1tri s ALA 63 N -1.67 -0.68 0.53 2.27 0.00 -0.92 -3.98 121.76 117.32 1tri s ALA 63 Ca 0.23 -0.15 0.09 0.00 0.00 0.00 0.00 51.96 52.12 1tri s ALA 63 Cb -0.08 0.50 0.07 0.00 0.00 0.00 0.00 23.12 23.60 1tri s ALA 63 CO 0.12 -0.53 0.73 0.00 0.00 0.00 0.00 175.76 176.09 1tri s ALA 64 N -3.35 4.65 0.04 0.00 0.00 -0.18 -2.02 121.76 120.91 1tri s ALA 64 Ca 0.01 -2.01 0.06 0.00 0.00 0.00 0.00 51.96 50.01 1tri s ALA 64 Cb 0.02 -1.51 -0.03 0.00 0.00 0.00 0.00 23.12 21.59 1tri s ALA 64 CO -0.08 -0.71 -0.12 -0.65 0.00 0.00 0.00 175.76 174.20 1tri s GLN 65 N -4.58 2.26 -0.06 0.00 -0.21 -1.22 -1.03 119.66 114.80 1tri s GLN 65 Ca 0.60 -0.90 0.00 0.00 0.02 0.00 0.00 55.36 55.08 1tri s GLN 65 Cb -0.07 -2.33 0.00 0.00 1.00 0.00 0.00 33.01 31.61 1tri s GLN 65 CO 0.37 0.55 0.00 0.09 -2.12 0.00 0.00 175.29 174.19 1tri n ASN 66 N 1.33 -1.09 -4.68 5.90 3.02 0.71 -4.89 115.26 115.56 1tri n ASN 66 Ca -0.15 0.44 -0.42 0.00 -0.03 0.00 0.00 54.58 54.42 1tri n ASN 66 Cb 0.52 -1.10 -0.03 0.00 -0.61 0.00 0.00 39.78 38.57 1tri n ASN 66 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1tri s ALA 67 N -1.96 3.64 0.00 5.41 0.00 -1.26 -4.96 121.76 122.64 1tri s ALA 67 Ca 0.00 1.07 0.00 0.00 0.00 0.00 0.00 51.96 53.03 1tri s ALA 67 Cb 0.00 -3.71 0.00 0.00 0.00 0.00 0.00 23.12 19.41 1tri s ALA 67 CO 0.00 -1.22 0.00 0.41 0.00 0.00 0.00 175.76 174.95 1tri n GLY 68 N 4.04 -0.18 3.05 0.00 0.00 -1.26 -4.95 105.19 105.89 1tri n GLY 68 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 1tri n GLY 68 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1tri n ASN 69 N -0.01 -3.03 -0.33 1.61 2.85 -1.26 -4.70 115.26 110.38 1tri n ASN 69 Ca 0.00 0.69 0.19 0.00 -0.11 0.00 0.00 54.58 55.35 1tri n ASN 69 Cb 0.00 -0.81 0.43 0.00 1.24 0.00 0.00 39.78 40.64 1tri n ASN 69 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1tri h ALA 70 N 0.15 1.98 0.06 5.20 0.00 -1.99 -1.96 119.26 122.70 1tri h ALA 70 Ca -0.36 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.63 1tri h ALA 70 Cb 1.35 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.15 1tri h ALA 70 CO 0.41 -0.40 -0.03 -0.44 0.00 0.00 0.00 179.25 178.80 1tri h ASP 71 N 0.52 -0.07 -0.72 0.00 5.19 -2.00 -2.23 116.42 117.12 1tri h ASP 71 Ca 0.61 -0.30 0.16 0.00 -0.62 0.00 0.00 57.03 56.88 1tri h ASP 71 Cb 1.30 0.02 -0.11 0.00 0.18 0.00 0.00 39.33 40.71 1tri h ASP 71 CO -0.38 0.27 0.14 0.00 -3.12 0.00 0.00 179.24 176.16 1tri h ALA 72 N 0.50 0.90 -0.55 3.45 0.00 -1.71 0.28 119.26 122.14 1tri h ALA 72 Ca -0.01 0.18 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 1tri h ALA 72 Cb 0.36 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 1tri h ALA 72 CO 0.01 -0.35 0.14 1.25 0.00 0.00 0.00 179.25 180.30 1tri h LEU 80 N 0.23 0.77 -0.24 0.00 5.85 -1.39 -0.23 115.31 120.31 1tri h LEU 80 Ca 0.40 -0.13 -0.09 0.00 0.84 0.00 0.00 57.88 58.90 1tri h LEU 80 Cb 0.69 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 41.52 1tri h LEU 80 CO -0.53 0.75 -0.22 0.00 -0.34 0.00 0.00 178.44 178.11 1tri h ALA 81 N 1.35 0.35 -0.23 1.25 0.00 0.17 -2.65 119.26 119.50 1tri h ALA 81 Ca 0.18 -0.36 -0.12 0.00 0.00 0.00 0.00 54.91 54.61 1tri h ALA 81 Cb 0.28 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1tri h ALA 81 CO -0.00 0.30 -0.35 0.66 0.00 0.00 0.00 179.25 179.86 1tri h SER 82 N 0.27 0.51 0.00 0.00 4.64 -1.06 0.19 113.55 118.10 1tri h SER 82 Ca 0.04 -0.20 -0.04 0.00 -0.47 0.00 0.00 61.79 61.12 1tri h SER 82 Cb 0.77 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.71 1tri h SER 82 CO 0.06 0.82 -0.09 -0.07 -0.87 0.00 0.00 176.83 176.67 1tri h LEU 83 N 0.42 0.20 -0.02 5.97 3.38 -1.01 0.88 115.31 125.13 1tri h LEU 83 Ca 0.05 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1tri h LEU 83 Cb 0.81 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.50 1tri h LEU 83 CO 0.07 0.33 -0.01 0.50 0.09 0.00 0.00 178.44 179.41 1tri h LYS 84 N 0.21 0.04 -0.06 1.13 3.11 -1.03 0.72 116.57 120.68 1tri h LYS 84 Ca 0.05 -0.02 0.00 0.00 -2.81 0.00 0.00 60.65 57.87 1tri h LYS 84 Cb 0.30 -0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.53 1tri h LYS 84 CO 0.02 0.49 0.00 -3.47 -2.81 0.00 0.00 179.45 173.67 1tri n ASP 85 N -4.84 0.06 0.00 4.20 -0.08 0.60 -2.36 116.55 114.14 1tri n ASP 85 Ca -0.08 -1.15 0.00 0.00 -1.51 0.00 0.00 54.79 52.05 1tri n ASP 85 Cb 0.25 -0.03 0.00 0.00 2.34 0.00 0.00 41.12 43.67 1tri n ASP 85 CO 0.00 0.00 0.00 0.33 0.12 0.00 0.00 177.20 177.65 1tri n PHE 86 N -0.42 0.00 -0.14 -0.67 7.35 0.20 -4.97 117.46 118.81 1tri n PHE 86 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 1tri n PHE 86 Cb 0.02 0.00 0.00 0.00 0.35 0.00 0.00 39.48 39.85 1tri n PHE 86 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1tri n GLY 87 N 0.42 0.92 3.68 7.13 0.00 -1.00 -5.05 105.19 111.29 1tri n GLY 87 Ca 0.00 -0.12 -0.36 0.00 0.00 0.00 0.00 46.02 45.54 1tri n GLY 87 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1tri s VAL 88 N -2.00 5.35 -0.66 1.61 1.01 0.25 -4.96 120.40 120.99 1tri s VAL 88 Ca 0.00 0.26 0.07 0.00 0.00 0.00 0.00 61.98 62.31 1tri s VAL 88 Cb 0.00 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 32.85 1tri s VAL 88 CO 0.00 0.35 0.53 0.59 0.00 0.00 0.00 175.10 176.58 1tri n ASN 89 N 4.13 1.04 -4.23 3.32 3.02 -1.26 -4.01 115.26 117.27 1tri n ASN 89 Ca -0.14 -1.02 -0.21 0.00 -0.03 0.00 0.00 54.58 53.18 1tri n ASN 89 Cb 0.52 0.45 -0.12 0.00 -0.61 0.00 0.00 39.78 40.02 1tri n ASN 89 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 1tri s TRP 90 N -1.07 1.50 0.02 3.10 0.52 -1.26 -1.49 118.94 120.26 1tri s TRP 90 Ca 0.06 -0.44 -0.01 0.00 0.02 0.00 0.00 56.10 55.72 1tri s TRP 90 Cb 0.06 -0.83 -0.02 0.00 -1.15 0.00 0.00 33.47 31.53 1tri s TRP 90 CO 0.17 0.13 -0.00 0.42 0.02 0.00 0.00 176.95 177.69 1tri s ILE 91 N -1.25 0.11 -0.11 2.03 1.01 -0.19 -1.01 121.20 121.78 1tri s ILE 91 Ca 0.02 -0.90 -0.01 0.00 0.00 0.00 0.00 60.65 59.77 1tri s ILE 91 Cb -0.10 -0.32 0.03 0.00 0.01 0.00 0.00 42.46 42.08 1tri s ILE 91 CO 0.03 -0.49 -0.04 -0.69 0.00 0.00 0.00 174.94 173.74 1tri s VAL 92 N -1.51 0.82 -0.39 2.92 1.01 -0.20 0.81 120.40 123.85 1tri s VAL 92 Ca -0.15 -0.22 -0.09 0.00 0.00 0.00 0.00 61.98 61.52 1tri s VAL 92 Cb -0.09 -0.92 0.06 0.00 0.00 0.00 0.00 36.38 35.42 1tri s VAL 92 CO -0.01 0.28 0.21 -0.76 0.00 0.00 0.00 175.10 174.82 1tri s LEU 93 N 1.79 4.86 -1.39 3.92 1.02 0.12 -0.21 118.68 128.79 1tri s LEU 93 Ca 0.04 -1.29 -0.12 0.00 0.02 0.00 0.00 54.13 52.79 1tri s LEU 93 Cb -0.13 -1.97 0.09 0.00 0.02 0.00 0.00 46.19 44.20 1tri s LEU 93 CO -0.07 -0.45 2.10 0.61 0.02 0.00 0.00 176.35 178.55 1tri n GLY 94 N 4.92 4.57 0.10 -3.19 0.00 -1.26 0.81 105.19 111.14 1tri n GLY 94 Ca -0.11 -1.80 -0.12 0.00 0.00 0.00 0.00 46.02 43.99 1tri n GLY 94 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1tri h HIS 95 N 5.86 0.23 -1.07 1.61 2.76 -1.82 -3.18 115.15 119.55 1tri h HIS 95 Ca 0.50 -0.05 0.29 0.00 -2.20 0.00 0.00 60.37 58.92 1tri h HIS 95 Cb 0.63 -0.06 -0.07 0.00 1.55 0.00 0.00 27.41 29.46 1tri h HIS 95 CO 1.38 0.49 0.73 0.66 -1.30 0.00 0.00 177.93 179.89 1tri h SER 96 N -0.09 0.20 0.16 3.26 4.64 -1.39 0.18 113.55 120.52 1tri h SER 96 Ca 0.03 0.04 -0.28 0.00 -0.47 0.00 0.00 61.79 61.11 1tri h SER 96 Cb 0.40 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.51 1tri h SER 96 CO 0.01 0.04 -1.35 -0.33 -0.87 0.00 0.00 176.83 174.33 1tri h GLU 97 N 0.18 0.35 -0.68 4.77 5.08 -1.86 -3.04 114.58 119.37 1tri h GLU 97 Ca 0.55 -0.59 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 1tri h GLU 97 Cb 1.82 0.22 -0.03 0.00 0.50 0.00 0.00 28.75 31.26 1tri h GLU 97 CO -0.13 1.28 0.35 0.00 -1.00 0.00 0.00 179.01 179.51 1tri h ARG 98 N -0.15 0.94 0.34 2.33 3.08 -1.38 0.19 114.38 119.73 1tri h ARG 98 Ca -0.26 -0.11 -0.02 0.00 0.07 0.00 0.00 59.98 59.66 1tri h ARG 98 Cb 1.88 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 31.75 1tri h ARG 98 CO 0.15 0.71 -0.16 -0.09 -1.07 0.00 0.00 179.97 179.51 1tri h ARG 99 N 0.95 -0.44 -0.81 0.04 2.43 -0.79 -1.01 114.38 114.75 1tri h ARG 99 Ca 0.24 0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.46 1tri h ARG 99 Cb 0.06 0.10 -0.05 0.00 -0.42 0.00 0.00 29.97 29.66 1tri h ARG 99 CO -0.04 -0.12 0.52 0.00 -1.51 0.00 0.00 179.97 178.83 1tri h ALA 100 N -0.31 1.05 0.07 2.80 0.00 -1.40 -0.08 119.26 121.40 1tri h ALA 100 Ca -0.05 -0.04 -0.34 0.00 0.00 0.00 0.00 54.91 54.49 1tri h ALA 100 Cb 0.52 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1tri h ALA 100 CO 0.08 0.36 -1.87 0.66 0.00 0.00 0.00 179.25 178.48 1tri n TYR 101 N -4.57 0.98 0.73 0.00 4.01 0.65 -4.57 117.16 114.39 1tri n TYR 101 Ca 0.09 0.27 0.08 0.00 -0.16 0.00 0.00 57.90 58.19 1tri n TYR 101 Cb 0.07 -1.12 0.05 0.00 -0.31 0.00 0.00 39.34 38.03 1tri n TYR 101 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1tri n TYR 102 N -3.79 0.00 -3.27 -0.72 4.01 -0.44 -5.01 117.16 107.93 1tri n TYR 102 Ca -0.35 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.21 1tri n TYR 102 Cb 0.92 0.00 0.06 0.00 -0.31 0.00 0.00 39.34 40.01 1tri n TYR 102 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1tri n GLY 103 N 1.04 -0.17 3.73 2.72 0.00 -0.04 -4.98 105.19 107.49 1tri n GLY 103 Ca 0.09 0.01 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1tri n GLY 103 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1tri s GLU 104 N -5.93 4.40 0.56 1.61 2.12 -0.88 -4.94 118.70 115.65 1tri s GLU 104 Ca 0.42 2.01 -0.16 0.00 0.36 0.00 0.00 54.97 57.60 1tri s GLU 104 Cb -0.19 -3.21 -0.05 0.00 0.26 0.00 0.00 34.13 30.94 1tri s GLU 104 CO 0.52 -0.24 1.03 0.95 -0.54 0.00 0.00 175.26 176.98 1tri s THR 105 N 0.18 4.11 0.47 -1.70 -4.23 -1.26 -4.33 115.64 108.88 1tri s THR 105 Ca 0.57 1.01 0.30 0.00 -1.18 0.00 0.00 61.69 62.39 1tri s THR 105 Cb -0.35 -3.52 0.33 0.00 1.34 0.00 0.00 72.50 70.29 1tri s THR 105 CO 0.37 -0.58 2.15 0.78 -0.54 0.00 0.00 174.62 176.80 1tri h ASN 106 N 0.66 0.00 -0.42 3.99 2.35 -1.97 -2.26 115.58 117.92 1tri h ASN 106 Ca -0.47 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.24 1tri h ASN 106 Cb 1.21 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.56 1tri h ASN 106 CO 0.59 0.07 0.11 -0.33 -1.65 0.00 0.00 177.43 176.22 1tri h GLU 107 N 0.00 0.67 -0.34 0.81 4.39 -1.93 -3.01 114.58 115.17 1tri h GLU 107 Ca -0.00 -0.16 -0.05 0.00 0.34 0.00 0.00 59.36 59.49 1tri h GLU 107 Cb 0.23 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.77 1tri h GLU 107 CO 0.01 0.68 0.01 0.82 -1.16 0.00 0.00 179.01 179.37 1tri h ILE 108 N 0.55 1.26 0.00 3.13 2.04 -1.79 -2.74 117.51 119.94 1tri h ILE 108 Ca 0.13 -0.95 -0.04 0.00 1.00 0.00 0.00 64.86 65.00 1tri h ILE 108 Cb 0.30 1.20 -0.01 0.00 -0.74 0.00 0.00 36.82 37.58 1tri h ILE 108 CO 0.00 0.31 -0.20 1.62 0.00 0.00 0.00 178.15 179.88 1tri h VAL 109 N 0.41 0.93 -0.31 1.67 3.04 -1.55 -2.68 116.25 117.76 1tri h VAL 109 Ca 0.10 -0.75 -0.13 0.00 -1.01 0.00 0.00 66.70 64.91 1tri h VAL 109 Cb 0.44 1.43 -0.01 0.00 -2.01 0.00 0.00 31.29 31.14 1tri h VAL 109 CO 0.02 0.20 -0.35 0.00 -1.01 0.00 0.00 177.57 176.42 1tri h ALA 110 N 1.80 0.80 -0.14 3.17 0.00 -1.37 -0.50 119.26 123.03 1tri h ALA 110 Ca -0.00 -0.42 -0.10 0.00 0.00 0.00 0.00 54.91 54.39 1tri h ALA 110 Cb 0.41 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1tri h ALA 110 CO 0.03 0.65 -0.35 -0.44 0.00 0.00 0.00 179.25 179.14 1tri h ASP 111 N 0.58 0.29 0.31 0.00 3.32 -1.36 -1.74 116.42 117.83 1tri h ASP 111 Ca 0.06 -0.11 -0.02 0.00 0.02 0.00 0.00 57.03 56.99 1tri h ASP 111 Cb 0.87 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.35 1tri h ASP 111 CO 0.08 0.62 -0.15 0.11 -1.72 0.00 0.00 179.24 178.18 1tri h LYS 112 N 0.24 -0.41 -0.45 3.56 1.57 -1.16 0.22 116.57 120.15 1tri h LYS 112 Ca 0.03 0.03 0.04 0.00 -1.87 0.00 0.00 60.65 58.88 1tri h LYS 112 Cb 0.73 0.09 -0.04 0.00 0.08 0.00 0.00 32.23 33.09 1tri h LYS 112 CO 0.06 -0.11 0.22 0.28 -0.57 0.00 0.00 179.45 179.33 1tri h VAL 113 N -0.71 0.95 -0.10 0.50 2.07 -1.08 0.07 116.25 117.95 1tri h VAL 113 Ca -0.04 -0.15 0.04 0.00 0.82 0.00 0.00 66.70 67.37 1tri h VAL 113 Cb 0.49 0.48 -0.05 0.00 -1.52 0.00 0.00 31.29 30.69 1tri h VAL 113 CO 0.07 0.08 -0.19 0.00 0.02 0.00 0.00 177.57 177.55 1tri h ALA 114 N 1.25 -0.16 -0.91 1.67 0.00 -1.16 0.27 119.26 120.22 1tri h ALA 114 Ca 0.20 0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.15 1tri h ALA 114 Cb 0.12 0.36 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 1tri h ALA 114 CO -0.15 -0.65 0.60 0.00 0.00 0.00 0.00 179.25 179.05 1tri h ALA 115 N 0.73 1.15 -0.06 0.00 0.00 -0.06 -1.88 119.26 119.15 1tri h ALA 115 Ca 0.09 -0.07 -0.24 0.00 0.00 0.00 0.00 54.91 54.70 1tri h ALA 115 Cb 0.38 -0.37 0.02 0.00 0.00 0.00 0.00 17.79 17.82 1tri h ALA 115 CO -0.25 0.55 -0.88 0.00 0.00 0.00 0.00 179.25 178.68 1tri h ALA 116 N 1.33 0.19 -0.95 0.00 0.00 -0.59 -2.69 119.26 116.55 1tri h ALA 116 Ca 0.33 -0.64 0.13 0.00 0.00 0.00 0.00 54.91 54.73 1tri h ALA 116 Cb -0.14 0.03 -0.08 0.00 0.00 0.00 0.00 17.79 17.60 1tri h ALA 116 CO -0.07 0.64 0.60 0.28 0.00 0.00 0.00 179.25 180.70 1tri h VAL 117 N 0.39 0.89 -0.08 0.00 2.07 -0.16 -0.08 116.25 119.28 1tri h VAL 117 Ca -0.09 -0.30 -0.09 0.00 0.82 0.00 0.00 66.70 67.04 1tri h VAL 117 Cb 1.53 -0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 1tri h VAL 117 CO 0.18 0.16 -0.36 0.00 0.02 0.00 0.00 177.57 177.57 1tri h ALA 118 N 1.57 1.25 -0.00 1.67 0.00 -1.33 -1.13 119.26 121.28 1tri h ALA 118 Ca 0.47 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1tri h ALA 118 Cb 0.57 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1tri h ALA 118 CO -0.23 0.52 -0.03 0.43 0.00 0.00 0.00 179.25 179.93 1tri n SER 119 N -4.08 0.43 0.00 0.00 7.64 -0.18 -4.91 113.62 112.52 1tri n SER 119 Ca -0.01 -0.89 0.00 0.00 1.01 0.00 0.00 58.87 58.98 1tri n SER 119 Cb 0.43 -0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.58 1tri n SER 119 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1tri n GLY 120 N 1.14 0.69 3.92 0.23 0.00 -0.43 -5.05 105.19 105.69 1tri n GLY 120 Ca 0.19 -0.51 -0.26 0.00 0.00 0.00 0.00 46.02 45.44 1tri n GLY 120 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1tri s PHE 121 N -2.00 3.54 -0.03 1.61 0.40 -0.41 -4.97 117.98 116.11 1tri s PHE 121 Ca 0.00 0.65 -0.21 0.00 -0.60 0.00 0.00 56.93 56.77 1tri s PHE 121 Cb 0.00 -2.16 -0.05 0.00 0.51 0.00 0.00 43.02 41.32 1tri s PHE 121 CO 0.00 -0.11 0.63 -1.64 0.70 0.00 0.00 175.22 174.79 1tri s MET 122 N -4.51 4.37 -0.12 0.44 -1.94 -0.56 -4.43 119.30 112.56 1tri s MET 122 Ca 0.45 0.77 0.02 0.00 -1.71 0.00 0.00 55.69 55.22 1tri s MET 122 Cb -0.10 -3.38 0.01 0.00 2.01 0.00 0.00 34.83 33.37 1tri s MET 122 CO 0.41 0.26 -0.17 0.08 -0.01 0.00 0.00 175.02 175.59 1tri s VAL 123 N 0.17 1.64 -0.42 -6.03 1.01 -0.55 -1.03 120.40 115.19 1tri s VAL 123 Ca 0.33 -0.73 -0.13 0.00 0.00 0.00 0.00 61.98 61.45 1tri s VAL 123 Cb -0.18 -1.49 0.05 0.00 0.00 0.00 0.00 36.38 34.76 1tri s VAL 123 CO 0.17 0.47 0.30 -0.63 0.00 0.00 0.00 175.10 175.41 1tri s ILE 124 N 0.95 4.86 -0.27 2.22 1.01 0.24 -0.82 121.20 129.39 1tri s ILE 124 Ca -0.06 -0.99 -0.11 0.00 0.00 0.00 0.00 60.65 59.49 1tri s ILE 124 Cb -0.15 -3.82 -0.05 0.00 0.01 0.00 0.00 42.46 38.45 1tri s ILE 124 CO -0.02 -0.41 0.18 0.00 0.00 0.00 0.00 174.94 174.69 1tri s ALA 125 N 1.58 3.55 -0.27 9.38 0.00 -0.95 0.15 121.76 135.20 1tri s ALA 125 Ca 0.03 -1.03 -0.14 0.00 0.00 0.00 0.00 51.96 50.82 1tri s ALA 125 Cb -0.21 -2.44 -0.04 0.00 0.00 0.00 0.00 23.12 20.42 1tri s ALA 125 CO 0.07 -0.46 0.32 0.00 0.00 0.00 0.00 175.76 175.69 1tri s ILE 127 N 1.95 1.54 0.00 0.00 -4.36 0.14 -1.07 121.20 119.40 1tri s ILE 127 Ca 0.13 -1.86 0.00 0.00 -0.26 0.00 0.00 60.65 58.66 1tri s ILE 127 Cb -0.16 -1.71 0.00 0.00 1.25 0.00 0.00 42.46 41.84 1tri s ILE 127 CO 0.10 -0.42 0.00 0.61 0.24 0.00 0.00 174.94 175.47 1tri n GLY 128 N 0.31 0.89 3.85 6.27 0.00 -1.26 -0.11 105.19 115.15 1tri n GLY 128 Ca -0.14 -1.14 -0.22 0.00 0.00 0.00 0.00 46.02 44.52 1tri n GLY 128 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1tri s GLU 129 N -2.00 3.04 0.57 1.61 1.03 -1.26 -4.80 118.70 116.89 1tri s GLU 129 Ca 0.00 -0.96 -0.08 0.00 0.03 0.00 0.00 54.97 53.96 1tri s GLU 129 Cb 0.00 -2.65 -0.02 0.00 -0.80 0.00 0.00 34.13 30.66 1tri s GLU 129 CO 0.00 0.42 0.92 0.95 -1.33 0.00 0.00 175.26 176.22 1tri s THR 130 N -2.05 4.45 0.15 1.83 -4.23 -1.26 -1.31 115.64 113.22 1tri s THR 130 Ca 0.33 0.42 -0.28 0.00 -1.18 0.00 0.00 61.69 60.98 1tri s THR 130 Cb -0.08 -3.75 -0.02 0.00 1.34 0.00 0.00 72.50 69.99 1tri s THR 130 CO 0.26 -0.85 1.57 0.25 -0.54 0.00 0.00 174.62 175.30 1tri h LEU 131 N -0.13 -1.50 -0.94 4.79 5.85 -1.97 0.50 115.31 121.92 1tri h LEU 131 Ca -0.45 0.22 0.15 0.00 0.84 0.00 0.00 57.88 58.64 1tri h LEU 131 Cb 1.21 0.65 -0.09 0.00 0.37 0.00 0.00 40.66 42.80 1tri h LEU 131 CO 0.62 -0.37 0.55 1.56 -0.34 0.00 0.00 178.44 180.45 1tri h GLN 132 N -0.34 0.76 -0.25 1.25 7.50 -2.00 0.11 115.11 122.14 1tri h GLN 132 Ca 0.13 -0.05 -0.16 0.00 0.50 0.00 0.00 58.65 59.08 1tri h GLN 132 Cb 0.59 -0.17 -0.01 0.00 0.05 0.00 0.00 27.48 27.94 1tri h GLN 132 CO -0.58 0.50 -0.48 0.93 -1.50 0.00 0.00 178.83 177.69 1tri h GLU 133 N 0.78 0.67 -0.10 1.46 5.08 -1.51 -2.80 114.58 118.16 1tri h GLU 133 Ca 0.51 -0.39 0.02 0.00 -1.00 0.00 0.00 59.36 58.50 1tri h GLU 133 Cb 0.68 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.94 1tri h GLU 133 CO -0.34 1.00 -0.01 -0.09 -1.00 0.00 0.00 179.01 178.58 1tri h ARG 134 N 0.53 0.02 0.53 2.33 9.65 0.12 0.17 114.38 127.73 1tri h ARG 134 Ca 0.03 -0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 58.89 1tri h ARG 134 Cb 1.04 -0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.59 1tri h ARG 134 CO 0.10 0.01 -0.51 0.93 2.80 0.00 0.00 179.97 183.30 1tri h GLU 135 N 0.02 -1.00 -0.25 0.20 5.08 -0.91 -2.66 114.58 115.06 1tri h GLU 135 Ca 0.05 0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1tri h GLU 135 Cb 0.06 0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1tri h GLU 135 CO -0.09 -0.67 0.00 -1.13 -1.00 0.00 0.00 179.01 176.12 1tri n SER 136 N -5.56 0.25 -2.22 1.42 3.41 -1.06 -4.72 113.62 105.14 1tri n SER 136 Ca -0.12 -0.64 -0.18 0.00 -0.26 0.00 0.00 58.87 57.66 1tri n SER 136 Cb 0.47 -0.12 -0.02 0.00 -0.26 0.00 0.00 64.21 64.27 1tri n SER 136 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1tri n GLY 137 N 0.22 0.00 1.18 5.00 0.00 -1.00 -4.87 105.19 105.72 1tri n GLY 137 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 1tri n GLY 137 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tri n ARG 138 N -2.79 2.75 0.50 1.61 1.74 0.59 -4.63 116.66 116.44 1tri n ARG 138 Ca -0.21 -2.14 -0.21 0.00 -0.77 0.00 0.00 57.85 54.53 1tri n ARG 138 Cb 0.65 -1.61 -0.10 0.00 -1.02 0.00 0.00 32.46 30.38 1tri n ARG 138 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 1tri h THR 139 N 3.24 0.01 -0.59 0.55 2.02 -1.84 -2.15 112.91 114.14 1tri h THR 139 Ca 0.00 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.28 1tri h THR 139 Cb 0.99 0.01 -0.08 0.00 -1.74 0.00 0.00 68.15 67.33 1tri h THR 139 CO 0.10 0.00 0.18 0.00 0.37 0.00 0.00 175.52 176.17 1tri h ALA 140 N -1.29 0.73 0.74 6.16 0.00 -1.95 -0.59 119.26 123.06 1tri h ALA 140 Ca -0.13 0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1tri h ALA 140 Cb 1.02 0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.93 1tri h ALA 140 CO 0.19 -0.25 -0.36 0.28 0.00 0.00 0.00 179.25 179.11 1tri h VAL 141 N 0.33 0.25 -0.51 0.00 2.07 -1.88 -2.04 116.25 114.47 1tri h VAL 141 Ca 0.30 -0.07 0.10 0.00 0.82 0.00 0.00 66.70 67.86 1tri h VAL 141 Cb 0.41 0.27 -0.10 0.00 -1.52 0.00 0.00 31.29 30.35 1tri h VAL 141 CO -0.35 0.01 -0.11 0.58 0.02 0.00 0.00 177.57 177.72 1tri h VAL 142 N -1.04 0.50 0.21 2.57 2.07 -1.13 0.87 116.25 120.30 1tri h VAL 142 Ca -0.10 -0.01 -0.01 0.00 0.82 0.00 0.00 66.70 67.40 1tri h VAL 142 Cb 0.77 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 31.03 1tri h VAL 142 CO 0.17 0.00 -0.10 0.58 0.02 0.00 0.00 177.57 178.24 1tri h VAL 143 N 0.02 0.85 -0.96 2.57 2.07 -1.11 -1.12 116.25 118.56 1tri h VAL 143 Ca 0.25 -0.29 0.12 0.00 0.82 0.00 0.00 66.70 67.59 1tri h VAL 143 Cb 0.38 1.02 -0.08 0.00 -1.52 0.00 0.00 31.29 31.09 1tri h VAL 143 CO -0.51 0.07 0.59 -0.07 0.02 0.00 0.00 177.57 177.66 1tri h LEU 144 N -0.43 0.86 -1.23 2.57 3.38 -1.05 0.66 115.31 120.07 1tri h LEU 144 Ca -0.03 0.05 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 1tri h LEU 144 Cb 0.33 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 1tri h LEU 144 CO 0.05 0.46 0.00 0.74 0.09 0.00 0.00 178.44 179.78 1tri h THR 145 N 0.94 1.20 -0.02 0.22 2.02 -0.61 -2.55 112.91 114.10 1tri h THR 145 Ca 0.47 -0.78 -0.02 0.00 0.77 0.00 0.00 66.41 66.86 1tri h THR 145 Cb 0.47 0.94 0.00 0.00 -1.74 0.00 0.00 68.15 67.82 1tri h THR 145 CO -0.27 0.27 -0.05 1.56 0.37 0.00 0.00 175.52 177.41 1tri h GLN 146 N 0.51 0.07 -0.37 6.66 4.20 0.16 -2.89 115.11 123.45 1tri h GLN 146 Ca 0.11 -0.05 0.08 0.00 0.06 0.00 0.00 58.65 58.85 1tri h GLN 146 Cb 0.33 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.09 1tri h GLN 146 CO 0.01 0.63 0.26 0.97 -0.67 0.00 0.00 178.83 180.03 1tri h ILE 147 N -0.49 0.90 -0.12 2.54 6.09 -1.35 -2.96 117.51 122.12 1tri h ILE 147 Ca 0.00 -0.06 -0.13 0.00 -1.37 0.00 0.00 64.86 63.31 1tri h ILE 147 Cb 0.63 0.72 0.00 0.00 0.47 0.00 0.00 36.82 38.65 1tri h ILE 147 CO 0.01 0.03 -0.42 0.00 -3.07 0.00 0.00 178.15 174.70 1tri h ALA 148 N 1.81 0.21 -0.79 0.18 0.00 -1.49 -0.69 119.26 118.49 1tri h ALA 148 Ca 0.17 -0.47 0.05 0.00 0.00 0.00 0.00 54.91 54.65 1tri h ALA 148 Cb 0.46 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.18 1tri h ALA 148 CO -0.03 0.33 0.52 0.00 0.00 0.00 0.00 179.25 180.07 1tri h ALA 149 N 0.50 1.57 -0.01 0.00 0.00 -1.35 -0.24 119.26 119.72 1tri h ALA 149 Ca -0.02 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1tri h ALA 149 Cb 1.05 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 1tri h ALA 149 CO 0.09 0.33 -0.02 0.82 0.00 0.00 0.00 179.25 180.47 1tri h ILE 150 N 0.92 1.41 -0.60 0.00 2.04 -1.44 -3.24 117.51 116.60 1tri h ILE 150 Ca 0.32 -1.23 0.10 0.00 1.00 0.00 0.00 64.86 65.06 1tri h ILE 150 Cb 0.12 2.21 -0.08 0.00 -0.74 0.00 0.00 36.82 38.34 1tri h ILE 150 CO -0.10 0.32 0.19 0.00 0.00 0.00 0.00 178.15 178.56 1tri h ALA 151 N 0.49 0.76 -1.53 1.87 0.00 -0.85 -2.04 119.26 117.96 1tri h ALA 151 Ca 0.00 0.10 0.45 0.00 0.00 0.00 0.00 54.91 55.46 1tri h ALA 151 Cb 0.54 0.11 -0.07 0.00 0.00 0.00 0.00 17.79 18.36 1tri h ALA 151 CO 0.00 -0.25 1.09 -0.22 0.00 0.00 0.00 179.25 179.87 1tri h LYS 152 N 0.34 0.03 -0.39 0.00 3.64 -1.07 -2.05 116.57 117.07 1tri h LYS 152 Ca 0.31 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.69 1tri h LYS 152 Cb 0.42 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 1tri h LYS 152 CO -0.35 0.02 0.00 1.63 -2.27 0.00 0.00 179.45 178.48 1tri n LYS 153 N -4.15 2.62 -4.81 1.90 5.02 -0.77 -4.99 118.16 112.98 1tri n LYS 153 Ca 0.35 -2.10 -0.32 0.00 -2.02 0.00 0.00 58.31 54.22 1tri n LYS 153 Cb 1.58 -1.33 -0.13 0.00 -0.02 0.00 0.00 35.03 35.13 1tri n LYS 153 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1tri s LEU 154 N -1.02 2.74 0.56 -0.35 1.43 -0.77 -4.84 118.68 116.44 1tri s LEU 154 Ca 0.28 -0.24 -0.04 0.00 -1.03 0.00 0.00 54.13 53.09 1tri s LEU 154 Cb 0.15 -1.57 0.01 0.00 0.03 0.00 0.00 46.19 44.81 1tri s LEU 154 CO 0.20 0.32 0.85 -0.54 0.23 0.00 0.00 176.35 177.41 1tri s LYS 155 N -0.94 2.91 0.28 1.70 1.02 -1.26 -4.95 119.74 118.50 1tri s LYS 155 Ca 0.13 -0.13 0.01 0.00 0.02 0.00 0.00 55.97 55.99 1tri s LYS 155 Cb -0.11 -2.33 0.56 0.00 -0.52 0.00 0.00 37.83 35.43 1tri s LYS 155 CO 0.02 -0.63 1.82 -0.22 -0.92 0.00 0.00 175.35 175.42 1tri h LYS 156 N -0.07 0.89 0.00 1.68 3.11 -1.98 -1.57 116.57 118.63 1tri h LYS 156 Ca -0.45 -0.05 -0.06 0.00 -2.81 0.00 0.00 60.65 57.28 1tri h LYS 156 Cb 1.26 -0.20 -0.01 0.00 -1.00 0.00 0.00 32.23 32.28 1tri h LYS 156 CO 0.60 0.59 -0.27 0.00 -2.81 0.00 0.00 179.45 177.56 1tri h ALA 157 N 1.54 1.18 -0.10 5.00 0.00 -2.02 -2.91 119.26 121.95 1tri h ALA 157 Ca 0.49 -0.24 0.03 0.00 0.00 0.00 0.00 54.91 55.19 1tri h ALA 157 Cb 0.54 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 1tri h ALA 157 CO -0.29 0.33 0.08 -0.44 0.00 0.00 0.00 179.25 178.93 1tri h ASP 158 N 0.00 0.00 0.13 0.00 3.32 -1.65 -2.38 116.42 115.85 1tri h ASP 158 Ca -0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 1tri h ASP 158 Cb 0.63 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.18 1tri h ASP 158 CO 0.03 0.00 -0.02 -0.50 -1.72 0.00 0.00 179.24 177.04 1tri h TRP 159 N 0.00 0.00 -0.78 4.55 4.06 -1.61 -2.15 115.95 120.02 1tri h TRP 159 Ca 0.05 0.00 0.15 0.00 2.06 0.00 0.00 58.89 61.15 1tri h TRP 159 Cb 0.21 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 28.31 1tri h TRP 159 CO 0.00 0.02 0.52 0.00 -3.56 0.00 0.00 178.44 175.42 1tri h ALA 160 N 1.98 2.06 -0.47 1.49 0.00 -1.65 -1.48 119.26 121.19 1tri h ALA 160 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1tri h ALA 160 Cb 0.08 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1tri h ALA 160 CO 0.00 -0.27 0.00 1.63 0.00 0.00 0.00 179.25 180.61 1tri n LYS 161 N -4.49 4.18 -5.17 0.00 5.02 -0.81 -4.97 118.16 111.92 1tri n LYS 161 Ca 0.15 -2.56 -0.29 0.00 -2.02 0.00 0.00 58.31 53.59 1tri n LYS 161 Cb 0.52 -2.13 -0.16 0.00 -0.02 0.00 0.00 35.03 33.24 1tri n LYS 161 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1tri s VAL 162 N -2.43 1.86 0.00 -0.18 1.01 -0.56 -1.48 120.40 118.63 1tri s VAL 162 Ca 0.44 -1.00 0.05 0.00 0.00 0.00 0.00 61.98 61.47 1tri s VAL 162 Cb 0.34 -1.55 -0.01 0.00 0.00 0.00 0.00 36.38 35.15 1tri s VAL 162 CO 0.13 0.53 -0.15 -0.69 0.00 0.00 0.00 175.10 174.91 1tri s VAL 163 N -0.45 1.21 -0.06 2.92 1.01 -0.00 -4.62 120.40 120.41 1tri s VAL 163 Ca 0.06 -0.76 0.03 0.00 0.00 0.00 0.00 61.98 61.32 1tri s VAL 163 Cb -0.10 -1.03 -0.02 0.00 0.00 0.00 0.00 36.38 35.23 1tri s VAL 163 CO 0.00 0.26 -0.15 -0.63 0.00 0.00 0.00 175.10 174.58 1tri s ILE 164 N -0.49 2.95 -0.25 2.22 -1.09 0.16 -2.23 121.20 122.46 1tri s ILE 164 Ca 0.05 -0.75 0.02 0.00 -2.23 0.00 0.00 60.65 57.74 1tri s ILE 164 Cb -0.06 -2.16 0.06 0.00 -1.58 0.00 0.00 42.46 38.72 1tri s ILE 164 CO -0.00 0.58 -0.09 0.00 -1.23 0.00 0.00 174.94 174.20 1tri s ALA 165 N -0.51 2.33 -0.51 9.38 0.00 -0.92 0.80 121.76 132.34 1tri s ALA 165 Ca 0.07 -1.59 -0.23 0.00 0.00 0.00 0.00 51.96 50.20 1tri s ALA 165 Cb -0.12 -1.51 0.04 0.00 0.00 0.00 0.00 23.12 21.53 1tri s ALA 165 CO 0.01 -1.17 0.86 -0.47 0.00 0.00 0.00 175.76 175.00 1tri s TYR 166 N 1.22 2.89 -0.35 0.00 5.04 0.28 -0.68 117.35 125.73 1tri s TYR 166 Ca -0.07 0.00 -0.00 0.00 -2.44 0.00 0.00 57.07 54.56 1tri s TYR 166 Cb -0.19 -3.89 0.13 0.00 0.35 0.00 0.00 41.96 38.36 1tri s TYR 166 CO -0.06 -1.19 0.20 -2.00 -1.34 0.00 0.00 175.55 171.16 1tri s GLU 167 N 3.59 0.62 0.01 4.97 2.12 0.84 -1.15 118.70 129.71 1tri s GLU 167 Ca 0.29 -1.31 -0.30 0.00 0.36 0.00 0.00 54.97 54.01 1tri s GLU 167 Cb -0.13 -1.48 -0.04 0.00 0.26 0.00 0.00 34.13 32.74 1tri s GLU 167 CO 0.20 -1.16 1.10 -1.25 -0.54 0.00 0.00 175.26 173.60 1tri s PRO 168 N 1.13 4.47 0.33 4.30 0.04 -1.26 -4.09 135.00 139.93 1tri s PRO 168 Ca 0.16 1.59 0.13 0.00 0.04 0.00 0.00 61.00 62.92 1tri s PRO 168 Cb -0.22 -3.43 1.03 0.00 0.04 0.00 0.00 34.50 31.92 1tri s PRO 168 CO -0.06 -0.20 1.66 0.28 0.04 0.00 0.00 177.00 178.72 1tri h VAL 169 N 4.72 0.29 0.00 -0.36 2.07 -1.51 0.37 116.25 121.84 1tri h VAL 169 Ca -0.40 -0.10 -0.01 0.00 0.82 0.00 0.00 66.70 67.01 1tri h VAL 169 Cb 1.21 -0.03 -0.00 0.00 -1.52 0.00 0.00 31.29 30.94 1tri h VAL 169 CO 0.80 0.05 -0.03 4.11 0.02 0.00 0.00 177.57 182.52 1tri h TRP 170 N 0.30 0.00 -0.02 1.57 5.08 -1.90 -2.50 115.95 118.48 1tri h TRP 170 Ca 0.71 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.68 1tri h TRP 170 Cb 1.60 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.76 1tri h TRP 170 CO -0.05 0.03 -0.08 0.00 -1.28 0.00 0.00 178.44 177.06 1tri n ALA 171 N -2.16 2.68 -2.57 0.11 0.00 0.13 -4.59 120.51 114.12 1tri n ALA 171 Ca -0.02 -0.59 -0.41 0.00 0.00 0.00 0.00 53.44 52.42 1tri n ALA 171 Cb 0.17 -0.94 -0.03 0.00 0.00 0.00 0.00 19.45 18.65 1tri n ALA 171 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1tri s ILE 172 N -2.10 3.82 -0.49 0.00 1.01 -0.94 -0.97 121.20 121.53 1tri s ILE 172 Ca 0.29 -0.03 -0.03 0.00 0.00 0.00 0.00 60.65 60.88 1tri s ILE 172 Cb 0.20 -4.96 0.00 0.00 0.01 0.00 0.00 42.46 37.72 1tri s ILE 172 CO 0.36 -1.87 0.40 0.61 0.00 0.00 0.00 174.94 174.44 1tri n GLY 173 N 5.89 0.41 0.00 6.18 0.00 -1.26 -4.91 105.19 111.49 1tri n GLY 173 Ca 0.13 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.79 1tri n GLY 173 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1tri n THR 174 N -3.42 0.00 -0.18 2.61 -2.24 -1.25 -4.97 114.28 104.83 1tri n THR 174 Ca -0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1tri n THR 174 Cb 0.52 -0.77 0.00 0.00 -2.10 0.00 0.00 70.33 67.98 1tri n THR 174 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1tri n GLY 175 N 2.45 0.64 3.32 3.38 0.00 -1.26 -4.98 105.19 108.74 1tri n GLY 175 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.56 1tri n GLY 175 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1tri s LYS 176 N -0.76 3.11 -0.01 1.61 2.47 -1.26 -5.02 119.74 119.88 1tri s LYS 176 Ca 0.00 -1.82 -0.15 0.00 -1.56 0.00 0.00 55.97 52.44 1tri s LYS 176 Cb 0.00 -4.33 -0.06 0.00 -1.46 0.00 0.00 37.83 31.99 1tri s LYS 176 CO 0.00 -1.34 0.42 0.54 0.16 0.00 0.00 175.35 175.13 1tri s VAL 177 N 1.41 5.03 0.90 4.02 0.11 -1.26 -3.76 120.40 126.85 1tri s VAL 177 Ca 0.06 0.86 -0.12 0.00 -2.93 0.00 0.00 61.98 59.85 1tri s VAL 177 Cb -0.26 -3.73 0.06 0.00 -1.53 0.00 0.00 36.38 30.92 1tri s VAL 177 CO 0.01 0.56 0.69 0.00 -3.33 0.00 0.00 175.10 173.02 1tri n ALA 178 N 1.97 -1.77 -2.02 1.54 0.00 -1.26 -4.97 120.51 114.00 1tri n ALA 178 Ca -0.13 -0.53 -0.26 0.00 0.00 0.00 0.00 53.44 52.52 1tri n ALA 178 Cb 0.52 -1.95 0.04 0.00 0.00 0.00 0.00 19.45 18.06 1tri n ALA 178 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1tri s THR 179 N -2.37 3.22 0.04 0.00 -4.23 -1.26 -4.84 115.64 106.20 1tri s THR 179 Ca 0.62 -0.06 0.28 0.00 -1.18 0.00 0.00 61.69 61.34 1tri s THR 179 Cb -0.24 -3.31 0.28 0.00 1.34 0.00 0.00 72.50 70.57 1tri s THR 179 CO 0.62 -0.33 1.85 -0.65 -0.54 0.00 0.00 174.62 175.57 1tri h PRO 180 N -0.32 0.00 0.02 3.99 0.11 -1.93 -0.82 132.00 133.05 1tri h PRO 180 Ca -0.45 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.66 1tri h PRO 180 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1tri h PRO 180 CO 0.61 0.00 -0.01 1.96 -0.21 0.00 0.00 178.00 180.35 1tri h GLN 181 N 0.00 -0.02 -0.74 1.05 7.50 -1.97 -1.69 115.11 119.23 1tri h GLN 181 Ca 0.00 0.00 0.13 0.00 0.50 0.00 0.00 58.65 59.28 1tri h GLN 181 Cb 0.02 0.01 -0.09 0.00 0.05 0.00 0.00 27.48 27.46 1tri h GLN 181 CO 0.00 0.18 0.31 1.96 -1.50 0.00 0.00 178.83 179.78 1tri h GLN 182 N -1.00 0.47 0.83 1.46 4.20 -1.81 -0.88 115.11 118.37 1tri h GLN 182 Ca -0.00 -0.03 -0.04 0.00 0.06 0.00 0.00 58.65 58.64 1tri h GLN 182 Cb 0.22 -0.11 0.01 0.00 0.30 0.00 0.00 27.48 27.90 1tri h GLN 182 CO 0.00 0.31 -0.40 0.00 -0.67 0.00 0.00 178.83 178.08 1tri h ALA 183 N 1.51 -1.11 -0.98 3.87 0.00 -1.25 -2.73 119.26 118.57 1tri h ALA 183 Ca 0.39 -0.24 0.21 0.00 0.00 0.00 0.00 54.91 55.27 1tri h ALA 183 Cb 0.55 0.43 -0.11 0.00 0.00 0.00 0.00 17.79 18.66 1tri h ALA 183 CO -0.37 -1.12 0.57 0.37 0.00 0.00 0.00 179.25 178.70 1tri h GLN 184 N -1.12 0.63 0.09 0.00 5.75 -0.84 0.11 115.11 119.74 1tri h GLN 184 Ca -0.11 -0.04 -0.00 0.00 -0.15 0.00 0.00 58.65 58.34 1tri h GLN 184 Cb 0.85 -0.14 0.00 0.00 1.07 0.00 0.00 27.48 29.26 1tri h GLN 184 CO 0.19 0.42 -0.04 1.49 -2.65 0.00 0.00 178.83 178.23 1tri h GLU 185 N 0.65 -0.12 -0.49 1.69 4.81 -1.08 0.43 114.58 120.48 1tri h GLU 185 Ca 0.60 0.01 -0.11 0.00 -0.13 0.00 0.00 59.36 59.72 1tri h GLU 185 Cb 1.03 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.42 1tri h GLU 185 CO -0.43 -0.02 -0.15 0.00 -0.73 0.00 0.00 179.01 177.68 1tri h ALA 186 N 0.71 0.67 -0.78 2.92 0.00 -1.11 0.77 119.26 122.44 1tri h ALA 186 Ca -0.01 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.54 1tri h ALA 186 Cb 0.16 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 1tri h ALA 186 CO 0.02 0.61 0.47 0.45 0.00 0.00 0.00 179.25 180.80 1tri h HIS 187 N 0.81 1.02 0.24 0.00 3.86 -0.83 -0.94 115.15 119.31 1tri h HIS 187 Ca 0.12 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.32 1tri h HIS 187 Cb 0.71 -0.34 0.00 0.00 1.06 0.00 0.00 27.41 28.85 1tri h HIS 187 CO 0.05 0.68 -0.12 0.00 0.86 0.00 0.00 177.93 179.40 1tri h ALA 188 N 1.25 -0.33 -0.38 2.45 0.00 0.18 -0.45 119.26 122.00 1tri h ALA 188 Ca 0.28 -0.11 0.08 0.00 0.00 0.00 0.00 54.91 55.16 1tri h ALA 188 Cb -0.05 0.13 -0.07 0.00 0.00 0.00 0.00 17.79 17.80 1tri h ALA 188 CO -0.05 -0.64 -0.08 1.25 0.00 0.00 0.00 179.25 179.73 1tri h LEU 189 N -0.42 -0.33 -0.39 0.00 6.46 0.79 -2.71 115.31 118.70 1tri h LEU 189 Ca -0.03 0.11 -0.00 0.00 -0.12 0.00 0.00 57.88 57.83 1tri h LEU 189 Cb 0.32 0.22 -0.02 0.00 -0.73 0.00 0.00 40.66 40.46 1tri h LEU 189 CO 0.05 -0.11 0.23 0.40 -0.62 0.00 0.00 178.44 178.39 1tri h ILE 190 N 0.01 1.14 -0.03 4.05 2.04 -1.04 -2.58 117.51 121.10 1tri h ILE 190 Ca 0.18 -0.33 0.04 0.00 1.00 0.00 0.00 64.86 65.75 1tri h ILE 190 Cb 0.28 0.64 -0.05 0.00 -0.74 0.00 0.00 36.82 36.94 1tri h ILE 190 CO -0.38 0.14 -0.34 -0.09 0.00 0.00 0.00 178.15 177.48 1tri h ARG 191 N 0.51 -0.46 -0.99 2.37 2.43 -0.79 -2.30 114.38 115.15 1tri h ARG 191 Ca 0.14 0.03 0.18 0.00 -0.81 0.00 0.00 59.98 59.52 1tri h ARG 191 Cb 0.02 0.11 -0.10 0.00 -0.42 0.00 0.00 29.97 29.58 1tri h ARG 191 CO -0.02 -0.31 0.61 0.77 -1.51 0.00 0.00 179.97 179.51 1tri h SER 192 N -0.48 0.76 0.28 -3.80 0.02 -1.46 0.39 113.55 109.26 1tri h SER 192 Ca 0.07 0.08 -0.10 0.00 -0.84 0.00 0.00 61.79 61.00 1tri h SER 192 Cb 0.58 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.04 1tri h SER 192 CO -0.29 0.30 -0.40 -0.25 -1.14 0.00 0.00 176.83 175.05 1tri h TRP 193 N 0.76 0.19 -0.08 3.45 7.01 -1.12 -2.08 115.95 124.08 1tri h TRP 193 Ca 0.55 -0.05 -0.22 0.00 2.11 0.00 0.00 58.89 61.27 1tri h TRP 193 Cb 0.86 -0.04 0.01 0.00 -2.10 0.00 0.00 29.16 27.89 1tri h TRP 193 CO -0.00 0.55 -0.83 0.28 -2.79 0.00 0.00 178.44 175.64 1tri h VAL 194 N 0.14 1.30 -0.38 2.65 2.07 -0.27 -1.32 116.25 120.44 1tri h VAL 194 Ca 0.01 -2.06 0.05 0.00 0.82 0.00 0.00 66.70 65.52 1tri h VAL 194 Cb 0.77 2.20 -0.05 0.00 -1.52 0.00 0.00 31.29 32.70 1tri h VAL 194 CO 0.06 0.64 0.10 -1.28 0.02 0.00 0.00 177.57 177.11 1tri h SER 195 N 0.38 0.08 -0.01 0.57 0.87 -0.13 0.23 113.55 115.54 1tri h SER 195 Ca -0.08 0.05 -0.02 0.00 -1.23 0.00 0.00 61.79 60.51 1tri h SER 195 Cb 1.48 0.06 0.00 0.00 -0.44 0.00 0.00 62.40 63.49 1tri h SER 195 CO 0.17 0.08 -0.08 0.28 -0.53 0.00 0.00 176.83 176.74 1tri h SER 196 N 0.24 0.09 1.56 6.23 0.02 -1.41 -2.29 113.55 118.00 1tri h SER 196 Ca 0.18 -0.70 0.00 0.00 -0.84 0.00 0.00 61.79 60.43 1tri h SER 196 Cb 0.19 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.70 1tri h SER 196 CO -0.21 0.78 -0.18 0.11 -1.14 0.00 0.00 176.83 176.19 1tri h LYS 197 N -0.59 0.00 0.00 3.45 1.79 -1.11 -3.41 116.57 116.70 1tri h LYS 197 Ca -0.01 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 1tri h LYS 197 Cb 0.78 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.43 1tri h LYS 197 CO 0.02 0.00 -0.79 -0.89 -1.08 0.00 0.00 179.45 176.71 1tri n ILE 198 N -2.62 0.12 0.00 1.86 2.08 0.74 -5.05 119.36 116.49 1tri n ILE 198 Ca 0.04 0.04 0.00 0.00 0.56 0.00 0.00 62.75 63.39 1tri n ILE 198 Cb 0.48 -1.40 0.00 0.00 -0.75 0.00 0.00 39.64 37.98 1tri n ILE 198 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1tri n GLY 199 N 2.88 3.72 0.01 7.39 0.00 -0.74 -4.92 105.19 113.52 1tri n GLY 199 Ca 0.00 -0.67 0.14 0.00 0.00 0.00 0.00 46.02 45.49 1tri n GLY 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tri n ALA 200 N -1.15 2.38 0.03 4.61 0.00 -1.21 -2.40 120.51 122.78 1tri n ALA 200 Ca 0.00 -0.11 -0.05 0.00 0.00 0.00 0.00 53.44 53.28 1tri n ALA 200 Cb 0.00 -1.45 -0.03 0.00 0.00 0.00 0.00 19.45 17.97 1tri n ALA 200 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 1tri h ASP 201 N 0.00 -0.16 -0.40 0.00 2.03 -1.92 -3.07 116.42 112.90 1tri h ASP 201 Ca 0.00 -0.12 0.08 0.00 -0.73 0.00 0.00 57.03 56.26 1tri h ASP 201 Cb 0.51 0.04 -0.09 0.00 -0.83 0.00 0.00 39.33 38.96 1tri h ASP 201 CO 0.00 0.37 -0.31 0.58 -1.03 0.00 0.00 179.24 178.85 1tri h VAL 202 N -1.03 0.25 -0.37 4.15 2.07 -1.91 -2.18 116.25 117.23 1tri h VAL 202 Ca -0.02 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.58 1tri h VAL 202 Cb 0.26 0.25 -0.07 0.00 -1.52 0.00 0.00 31.29 30.21 1tri h VAL 202 CO 0.03 0.00 -0.10 0.00 0.02 0.00 0.00 177.57 177.52 1tri h ALA 203 N 0.82 0.23 0.00 1.67 0.00 -1.62 -1.69 119.26 118.68 1tri h ALA 203 Ca 0.18 0.14 -0.03 0.00 0.00 0.00 0.00 54.91 55.21 1tri h ALA 203 Cb 0.53 0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 1tri h ALA 203 CO -0.53 -0.46 -0.13 0.78 0.00 0.00 0.00 179.25 178.91 1tri h GLY 204 N -0.01 0.00 -2.28 0.00 0.00 -1.30 -2.22 103.07 97.25 1tri h GLY 204 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.51 1tri h GLY 204 CO -0.39 0.00 0.00 -1.84 0.00 0.00 0.00 176.54 174.31 1tri n GLU 205 N -3.36 2.63 -3.15 4.80 0.28 -0.85 -4.49 120.64 116.48 1tri n GLU 205 Ca -0.01 -2.41 -0.35 0.00 -0.16 0.00 0.00 57.16 54.23 1tri n GLU 205 Cb 0.32 -1.49 -0.06 0.00 1.43 0.00 0.00 31.44 31.64 1tri n GLU 205 CO 0.00 0.00 0.00 -1.17 -0.16 0.00 0.00 177.13 175.80 1tri s LEU 206 N -1.12 4.27 -0.27 -1.84 2.96 -0.69 -4.93 118.68 117.07 1tri s LEU 206 Ca 0.40 1.33 -0.09 0.00 -0.22 0.00 0.00 54.13 55.55 1tri s LEU 206 Cb 0.22 -3.66 -0.04 0.00 0.50 0.00 0.00 46.19 43.21 1tri s LEU 206 CO 0.29 -0.02 0.13 -0.13 -1.32 0.00 0.00 176.35 175.30 1tri s ARG 207 N -2.23 3.77 -0.24 1.98 3.00 -1.26 -4.84 118.95 119.13 1tri s ARG 207 Ca 0.45 -0.42 0.02 0.00 0.00 0.00 0.00 55.73 55.79 1tri s ARG 207 Cb -0.15 -3.48 0.05 0.00 0.00 0.00 0.00 34.95 31.37 1tri s ARG 207 CO 0.20 -0.19 -0.12 0.42 0.00 0.00 0.00 175.30 175.61 1tri s ILE 208 N 1.68 2.06 0.09 1.52 1.01 -1.25 -0.67 121.20 125.64 1tri s ILE 208 Ca 0.07 -1.46 -0.05 0.00 0.00 0.00 0.00 60.65 59.21 1tri s ILE 208 Cb -0.16 -2.14 -0.05 0.00 0.01 0.00 0.00 42.46 40.13 1tri s ILE 208 CO 0.07 0.06 0.32 -0.76 0.00 0.00 0.00 174.94 174.63 1tri s LEU 209 N 1.18 4.31 -0.10 2.97 1.43 0.24 -0.65 118.68 128.06 1tri s LEU 209 Ca -0.06 0.54 -0.10 0.00 -1.03 0.00 0.00 54.13 53.49 1tri s LEU 209 Cb -0.19 -3.07 -0.05 0.00 0.03 0.00 0.00 46.19 42.92 1tri s LEU 209 CO -0.06 0.13 0.22 -0.47 0.23 0.00 0.00 176.35 176.40 1tri s TYR 210 N -1.52 3.61 0.03 0.29 5.04 -0.12 0.98 117.35 125.66 1tri s TYR 210 Ca 0.36 0.64 0.02 0.00 -2.44 0.00 0.00 57.07 55.65 1tri s TYR 210 Cb -0.13 -2.07 -0.02 0.00 0.35 0.00 0.00 41.96 40.09 1tri s TYR 210 CO 0.23 0.65 -0.07 0.20 -1.34 0.00 0.00 175.55 175.22 1tri s GLY 211 N -0.85 0.44 0.00 8.97 0.00 -0.30 -0.32 107.32 115.26 1tri s GLY 211 Ca 0.17 -0.59 0.00 0.00 0.00 0.00 0.00 44.72 44.29 1tri s GLY 211 CO 0.06 -0.61 0.00 0.61 0.00 0.00 0.00 173.10 173.16 1tri n GLY 212 N 1.96 2.52 2.41 0.20 0.00 -1.26 -4.13 105.19 106.89 1tri n GLY 212 Ca -0.19 -0.76 -0.17 0.00 0.00 0.00 0.00 46.02 44.89 1tri n GLY 212 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1tri n SER 213 N 0.00 -5.11 -4.77 1.61 7.64 -0.14 -4.54 113.62 108.31 1tri n SER 213 Ca 0.00 0.19 -0.39 0.00 1.01 0.00 0.00 58.87 59.67 1tri n SER 213 Cb 0.00 -4.17 -0.03 0.00 -1.01 0.00 0.00 64.21 58.99 1tri n SER 213 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1tri s VAL 214 N -2.77 3.31 0.30 0.44 1.01 -1.26 -4.73 120.40 116.70 1tri s VAL 214 Ca 0.00 1.22 -0.00 0.00 0.00 0.00 0.00 61.98 63.20 1tri s VAL 214 Cb 0.00 -3.74 -0.02 0.00 0.00 0.00 0.00 36.38 32.62 1tri s VAL 214 CO 0.00 0.22 0.35 0.54 0.00 0.00 0.00 175.10 176.21 1tri s ASN 215 N -0.96 0.93 0.42 3.32 2.20 -1.26 -4.59 114.94 115.00 1tri s ASN 215 Ca 0.50 -1.51 0.28 0.00 -0.94 0.00 0.00 52.86 51.19 1tri s ASN 215 Cb -0.32 0.57 0.89 0.00 -2.00 0.00 0.00 41.25 40.40 1tri s ASN 215 CO 0.41 -1.13 1.79 1.23 -2.94 0.00 0.00 177.10 176.46 1tri h GLY 216 N 2.22 0.00 0.67 0.45 0.00 -1.94 -0.43 103.07 104.04 1tri h GLY 216 Ca -0.28 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 46.84 1tri h GLY 216 CO 0.40 0.00 -0.96 1.70 0.00 0.00 0.00 176.54 177.68 1tri h LYS 217 N 0.00 0.29 0.00 4.80 1.63 -1.94 -3.39 116.57 117.96 1tri h LYS 217 Ca 0.00 -0.50 0.00 0.00 -0.85 0.00 0.00 60.65 59.30 1tri h LYS 217 Cb 0.68 0.18 0.00 0.00 -0.60 0.00 0.00 32.23 32.50 1tri h LYS 217 CO 0.00 1.24 -0.76 -2.95 -3.45 0.00 0.00 179.45 173.53 1tri h ASN 218 N -0.35 0.00 -0.96 4.20 7.08 -1.93 -3.42 115.58 120.20 1tri h ASN 218 Ca -0.18 -0.08 0.13 0.00 -3.08 0.00 0.00 56.30 53.09 1tri h ASN 218 Cb 1.68 0.00 -0.08 0.00 -2.08 0.00 0.00 38.32 37.84 1tri h ASN 218 CO 0.13 0.04 0.61 0.00 -2.08 0.00 0.00 177.43 176.13 1tri h ALA 219 N 2.19 1.65 -0.32 4.14 0.00 -1.27 -3.23 119.26 122.41 1tri h ALA 219 Ca 0.00 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 1tri h ALA 219 Cb 0.91 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1tri h ALA 219 CO 0.00 0.11 -0.10 -0.09 0.00 0.00 0.00 179.25 179.16 1tri h ARG 220 N 0.87 0.64 -0.55 0.00 2.43 -1.86 -0.97 114.38 114.94 1tri h ARG 220 Ca 0.48 -0.26 -0.08 0.00 -0.81 0.00 0.00 59.98 59.32 1tri h ARG 220 Cb 0.58 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.08 1tri h ARG 220 CO -0.24 0.83 0.03 1.79 -1.51 0.00 0.00 179.97 180.86 1tri h THR 221 N 0.41 1.25 -0.48 0.20 1.35 -1.90 0.17 112.91 113.92 1tri h THR 221 Ca 0.08 -1.03 -0.05 0.00 -0.55 0.00 0.00 66.41 64.86 1tri h THR 221 Cb 0.61 0.80 -0.02 0.00 -1.73 0.00 0.00 68.15 67.81 1tri h THR 221 CO 0.04 0.37 0.09 -0.07 -0.25 0.00 0.00 175.52 175.70 1tri h LEU 222 N 0.85 0.68 -0.22 3.87 3.38 -1.55 -2.54 115.31 119.78 1tri h LEU 222 Ca 0.16 -0.12 -0.10 0.00 0.09 0.00 0.00 57.88 57.91 1tri h LEU 222 Cb 0.46 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 1tri h LEU 222 CO 0.02 0.69 -0.48 0.22 0.09 0.00 0.00 178.44 178.98 1tri h TYR 223 N 0.70 0.00 0.00 1.13 3.20 -0.33 -2.97 116.97 118.71 1tri h TYR 223 Ca 0.15 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.02 1tri h TYR 223 Cb 0.30 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.57 1tri h TYR 223 CO 0.01 0.48 0.00 1.96 -1.64 0.00 0.00 178.16 178.97 1tri h GLN 224 N 0.00 0.00 -6.77 1.82 4.20 -0.24 -3.42 115.11 110.69 1tri h GLN 224 Ca -0.00 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.18 1tri h GLN 224 Cb 1.28 0.00 0.07 0.00 0.30 0.00 0.00 27.48 29.13 1tri h GLN 224 CO 0.06 0.00 0.81 -0.65 -0.67 0.00 0.00 178.83 178.38 1tri s GLN 225 N -3.96 4.21 0.32 1.46 -1.52 -1.12 -4.92 119.66 114.13 1tri s GLN 225 Ca -0.03 2.41 0.09 0.00 -1.95 0.00 0.00 55.36 55.88 1tri s GLN 225 Cb 0.11 -3.08 0.84 0.00 -0.22 0.00 0.00 33.01 30.67 1tri s GLN 225 CO 0.46 -0.50 1.77 -0.09 -0.25 0.00 0.00 175.29 176.68 1tri h ARG 226 N 4.93 0.64 -0.59 2.91 2.43 -1.89 -2.89 114.38 119.92 1tri h ARG 226 Ca -0.46 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.67 1tri h ARG 226 Cb 1.22 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.63 1tri h ARG 226 CO 0.78 0.42 0.00 -0.25 -1.51 0.00 0.00 179.97 179.41 1tri n ASP 227 N -4.77 3.83 -4.65 -3.80 8.00 -1.26 -4.90 116.55 109.00 1tri n ASP 227 Ca 0.24 -2.14 -0.38 0.00 0.71 0.00 0.00 54.79 53.23 1tri n ASP 227 Cb 0.66 -0.44 -0.09 0.00 -0.02 0.00 0.00 41.12 41.24 1tri n ASP 227 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1tri s VAL 228 N -1.26 5.24 -0.23 2.53 1.01 -1.09 -4.65 120.40 121.95 1tri s VAL 228 Ca 0.42 0.52 0.12 0.00 0.00 0.00 0.00 61.98 63.05 1tri s VAL 228 Cb 0.24 -3.66 0.46 0.00 0.00 0.00 0.00 36.38 33.42 1tri s VAL 228 CO 0.26 0.25 1.36 0.59 0.00 0.00 0.00 175.10 177.55 1tri n ASN 229 N 4.68 2.58 0.00 3.32 4.13 0.17 -4.87 115.26 125.27 1tri n ASN 229 Ca -0.10 -3.54 0.00 0.00 1.68 0.00 0.00 54.58 52.61 1tri n ASN 229 Cb 0.51 -0.56 0.00 0.00 -1.54 0.00 0.00 39.78 38.19 1tri n ASN 229 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1tri n GLY 230 N -1.05 0.93 3.16 7.41 0.00 -1.26 -2.78 105.19 111.60 1tri n GLY 230 Ca 0.25 -2.11 -0.14 0.00 0.00 0.00 0.00 46.02 44.03 1tri n GLY 230 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1tri s PHE 231 N -1.02 0.98 -0.30 1.61 0.08 -0.74 -0.94 117.98 117.65 1tri s PHE 231 Ca 0.00 -0.68 -0.04 0.00 0.12 0.00 0.00 56.93 56.33 1tri s PHE 231 Cb 0.00 -0.55 0.04 0.00 -0.57 0.00 0.00 43.02 41.94 1tri s PHE 231 CO 0.00 -0.04 0.03 -1.17 -0.10 0.00 0.00 175.22 173.95 1tri s LEU 232 N -2.44 3.90 -0.25 -0.37 2.96 0.56 -0.31 118.68 122.73 1tri s LEU 232 Ca 0.05 -1.08 -0.06 0.00 -0.22 0.00 0.00 54.13 52.81 1tri s LEU 232 Cb -0.02 -1.77 -0.01 0.00 0.50 0.00 0.00 46.19 44.88 1tri s LEU 232 CO -0.01 -0.25 0.04 -0.69 -1.32 0.00 0.00 176.35 174.12 1tri s VAL 233 N 1.35 3.91 0.00 1.68 1.01 0.34 -4.09 120.40 124.59 1tri s VAL 233 Ca -0.02 -0.42 0.00 0.00 0.00 0.00 0.00 61.98 61.54 1tri s VAL 233 Cb -0.19 -2.87 0.00 0.00 0.00 0.00 0.00 36.38 33.33 1tri s VAL 233 CO 0.00 0.29 0.00 0.61 0.00 0.00 0.00 175.10 176.00 1tri n GLY 234 N 4.87 0.95 0.06 4.51 0.00 -1.26 0.30 105.19 114.62 1tri n GLY 234 Ca -0.16 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.84 1tri n GLY 234 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tri n GLY 235 N 3.90 -2.54 0.00 -0.02 0.00 -1.26 0.23 105.19 105.50 1tri n GLY 235 Ca 0.00 0.58 0.05 0.00 0.00 0.00 0.00 46.02 46.65 1tri n GLY 235 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tri n ALA 236 N -2.93 1.72 1.55 4.61 0.00 -1.26 -0.94 120.51 123.26 1tri n ALA 236 Ca 0.00 -0.05 0.13 0.00 0.00 0.00 0.00 53.44 53.52 1tri n ALA 236 Cb 0.04 -1.16 0.55 0.00 0.00 0.00 0.00 19.45 18.88 1tri n ALA 236 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1tri n SER 237 N -1.17 1.18 -0.48 0.00 3.41 0.13 -3.10 113.62 113.59 1tri n SER 237 Ca 0.06 -1.47 0.08 0.00 -0.26 0.00 0.00 58.87 57.28 1tri n SER 237 Cb 0.06 -0.03 0.03 0.00 -0.26 0.00 0.00 64.21 64.01 1tri n SER 237 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1tri n LEU 238 N -0.05 1.92 -4.77 1.04 7.99 -0.12 -4.91 117.00 118.11 1tri n LEU 238 Ca 0.19 -0.86 -0.24 0.00 -0.01 0.00 0.00 56.01 55.09 1tri n LEU 238 Cb 0.29 0.00 -0.06 0.00 -0.11 0.00 0.00 43.42 43.53 1tri n LEU 238 CO 0.15 0.35 -0.13 -0.54 -1.51 0.00 0.00 177.39 175.72 1tri s LYS 239 N -1.69 2.28 0.22 3.23 1.02 -1.20 -5.02 119.74 118.57 1tri s LYS 239 Ca 0.16 -1.79 0.26 0.00 0.02 0.00 0.00 55.97 54.61 1tri s LYS 239 Cb 0.13 -2.05 0.80 0.00 -0.52 0.00 0.00 37.83 36.19 1tri s LYS 239 CO 0.33 -0.14 1.77 -2.30 -0.92 0.00 0.00 175.35 174.09 1tri n PRO 240 N -1.30 0.27 0.25 -1.68 -0.02 -1.26 -2.80 135.00 128.45 1tri n PRO 240 Ca -0.00 0.23 0.17 0.00 -2.02 0.00 0.00 63.50 61.87 1tri n PRO 240 Cb 0.64 -1.82 0.90 0.00 -0.02 0.00 0.00 33.50 33.20 1tri n PRO 240 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1tri h GLU 241 N 0.00 0.00 -0.03 -0.52 4.81 -1.96 -2.52 114.58 114.36 1tri h GLU 241 Ca 0.00 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.24 1tri h GLU 241 Cb 0.74 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.12 1tri h GLU 241 CO 0.00 0.00 0.04 0.35 -0.73 0.00 0.00 179.01 178.67 1tri h PHE 242 N 0.00 0.00 -0.07 0.92 3.57 -1.45 -1.30 116.94 118.61 1tri h PHE 242 Ca 0.00 0.00 -0.18 0.00 3.53 0.00 0.00 57.97 61.32 1tri h PHE 242 Cb 0.03 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.76 1tri h PHE 242 CO 0.00 0.00 -0.70 0.28 -2.23 0.00 0.00 178.31 175.66 1tri h VAL 243 N 0.00 1.39 -0.66 1.41 2.07 -1.73 0.25 116.25 118.99 1tri h VAL 243 Ca 0.01 -2.13 -0.05 0.00 0.82 0.00 0.00 66.70 65.36 1tri h VAL 243 Cb 0.09 2.10 -0.03 0.00 -1.52 0.00 0.00 31.29 31.93 1tri h VAL 243 CO -0.00 0.64 0.22 0.44 0.02 0.00 0.00 177.57 178.89 1tri h ASP 244 N 0.25 0.92 -0.19 0.57 3.32 -1.42 0.00 116.42 119.87 1tri h ASP 244 Ca -0.02 -0.15 -0.21 0.00 0.02 0.00 0.00 57.03 56.66 1tri h ASP 244 Cb 1.27 -0.24 0.01 0.00 0.22 0.00 0.00 39.33 40.59 1tri h ASP 244 CO 0.12 0.85 -0.72 0.40 -1.72 0.00 0.00 179.24 178.17 1tri h ILE 245 N 0.96 1.27 -0.86 0.35 2.04 -1.33 -0.89 117.51 119.05 1tri h ILE 245 Ca 0.22 -1.90 0.02 0.00 1.00 0.00 0.00 64.86 64.19 1tri h ILE 245 Cb 0.25 1.89 -0.04 0.00 -0.74 0.00 0.00 36.82 38.17 1tri h ILE 245 CO -0.01 0.61 0.56 0.40 0.00 0.00 0.00 178.15 179.71 1tri h ILE 246 N 0.57 1.20 0.00 -0.67 5.03 -0.10 -2.32 117.51 121.22 1tri h ILE 246 Ca -0.04 -0.39 -0.02 0.00 -0.12 0.00 0.00 64.86 64.30 1tri h ILE 246 Cb 1.34 -0.04 -0.00 0.00 -3.03 0.00 0.00 36.82 35.09 1tri h ILE 246 CO 0.15 0.21 -0.08 0.11 -0.68 0.00 0.00 178.15 177.86 1tri h LYS 247 N 1.14 0.00 0.00 2.37 1.57 -0.79 -2.59 116.57 118.26 1tri h LYS 247 Ca 0.32 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.10 1tri h LYS 247 Cb -0.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.22 1tri h LYS 247 CO -0.08 0.08 0.00 0.00 -0.57 0.00 0.00 179.45 178.87 1tri n ALA 248 N -2.14 1.70 -0.03 3.86 0.00 -0.36 -3.66 120.51 119.88 1tri n ALA 248 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1tri n ALA 248 Cb 0.34 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.42 1tri n ALA 248 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1tri n THR 249 N -2.14 1.64 -0.81 0.00 -2.24 -0.98 -4.80 114.28 104.95 1tri n THR 249 Ca 0.02 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 1tri n THR 249 Cb 0.23 -1.33 0.00 0.00 -2.10 0.00 0.00 70.33 67.13 1tri n THR 249 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50