#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hsd s VAL 2 N 0.00 5.07 -0.04 12.58 1.01 -1.26 -0.37 120.40 137.39 3hsd s VAL 2 Ca 0.00 0.57 -0.03 0.00 0.00 0.00 0.00 61.98 62.52 3hsd s VAL 2 Cb 0.00 -3.86 -0.04 0.00 0.00 0.00 0.00 36.38 32.48 3hsd s VAL 2 CO 0.00 -0.04 0.15 0.00 0.00 0.00 0.00 175.10 175.21 3hsd s ALA 3 N 2.30 3.84 -0.17 5.51 0.00 0.01 -0.91 121.76 132.34 3hsd s ALA 3 Ca 0.19 -0.76 -0.01 0.00 0.00 0.00 0.00 51.96 51.38 3hsd s ALA 3 Cb -0.16 -1.83 -0.01 0.00 0.00 0.00 0.00 23.12 21.13 3hsd s ALA 3 CO 0.11 0.70 -0.11 0.71 0.00 0.00 0.00 175.76 177.17 3hsd s TYR 4 N -1.21 2.86 -0.10 0.00 2.02 -0.10 -0.67 117.35 120.15 3hsd s TYR 4 Ca 0.23 -0.89 0.04 0.00 -0.37 0.00 0.00 57.07 56.08 3hsd s TYR 4 Cb -0.12 -1.95 -0.00 0.00 -0.40 0.00 0.00 41.96 39.48 3hsd s TYR 4 CO 0.14 -0.42 -0.23 0.42 -1.57 0.00 0.00 175.55 173.89 3hsd s ILE 5 N 0.90 2.15 0.01 2.71 1.01 -0.19 -0.09 121.20 127.70 3hsd s ILE 5 Ca -0.03 -0.99 -0.19 0.00 0.00 0.00 0.00 60.65 59.44 3hsd s ILE 5 Cb -0.15 -1.82 -0.06 0.00 0.01 0.00 0.00 42.46 40.44 3hsd s ILE 5 CO -0.00 0.56 0.55 0.00 0.00 0.00 0.00 174.94 176.04 3hsd s ALA 6 N 0.31 3.55 -0.10 9.38 0.00 0.32 -0.42 121.76 134.80 3hsd s ALA 6 Ca -0.17 -0.03 0.03 0.00 0.00 0.00 0.00 51.96 51.79 3hsd s ALA 6 Cb -0.18 -2.65 -0.01 0.00 0.00 0.00 0.00 23.12 20.29 3hsd s ALA 6 CO 0.08 0.27 -0.21 0.42 0.00 0.00 0.00 175.76 176.33 3hsd s ILE 7 N -0.55 2.34 -0.03 0.00 1.01 -0.20 -1.15 121.20 122.62 3hsd s ILE 7 Ca 0.29 -0.93 0.02 0.00 0.00 0.00 0.00 60.65 60.03 3hsd s ILE 7 Cb -0.18 -1.91 0.01 0.00 0.01 0.00 0.00 42.46 40.39 3hsd s ILE 7 CO 0.17 0.55 -0.08 -0.83 0.00 0.00 0.00 174.94 174.75 3hsd s GLY 8 N 0.21 0.52 -0.01 6.18 0.00 -0.31 -1.10 107.32 112.82 3hsd s GLY 8 Ca -0.13 -0.25 0.01 0.00 0.00 0.00 0.00 44.72 44.35 3hsd s GLY 8 CO 0.07 0.08 -0.04 -0.45 0.00 0.00 0.00 173.10 172.76 3hsd s SER 9 N 0.44 0.61 -0.19 1.64 0.15 -0.51 -1.02 113.70 114.81 3hsd s SER 9 Ca -0.07 -0.09 0.13 0.00 0.70 0.00 0.00 55.95 56.62 3hsd s SER 9 Cb -0.11 -0.13 0.40 0.00 -1.71 0.00 0.00 66.02 64.47 3hsd s SER 9 CO 0.01 0.03 1.21 -0.46 1.20 0.00 0.00 173.24 175.23 3hsd n ASN 10 N 3.21 1.82 -4.75 5.45 2.04 -0.56 -0.46 115.26 122.00 3hsd n ASN 10 Ca -0.16 -3.74 -0.35 0.00 -0.44 0.00 0.00 54.58 49.89 3hsd n ASN 10 Cb 0.56 -0.51 0.04 0.00 -2.53 0.00 0.00 39.78 37.35 3hsd n ASN 10 CO 0.00 0.00 0.00 -0.76 -0.44 0.00 0.00 177.26 176.06 3hsd s LEU 11 N -3.15 3.57 0.40 -4.53 1.43 -1.26 -4.57 118.68 110.57 3hsd s LEU 11 Ca 0.37 2.29 0.10 0.00 -1.03 0.00 0.00 54.13 55.86 3hsd s LEU 11 Cb 0.35 -4.59 0.91 0.00 0.03 0.00 0.00 46.19 42.89 3hsd s LEU 11 CO -0.05 -1.67 1.96 0.00 0.23 0.00 0.00 176.35 176.82 3hsd h ALA 12 N 0.58 1.88 -2.83 4.21 0.00 -1.95 -3.20 119.26 117.95 3hsd h ALA 12 Ca -0.49 -0.01 -0.60 0.00 0.00 0.00 0.00 54.91 53.80 3hsd h ALA 12 Cb 1.28 -0.13 -0.40 0.00 0.00 0.00 0.00 17.79 18.55 3hsd h ALA 12 CO 0.54 -0.02 -0.78 0.45 0.00 0.00 0.00 179.25 179.45 3hsd s SER 13 N -6.20 3.29 0.00 0.00 0.15 -1.26 -4.99 113.70 104.69 3hsd s SER 13 Ca -0.09 -2.75 0.26 0.00 0.70 0.00 0.00 55.95 54.08 3hsd s SER 13 Cb 0.20 -0.89 0.72 0.00 -1.71 0.00 0.00 66.02 64.34 3hsd s SER 13 CO 0.76 -0.24 1.57 -0.81 1.20 0.00 0.00 173.24 175.72 3hsd n PRO 14 N 3.35 0.00 -0.19 5.44 -0.04 -1.21 -4.40 135.00 137.95 3hsd n PRO 14 Ca 0.14 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.58 3hsd n PRO 14 Cb 0.37 -1.50 0.09 0.00 -0.04 0.00 0.00 33.50 32.42 3hsd n PRO 14 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 3hsd h LEU 15 N 0.00 0.27 -0.47 1.53 3.38 -1.94 -1.16 115.31 116.91 3hsd h LEU 15 Ca 0.00 0.06 -0.15 0.00 0.09 0.00 0.00 57.88 57.88 3hsd h LEU 15 Cb 0.50 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 3hsd h LEU 15 CO 0.00 0.17 -0.40 -0.33 0.09 0.00 0.00 178.44 177.97 3hsd h GLU 16 N 0.44 0.82 -0.39 1.13 4.39 -2.00 -0.05 114.58 118.92 3hsd h GLU 16 Ca 0.28 -0.43 0.00 0.00 0.34 0.00 0.00 59.36 59.55 3hsd h GLU 16 Cb 0.30 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.95 3hsd h GLU 16 CO -0.26 1.07 0.26 0.37 -1.16 0.00 0.00 179.01 179.29 3hsd h GLN 17 N 0.67 0.52 -0.55 2.33 4.15 -1.74 -0.96 115.11 119.53 3hsd h GLN 17 Ca 0.05 -0.03 -0.04 0.00 0.77 0.00 0.00 58.65 59.40 3hsd h GLN 17 Cb 0.97 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 28.52 3hsd h GLN 17 CO 0.09 0.36 0.19 0.28 -1.93 0.00 0.00 178.83 177.82 3hsd h VAL 18 N 0.53 1.23 -0.72 2.39 2.07 -0.96 -0.32 116.25 120.47 3hsd h VAL 18 Ca 0.14 -0.74 0.02 0.00 0.82 0.00 0.00 66.70 66.94 3hsd h VAL 18 Cb -0.05 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 30.37 3hsd h VAL 18 CO -0.03 0.28 0.46 0.78 0.02 0.00 0.00 177.57 179.08 3hsd h ASN 19 N 0.75 0.77 -0.77 0.57 2.35 -0.84 -0.06 115.58 118.36 3hsd h ASN 19 Ca 0.18 -0.01 -0.05 0.00 -0.55 0.00 0.00 56.30 55.87 3hsd h ASN 19 Cb 0.24 -0.18 -0.03 0.00 0.05 0.00 0.00 38.32 38.40 3hsd h ASN 19 CO -0.01 0.55 0.27 0.00 -1.65 0.00 0.00 177.43 176.58 3hsd h ALA 20 N 1.29 1.01 -0.65 -0.83 0.00 -0.84 -0.89 119.26 118.36 3hsd h ALA 20 Ca 0.28 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 3hsd h ALA 20 Cb -0.03 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.43 3hsd h ALA 20 CO -0.09 0.67 0.16 0.00 0.00 0.00 0.00 179.25 179.99 3hsd h ALA 21 N 1.15 0.86 -0.29 0.00 0.00 -0.56 -1.29 119.26 119.13 3hsd h ALA 21 Ca 0.25 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 3hsd h ALA 21 Cb 0.28 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3hsd h ALA 21 CO -0.01 0.57 0.09 -0.07 0.00 0.00 0.00 179.25 179.83 3hsd h LEU 22 N 0.97 0.42 -0.55 0.00 3.38 -0.67 -0.46 115.31 118.39 3hsd h LEU 22 Ca 0.21 -0.20 0.10 0.00 0.09 0.00 0.00 57.88 58.07 3hsd h LEU 22 Cb 0.36 -0.11 -0.08 0.00 0.09 0.00 0.00 40.66 40.92 3hsd h LEU 22 CO 0.00 0.51 0.13 0.11 0.09 0.00 0.00 178.44 179.28 3hsd h LYS 23 N 0.30 0.27 -0.79 1.13 1.57 -1.05 -1.57 116.57 116.43 3hsd h LYS 23 Ca 0.09 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.83 3hsd h LYS 23 Cb 0.24 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.45 3hsd h LYS 23 CO -0.00 0.18 0.41 0.00 -0.57 0.00 0.00 179.45 179.46 3hsd h ALA 24 N 1.42 1.02 -0.93 3.86 0.00 -0.86 -2.02 119.26 121.74 3hsd h ALA 24 Ca 0.28 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3hsd h ALA 24 Cb 0.39 -0.31 -0.05 0.00 0.00 0.00 0.00 17.79 17.82 3hsd h ALA 24 CO -0.35 0.56 0.58 -0.07 0.00 0.00 0.00 179.25 179.97 3hsd h LEU 25 N 1.11 1.09 -2.03 0.00 3.38 -0.47 -1.32 115.31 117.07 3hsd h LEU 25 Ca 0.28 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.18 3hsd h LEU 25 Cb 0.08 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.55 3hsd h LEU 25 CO -0.04 0.82 -0.08 1.23 0.09 0.00 0.00 178.44 180.46 3hsd h GLY 26 N 1.27 0.00 0.25 0.83 0.00 -0.68 -2.48 103.07 102.25 3hsd h GLY 26 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.67 3hsd h GLY 26 CO -0.07 0.00 -0.17 1.22 0.00 0.00 0.00 176.54 177.52 3hsd n ASP 27 N -3.45 0.99 -4.76 0.19 8.00 -0.51 -4.78 116.55 112.21 3hsd n ASP 27 Ca -0.02 -0.95 -0.41 0.00 0.71 0.00 0.00 54.79 54.12 3hsd n ASP 27 Cb 0.22 0.06 -0.01 0.00 -0.02 0.00 0.00 41.12 41.37 3hsd n ASP 27 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 3hsd n ILE 28 N -0.56 1.40 -1.67 0.53 5.41 -0.94 -4.92 119.36 118.61 3hsd n ILE 28 Ca 0.14 -0.35 -0.41 0.00 1.00 0.00 0.00 62.75 63.13 3hsd n ILE 28 Cb 0.33 -2.00 0.01 0.00 -0.71 0.00 0.00 39.64 37.28 3hsd n ILE 28 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 3hsd n PRO 29 N 1.49 1.71 -2.06 0.38 -0.02 -1.26 -2.71 135.00 132.53 3hsd n PRO 29 Ca 0.05 0.61 -0.17 0.00 -2.02 0.00 0.00 63.50 61.98 3hsd n PRO 29 Cb 0.38 -2.29 -0.03 0.00 -0.02 0.00 0.00 33.50 31.54 3hsd n PRO 29 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3hsd n GLU 30 N -0.03 -1.71 -4.02 -0.52 1.02 -1.26 -4.79 120.64 109.32 3hsd n GLU 30 Ca 0.08 0.90 -0.12 0.00 -0.02 0.00 0.00 57.16 57.99 3hsd n GLU 30 Cb 0.40 -5.41 -0.12 0.00 -0.02 0.00 0.00 31.44 26.29 3hsd n GLU 30 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 3hsd s SER 31 N -2.20 0.49 -0.04 1.62 0.01 -1.10 -1.85 113.70 110.63 3hsd s SER 31 Ca 0.00 -0.38 -0.01 0.00 1.31 0.00 0.00 55.95 56.86 3hsd s SER 31 Cb 0.00 0.04 0.03 0.00 0.21 0.00 0.00 66.02 66.30 3hsd s SER 31 CO 0.00 -0.16 0.08 -2.28 0.41 0.00 0.00 173.24 171.29 3hsd s HIS 32 N -1.01 -0.05 0.01 2.43 2.46 0.15 -4.72 115.29 114.56 3hsd s HIS 32 Ca -0.09 0.30 -0.30 0.00 0.47 0.00 0.00 55.06 55.44 3hsd s HIS 32 Cb -0.07 -0.20 -0.05 0.00 -0.13 0.00 0.00 32.58 32.12 3hsd s HIS 32 CO -0.00 -0.14 1.33 0.42 -2.47 0.00 0.00 174.74 173.88 3hsd s ILE 33 N 1.26 3.81 -0.21 0.89 1.01 -1.26 -0.13 121.20 126.57 3hsd s ILE 33 Ca -0.07 1.22 -0.18 0.00 0.00 0.00 0.00 60.65 61.61 3hsd s ILE 33 Cb -0.12 -3.78 -0.19 0.00 0.01 0.00 0.00 42.46 38.37 3hsd s ILE 33 CO -0.04 0.02 0.14 0.18 0.00 0.00 0.00 174.94 175.24 3hsd n LEU 34 N 4.95 1.98 -3.70 2.97 4.77 0.50 -4.92 117.00 123.56 3hsd n LEU 34 Ca 0.12 0.38 -0.09 0.00 -0.03 0.00 0.00 56.01 56.38 3hsd n LEU 34 Cb 0.44 -0.96 -0.02 0.00 -2.33 0.00 0.00 43.42 40.55 3hsd n LEU 34 CO 0.57 0.40 0.41 0.28 -1.33 0.00 0.00 177.39 177.72 3hsd s THR 35 N -2.41 0.00 0.01 -5.08 -1.32 -1.21 -5.02 115.64 100.62 3hsd s THR 35 Ca -0.30 -0.63 0.03 0.00 -1.21 0.00 0.00 61.69 59.58 3hsd s THR 35 Cb 0.07 -1.60 -0.01 0.00 -1.51 0.00 0.00 72.50 69.45 3hsd s THR 35 CO 0.60 -0.02 -0.10 -0.69 -2.21 0.00 0.00 174.62 172.20 3hsd s VAL 36 N -3.86 0.76 1.14 5.08 1.01 -1.26 -1.21 120.40 122.06 3hsd s VAL 36 Ca 0.08 -0.59 -0.18 0.00 0.00 0.00 0.00 61.98 61.29 3hsd s VAL 36 Cb -0.04 -0.67 0.26 0.00 0.00 0.00 0.00 36.38 35.93 3hsd s VAL 36 CO -0.01 0.09 1.13 -0.94 0.00 0.00 0.00 175.10 175.37 3hsd s SER 37 N -0.56 1.48 1.05 3.32 1.04 -0.05 -5.00 113.70 114.98 3hsd s SER 37 Ca 0.01 0.68 -0.13 0.00 0.48 0.00 0.00 55.95 57.00 3hsd s SER 37 Cb -0.05 -0.98 0.22 0.00 0.10 0.00 0.00 66.02 65.30 3hsd s SER 37 CO 0.00 -3.78 1.08 -0.44 0.98 0.00 0.00 173.24 171.08 3hsd s SER 38 N -3.94 2.17 -0.16 7.02 0.01 -1.26 -4.80 113.70 112.74 3hsd s SER 38 Ca 0.70 1.20 -0.16 0.00 1.31 0.00 0.00 55.95 59.01 3hsd s SER 38 Cb -0.11 -1.89 -0.04 0.00 0.21 0.00 0.00 66.02 64.19 3hsd s SER 38 CO 0.56 -3.41 0.37 -0.36 0.41 0.00 0.00 173.24 170.81 3hsd s PHE 39 N -2.88 3.45 0.07 2.43 0.08 -1.26 -4.61 117.98 115.26 3hsd s PHE 39 Ca 0.66 0.68 0.06 0.00 0.12 0.00 0.00 56.93 58.45 3hsd s PHE 39 Cb -0.20 -2.45 -0.04 0.00 -0.57 0.00 0.00 43.02 39.77 3hsd s PHE 39 CO 0.59 0.16 -0.10 0.71 -0.10 0.00 0.00 175.22 176.48 3hsd s TYR 40 N 0.72 2.76 -0.16 0.36 1.51 0.60 0.15 117.35 123.29 3hsd s TYR 40 Ca 0.20 -0.14 -0.05 0.00 -1.01 0.00 0.00 57.07 56.08 3hsd s TYR 40 Cb -0.14 -1.49 -0.03 0.00 -0.11 0.00 0.00 41.96 40.19 3hsd s TYR 40 CO 0.07 0.39 -0.00 0.50 -1.11 0.00 0.00 175.55 175.39 3hsd s ARG 41 N -1.90 3.72 -0.04 -0.62 3.52 0.47 0.01 118.95 124.11 3hsd s ARG 41 Ca 0.20 -0.46 0.04 0.00 -0.13 0.00 0.00 55.73 55.38 3hsd s ARG 41 Cb -0.11 -3.00 -0.00 0.00 -1.56 0.00 0.00 34.95 30.28 3hsd s ARG 41 CO 0.11 0.29 -0.16 0.95 -0.81 0.00 0.00 175.30 175.68 3hsd s THR 42 N 0.27 1.36 0.85 4.11 -4.23 -0.60 -4.19 115.64 113.22 3hsd s THR 42 Ca -0.01 -0.68 -0.11 0.00 -1.18 0.00 0.00 61.69 59.71 3hsd s THR 42 Cb -0.13 -1.17 0.10 0.00 1.34 0.00 0.00 72.50 72.63 3hsd s THR 42 CO 0.02 0.40 1.09 -2.16 -0.54 0.00 0.00 174.62 173.43 3hsd s PRO 43 N 0.05 1.63 0.82 3.99 0.04 -1.26 -0.23 135.00 140.04 3hsd s PRO 43 Ca -0.04 0.76 -0.11 0.00 0.04 0.00 0.00 61.00 61.65 3hsd s PRO 43 Cb -0.11 -1.86 0.09 0.00 0.04 0.00 0.00 34.50 32.66 3hsd s PRO 43 CO 0.02 -1.97 1.09 -2.14 0.04 0.00 0.00 177.00 174.04 3hsd s PRO 44 N -5.02 1.85 0.03 0.56 0.02 -1.26 -4.72 135.00 126.46 3hsd s PRO 44 Ca 0.62 1.00 -0.14 0.00 0.02 0.00 0.00 61.00 62.51 3hsd s PRO 44 Cb -0.16 -1.86 -0.06 0.00 0.02 0.00 0.00 34.50 32.43 3hsd s PRO 44 CO 0.56 -1.88 0.42 -0.51 -0.33 0.00 0.00 177.00 175.26 3hsd s LEU 45 N -6.03 4.44 0.00 -5.54 1.43 -1.26 -4.92 118.68 106.79 3hsd s LEU 45 Ca 0.62 0.94 0.00 0.00 -1.03 0.00 0.00 54.13 54.66 3hsd s LEU 45 Cb -0.17 -2.73 0.00 0.00 0.03 0.00 0.00 46.19 43.31 3hsd s LEU 45 CO 0.56 0.27 0.00 0.61 0.23 0.00 0.00 176.35 178.03 3hsd n GLY 46 N 1.53 -0.13 3.57 -3.19 0.00 -1.26 -4.90 105.19 100.81 3hsd n GLY 46 Ca -0.12 -1.25 -0.49 0.00 0.00 0.00 0.00 46.02 44.16 3hsd n GLY 46 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3hsd n PRO 47 N 2.02 1.07 -1.76 1.61 -0.02 -1.26 -4.83 135.00 131.84 3hsd n PRO 47 Ca 0.00 0.38 -0.35 0.00 -2.02 0.00 0.00 63.50 61.52 3hsd n PRO 47 Cb 0.00 -1.86 -0.03 0.00 -0.02 0.00 0.00 33.50 31.59 3hsd n PRO 47 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3hsd n GLN 48 N 1.69 3.77 -0.12 -0.52 1.13 -1.26 -4.36 117.38 117.71 3hsd n GLN 48 Ca 0.15 -2.94 0.06 0.00 -1.94 0.00 0.00 57.00 52.33 3hsd n GLN 48 Cb 0.24 -2.46 0.08 0.00 0.11 0.00 0.00 30.24 28.21 3hsd n GLN 48 CO 0.00 0.00 0.00 -0.40 -1.44 0.00 0.00 177.06 175.22 3hsd n ASP 49 N 1.60 1.78 -4.21 1.08 5.75 -1.26 -5.03 116.55 116.25 3hsd n ASP 49 Ca 0.59 -2.59 -0.12 0.00 -0.01 0.00 0.00 54.79 52.65 3hsd n ASP 49 Cb 0.37 -0.29 -0.10 0.00 -1.03 0.00 0.00 41.12 40.07 3hsd n ASP 49 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3hsd s GLN 50 N -1.90 1.01 0.53 0.11 -2.07 -1.26 -5.14 119.66 110.95 3hsd s GLN 50 Ca 0.19 -1.47 -0.22 0.00 -1.82 0.00 0.00 55.36 52.04 3hsd s GLN 50 Cb 0.17 -0.19 -0.05 0.00 -1.09 0.00 0.00 33.01 31.84 3hsd s GLN 50 CO 0.02 -0.11 1.33 -2.14 -1.32 0.00 0.00 175.29 173.06 3hsd s PRO 51 N -3.91 3.23 0.89 9.60 0.02 -1.26 -4.66 135.00 138.91 3hsd s PRO 51 Ca 0.21 2.17 -0.11 0.00 0.02 0.00 0.00 61.00 63.28 3hsd s PRO 51 Cb 0.06 -2.28 0.11 0.00 0.02 0.00 0.00 34.50 32.40 3hsd s PRO 51 CO 0.01 -1.10 0.99 -0.25 -0.33 0.00 0.00 177.00 176.33 3hsd n ASP 52 N -0.94 -0.05 -4.86 2.53 8.00 -1.26 -4.49 116.55 115.47 3hsd n ASP 52 Ca 0.10 0.44 -0.36 0.00 0.71 0.00 0.00 54.79 55.68 3hsd n ASP 52 Cb 0.45 -1.42 -0.06 0.00 -0.02 0.00 0.00 41.12 40.07 3hsd n ASP 52 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hsd s ALA 53 N -2.45 3.75 -0.22 2.24 0.00 0.68 -4.62 121.76 121.14 3hsd s ALA 53 Ca 0.66 -0.39 -0.15 0.00 0.00 0.00 0.00 51.96 52.09 3hsd s ALA 53 Cb -0.24 -2.24 -0.04 0.00 0.00 0.00 0.00 23.12 20.59 3hsd s ALA 53 CO 0.58 0.56 0.36 -1.17 0.00 0.00 0.00 175.76 176.09 3hsd s LEU 54 N -1.50 4.13 -0.03 0.00 0.20 0.39 -1.55 118.68 120.32 3hsd s LEU 54 Ca 0.27 0.42 0.08 0.00 0.69 0.00 0.00 54.13 55.58 3hsd s LEU 54 Cb -0.15 -2.44 -0.02 0.00 -0.43 0.00 0.00 46.19 43.15 3hsd s LEU 54 CO 0.14 -0.08 -0.25 0.20 -0.29 0.00 0.00 176.35 176.07 3hsd s ASN 55 N 1.15 3.10 0.19 3.68 0.01 0.10 -1.43 114.94 121.74 3hsd s ASN 55 Ca 0.17 -0.46 -0.13 0.00 -0.71 0.00 0.00 52.86 51.73 3hsd s ASN 55 Cb -0.15 -0.43 0.01 0.00 0.41 0.00 0.00 41.25 41.09 3hsd s ASN 55 CO 0.08 0.31 0.40 0.00 -1.51 0.00 0.00 177.10 176.38 3hsd s ALA 56 N -0.56 -0.37 0.03 0.60 0.00 -0.26 -0.29 121.76 120.91 3hsd s ALA 56 Ca 0.08 -0.65 0.06 0.00 0.00 0.00 0.00 51.96 51.46 3hsd s ALA 56 Cb -0.11 0.89 -0.02 0.00 0.00 0.00 0.00 23.12 23.88 3hsd s ALA 56 CO -0.00 -0.74 -0.18 0.00 0.00 0.00 0.00 175.76 174.84 3hsd s ALA 57 N -3.94 1.51 -0.05 0.00 0.00 -1.26 -1.03 121.76 116.98 3hsd s ALA 57 Ca 0.15 -0.91 0.04 0.00 0.00 0.00 0.00 51.96 51.24 3hsd s ALA 57 Cb 0.01 -0.30 -0.00 0.00 0.00 0.00 0.00 23.12 22.83 3hsd s ALA 57 CO 0.00 0.33 -0.17 0.08 0.00 0.00 0.00 175.76 176.01 3hsd s VAL 58 N -0.71 1.40 -0.28 0.00 1.01 0.43 -0.87 120.40 121.38 3hsd s VAL 58 Ca 0.06 -0.69 -0.12 0.00 0.00 0.00 0.00 61.98 61.23 3hsd s VAL 58 Cb -0.08 -1.21 -0.04 0.00 0.00 0.00 0.00 36.38 35.05 3hsd s VAL 58 CO 0.01 0.40 0.24 0.00 0.00 0.00 0.00 175.10 175.75 3hsd s ALA 59 N 0.11 3.53 -0.22 5.51 0.00 -0.35 -1.02 121.76 129.32 3hsd s ALA 59 Ca -0.05 -1.05 0.02 0.00 0.00 0.00 0.00 51.96 50.87 3hsd s ALA 59 Cb -0.12 -2.55 0.05 0.00 0.00 0.00 0.00 23.12 20.50 3hsd s ALA 59 CO 0.02 -0.62 -0.11 -1.17 0.00 0.00 0.00 175.76 173.89 3hsd s LEU 60 N 1.83 2.75 0.05 0.00 2.96 0.15 -0.37 118.68 126.06 3hsd s LEU 60 Ca 0.09 -1.09 -0.31 0.00 -0.22 0.00 0.00 54.13 52.60 3hsd s LEU 60 Cb -0.16 -1.39 -0.05 0.00 0.50 0.00 0.00 46.19 45.09 3hsd s LEU 60 CO 0.11 -0.15 1.20 -0.70 -1.32 0.00 0.00 176.35 175.49 3hsd s GLU 61 N 1.26 4.42 -0.01 1.98 2.56 0.81 -0.81 118.70 128.91 3hsd s GLU 61 Ca -0.04 1.77 -0.10 0.00 0.00 0.00 0.00 54.97 56.60 3hsd s GLU 61 Cb -0.18 -3.37 0.01 0.00 2.00 0.00 0.00 34.13 32.60 3hsd s GLU 61 CO -0.07 -0.28 0.21 -0.08 -0.56 0.00 0.00 175.26 174.48 3hsd s THR 62 N 1.18 0.07 -1.16 -1.70 -1.32 0.50 0.31 115.64 113.52 3hsd s THR 62 Ca 0.59 -0.54 0.13 0.00 -1.21 0.00 0.00 61.69 60.65 3hsd s THR 62 Cb -0.29 -0.49 0.32 0.00 -1.51 0.00 0.00 72.50 70.53 3hsd s THR 62 CO 0.29 -0.30 1.25 -1.54 -2.21 0.00 0.00 174.62 172.11 3hsd n SER 63 N 1.53 2.95 -4.78 8.08 3.41 -0.77 -0.91 113.62 123.13 3hsd n SER 63 Ca -0.21 -1.94 -0.32 0.00 -0.26 0.00 0.00 58.87 56.13 3hsd n SER 63 Cb 0.56 -0.23 0.05 0.00 -0.26 0.00 0.00 64.21 64.32 3hsd n SER 63 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3hsd s LEU 64 N -1.01 3.32 0.66 1.04 1.43 -1.26 -5.02 118.68 117.83 3hsd s LEU 64 Ca 0.26 1.90 -0.13 0.00 -1.03 0.00 0.00 54.13 55.12 3hsd s LEU 64 Cb 0.14 -4.54 -0.00 0.00 0.03 0.00 0.00 46.19 41.82 3hsd s LEU 64 CO 0.18 -1.60 1.07 0.00 0.23 0.00 0.00 176.35 176.23 3hsd s ALA 65 N -2.53 2.61 0.18 4.21 0.00 -1.26 -4.83 121.76 120.15 3hsd s ALA 65 Ca 0.64 0.30 -0.14 0.00 0.00 0.00 0.00 51.96 52.77 3hsd s ALA 65 Cb -0.18 -3.23 0.16 0.00 0.00 0.00 0.00 23.12 19.86 3hsd s ALA 65 CO 0.44 -1.14 1.73 -1.35 0.00 0.00 0.00 175.76 175.44 3hsd h PRO 66 N -0.20 0.25 0.00 0.00 0.11 -1.99 -0.26 132.00 129.91 3hsd h PRO 66 Ca -0.45 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.60 3hsd h PRO 66 Cb 1.22 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 3hsd h PRO 66 CO 0.56 0.17 -0.19 0.93 -0.21 0.00 0.00 178.00 179.25 3hsd h GLU 67 N 0.26 0.00 -0.30 1.05 5.08 -1.99 -1.04 114.58 117.64 3hsd h GLU 67 Ca 0.23 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.51 3hsd h GLU 67 Cb 0.28 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 3hsd h GLU 67 CO -0.28 0.19 -0.12 0.93 -1.00 0.00 0.00 179.01 178.74 3hsd h GLU 68 N 0.00 0.62 -0.75 2.33 5.08 -1.63 -1.26 114.58 118.98 3hsd h GLU 68 Ca -0.00 -0.26 -0.00 0.00 -1.00 0.00 0.00 59.36 58.10 3hsd h GLU 68 Cb 0.78 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.97 3hsd h GLU 68 CO 0.03 0.83 0.45 1.25 -1.00 0.00 0.00 179.01 180.56 3hsd h LEU 69 N 0.38 0.90 -0.93 1.33 5.85 -0.69 -2.54 115.31 119.61 3hsd h LEU 69 Ca 0.07 -0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.75 3hsd h LEU 69 Cb 0.62 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 41.38 3hsd h LEU 69 CO 0.04 0.70 0.61 0.25 -0.34 0.00 0.00 178.44 179.70 3hsd h LEU 70 N 1.02 1.03 -0.80 2.25 5.85 -1.04 0.01 115.31 123.63 3hsd h LEU 70 Ca 0.27 -0.01 0.15 0.00 0.84 0.00 0.00 57.88 59.12 3hsd h LEU 70 Cb -0.03 -0.24 -0.10 0.00 0.37 0.00 0.00 40.66 40.66 3hsd h LEU 70 CO -0.05 0.72 0.36 0.78 -0.34 0.00 0.00 178.44 179.91 3hsd h ASN 71 N 1.20 0.38 -0.04 1.25 2.35 -0.80 -0.19 115.58 119.72 3hsd h ASN 71 Ca 0.36 0.10 -0.15 0.00 -0.55 0.00 0.00 56.30 56.06 3hsd h ASN 71 Cb -0.05 0.06 0.01 0.00 0.05 0.00 0.00 38.32 38.39 3hsd h ASN 71 CO -0.11 0.14 -0.58 0.45 -1.65 0.00 0.00 177.43 175.69 3hsd h HIS 72 N 0.51 0.66 -0.72 1.19 3.86 -1.02 -1.51 115.15 118.12 3hsd h HIS 72 Ca 0.44 -0.33 -0.05 0.00 -1.16 0.00 0.00 60.37 59.27 3hsd h HIS 72 Cb 0.66 -0.09 -0.03 0.00 1.06 0.00 0.00 27.41 29.01 3hsd h HIS 72 CO -0.13 1.13 0.25 1.79 0.86 0.00 0.00 177.93 181.83 3hsd h THR 73 N 0.01 1.25 -0.53 2.45 1.35 -0.79 -0.38 112.91 116.27 3hsd h THR 73 Ca -0.06 -0.84 -0.09 0.00 -0.55 0.00 0.00 66.41 64.87 3hsd h THR 73 Cb 1.26 0.42 -0.02 0.00 -1.73 0.00 0.00 68.15 68.08 3hsd h THR 73 CO 0.12 0.33 -0.03 1.56 -0.25 0.00 0.00 175.52 177.25 3hsd h GLN 74 N 1.06 0.92 -0.17 4.72 4.20 -1.07 -0.53 115.11 124.25 3hsd h GLN 74 Ca 0.24 -0.28 0.00 0.00 0.06 0.00 0.00 58.65 58.67 3hsd h GLN 74 Cb 0.25 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.94 3hsd h GLN 74 CO -0.01 0.93 0.11 -0.09 -0.67 0.00 0.00 178.83 179.10 3hsd h ARG 75 N 0.85 0.22 -0.69 1.46 2.43 -0.78 -1.58 114.38 116.29 3hsd h ARG 75 Ca 0.15 -0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.24 3hsd h ARG 75 Cb 0.54 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.01 3hsd h ARG 75 CO 0.03 0.16 0.16 0.82 -1.51 0.00 0.00 179.97 179.63 3hsd h ILE 76 N 0.22 1.26 -0.84 1.20 2.04 -0.90 0.53 117.51 121.02 3hsd h ILE 76 Ca 0.06 -0.96 -0.03 0.00 1.00 0.00 0.00 64.86 64.93 3hsd h ILE 76 Cb -0.01 0.55 -0.04 0.00 -0.74 0.00 0.00 36.82 36.58 3hsd h ILE 76 CO -0.01 0.37 0.39 -0.08 0.00 0.00 0.00 178.15 178.82 3hsd h GLU 77 N 1.04 1.22 -0.13 2.37 4.81 -0.87 0.01 114.58 123.03 3hsd h GLU 77 Ca 0.22 -0.19 -0.03 0.00 -0.13 0.00 0.00 59.36 59.23 3hsd h GLU 77 Cb 0.37 -0.22 -0.00 0.00 0.63 0.00 0.00 28.75 29.53 3hsd h GLU 77 CO 0.00 0.95 -0.05 1.25 -0.73 0.00 0.00 179.01 180.43 3hsd h LEU 78 N 1.21 0.28 -1.18 1.64 5.85 -0.83 -0.21 115.31 122.06 3hsd h LEU 78 Ca 0.29 -0.40 -0.07 0.00 0.84 0.00 0.00 57.88 58.55 3hsd h LEU 78 Cb 0.14 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 3hsd h LEU 78 CO -0.03 0.61 -0.13 1.56 -0.34 0.00 0.00 178.44 180.11 3hsd h GLN 79 N -0.06 0.41 0.00 1.25 4.20 -0.61 -3.23 115.11 117.08 3hsd h GLN 79 Ca 0.03 -0.11 0.00 0.00 0.06 0.00 0.00 58.65 58.63 3hsd h GLN 79 Cb 0.50 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.23 3hsd h GLN 79 CO 0.02 0.55 -1.36 1.04 -0.67 0.00 0.00 178.83 178.41 3hsd n GLN 80 N -4.22 0.85 -0.00 1.46 1.13 -0.04 -4.68 117.38 111.88 3hsd n GLN 80 Ca 0.00 -0.09 0.07 0.00 -1.94 0.00 0.00 57.00 55.05 3hsd n GLN 80 Cb 0.31 -1.38 -0.10 0.00 0.11 0.00 0.00 30.24 29.18 3hsd n GLN 80 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3hsd n GLY 81 N 1.44 -0.53 2.55 1.08 0.00 -0.09 -4.65 105.19 105.00 3hsd n GLY 81 Ca -0.00 -0.41 -0.41 0.00 0.00 0.00 0.00 46.02 45.20 3hsd n GLY 81 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hsd n ARG 82 N -1.58 3.77 -4.25 1.61 5.12 -1.22 -4.19 116.66 115.91 3hsd n ARG 82 Ca 0.01 -2.90 -0.14 0.00 -1.93 0.00 0.00 57.85 52.89 3hsd n ARG 82 Cb 0.29 -2.88 -0.10 0.00 -1.16 0.00 0.00 32.46 28.61 3hsd n ARG 82 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 3hsd s VAL 83 N 1.09 0.95 0.00 1.55 -7.23 -1.25 -4.15 120.40 111.36 3hsd s VAL 83 Ca 0.55 -2.02 0.00 0.00 -1.81 0.00 0.00 61.98 58.70 3hsd s VAL 83 Cb 0.16 -2.01 0.00 0.00 0.56 0.00 0.00 36.38 35.09 3hsd s VAL 83 CO -0.06 -0.60 0.00 0.54 -0.31 0.00 0.00 175.10 174.67 3hsd n ARG 84 N -0.24 0.00 0.27 4.82 5.12 -1.26 -0.44 116.66 124.93 3hsd n ARG 84 Ca -0.08 0.00 0.11 0.00 -1.93 0.00 0.00 57.85 55.95 3hsd n ARG 84 Cb 0.62 0.00 0.75 0.00 -1.16 0.00 0.00 32.46 32.67 3hsd n ARG 84 CO 0.00 0.00 0.00 0.87 -1.93 0.00 0.00 177.63 176.57 3hsd h LYS 85 N 0.00 0.00 -0.69 5.56 1.79 -1.96 -2.13 116.57 119.14 3hsd h LYS 85 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 3hsd h LYS 85 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 3hsd h LYS 85 CO 0.00 0.00 0.00 0.00 -1.08 0.00 0.00 179.45 178.37 3hsd n ALA 86 N -2.45 3.28 -0.26 3.86 0.00 0.42 -3.50 120.51 121.85 3hsd n ALA 86 Ca -0.03 -1.22 -0.07 0.00 0.00 0.00 0.00 53.44 52.13 3hsd n ALA 86 Cb 0.10 -1.07 0.05 0.00 0.00 0.00 0.00 19.45 18.54 3hsd n ALA 86 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3hsd h GLU 87 N 2.71 1.13 -7.09 0.00 5.08 -1.40 -3.31 114.58 111.70 3hsd h GLU 87 Ca 0.00 -0.25 -0.49 0.00 -1.00 0.00 0.00 59.36 57.62 3hsd h GLU 87 Cb 1.36 -0.16 0.05 0.00 0.50 0.00 0.00 28.75 30.51 3hsd h GLU 87 CO 0.28 0.98 0.41 0.50 -1.00 0.00 0.00 179.01 180.17 3hsd s ARG 88 N -5.38 3.53 -0.13 2.33 3.52 -1.23 -4.95 118.95 116.64 3hsd s ARG 88 Ca -0.12 1.47 -0.29 0.00 -0.13 0.00 0.00 55.73 56.65 3hsd s ARG 88 Cb 0.15 -2.04 -0.02 0.00 -1.56 0.00 0.00 34.95 31.48 3hsd s ARG 88 CO 0.84 -0.68 1.16 -0.46 -0.81 0.00 0.00 175.30 175.36 3hsd s TRP 89 N -1.92 3.15 0.00 5.12 -0.11 -1.26 -4.16 118.94 119.76 3hsd s TRP 89 Ca 0.70 1.25 0.00 0.00 1.22 0.00 0.00 56.10 59.27 3hsd s TRP 89 Cb -0.20 -3.39 0.00 0.00 -1.50 0.00 0.00 33.47 28.38 3hsd s TRP 89 CO 0.25 -1.13 0.00 0.41 -4.62 0.00 0.00 176.95 171.86 3hsd n GLY 90 N 3.40 2.55 3.70 5.86 0.00 -1.26 -5.11 105.19 114.32 3hsd n GLY 90 Ca 0.12 -0.53 -0.31 0.00 0.00 0.00 0.00 46.02 45.30 3hsd n GLY 90 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3hsd s PRO 91 N 0.00 1.32 0.01 1.61 0.02 -1.26 -5.06 135.00 131.63 3hsd s PRO 91 Ca 0.00 1.46 0.01 0.00 0.02 0.00 0.00 61.00 62.49 3hsd s PRO 91 Cb 0.00 -1.77 -0.01 0.00 0.02 0.00 0.00 34.50 32.75 3hsd s PRO 91 CO 0.00 -2.39 -0.02 0.50 -0.33 0.00 0.00 177.00 174.75 3hsd s ARG 92 N -4.71 0.20 0.00 5.54 3.52 -1.26 -4.59 118.95 117.65 3hsd s ARG 92 Ca 0.65 -0.20 0.00 0.00 -0.13 0.00 0.00 55.73 56.06 3hsd s ARG 92 Cb -0.21 -0.12 0.00 0.00 -1.56 0.00 0.00 34.95 33.06 3hsd s ARG 92 CO 0.57 0.03 0.00 0.25 -0.81 0.00 0.00 175.30 175.34 3hsd n THR 93 N 2.71 0.00 -4.14 4.11 -2.24 -1.26 -4.86 114.28 108.59 3hsd n THR 93 Ca -0.15 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.48 3hsd n THR 93 Cb 0.58 -0.24 -0.13 0.00 -2.10 0.00 0.00 70.33 68.44 3hsd n THR 93 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 3hsd s LEU 94 N -3.42 2.11 -0.10 3.22 2.96 -1.26 -1.50 118.68 120.68 3hsd s LEU 94 Ca 0.00 -0.28 -0.04 0.00 -0.22 0.00 0.00 54.13 53.59 3hsd s LEU 94 Cb 0.00 -0.26 0.05 0.00 0.50 0.00 0.00 46.19 46.49 3hsd s LEU 94 CO 0.00 -0.03 0.18 -0.62 -1.32 0.00 0.00 176.35 174.56 3hsd s ASP 95 N -0.70 0.75 -0.26 3.68 2.15 -0.19 -4.98 116.67 117.12 3hsd s ASP 95 Ca -0.02 0.33 -0.02 0.00 0.43 0.00 0.00 52.55 53.27 3hsd s ASP 95 Cb -0.05 0.36 0.03 0.00 -0.30 0.00 0.00 42.92 42.96 3hsd s ASP 95 CO 0.00 -0.25 -0.04 -0.76 -0.17 0.00 0.00 175.17 173.95 3hsd s LEU 96 N 2.32 3.35 -0.11 -1.34 1.02 -1.26 -1.16 118.68 121.50 3hsd s LEU 96 Ca 0.03 -0.93 0.02 0.00 0.02 0.00 0.00 54.13 53.27 3hsd s LEU 96 Cb -0.12 -1.68 -0.01 0.00 0.02 0.00 0.00 46.19 44.39 3hsd s LEU 96 CO -0.07 -0.15 -0.18 -1.81 0.02 0.00 0.00 176.35 174.16 3hsd s ASP 97 N 1.32 3.65 -0.48 2.29 1.01 -0.30 -4.88 116.67 119.28 3hsd s ASP 97 Ca -0.01 -0.41 -0.28 0.00 0.71 0.00 0.00 52.55 52.56 3hsd s ASP 97 Cb -0.17 -1.44 0.01 0.00 1.01 0.00 0.00 42.92 42.33 3hsd s ASP 97 CO -0.03 0.18 1.38 -0.63 0.21 0.00 0.00 175.17 176.28 3hsd s ILE 98 N 0.23 3.90 -0.13 0.77 1.01 -1.26 -0.52 121.20 125.19 3hsd s ILE 98 Ca -0.11 0.87 -0.28 0.00 0.00 0.00 0.00 60.65 61.12 3hsd s ILE 98 Cb -0.16 -4.34 -0.25 0.00 0.01 0.00 0.00 42.46 37.72 3hsd s ILE 98 CO 0.06 -0.94 0.78 0.24 0.00 0.00 0.00 174.94 175.08 3hsd h MET 99 N 10.67 -0.00 -3.97 2.79 2.86 -0.86 -3.37 114.93 123.05 3hsd h MET 99 Ca -0.27 0.00 -0.19 0.00 -2.06 0.00 0.00 59.70 57.19 3hsd h MET 99 Cb 1.09 0.00 -0.22 0.00 0.06 0.00 0.00 31.60 32.53 3hsd h MET 99 CO 1.12 0.95 -0.71 -0.51 1.06 0.00 0.00 176.91 178.83 3hsd s LEU 100 N -8.28 2.20 -0.36 1.22 1.43 -1.09 -1.15 118.68 112.65 3hsd s LEU 100 Ca -0.18 -0.41 0.00 0.00 -1.03 0.00 0.00 54.13 52.51 3hsd s LEU 100 Cb -0.03 0.07 0.12 0.00 0.03 0.00 0.00 46.19 46.37 3hsd s LEU 100 CO 0.67 -0.24 0.16 0.12 0.23 0.00 0.00 176.35 177.29 3hsd s PHE 101 N -1.18 1.62 0.00 0.29 2.19 -1.26 -0.92 117.98 118.71 3hsd s PHE 101 Ca -0.13 -1.91 0.00 0.00 0.33 0.00 0.00 56.93 55.22 3hsd s PHE 101 Cb -0.08 -1.64 0.00 0.00 -1.31 0.00 0.00 43.02 39.99 3hsd s PHE 101 CO -0.01 -0.84 0.00 0.41 1.83 0.00 0.00 175.22 176.61 3hsd n GLY 102 N 4.34 3.13 1.16 13.12 0.00 -0.09 -1.32 105.19 125.53 3hsd n GLY 102 Ca 0.03 -0.16 0.09 0.00 0.00 0.00 0.00 46.02 45.98 3hsd n GLY 102 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3hsd n ASN 103 N 2.89 3.92 -4.78 1.61 3.02 -1.26 -4.96 115.26 115.70 3hsd n ASN 103 Ca 0.00 -2.28 -0.35 0.00 -0.03 0.00 0.00 54.58 51.92 3hsd n ASN 103 Cb 0.00 -0.45 -0.00 0.00 -0.61 0.00 0.00 39.78 38.72 3hsd n ASN 103 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 3hsd s GLU 104 N -1.52 3.46 -0.18 3.52 2.02 -0.44 -4.70 118.70 120.87 3hsd s GLU 104 Ca 0.41 1.62 -0.02 0.00 0.02 0.00 0.00 54.97 57.00 3hsd s GLU 104 Cb 0.25 -2.08 -0.01 0.00 0.10 0.00 0.00 34.13 32.39 3hsd s GLU 104 CO 0.22 -0.77 -0.10 0.08 0.02 0.00 0.00 175.26 174.71 3hsd s VAL 105 N -1.75 3.05 -0.03 2.63 1.01 -1.26 -4.34 120.40 119.72 3hsd s VAL 105 Ca 0.71 -0.62 0.02 0.00 0.00 0.00 0.00 61.98 62.09 3hsd s VAL 105 Cb -0.24 -2.33 0.00 0.00 0.00 0.00 0.00 36.38 33.81 3hsd s VAL 105 CO 0.28 0.48 -0.09 -0.63 0.00 0.00 0.00 175.10 175.13 3hsd s ILE 106 N 0.99 0.82 -0.44 2.22 1.01 0.46 -4.98 121.20 121.28 3hsd s ILE 106 Ca -0.01 -0.37 0.07 0.00 0.00 0.00 0.00 60.65 60.34 3hsd s ILE 106 Cb -0.15 -0.74 0.24 0.00 0.01 0.00 0.00 42.46 41.83 3hsd s ILE 106 CO -0.01 0.26 0.69 -3.20 0.00 0.00 0.00 174.94 172.68 3hsd n ASN 107 N 3.35 -1.40 -5.00 3.58 4.05 -1.21 -0.86 115.26 117.77 3hsd n ASN 107 Ca -0.19 -2.97 -0.19 0.00 0.45 0.00 0.00 54.58 51.67 3hsd n ASN 107 Cb 0.54 0.59 0.05 0.00 1.23 0.00 0.00 39.78 42.19 3hsd n ASN 107 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 177.26 174.63 3hsd s THR 108 N -0.20 2.35 0.27 -0.44 -4.23 0.01 -4.98 115.64 108.42 3hsd s THR 108 Ca 0.33 -0.96 -0.02 0.00 -1.18 0.00 0.00 61.69 59.86 3hsd s THR 108 Cb 0.19 -2.38 0.27 0.00 1.34 0.00 0.00 72.50 71.92 3hsd s THR 108 CO -0.18 0.00 1.88 -0.08 -0.54 0.00 0.00 174.62 175.71 3hsd h GLU 109 N 0.23 1.12 0.00 3.99 4.81 -2.06 -2.94 114.58 119.73 3hsd h GLU 109 Ca -0.33 -0.07 -0.20 0.00 -0.13 0.00 0.00 59.36 58.63 3hsd h GLU 109 Cb 1.29 -0.25 -0.03 0.00 0.63 0.00 0.00 28.75 30.38 3hsd h GLU 109 CO 0.42 0.74 -1.04 0.00 -0.73 0.00 0.00 179.01 178.40 3hsd h ARG 110 N 1.15 0.00 -3.23 1.92 3.08 -2.02 -3.47 114.38 111.81 3hsd h ARG 110 Ca 0.44 0.00 -0.27 0.00 0.07 0.00 0.00 59.98 60.21 3hsd h ARG 110 Cb 0.20 0.00 -0.34 0.00 0.08 0.00 0.00 29.97 29.91 3hsd h ARG 110 CO -0.18 0.81 -0.63 -1.17 -1.07 0.00 0.00 179.97 177.73 3hsd s LEU 111 N -6.53 0.46 -0.19 3.04 2.96 -1.11 -5.12 118.68 112.18 3hsd s LEU 111 Ca 0.00 0.27 0.01 0.00 -0.22 0.00 0.00 54.13 54.20 3hsd s LEU 111 Cb 0.09 0.26 0.04 0.00 0.50 0.00 0.00 46.19 47.08 3hsd s LEU 111 CO 0.81 -0.18 -0.13 -0.89 -1.32 0.00 0.00 176.35 174.63 3hsd s THR 112 N 1.59 1.77 -0.01 3.68 2.01 -1.26 -0.81 115.64 122.61 3hsd s THR 112 Ca -0.04 -1.00 0.00 0.00 0.31 0.00 0.00 61.69 60.96 3hsd s THR 112 Cb -0.12 -1.77 0.02 0.00 0.01 0.00 0.00 72.50 70.64 3hsd s THR 112 CO -0.05 0.27 0.01 -0.69 -0.69 0.00 0.00 174.62 173.47 3hsd s VAL 113 N 1.36 0.03 0.58 3.82 1.01 -0.04 -3.56 120.40 123.60 3hsd s VAL 113 Ca 0.00 0.10 -0.19 0.00 0.00 0.00 0.00 61.98 61.89 3hsd s VAL 113 Cb -0.15 -0.11 -0.05 0.00 0.00 0.00 0.00 36.38 36.07 3hsd s VAL 113 CO -0.09 0.07 0.99 -2.65 0.00 0.00 0.00 175.10 173.42 3hsd n PRO 114 N 3.75 0.99 -1.67 2.72 -0.02 -1.26 -0.40 135.00 139.10 3hsd n PRO 114 Ca -0.22 0.38 -0.45 0.00 -2.02 0.00 0.00 63.50 61.20 3hsd n PRO 114 Cb 0.54 -2.18 -0.02 0.00 -0.02 0.00 0.00 33.50 31.81 3hsd n PRO 114 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 3hsd n HIS 115 N -1.57 2.14 -1.68 6.00 -0.00 -0.30 -4.79 115.22 115.02 3hsd n HIS 115 Ca 0.13 0.46 -0.53 0.00 0.46 0.00 0.00 57.72 58.24 3hsd n HIS 115 Cb 0.46 -2.44 -0.06 0.00 -0.12 0.00 0.00 29.99 27.83 3hsd n HIS 115 CO 0.00 0.00 0.00 0.98 0.46 0.00 0.00 176.34 177.78 3hsd n TYR 116 N 1.66 2.04 -0.92 1.57 9.36 -1.26 -2.01 117.16 127.60 3hsd n TYR 116 Ca 0.11 0.40 0.00 0.00 3.32 0.00 0.00 57.90 61.72 3hsd n TYR 116 Cb 0.32 -2.49 0.00 0.00 -0.63 0.00 0.00 39.34 36.54 3hsd n TYR 116 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 3hsd n ASP 117 N 4.93 -1.27 0.12 2.98 2.03 -1.26 -4.89 116.55 119.19 3hsd n ASP 117 Ca 0.23 0.00 0.08 0.00 0.52 0.00 0.00 54.79 55.62 3hsd n ASP 117 Cb 0.20 -0.83 0.56 0.00 -0.72 0.00 0.00 41.12 40.33 3hsd n ASP 117 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3hsd h MET 118 N 1.75 0.22 0.00 -0.67 -0.00 -1.76 -0.11 114.93 114.36 3hsd h MET 118 Ca 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 59.70 59.69 3hsd h MET 118 Cb 0.08 -0.05 0.00 0.00 -0.00 0.00 0.00 31.60 31.63 3hsd h MET 118 CO 0.00 0.15 0.00 1.63 -0.00 0.00 0.00 176.91 178.69 3hsd n LYS 119 N -4.50 0.15 -0.13 -0.10 5.02 -1.26 -1.92 118.16 115.42 3hsd n LYS 119 Ca 0.01 0.18 0.09 0.00 -2.02 0.00 0.00 58.31 56.58 3hsd n LYS 119 Cb 0.15 -1.50 0.15 0.00 -0.02 0.00 0.00 35.03 33.82 3hsd n LYS 119 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3hsd n ASN 120 N -1.33 2.97 -4.09 4.39 3.02 -0.05 -4.91 115.26 115.25 3hsd n ASN 120 Ca 0.06 -1.87 -0.33 0.00 -0.03 0.00 0.00 54.58 52.41 3hsd n ASN 120 Cb 0.11 -0.17 -0.14 0.00 -0.61 0.00 0.00 39.78 38.97 3hsd n ASN 120 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3hsd s ARG 121 N -1.28 2.09 0.45 3.52 0.52 -0.81 -4.96 118.95 118.48 3hsd s ARG 121 Ca 0.29 -1.51 0.17 0.00 -0.52 0.00 0.00 55.73 54.16 3hsd s ARG 121 Cb 0.17 -3.14 1.11 0.00 0.52 0.00 0.00 34.95 33.62 3hsd s ARG 121 CO 0.24 -0.74 1.95 0.78 0.02 0.00 0.00 175.30 177.55 3hsd h GLY 122 N 7.83 0.54 2.00 -3.53 0.00 -1.91 -0.44 103.07 107.57 3hsd h GLY 122 Ca -0.15 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.04 3hsd h GLY 122 CO 0.53 0.06 0.00 1.97 0.00 0.00 0.00 176.54 179.09 3hsd n PHE 123 N -4.46 0.58 -0.13 5.60 1.16 -1.26 -1.18 117.46 117.76 3hsd n PHE 123 Ca 0.12 0.22 -0.24 0.00 -1.87 0.00 0.00 57.45 55.68 3hsd n PHE 123 Cb 0.51 -0.85 -0.11 0.00 -1.61 0.00 0.00 39.48 37.42 3hsd n PHE 123 CO 0.00 0.00 0.00 -1.33 -1.87 0.00 0.00 176.76 173.56 3hsd n MET 124 N -2.02 0.62 -0.14 3.97 2.81 -0.49 -4.52 117.12 117.35 3hsd n MET 124 Ca 0.03 0.22 -0.11 0.00 -1.81 0.00 0.00 57.70 56.03 3hsd n MET 124 Cb 0.24 -1.51 -0.01 0.00 -0.71 0.00 0.00 33.22 31.23 3hsd n MET 124 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 3hsd h LEU 125 N -0.55 0.79 0.16 4.03 3.38 -0.96 -2.55 115.31 119.61 3hsd h LEU 125 Ca -0.64 -0.35 -0.01 0.00 0.09 0.00 0.00 57.88 56.97 3hsd h LEU 125 Cb 1.74 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 42.28 3hsd h LEU 125 CO -0.27 0.95 -0.08 -0.50 0.09 0.00 0.00 178.44 178.64 3hsd h TRP 126 N 0.62 -0.20 -0.74 1.13 -0.00 -1.40 0.05 115.95 115.41 3hsd h TRP 126 Ca 0.11 -0.00 0.03 0.00 -0.00 0.00 0.00 58.89 59.02 3hsd h TRP 126 Cb 0.59 0.07 -0.04 0.00 -0.00 0.00 0.00 29.16 29.78 3hsd h TRP 126 CO 0.05 0.02 0.49 -1.35 -0.00 0.00 0.00 178.44 177.64 3hsd h PRO 127 N -0.39 0.90 -0.77 0.49 0.11 -1.77 -1.70 132.00 128.86 3hsd h PRO 127 Ca -0.02 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 66.00 3hsd h PRO 127 Cb 0.31 -0.20 -0.04 0.00 0.11 0.00 0.00 31.00 31.18 3hsd h PRO 127 CO 0.04 0.60 0.36 1.25 -0.21 0.00 0.00 178.00 180.03 3hsd h LEU 128 N 0.93 1.02 -1.37 2.35 5.85 -1.22 -2.59 115.31 120.28 3hsd h LEU 128 Ca 0.29 -0.14 -0.07 0.00 0.84 0.00 0.00 57.88 58.80 3hsd h LEU 128 Cb -0.00 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.76 3hsd h LEU 128 CO -0.08 0.88 -0.32 0.15 -0.34 0.00 0.00 178.44 178.74 3hsd h PHE 129 N 1.09 0.00 -0.80 1.25 3.57 -0.27 0.16 116.94 121.94 3hsd h PHE 129 Ca 0.26 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.72 3hsd h PHE 129 Cb 0.14 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 38.84 3hsd h PHE 129 CO 0.01 0.32 0.33 1.49 -2.23 0.00 0.00 178.31 178.23 3hsd h GLU 130 N 0.00 1.19 0.00 1.11 4.81 -0.93 -2.91 114.58 117.85 3hsd h GLU 130 Ca -0.00 -0.21 0.00 0.00 -0.13 0.00 0.00 59.36 59.02 3hsd h GLU 130 Cb 0.58 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.76 3hsd h GLU 130 CO 0.04 0.95 -1.19 0.44 -0.73 0.00 0.00 179.01 178.53 3hsd n ILE 131 N -4.29 0.00 -3.05 2.32 -5.35 -0.98 -4.66 119.36 103.36 3hsd n ILE 131 Ca 0.07 -0.10 -0.16 0.00 -0.27 0.00 0.00 62.75 62.29 3hsd n ILE 131 Cb 0.18 0.77 0.00 0.00 -1.74 0.00 0.00 39.64 38.85 3hsd n ILE 131 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3hsd n ALA 132 N -1.66 1.13 0.31 -1.28 0.00 0.51 -4.98 120.51 114.55 3hsd n ALA 132 Ca 0.02 -2.78 0.20 0.00 0.00 0.00 0.00 53.44 50.88 3hsd n ALA 132 Cb 0.38 -1.00 1.01 0.00 0.00 0.00 0.00 19.45 19.84 3hsd n ALA 132 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3hsd h PRO 133 N 3.16 0.00 -0.64 0.00 0.13 -1.72 -1.71 132.00 131.22 3hsd h PRO 133 Ca 0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 3hsd h PRO 133 Cb 1.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.13 3hsd h PRO 133 CO 0.39 0.02 0.00 0.39 -0.23 0.00 0.00 178.00 178.57 3hsd n GLU 134 N -3.23 2.56 -1.74 0.86 -0.58 -1.26 -4.33 120.64 112.92 3hsd n GLU 134 Ca -0.02 -2.42 -0.42 0.00 -0.42 0.00 0.00 57.16 53.88 3hsd n GLU 134 Cb 0.15 -1.53 -0.01 0.00 -0.57 0.00 0.00 31.44 29.48 3hsd n GLU 134 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 3hsd n LEU 135 N 1.48 4.24 -4.13 -4.62 0.00 -0.65 -4.89 117.00 108.43 3hsd n LEU 135 Ca 0.22 1.19 -0.28 0.00 0.00 0.00 0.00 56.01 57.15 3hsd n LEU 135 Cb 0.58 -1.57 -0.17 0.00 0.00 0.00 0.00 43.42 42.27 3hsd n LEU 135 CO 0.16 -0.05 -0.51 -0.69 0.00 0.00 0.00 177.39 176.30 3hsd s VAL 136 N -0.70 1.58 0.74 1.96 1.01 -1.26 -0.86 120.40 122.87 3hsd s VAL 136 Ca 0.58 -0.76 -0.12 0.00 0.00 0.00 0.00 61.98 61.68 3hsd s VAL 136 Cb -0.52 -1.38 0.04 0.00 0.00 0.00 0.00 36.38 34.52 3hsd s VAL 136 CO 0.58 0.45 1.10 -0.36 0.00 0.00 0.00 175.10 176.88 3hsd s PHE 137 N 0.33 3.14 0.30 5.22 0.40 0.70 -4.91 117.98 123.16 3hsd s PHE 137 Ca -0.12 1.05 0.36 0.00 -0.60 0.00 0.00 56.93 57.62 3hsd s PHE 137 Cb -0.15 -3.12 1.91 0.00 0.51 0.00 0.00 43.02 42.16 3hsd s PHE 137 CO 0.05 -1.42 2.09 -1.35 0.70 0.00 0.00 175.22 175.30 3hsd h PRO 138 N -0.82 0.00 -0.01 0.24 0.11 -1.88 0.73 132.00 130.37 3hsd h PRO 138 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3hsd h PRO 138 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 3hsd h PRO 138 CO 0.63 0.00 -0.03 -0.40 -0.21 0.00 0.00 178.00 177.99 3hsd n ASP 139 N -2.78 1.30 0.00 -2.05 5.75 -1.26 -4.92 116.55 112.59 3hsd n ASP 139 Ca -0.02 -1.37 0.00 0.00 -0.01 0.00 0.00 54.79 53.39 3hsd n ASP 139 Cb 0.08 0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.18 3hsd n ASP 139 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3hsd n GLY 140 N 1.18 0.53 3.73 6.12 0.00 0.25 -5.06 105.19 111.95 3hsd n GLY 140 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 3hsd n GLY 140 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hsd s GLU 141 N -0.83 4.52 0.09 1.61 2.02 -1.26 -4.72 118.70 120.13 3hsd s GLU 141 Ca 0.00 1.78 -0.28 0.00 0.02 0.00 0.00 54.97 56.49 3hsd s GLU 141 Cb 0.00 -3.29 -0.06 0.00 0.10 0.00 0.00 34.13 30.88 3hsd s GLU 141 CO 0.00 -0.07 0.87 -1.64 0.02 0.00 0.00 175.26 174.45 3hsd s MET 142 N 0.07 4.62 0.26 1.61 -1.94 -1.26 -0.22 119.30 122.44 3hsd s MET 142 Ca 0.53 1.29 -0.01 0.00 -1.71 0.00 0.00 55.69 55.79 3hsd s MET 142 Cb -0.30 -3.36 0.53 0.00 2.01 0.00 0.00 34.83 33.71 3hsd s MET 142 CO 0.34 0.28 1.77 1.25 -0.01 0.00 0.00 175.02 178.65 3hsd h LEU 143 N 5.47 0.58 -1.11 -0.03 5.85 -1.32 -0.93 115.31 123.81 3hsd h LEU 143 Ca -0.44 0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.36 3hsd h LEU 143 Cb 1.21 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 42.19 3hsd h LEU 143 CO 0.71 0.26 0.46 0.08 -0.34 0.00 0.00 178.44 179.60 3hsd h ARG 144 N 0.67 1.07 -0.21 1.25 0.11 -1.78 -1.32 114.38 114.16 3hsd h ARG 144 Ca 0.47 -0.10 -0.18 0.00 0.10 0.00 0.00 59.98 60.26 3hsd h ARG 144 Cb 0.63 -0.22 -0.00 0.00 1.11 0.00 0.00 29.97 31.49 3hsd h ARG 144 CO -0.35 0.76 -0.61 0.37 0.10 0.00 0.00 179.97 180.25 3hsd h GLN 145 N 1.08 0.71 -0.13 0.08 5.75 -1.61 -1.42 115.11 119.58 3hsd h GLN 145 Ca 0.28 -0.49 -0.01 0.00 -0.15 0.00 0.00 58.65 58.29 3hsd h GLN 145 Cb -0.02 0.07 -0.01 0.00 1.07 0.00 0.00 27.48 28.59 3hsd h GLN 145 CO -0.05 1.11 0.05 0.82 -2.65 0.00 0.00 178.83 178.11 3hsd h ILE 146 N 0.53 1.15 -0.86 2.39 2.04 -0.95 -0.87 117.51 120.94 3hsd h ILE 146 Ca -0.00 -0.46 -0.03 0.00 1.00 0.00 0.00 64.86 65.37 3hsd h ILE 146 Cb 1.20 1.21 -0.04 0.00 -0.74 0.00 0.00 36.82 38.45 3hsd h ILE 146 CO 0.12 0.14 0.44 -0.07 0.00 0.00 0.00 178.15 178.78 3hsd h LEU 147 N 0.06 1.11 0.01 1.44 3.38 -1.22 0.21 115.31 120.30 3hsd h LEU 147 Ca 0.04 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 3hsd h LEU 147 Cb 0.17 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.64 3hsd h LEU 147 CO -0.00 0.92 -0.00 -0.74 0.09 0.00 0.00 178.44 178.70 3hsd h HIS 148 N 1.22 -0.01 0.03 1.13 2.76 -1.04 -1.31 115.15 117.92 3hsd h HIS 148 Ca 0.30 -0.00 -0.25 0.00 -2.20 0.00 0.00 60.37 58.22 3hsd h HIS 148 Cb 0.09 0.00 0.01 0.00 1.55 0.00 0.00 27.41 29.06 3hsd h HIS 148 CO 0.01 0.02 -1.04 1.15 -1.30 0.00 0.00 177.93 176.78 3hsd h THR 149 N -0.04 1.36 -0.18 6.26 2.02 -0.86 -3.20 112.91 118.26 3hsd h THR 149 Ca -0.00 -2.44 -0.09 0.00 0.77 0.00 0.00 66.41 64.65 3hsd h THR 149 Cb 0.04 2.48 -0.01 0.00 -1.74 0.00 0.00 68.15 68.92 3hsd h THR 149 CO 0.00 0.74 -0.26 0.03 0.37 0.00 0.00 175.52 176.39 3hsd h ARG 150 N 0.27 0.34 -6.51 6.66 2.47 -0.59 -3.47 114.38 113.54 3hsd h ARG 150 Ca -0.11 -0.12 -0.50 0.00 -1.26 0.00 0.00 59.98 57.98 3hsd h ARG 150 Cb 1.69 -0.02 -0.08 0.00 -1.65 0.00 0.00 29.97 29.91 3hsd h ARG 150 CO 0.19 0.58 -0.86 0.00 0.56 0.00 0.00 179.97 180.44 3hsd n ALA 151 N -2.48 -1.82 -1.74 0.04 0.00 -0.50 -4.93 120.51 109.08 3hsd n ALA 151 Ca -0.01 -0.18 -0.37 0.00 0.00 0.00 0.00 53.44 52.88 3hsd n ALA 151 Cb 0.39 -2.10 0.05 0.00 0.00 0.00 0.00 19.45 17.79 3hsd n ALA 151 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3hsd s PHE 152 N -3.77 2.22 0.33 0.00 0.08 -1.26 -4.96 117.98 110.61 3hsd s PHE 152 Ca 0.19 1.45 -0.28 0.00 0.12 0.00 0.00 56.93 58.41 3hsd s PHE 152 Cb -0.10 -3.70 -0.12 0.00 -0.57 0.00 0.00 43.02 38.53 3hsd s PHE 152 CO 0.89 -2.78 1.32 -0.25 -0.10 0.00 0.00 175.22 174.30 3hsd n ASP 153 N -1.50 2.83 -4.75 1.36 8.00 -1.26 -4.97 116.55 116.26 3hsd n ASP 153 Ca 0.13 1.20 -0.35 0.00 0.71 0.00 0.00 54.79 56.48 3hsd n ASP 153 Cb 0.47 -1.48 0.05 0.00 -0.02 0.00 0.00 41.12 40.14 3hsd n ASP 153 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3hsd s LYS 154 N -1.64 2.73 0.03 -1.24 1.02 -1.26 -4.99 119.74 114.40 3hsd s LYS 154 Ca 0.57 1.69 -0.04 0.00 0.02 0.00 0.00 55.97 58.22 3hsd s LYS 154 Cb -0.57 -1.91 -0.04 0.00 -0.52 0.00 0.00 37.83 34.78 3hsd s LYS 154 CO 0.60 -1.36 0.25 -0.51 -0.92 0.00 0.00 175.35 173.41 3hsd s LEU 155 N -4.53 4.35 0.41 3.17 1.43 -1.26 -5.08 118.68 117.18 3hsd s LEU 155 Ca 0.74 0.44 -0.25 0.00 -1.03 0.00 0.00 54.13 54.02 3hsd s LEU 155 Cb -0.27 -2.81 -0.08 0.00 0.03 0.00 0.00 46.19 43.05 3hsd s LEU 155 CO 0.38 0.21 1.24 0.20 0.23 0.00 0.00 176.35 178.60 3hsd s ASN 156 N -2.06 6.35 0.74 2.29 0.01 -1.26 -4.87 114.94 116.14 3hsd s ASN 156 Ca 0.31 2.51 -0.11 0.00 -0.71 0.00 0.00 52.86 54.85 3hsd s ASN 156 Cb -0.13 -2.63 0.04 0.00 0.41 0.00 0.00 41.25 38.94 3hsd s ASN 156 CO 0.21 -0.81 1.09 -0.54 -1.51 0.00 0.00 177.10 175.54 3hsd s LYS 157 N -2.31 2.49 0.00 -0.60 3.01 -1.26 -0.39 119.74 120.67 3hsd s LYS 157 Ca 0.58 1.17 0.07 0.00 -1.01 0.00 0.00 55.97 56.78 3hsd s LYS 157 Cb -0.34 -1.92 0.44 0.00 -1.01 0.00 0.00 37.83 34.99 3hsd s LYS 157 CO 0.44 -1.47 0.90 1.87 0.51 0.00 0.00 175.35 177.60