#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1loe s GLU 2 N 0.00 0.07 0.07 -2.82 2.02 -1.26 -5.15 118.70 111.63 1loe s GLU 2 Ca 0.00 0.12 0.06 0.00 0.02 0.00 0.00 54.97 55.17 1loe s GLU 2 Cb 0.00 -0.27 -0.03 0.00 0.10 0.00 0.00 34.13 33.93 1loe s GLU 2 CO 0.00 -0.12 -0.16 0.95 0.02 0.00 0.00 175.26 175.94 1loe s THR 3 N 0.85 1.28 -0.04 3.63 -4.23 -1.26 -5.06 115.64 110.82 1loe s THR 3 Ca -0.07 -1.30 0.02 0.00 -1.18 0.00 0.00 61.69 59.15 1loe s THR 3 Cb -0.11 -1.19 0.01 0.00 1.34 0.00 0.00 72.50 72.55 1loe s THR 3 CO -0.02 -0.12 -0.07 -0.89 -0.54 0.00 0.00 174.62 172.97 1loe s THR 4 N -1.14 0.72 0.03 3.99 2.01 -1.26 -5.10 115.64 114.89 1loe s THR 4 Ca 0.01 -0.27 -0.07 0.00 0.31 0.00 0.00 61.69 61.67 1loe s THR 4 Cb -0.10 -0.68 -0.01 0.00 0.01 0.00 0.00 72.50 71.73 1loe s THR 4 CO 0.03 0.25 0.12 -0.44 -0.69 0.00 0.00 174.62 173.89 1loe s SER 5 N 0.57 0.12 0.07 3.53 0.01 -1.26 -5.11 113.70 111.63 1loe s SER 5 Ca -0.09 -0.43 -0.26 0.00 1.31 0.00 0.00 55.95 56.48 1loe s SER 5 Cb -0.12 0.23 0.09 0.00 0.21 0.00 0.00 66.02 66.43 1loe s SER 5 CO 0.01 -0.49 0.78 0.72 0.41 0.00 0.00 173.24 174.67 1loe s PHE 6 N -2.32 -0.41 -0.12 2.43 -0.12 -1.26 -5.17 117.98 111.02 1loe s PHE 6 Ca -0.07 0.23 -0.12 0.00 -0.05 0.00 0.00 56.93 56.91 1loe s PHE 6 Cb -0.03 0.55 0.03 0.00 -0.63 0.00 0.00 43.02 42.95 1loe s PHE 6 CO -0.03 -0.69 0.34 -1.54 -0.05 0.00 0.00 175.22 173.25 1loe s SER 7 N -2.61 -0.34 -0.23 1.98 1.04 -1.26 -5.11 113.70 107.18 1loe s SER 7 Ca 0.04 0.63 -0.02 0.00 0.48 0.00 0.00 55.95 57.08 1loe s SER 7 Cb -0.01 0.66 0.07 0.00 0.10 0.00 0.00 66.02 66.84 1loe s SER 7 CO -0.10 -0.15 0.05 -0.63 0.98 0.00 0.00 173.24 173.40 1loe s ILE 8 N 0.04 0.59 -0.17 -1.02 1.01 -1.26 -5.01 121.20 115.38 1loe s ILE 8 Ca -0.01 -0.77 0.19 0.00 0.00 0.00 0.00 60.65 60.06 1loe s ILE 8 Cb -0.03 -1.18 -0.06 0.00 0.01 0.00 0.00 42.46 41.19 1loe s ILE 8 CO 0.01 -0.34 0.96 0.74 0.00 0.00 0.00 174.94 176.32 1loe h THR 9 N 6.51 0.36 -3.13 2.92 2.02 -2.00 -3.45 112.91 116.13 1loe h THR 9 Ca -0.16 -1.67 -0.25 0.00 0.77 0.00 0.00 66.41 65.10 1loe h THR 9 Cb 1.09 1.90 -0.33 0.00 -1.74 0.00 0.00 68.15 69.07 1loe h THR 9 CO 0.37 0.20 -0.59 -1.59 0.37 0.00 0.00 175.52 174.29 1loe s LYS 10 N -3.07 0.09 0.17 6.66 -2.85 -1.26 -5.09 119.74 114.39 1loe s LYS 10 Ca -0.01 0.49 -0.18 0.00 -1.00 0.00 0.00 55.97 55.26 1loe s LYS 10 Cb 0.09 -0.19 -0.07 0.00 -2.06 0.00 0.00 37.83 35.59 1loe s LYS 10 CO 0.80 -0.22 0.64 -0.06 0.10 0.00 0.00 175.35 176.61 1loe s PHE 11 N 1.66 3.68 0.47 1.78 0.40 -0.41 -5.02 117.98 120.53 1loe s PHE 11 Ca -0.04 1.28 0.07 0.00 -0.60 0.00 0.00 56.93 57.64 1loe s PHE 11 Cb -0.12 -2.52 0.01 0.00 0.51 0.00 0.00 43.02 40.90 1loe s PHE 11 CO -0.06 0.43 0.46 0.20 0.70 0.00 0.00 175.22 176.94 1loe s GLY 12 N -1.54 2.12 0.22 4.36 0.00 -1.26 -3.71 107.32 107.51 1loe s GLY 12 Ca 0.38 -1.77 0.24 0.00 0.00 0.00 0.00 44.72 43.57 1loe s GLY 12 CO 0.20 -1.73 1.71 -1.55 0.00 0.00 0.00 173.10 171.73 1loe n PRO 13 N -1.72 0.19 -3.50 2.90 -0.04 -1.26 -3.68 135.00 127.88 1loe n PRO 13 Ca 0.04 0.35 -0.27 0.00 -0.04 0.00 0.00 63.50 63.59 1loe n PRO 13 Cb 0.62 -1.82 -0.10 0.00 -0.04 0.00 0.00 33.50 32.17 1loe n PRO 13 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1loe n ASP 14 N -2.16 1.20 -4.57 3.54 2.03 -1.26 -4.90 116.55 110.43 1loe n ASP 14 Ca 0.03 -2.81 -0.39 0.00 0.52 0.00 0.00 54.79 52.14 1loe n ASP 14 Cb 0.27 -0.64 -0.03 0.00 -0.72 0.00 0.00 41.12 40.00 1loe n ASP 14 CO 0.00 0.00 0.00 -1.58 -1.92 0.00 0.00 177.20 173.70 1loe s GLN 15 N -0.94 3.51 0.26 -0.67 2.00 -1.24 -4.82 119.66 117.76 1loe s GLN 15 Ca 0.32 -1.27 0.23 0.00 -2.00 0.00 0.00 55.36 52.64 1loe s GLN 15 Cb 0.05 -5.37 1.00 0.00 0.80 0.00 0.00 33.01 29.49 1loe s GLN 15 CO -0.15 -2.48 1.69 1.04 -0.50 0.00 0.00 175.29 174.90 1loe n GLN 16 N 8.71 0.18 -0.37 1.67 6.02 -1.26 -2.33 117.38 130.00 1loe n GLN 16 Ca 0.39 0.45 0.05 0.00 -0.01 0.00 0.00 57.00 57.88 1loe n GLN 16 Cb 0.49 -1.88 0.20 0.00 1.02 0.00 0.00 30.24 30.07 1loe n GLN 16 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 1loe n ASN 17 N -2.22 2.95 -4.39 1.08 6.94 -1.26 -4.85 115.26 113.50 1loe n ASN 17 Ca 0.02 -2.30 -0.25 0.00 -0.02 0.00 0.00 54.58 52.02 1loe n ASN 17 Cb 0.20 -0.47 -0.12 0.00 -2.36 0.00 0.00 39.78 37.04 1loe n ASN 17 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1loe s LEU 18 N -1.28 2.42 -0.13 -4.53 1.43 -0.99 -1.19 118.68 114.42 1loe s LEU 18 Ca 0.28 -0.85 -0.02 0.00 -1.03 0.00 0.00 54.13 52.51 1loe s LEU 18 Cb 0.19 -1.07 -0.02 0.00 0.03 0.00 0.00 46.19 45.32 1loe s LEU 18 CO 0.12 0.08 -0.08 -0.63 0.23 0.00 0.00 176.35 176.07 1loe s ILE 19 N -1.71 3.50 -0.11 -0.59 1.01 0.14 -4.83 121.20 118.61 1loe s ILE 19 Ca 0.18 -0.51 -0.00 0.00 0.00 0.00 0.00 60.65 60.32 1loe s ILE 19 Cb -0.08 -2.50 -0.02 0.00 0.01 0.00 0.00 42.46 39.87 1loe s ILE 19 CO 0.08 0.52 -0.08 -0.36 0.00 0.00 0.00 174.94 175.10 1loe s PHE 20 N 0.21 2.90 0.14 3.97 0.08 -1.26 -0.90 117.98 123.12 1loe s PHE 20 Ca -0.05 -0.27 0.09 0.00 0.12 0.00 0.00 56.93 56.82 1loe s PHE 20 Cb -0.15 -1.81 -0.04 0.00 -0.57 0.00 0.00 43.02 40.46 1loe s PHE 20 CO 0.04 0.06 -0.22 -0.65 -0.10 0.00 0.00 175.22 174.35 1loe s GLN 21 N -0.14 1.27 6.60 0.44 -0.21 -0.27 -4.97 119.66 122.38 1loe s GLN 21 Ca 0.01 -1.31 0.00 0.00 0.02 0.00 0.00 55.36 54.08 1loe s GLN 21 Cb -0.13 -1.53 0.00 0.00 1.00 0.00 0.00 33.01 32.35 1loe s GLN 21 CO 0.03 0.34 0.00 0.41 -2.12 0.00 0.00 175.29 173.95 1loe n GLY 22 N 0.72 2.75 0.55 3.09 0.00 -1.26 -0.70 105.19 110.35 1loe n GLY 22 Ca -0.17 -0.34 0.09 0.00 0.00 0.00 0.00 46.02 45.60 1loe n GLY 22 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1loe n ASP 23 N 3.42 1.64 -4.73 1.61 8.00 0.45 -4.86 116.55 122.09 1loe n ASP 23 Ca 0.00 -1.78 -0.42 0.00 0.71 0.00 0.00 54.79 53.30 1loe n ASP 23 Cb 0.00 -0.14 -0.03 0.00 -0.02 0.00 0.00 41.12 40.94 1loe n ASP 23 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1loe s GLY 24 N -1.41 1.60 0.31 0.44 0.00 -1.07 -4.78 107.32 102.40 1loe s GLY 24 Ca 0.29 1.53 -0.13 0.00 0.00 0.00 0.00 44.72 46.41 1loe s GLY 24 CO 0.23 2.70 0.60 -2.52 0.00 0.00 0.00 173.10 174.11 1loe s TYR 25 N 0.77 0.34 -0.07 1.90 1.13 -0.64 -4.69 117.35 116.09 1loe s TYR 25 Ca 0.70 -0.77 0.02 0.00 -1.41 0.00 0.00 57.07 55.60 1loe s TYR 25 Cb -0.48 0.39 -0.03 0.00 -1.10 0.00 0.00 41.96 40.75 1loe s TYR 25 CO 0.37 -1.21 -0.10 0.95 -2.51 0.00 0.00 175.55 173.05 1loe s THR 26 N -3.40 3.38 -0.10 -3.49 -4.23 -1.26 0.04 115.64 106.57 1loe s THR 26 Ca 0.20 -0.59 -0.07 0.00 -1.18 0.00 0.00 61.69 60.05 1loe s THR 26 Cb -0.03 -2.37 0.04 0.00 1.34 0.00 0.00 72.50 71.48 1loe s THR 26 CO 0.11 0.58 0.25 -0.89 -0.54 0.00 0.00 174.62 174.14 1loe s THR 27 N -0.59 -0.02 -1.46 3.99 2.01 -0.26 -4.81 115.64 114.50 1loe s THR 27 Ca 0.09 0.09 -0.01 0.00 0.31 0.00 0.00 61.69 62.16 1loe s THR 27 Cb -0.12 -0.38 0.00 0.00 0.01 0.00 0.00 72.50 72.02 1loe s THR 27 CO 0.02 0.04 0.25 0.29 -0.69 0.00 0.00 174.62 174.52 1loe n LYS 28 N 3.72 -2.21 -1.16 4.92 5.02 -1.26 -0.60 118.16 126.59 1loe n LYS 28 Ca -0.20 0.27 -0.05 0.00 -2.02 0.00 0.00 58.31 56.30 1loe n LYS 28 Cb 0.55 -4.08 -0.02 0.00 -0.02 0.00 0.00 35.03 31.45 1loe n LYS 28 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1loe n GLU 29 N -4.49 -1.62 -4.42 1.97 1.02 -1.24 -4.99 120.64 106.87 1loe n GLU 29 Ca -0.31 0.65 -0.26 0.00 -0.02 0.00 0.00 57.16 57.21 1loe n GLU 29 Cb 0.69 -4.95 -0.12 0.00 -0.02 0.00 0.00 31.44 27.04 1loe n GLU 29 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1loe s ARG 30 N -2.28 1.51 -0.32 3.49 0.52 0.23 -1.29 118.95 120.80 1loe s ARG 30 Ca 0.00 -1.53 -0.20 0.00 -0.52 0.00 0.00 55.73 53.47 1loe s ARG 30 Cb 0.00 -1.80 -0.00 0.00 0.52 0.00 0.00 34.95 33.67 1loe s ARG 30 CO 0.00 0.38 0.64 -1.17 0.02 0.00 0.00 175.30 175.17 1loe s LEU 31 N -2.73 4.17 -0.42 2.53 2.96 -1.26 -1.10 118.68 122.83 1loe s LEU 31 Ca 0.21 0.35 -0.13 0.00 -0.22 0.00 0.00 54.13 54.34 1loe s LEU 31 Cb -0.08 -2.82 0.05 0.00 0.50 0.00 0.00 46.19 43.84 1loe s LEU 31 CO 0.10 -0.52 0.30 -0.89 -1.32 0.00 0.00 176.35 174.02 1loe s THR 32 N 2.66 4.93 -0.01 3.68 2.01 0.11 -4.97 115.64 124.05 1loe s THR 32 Ca 0.25 -0.95 -0.22 0.00 0.31 0.00 0.00 61.69 61.08 1loe s THR 32 Cb -0.15 -3.85 -0.21 0.00 0.01 0.00 0.00 72.50 68.30 1loe s THR 32 CO 0.13 -0.41 1.13 -0.07 -0.69 0.00 0.00 174.62 174.71 1loe h LEU 33 N 8.59 0.38 -8.06 4.42 4.07 -1.87 -1.69 115.31 121.14 1loe h LEU 33 Ca -0.26 -0.70 -0.23 0.00 0.08 0.00 0.00 57.88 56.77 1loe h LEU 33 Cb 1.11 -0.11 -0.21 0.00 1.08 0.00 0.00 40.66 42.52 1loe h LEU 33 CO 0.77 1.03 -0.72 0.42 -1.08 0.00 0.00 178.44 178.85 1loe s THR 34 N -3.43 0.33 0.65 0.22 -4.23 -1.26 -3.02 115.64 104.90 1loe s THR 34 Ca -0.14 -0.95 -0.02 0.00 -1.18 0.00 0.00 61.69 59.39 1loe s THR 34 Cb 0.03 -0.43 0.06 0.00 1.34 0.00 0.00 72.50 73.50 1loe s THR 34 CO 0.78 -0.41 0.92 -0.75 -0.54 0.00 0.00 174.62 174.61 1loe s LYS 35 N -1.45 2.21 -1.29 3.99 2.20 -1.26 -4.95 119.74 119.19 1loe s LYS 35 Ca -0.12 -0.63 -0.18 0.00 -0.36 0.00 0.00 55.97 54.67 1loe s LYS 35 Cb -0.10 -2.33 0.06 0.00 -1.51 0.00 0.00 37.83 33.96 1loe s LYS 35 CO -0.00 -1.08 1.76 0.00 -0.36 0.00 0.00 175.35 175.67 1loe n ALA 36 N -2.68 3.46 -3.10 3.13 0.00 -1.26 -4.85 120.51 115.20 1loe n ALA 36 Ca 0.09 -3.79 -0.11 0.00 0.00 0.00 0.00 53.44 49.63 1loe n ALA 36 Cb 0.60 -3.60 -0.10 0.00 0.00 0.00 0.00 19.45 16.35 1loe n ALA 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1loe s VAL 37 N 4.71 0.07 0.51 0.00 0.11 -1.26 -5.10 120.40 119.44 1loe s VAL 37 Ca 0.55 -0.55 -0.20 0.00 -2.93 0.00 0.00 61.98 58.85 1loe s VAL 37 Cb 0.04 -0.41 -0.07 0.00 -1.53 0.00 0.00 36.38 34.41 1loe s VAL 37 CO 0.08 -0.30 1.08 -0.13 -3.33 0.00 0.00 175.10 172.49 1loe s ARG 38 N -1.11 3.62 -1.31 1.54 0.52 -1.26 -4.40 118.95 116.56 1loe s ARG 38 Ca -0.12 1.46 -0.02 0.00 -0.52 0.00 0.00 55.73 56.54 1loe s ARG 38 Cb -0.06 -2.06 -0.00 0.00 0.52 0.00 0.00 34.95 33.35 1loe s ARG 38 CO 0.01 -0.60 0.65 0.09 0.02 0.00 0.00 175.30 175.47 1loe n ASN 39 N -1.10 -1.45 -4.37 0.23 3.02 -1.26 -5.02 115.26 105.32 1loe n ASN 39 Ca 0.10 -0.87 -0.18 0.00 -0.03 0.00 0.00 54.58 53.59 1loe n ASN 39 Cb 0.52 -3.82 -0.10 0.00 -0.61 0.00 0.00 39.78 35.77 1loe n ASN 39 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1loe s THR 40 N -3.71 1.04 0.00 3.41 -4.23 -1.26 -5.06 115.64 105.84 1loe s THR 40 Ca 0.05 -2.02 0.01 0.00 -1.18 0.00 0.00 61.69 58.55 1loe s THR 40 Cb -0.02 -2.52 -0.01 0.00 1.34 0.00 0.00 72.50 71.30 1loe s THR 40 CO 0.83 -0.18 -0.04 0.54 -0.54 0.00 0.00 174.62 175.23 1loe s VAL 41 N -3.41 0.26 -0.01 2.29 0.11 -1.26 -4.77 120.40 113.61 1loe s VAL 41 Ca 0.32 -0.26 0.00 0.00 -2.93 0.00 0.00 61.98 59.11 1loe s VAL 41 Cb 0.07 -0.25 0.01 0.00 -1.53 0.00 0.00 36.38 34.68 1loe s VAL 41 CO 0.12 -0.00 -0.01 -0.83 -3.33 0.00 0.00 175.10 171.05 1loe s GLY 42 N -0.29 0.11 0.08 6.54 0.00 -1.17 -0.41 107.32 112.19 1loe s GLY 42 Ca -0.01 0.04 0.02 0.00 0.00 0.00 0.00 44.72 44.77 1loe s GLY 42 CO -0.00 0.19 -0.07 0.50 0.00 0.00 0.00 173.10 173.71 1loe s ARG 43 N 0.34 0.76 -0.11 2.90 0.52 0.12 -4.78 118.95 118.71 1loe s ARG 43 Ca -0.03 -1.19 -0.07 0.00 -0.52 0.00 0.00 55.73 53.93 1loe s ARG 43 Cb -0.05 -0.25 0.04 0.00 0.52 0.00 0.00 34.95 35.21 1loe s ARG 43 CO -0.01 0.00 0.26 0.00 0.02 0.00 0.00 175.30 175.58 1loe s ALA 44 N -3.02 -0.62 0.05 2.13 0.00 -1.26 -1.11 121.76 117.93 1loe s ALA 44 Ca 0.06 0.96 0.09 0.00 0.00 0.00 0.00 51.96 53.07 1loe s ALA 44 Cb 0.01 -0.59 -0.03 0.00 0.00 0.00 0.00 23.12 22.51 1loe s ALA 44 CO -0.03 -0.18 -0.24 -0.51 0.00 0.00 0.00 175.76 174.80 1loe s LEU 45 N 0.93 2.19 0.32 0.00 1.43 -0.08 -4.93 118.68 118.53 1loe s LEU 45 Ca -0.06 -0.58 -0.29 0.00 -1.03 0.00 0.00 54.13 52.16 1loe s LEU 45 Cb -0.08 -1.15 -0.10 0.00 0.03 0.00 0.00 46.19 44.90 1loe s LEU 45 CO -0.06 0.21 1.32 -0.47 0.23 0.00 0.00 176.35 177.58 1loe s TYR 46 N -0.84 3.05 0.21 0.29 5.04 -1.26 -0.68 117.35 123.15 1loe s TYR 46 Ca 0.10 1.36 0.16 0.00 -2.44 0.00 0.00 57.07 56.25 1loe s TYR 46 Cb -0.10 -3.69 0.56 0.00 0.35 0.00 0.00 41.96 39.08 1loe s TYR 46 CO 0.02 -1.95 1.69 0.66 -1.34 0.00 0.00 175.55 174.63 1loe h SER 47 N 3.64 0.00 -3.52 4.32 4.64 -1.47 -3.43 113.55 117.72 1loe h SER 47 Ca -0.48 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.31 1loe h SER 47 Cb 1.22 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.29 1loe h SER 47 CO 0.67 0.46 0.33 -0.55 -0.87 0.00 0.00 176.83 176.87 1loe s SER 48 N -6.59 7.43 0.56 4.97 0.15 -1.26 -5.04 113.70 113.92 1loe s SER 48 Ca -0.00 1.71 -0.20 0.00 0.70 0.00 0.00 55.95 58.16 1loe s SER 48 Cb 0.12 -2.56 -0.06 0.00 -1.71 0.00 0.00 66.02 61.80 1loe s SER 48 CO 0.71 -0.08 0.94 -2.65 1.20 0.00 0.00 173.24 173.36 1loe n PRO 49 N 2.97 0.97 -4.88 5.44 -0.02 -1.26 -5.03 135.00 133.19 1loe n PRO 49 Ca 0.02 0.37 -0.26 0.00 -2.02 0.00 0.00 63.50 61.61 1loe n PRO 49 Cb 0.50 -2.11 -0.16 0.00 -0.02 0.00 0.00 33.50 31.71 1loe n PRO 49 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1loe s ILE 50 N -1.49 1.48 -0.55 4.25 1.01 -1.26 -5.08 121.20 119.56 1loe s ILE 50 Ca 0.73 -0.76 -0.20 0.00 0.00 0.00 0.00 60.65 60.42 1loe s ILE 50 Cb -0.44 -1.26 0.07 0.00 0.01 0.00 0.00 42.46 40.84 1loe s ILE 50 CO 0.50 0.42 0.73 -2.28 0.00 0.00 0.00 174.94 174.31 1loe s HIS 51 N -0.09 2.95 -0.12 3.97 2.46 -1.26 -4.87 115.29 118.33 1loe s HIS 51 Ca -0.01 -0.55 0.18 0.00 0.47 0.00 0.00 55.06 55.15 1loe s HIS 51 Cb -0.11 -3.81 -0.20 0.00 -0.13 0.00 0.00 32.58 28.34 1loe s HIS 51 CO 0.02 -1.21 0.59 1.51 -2.47 0.00 0.00 174.74 173.18 1loe n ILE 52 N 5.73 1.05 -3.96 0.89 0.13 -1.26 -4.77 119.36 117.17 1loe n ILE 52 Ca -0.06 -0.70 -0.09 0.00 -1.10 0.00 0.00 62.75 60.81 1loe n ILE 52 Cb 0.45 -0.56 -0.04 0.00 -0.84 0.00 0.00 39.64 38.64 1loe n ILE 52 CO 0.00 0.00 0.00 -1.66 2.80 0.00 0.00 176.55 177.69 1loe s TRP 53 N -2.91 0.23 -0.07 9.51 1.48 -1.26 0.18 118.94 126.10 1loe s TRP 53 Ca -0.05 -0.62 0.01 0.00 -1.06 0.00 0.00 56.10 54.38 1loe s TRP 53 Cb 0.09 0.32 0.02 0.00 -1.16 0.00 0.00 33.47 32.74 1loe s TRP 53 CO 0.83 -1.06 -0.08 0.34 -4.06 0.00 0.00 176.95 172.92 1loe s ASP 54 N -3.00 1.64 0.23 -2.66 2.15 0.18 -4.99 116.67 110.23 1loe s ASP 54 Ca 0.20 -0.24 0.03 0.00 0.43 0.00 0.00 52.55 52.96 1loe s ASP 54 Cb -0.02 -0.71 0.25 0.00 -0.30 0.00 0.00 42.92 42.14 1loe s ASP 54 CO 0.09 -0.04 1.57 0.77 -0.17 0.00 0.00 175.17 177.39 1loe h SER 55 N 7.38 0.34 -0.24 -0.34 4.64 -1.93 0.43 113.55 123.83 1loe h SER 55 Ca -0.32 -0.18 -0.01 0.00 -0.47 0.00 0.00 61.79 60.81 1loe h SER 55 Cb 1.16 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 63.14 1loe h SER 55 CO 0.45 0.83 0.10 0.50 -0.87 0.00 0.00 176.83 177.85 1loe h LYS 56 N 0.23 0.35 0.00 4.77 3.64 -1.97 -3.26 116.57 120.32 1loe h LYS 56 Ca 0.00 -0.06 -0.07 0.00 -1.27 0.00 0.00 60.65 59.26 1loe h LYS 56 Cb 1.06 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.81 1loe h LYS 56 CO 0.09 0.37 -1.45 0.25 -2.27 0.00 0.00 179.45 176.45 1loe n THR 57 N -4.81 0.65 -0.73 1.00 -2.24 -1.22 -4.97 114.28 101.95 1loe n THR 57 Ca -0.03 -0.59 0.00 0.00 -2.27 0.00 0.00 64.05 61.16 1loe n THR 57 Cb 0.11 -0.36 0.00 0.00 -2.10 0.00 0.00 70.33 67.98 1loe n THR 57 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1loe n GLY 58 N 1.29 1.34 3.77 3.38 0.00 0.15 -5.03 105.19 110.09 1loe n GLY 58 Ca -0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.60 1loe n GLY 58 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1loe s ASN 59 N -3.18 5.89 0.08 1.61 0.01 -1.22 -4.74 114.94 113.39 1loe s ASN 59 Ca 0.00 2.29 0.09 0.00 -0.71 0.00 0.00 52.86 54.53 1loe s ASN 59 Cb 0.00 -2.60 -0.03 0.00 0.41 0.00 0.00 41.25 39.03 1loe s ASN 59 CO 0.00 -1.11 -0.24 -0.69 -1.51 0.00 0.00 177.10 173.55 1loe s VAL 60 N -1.62 1.97 0.64 1.60 1.01 -1.26 -0.65 120.40 122.09 1loe s VAL 60 Ca 0.68 -1.47 -0.15 0.00 0.00 0.00 0.00 61.98 61.05 1loe s VAL 60 Cb -0.28 -1.72 -0.01 0.00 0.00 0.00 0.00 36.38 34.37 1loe s VAL 60 CO 0.32 0.17 1.08 0.00 0.00 0.00 0.00 175.10 176.68 1loe s ALA 61 N -0.94 2.60 0.02 5.51 0.00 0.13 -4.80 121.76 124.28 1loe s ALA 61 Ca 0.10 0.42 -0.05 0.00 0.00 0.00 0.00 51.96 52.43 1loe s ALA 61 Cb -0.10 -3.26 -0.05 0.00 0.00 0.00 0.00 23.12 19.71 1loe s ALA 61 CO 0.03 -1.09 0.26 -0.80 0.00 0.00 0.00 175.76 174.17 1loe s ASN 62 N -2.84 6.46 0.16 0.00 0.01 -1.26 -4.19 114.94 113.28 1loe s ASN 62 Ca 0.64 0.50 -0.17 0.00 -0.71 0.00 0.00 52.86 53.12 1loe s ASN 62 Cb -0.18 -2.06 0.03 0.00 0.41 0.00 0.00 41.25 39.45 1loe s ASN 62 CO 0.41 0.23 0.48 0.72 -1.51 0.00 0.00 177.10 177.44 1loe s PHE 63 N -1.35 -0.19 -0.01 2.20 -0.12 -0.92 -4.99 117.98 112.61 1loe s PHE 63 Ca 0.29 -0.13 -0.00 0.00 -0.05 0.00 0.00 56.93 57.03 1loe s PHE 63 Cb -0.13 0.35 0.01 0.00 -0.63 0.00 0.00 43.02 42.62 1loe s PHE 63 CO 0.18 -0.82 0.02 0.14 -0.05 0.00 0.00 175.22 174.69 1loe s VAL 64 N -3.83 -0.01 0.03 -2.49 -7.23 -1.26 -0.34 120.40 105.26 1loe s VAL 64 Ca 0.06 0.05 0.04 0.00 -1.81 0.00 0.00 61.98 60.32 1loe s VAL 64 Cb 0.00 -0.04 -0.02 0.00 0.56 0.00 0.00 36.38 36.88 1loe s VAL 64 CO -0.08 0.02 -0.12 0.28 -0.31 0.00 0.00 175.10 174.90 1loe s THR 65 N 0.24 0.92 0.06 5.32 -1.32 -0.64 -5.02 115.64 115.20 1loe s THR 65 Ca -0.02 -0.84 0.01 0.00 -1.21 0.00 0.00 61.69 59.64 1loe s THR 65 Cb -0.03 -0.84 -0.03 0.00 -1.51 0.00 0.00 72.50 70.09 1loe s THR 65 CO -0.01 0.01 -0.06 -0.94 -2.21 0.00 0.00 174.62 171.41 1loe s SER 66 N -0.94 0.80 0.06 8.08 1.04 -1.26 -1.33 113.70 120.15 1loe s SER 66 Ca 0.01 -0.72 -0.26 0.00 0.48 0.00 0.00 55.95 55.45 1loe s SER 66 Cb -0.07 0.08 0.09 0.00 0.10 0.00 0.00 66.02 66.22 1loe s SER 66 CO 0.01 -0.33 0.75 0.72 0.98 0.00 0.00 173.24 175.36 1loe s PHE 67 N -2.29 -0.46 -0.09 5.02 -0.71 -0.67 -5.01 117.98 113.77 1loe s PHE 67 Ca -0.03 0.36 0.00 0.00 -1.04 0.00 0.00 56.93 56.22 1loe s PHE 67 Cb -0.04 0.53 -0.03 0.00 -1.21 0.00 0.00 43.02 42.28 1loe s PHE 67 CO -0.02 -0.68 -0.08 0.99 -1.34 0.00 0.00 175.22 174.09 1loe s THR 68 N -3.15 3.55 0.22 -4.49 2.01 -1.26 -0.87 115.64 111.65 1loe s THR 68 Ca 0.02 -0.52 0.01 0.00 0.31 0.00 0.00 61.69 61.51 1loe s THR 68 Cb -0.01 -2.47 -0.05 0.00 0.01 0.00 0.00 72.50 69.99 1loe s THR 68 CO -0.09 0.57 0.06 0.72 -0.69 0.00 0.00 174.62 175.19 1loe s PHE 69 N -0.44 1.37 -0.02 4.92 -0.71 -0.86 -4.96 117.98 117.28 1loe s PHE 69 Ca 0.06 -1.13 0.00 0.00 -1.04 0.00 0.00 56.93 54.83 1loe s PHE 69 Cb -0.12 -0.78 0.03 0.00 -1.21 0.00 0.00 43.02 40.93 1loe s PHE 69 CO 0.02 -0.30 0.01 0.08 -1.34 0.00 0.00 175.22 173.69 1loe s VAL 70 N -3.74 0.08 -0.19 -2.49 1.01 -1.26 -1.88 120.40 111.93 1loe s VAL 70 Ca 0.32 0.14 -0.05 0.00 0.00 0.00 0.00 61.98 62.38 1loe s VAL 70 Cb 0.07 -0.19 -0.03 0.00 0.00 0.00 0.00 36.38 36.23 1loe s VAL 70 CO 0.09 0.12 0.01 -0.63 0.00 0.00 0.00 175.10 174.69 1loe s ILE 71 N 1.02 4.13 -0.28 2.22 1.01 -1.26 -5.03 121.20 123.00 1loe s ILE 71 Ca -0.09 -0.26 -0.00 0.00 0.00 0.00 0.00 60.65 60.29 1loe s ILE 71 Cb -0.13 -2.85 0.09 0.00 0.01 0.00 0.00 42.46 39.57 1loe s ILE 71 CO -0.02 0.45 0.06 -0.62 0.00 0.00 0.00 174.94 174.80 1loe s ASP 72 N 0.71 3.92 0.21 3.58 2.15 -1.26 -0.55 116.67 125.43 1loe s ASP 72 Ca 0.00 -1.50 0.06 0.00 0.43 0.00 0.00 52.55 51.54 1loe s ASP 72 Cb -0.14 -0.97 -0.04 0.00 -0.30 0.00 0.00 42.92 41.47 1loe s ASP 72 CO 0.02 -0.36 0.20 0.00 -0.17 0.00 0.00 175.17 174.86 1loe s ALA 73 N 1.53 3.66 0.56 3.66 0.00 -1.26 -4.82 121.76 125.08 1loe s ALA 73 Ca 0.06 -1.29 0.38 0.00 0.00 0.00 0.00 51.96 51.10 1loe s ALA 73 Cb -0.18 -1.42 2.05 0.00 0.00 0.00 0.00 23.12 23.58 1loe s ALA 73 CO -0.17 0.36 2.27 -1.35 0.00 0.00 0.00 175.76 176.87 1loe h PRO 74 N 1.83 0.00 -1.92 0.00 0.11 -2.00 -3.45 132.00 126.57 1loe h PRO 74 Ca -0.49 0.00 0.26 0.00 0.11 0.00 0.00 66.00 65.89 1loe h PRO 74 Cb 1.22 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.24 1loe h PRO 74 CO 0.62 0.02 0.71 0.54 -0.21 0.00 0.00 178.00 179.68 1loe s ASN 75 N -5.58 -0.08 0.10 -2.05 4.22 -1.26 -5.05 114.94 105.24 1loe s ASN 75 Ca -0.04 -0.29 0.20 0.00 -2.14 0.00 0.00 52.86 50.59 1loe s ASN 75 Cb 0.13 0.30 0.83 0.00 1.28 0.00 0.00 41.25 43.78 1loe s ASN 75 CO 0.48 -0.56 1.62 -1.20 -2.04 0.00 0.00 177.10 175.40 1loe n SER 76 N -0.64 0.28 -0.09 3.54 7.64 -1.26 -3.86 113.62 119.22 1loe n SER 76 Ca -0.06 0.56 -0.15 0.00 1.01 0.00 0.00 58.87 60.23 1loe n SER 76 Cb 0.61 -0.62 -0.14 0.00 -1.01 0.00 0.00 64.21 63.05 1loe n SER 76 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1loe n TYR 77 N -1.79 0.25 -3.49 1.43 4.01 -1.26 -4.76 117.16 111.54 1loe n TYR 77 Ca 0.04 0.07 -0.42 0.00 -0.16 0.00 0.00 57.90 57.42 1loe n TYR 77 Cb 0.23 -1.04 -0.05 0.00 -0.31 0.00 0.00 39.34 38.17 1loe n TYR 77 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 1loe s ASN 78 N -6.17 6.16 -0.04 7.72 0.01 -1.25 -4.99 114.94 116.38 1loe s ASN 78 Ca -0.22 -2.86 -0.00 0.00 -0.71 0.00 0.00 52.86 49.07 1loe s ASN 78 Cb 0.08 -2.06 0.03 0.00 0.41 0.00 0.00 41.25 39.70 1loe s ASN 78 CO 0.72 -0.46 0.01 -0.69 -1.51 0.00 0.00 177.10 175.18 1loe s VAL 79 N -0.08 0.17 0.19 1.60 1.01 -1.26 -4.54 120.40 117.49 1loe s VAL 79 Ca 0.19 0.15 -0.10 0.00 0.00 0.00 0.00 61.98 62.22 1loe s VAL 79 Cb -0.14 -0.31 -0.01 0.00 0.00 0.00 0.00 36.38 35.93 1loe s VAL 79 CO -0.07 0.18 0.34 0.00 0.00 0.00 0.00 175.10 175.55 1loe s ALA 80 N 1.41 -0.04 -0.15 5.51 0.00 -1.26 -4.21 121.76 123.02 1loe s ALA 80 Ca -0.04 -0.90 0.19 0.00 0.00 0.00 0.00 51.96 51.20 1loe s ALA 80 Cb -0.13 0.96 -0.26 0.00 0.00 0.00 0.00 23.12 23.69 1loe s ALA 80 CO -0.03 -0.71 0.23 -0.25 0.00 0.00 0.00 175.76 175.01 1loe n ASP 81 N -0.27 0.10 0.00 0.00 8.00 -1.26 -5.02 116.55 118.09 1loe n ASP 81 Ca -0.05 0.04 0.00 0.00 0.71 0.00 0.00 54.79 55.49 1loe n ASP 81 Cb 0.63 1.11 0.00 0.00 -0.02 0.00 0.00 41.12 42.84 1loe n ASP 81 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1loe n GLY 82 N 1.61 0.78 3.01 0.44 0.00 -1.26 -2.23 105.19 107.54 1loe n GLY 82 Ca -0.25 -1.83 -0.09 0.00 0.00 0.00 0.00 46.02 43.86 1loe n GLY 82 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1loe s PHE 83 N -2.40 0.35 -0.01 1.61 5.36 -0.62 -4.99 117.98 117.28 1loe s PHE 83 Ca 0.00 -0.68 -0.02 0.00 -0.96 0.00 0.00 56.93 55.27 1loe s PHE 83 Cb 0.00 -0.25 -0.00 0.00 -0.34 0.00 0.00 43.02 42.43 1loe s PHE 83 CO 0.00 -0.24 0.04 0.99 -1.46 0.00 0.00 175.22 174.55 1loe s THR 84 N -2.15 0.03 -0.21 0.12 2.01 -1.26 -0.13 115.64 114.05 1loe s THR 84 Ca -0.09 -0.28 -0.09 0.00 0.31 0.00 0.00 61.69 61.54 1loe s THR 84 Cb -0.05 -0.15 -0.05 0.00 0.01 0.00 0.00 72.50 72.26 1loe s THR 84 CO -0.03 -0.15 0.12 0.12 -0.69 0.00 0.00 174.62 173.98 1loe s PHE 85 N -0.45 3.33 0.17 4.92 5.36 -0.73 -4.95 117.98 125.62 1loe s PHE 85 Ca -0.05 0.20 0.05 0.00 -0.96 0.00 0.00 56.93 56.17 1loe s PHE 85 Cb -0.03 -2.18 -0.05 0.00 -0.34 0.00 0.00 43.02 40.42 1loe s PHE 85 CO -0.00 0.16 -0.08 -0.59 -1.46 0.00 0.00 175.22 173.25 1loe s PHE 86 N 0.63 1.36 -0.19 10.12 -0.71 -1.26 -1.34 117.98 126.59 1loe s PHE 86 Ca 0.07 -0.78 0.01 0.00 -1.04 0.00 0.00 56.93 55.18 1loe s PHE 86 Cb -0.12 -0.71 0.04 0.00 -1.21 0.00 0.00 43.02 41.02 1loe s PHE 86 CO 0.01 0.08 -0.10 0.42 -1.34 0.00 0.00 175.22 174.28 1loe s ILE 87 N -3.32 1.62 0.22 -4.49 1.01 0.51 -5.00 121.20 111.76 1loe s ILE 87 Ca 0.20 -0.97 0.01 0.00 0.00 0.00 0.00 60.65 59.89 1loe s ILE 87 Cb 0.03 -1.69 -0.05 0.00 0.01 0.00 0.00 42.46 40.76 1loe s ILE 87 CO 0.03 0.19 0.06 0.00 0.00 0.00 0.00 174.94 175.21 1loe s ALA 88 N 1.41 1.55 0.80 9.38 0.00 -1.26 -1.23 121.76 132.40 1loe s ALA 88 Ca -0.01 -1.75 -0.15 0.00 0.00 0.00 0.00 51.96 50.06 1loe s ALA 88 Cb -0.16 0.86 0.00 0.00 0.00 0.00 0.00 23.12 23.82 1loe s ALA 88 CO -0.08 -0.41 0.62 -2.30 0.00 0.00 0.00 175.76 173.58 1loe n PRO 89 N -0.36 0.14 -0.10 0.00 -0.02 -1.25 -4.87 135.00 128.53 1loe n PRO 89 Ca -0.03 0.10 0.15 0.00 -2.02 0.00 0.00 63.50 61.71 1loe n PRO 89 Cb 0.65 -1.95 0.55 0.00 -0.02 0.00 0.00 33.50 32.73 1loe n PRO 89 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1loe h VAL 90 N -0.76 0.81 -0.54 -1.45 2.07 -1.99 -1.28 116.25 113.11 1loe h VAL 90 Ca -0.45 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 66.96 1loe h VAL 90 Cb 1.32 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 31.56 1loe h VAL 90 CO 0.41 0.06 0.00 -0.90 0.02 0.00 0.00 177.57 177.16 1loe n ASP 91 N -4.45 5.10 -4.52 0.57 5.75 -1.26 -4.99 116.55 112.74 1loe n ASP 91 Ca 0.12 -2.75 -0.57 0.00 -0.01 0.00 0.00 54.79 51.58 1loe n ASP 91 Cb 0.49 -0.65 -0.07 0.00 -1.03 0.00 0.00 41.12 39.87 1loe n ASP 91 CO 0.00 0.00 0.00 1.07 -0.11 0.00 0.00 177.20 178.16 1loe n THR 92 N 0.66 0.09 -4.34 2.12 5.66 -0.49 -5.01 114.28 112.97 1loe n THR 92 Ca 0.25 -0.02 -0.21 0.00 -3.05 0.00 0.00 64.05 61.02 1loe n THR 92 Cb 1.05 -0.21 -0.11 0.00 -1.55 0.00 0.00 70.33 69.51 1loe n THR 92 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 1loe s LYS 93 N 0.07 1.30 0.19 1.09 1.02 -1.26 -5.09 119.74 117.06 1loe s LYS 93 Ca 0.88 -1.46 -0.33 0.00 0.02 0.00 0.00 55.97 55.08 1loe s LYS 93 Cb -1.17 -1.29 -0.14 0.00 -0.52 0.00 0.00 37.83 34.70 1loe s LYS 93 CO 0.54 0.25 1.43 -2.30 -0.92 0.00 0.00 175.35 174.35 1loe n PRO 94 N 0.10 1.88 0.00 -1.68 -0.02 -1.26 -4.96 135.00 129.07 1loe n PRO 94 Ca -0.12 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 1loe n PRO 94 Cb 0.58 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 1loe n PRO 94 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1loe n GLN 95 N 2.47 3.84 -1.94 -0.52 1.13 0.32 -4.99 117.38 117.69 1loe n GLN 95 Ca 0.14 0.00 -0.41 0.00 -1.94 0.00 0.00 57.00 54.79 1loe n GLN 95 Cb 0.29 0.00 -0.01 0.00 0.11 0.00 0.00 30.24 30.63 1loe n GLN 95 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 1loe s THR 96 N 2.80 2.35 0.00 5.09 2.01 -1.10 -4.53 115.64 122.26 1loe s THR 96 Ca 0.00 0.35 0.00 0.00 0.31 0.00 0.00 61.69 62.35 1loe s THR 96 Cb 0.00 -3.22 0.00 0.00 0.01 0.00 0.00 72.50 69.29 1loe s THR 96 CO 0.00 0.08 0.00 0.61 -0.69 0.00 0.00 174.62 174.62 1loe n GLY 97 N 0.61 -0.30 7.00 4.40 0.00 -1.26 -1.01 105.19 114.63 1loe n GLY 97 Ca 0.01 -1.69 0.00 0.00 0.00 0.00 0.00 46.02 44.33 1loe n GLY 97 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1loe n GLY 98 N 5.00 2.77 0.00 -0.02 0.00 -1.26 -2.55 105.19 109.13 1loe n GLY 98 Ca 0.00 -0.40 0.08 0.00 0.00 0.00 0.00 46.02 45.69 1loe n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1loe n GLY 99 N 0.00 -0.81 0.09 -0.02 0.00 -1.26 -1.78 105.19 101.41 1loe n GLY 99 Ca 0.00 -0.07 0.14 0.00 0.00 0.00 0.00 46.02 46.09 1loe n GLY 99 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1loe n TYR 100 N -1.30 0.00 -1.85 1.61 4.02 -1.06 -4.97 117.16 113.62 1loe n TYR 100 Ca 0.07 0.00 -0.18 0.00 -0.01 0.00 0.00 57.90 57.78 1loe n TYR 100 Cb 0.13 -0.22 -0.05 0.00 -0.02 0.00 0.00 39.34 39.18 1loe n TYR 100 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1loe n LEU 101 N -1.06 -1.50 0.00 7.72 4.32 -0.73 -2.51 117.00 123.25 1loe n LEU 101 Ca 0.13 0.25 0.00 0.00 -0.02 0.00 0.00 56.01 56.37 1loe n LEU 101 Cb 0.28 -2.52 0.00 0.00 -1.62 0.00 0.00 43.42 39.56 1loe n LEU 101 CO 0.25 -0.62 0.00 0.61 -1.22 0.00 0.00 177.39 176.41 1loe n GLY 102 N -0.90 0.49 0.00 -0.72 0.00 -0.18 -4.80 105.19 99.08 1loe n GLY 102 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1loe n GLY 102 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1loe n VAL 103 N -2.31 0.00 -4.49 1.61 3.14 -1.06 -0.52 118.33 114.70 1loe n VAL 103 Ca 0.00 0.00 -0.23 0.00 -2.96 0.00 0.00 64.34 61.15 1loe n VAL 103 Cb 0.09 -0.25 -0.10 0.00 -1.06 0.00 0.00 33.84 32.52 1loe n VAL 103 CO 0.00 0.00 0.00 -0.36 -6.46 0.00 0.00 176.83 170.01 1loe s PHE 104 N -1.59 1.97 0.00 1.45 0.08 -1.04 -4.75 117.98 114.09 1loe s PHE 104 Ca 0.00 -1.00 0.00 0.00 0.12 0.00 0.00 56.93 56.05 1loe s PHE 104 Cb 0.00 -1.32 0.00 0.00 -0.57 0.00 0.00 43.02 41.13 1loe s PHE 104 CO 0.00 -0.01 0.62 0.09 -0.10 0.00 0.00 175.22 175.82 1loe n ASN 105 N -0.86 0.89 -3.44 1.36 3.02 -1.26 -2.71 115.26 112.26 1loe n ASN 105 Ca -0.04 -1.37 -0.11 0.00 -0.03 0.00 0.00 54.58 53.02 1loe n ASN 105 Cb 0.66 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.81 1loe n ASN 105 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1loe s SER 106 N -0.37 -0.54 0.18 6.41 0.15 -1.26 -4.99 113.70 113.28 1loe s SER 106 Ca 0.00 -0.01 0.23 0.00 0.70 0.00 0.00 55.95 56.87 1loe s SER 106 Cb 0.00 0.57 0.09 0.00 -1.71 0.00 0.00 66.02 64.97 1loe s SER 106 CO 0.00 -0.93 1.12 0.50 1.20 0.00 0.00 173.24 175.13 1loe h LYS 107 N 2.00 0.00 -6.53 5.44 3.11 -1.95 -1.95 116.57 116.69 1loe h LYS 107 Ca -0.32 0.00 -0.52 0.00 -2.81 0.00 0.00 60.65 57.00 1loe h LYS 107 Cb 1.30 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 32.51 1loe h LYS 107 CO 0.37 0.00 -0.09 -0.51 -2.81 0.00 0.00 179.45 176.41 1loe s ASP 108 N -5.06 6.54 0.26 4.20 1.01 -1.26 -4.37 116.67 117.99 1loe s ASP 108 Ca 0.01 0.87 -0.31 0.00 0.71 0.00 0.00 52.55 53.84 1loe s ASP 108 Cb 0.10 -2.21 -0.12 0.00 1.01 0.00 0.00 42.92 41.71 1loe s ASP 108 CO 0.77 -0.18 1.64 -0.47 0.21 0.00 0.00 175.17 177.15 1loe s TYR 109 N -2.02 2.80 -0.32 4.23 5.04 -1.26 -4.62 117.35 121.20 1loe s TYR 109 Ca 0.47 0.62 0.01 0.00 -2.44 0.00 0.00 57.07 55.73 1loe s TYR 109 Cb -0.11 -4.10 0.10 0.00 0.35 0.00 0.00 41.96 38.20 1loe s TYR 109 CO 0.26 -3.87 0.08 0.34 -1.34 0.00 0.00 175.55 171.02 1loe s ASP 110 N 0.74 4.25 0.54 4.32 2.15 -0.75 -5.01 116.67 122.90 1loe s ASP 110 Ca 0.67 -1.78 0.25 0.00 0.43 0.00 0.00 52.55 52.12 1loe s ASP 110 Cb -0.49 -1.11 1.52 0.00 -0.30 0.00 0.00 42.92 42.55 1loe s ASP 110 CO 0.43 -0.40 2.16 0.07 -0.17 0.00 0.00 175.17 177.25 1loe h LYS 111 N 7.94 0.00 0.00 4.34 2.10 -1.93 -0.54 116.57 128.48 1loe h LYS 111 Ca -0.11 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.54 1loe h LYS 111 Cb 1.02 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.35 1loe h LYS 111 CO 0.48 0.06 0.00 0.25 -2.00 0.00 0.00 179.45 178.24 1loe n THR 112 N -3.99 0.05 -0.03 0.07 -2.24 -1.26 -3.56 114.28 103.32 1loe n THR 112 Ca -0.03 0.01 -0.13 0.00 -2.27 0.00 0.00 64.05 61.63 1loe n THR 112 Cb 0.14 -0.54 -0.11 0.00 -2.10 0.00 0.00 70.33 67.73 1loe n THR 112 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 1loe h SER 113 N 0.00 -0.00 -5.04 3.42 0.87 -1.44 -3.47 113.55 107.88 1loe h SER 113 Ca 0.00 -0.61 -0.41 0.00 -1.23 0.00 0.00 61.79 59.54 1loe h SER 113 Cb 0.21 0.00 0.04 0.00 -0.44 0.00 0.00 62.40 62.21 1loe h SER 113 CO 0.00 0.61 -0.62 0.00 -0.53 0.00 0.00 176.83 176.29 1loe n GLN 114 N -4.80 -5.17 -4.13 2.24 6.02 -1.23 -4.76 117.38 105.55 1loe n GLN 114 Ca -0.09 0.79 -0.15 0.00 -0.01 0.00 0.00 57.00 57.54 1loe n GLN 114 Cb 0.31 -5.66 -0.14 0.00 1.02 0.00 0.00 30.24 25.77 1loe n GLN 114 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 1loe s THR 115 N -3.17 0.38 0.00 5.09 -1.32 -1.26 -3.88 115.64 111.48 1loe s THR 115 Ca 0.40 -0.22 0.06 0.00 -1.21 0.00 0.00 61.69 60.72 1loe s THR 115 Cb -0.19 -0.32 -0.03 0.00 -1.51 0.00 0.00 72.50 70.45 1loe s THR 115 CO 0.49 0.10 -0.18 0.68 -2.21 0.00 0.00 174.62 173.50 1loe s VAL 116 N -0.13 2.73 0.06 5.08 -7.23 -0.37 -1.81 120.40 118.74 1loe s VAL 116 Ca 0.02 -1.03 0.01 0.00 -1.81 0.00 0.00 61.98 59.16 1loe s VAL 116 Cb -0.02 -2.09 -0.03 0.00 0.56 0.00 0.00 36.38 34.79 1loe s VAL 116 CO -0.00 0.46 -0.05 0.00 -0.31 0.00 0.00 175.10 175.19 1loe s ALA 117 N -0.81 0.63 -0.19 1.32 0.00 -0.45 -0.36 121.76 121.89 1loe s ALA 117 Ca 0.13 -1.08 -0.01 0.00 0.00 0.00 0.00 51.96 51.00 1loe s ALA 117 Cb -0.10 0.17 0.01 0.00 0.00 0.00 0.00 23.12 23.19 1loe s ALA 117 CO 0.03 -0.23 -0.14 0.08 0.00 0.00 0.00 175.76 175.50 1loe s VAL 118 N -2.98 2.60 0.06 0.00 1.01 -0.45 -0.82 120.40 119.82 1loe s VAL 118 Ca 0.02 -0.76 0.01 0.00 0.00 0.00 0.00 61.98 61.25 1loe s VAL 118 Cb 0.01 -2.13 -0.04 0.00 0.00 0.00 0.00 36.38 34.22 1loe s VAL 118 CO -0.05 0.50 0.16 -1.83 0.00 0.00 0.00 175.10 173.88 1loe s GLU 119 N 1.29 3.25 -0.46 2.72 -1.05 0.13 -1.77 118.70 122.82 1loe s GLU 119 Ca 0.04 -0.51 0.04 0.00 -0.15 0.00 0.00 54.97 54.39 1loe s GLU 119 Cb -0.14 -2.94 0.12 0.00 -0.44 0.00 0.00 34.13 30.73 1loe s GLU 119 CO -0.08 0.60 0.19 -0.06 0.95 0.00 0.00 175.26 176.87 1loe s PHE 120 N -1.44 3.37 -0.27 4.83 0.08 0.81 -1.55 117.98 123.81 1loe s PHE 120 Ca 0.32 -3.12 -0.09 0.00 0.12 0.00 0.00 56.93 54.16 1loe s PHE 120 Cb -0.13 -2.85 -0.03 0.00 -0.57 0.00 0.00 43.02 39.44 1loe s PHE 120 CO 0.25 -0.81 0.14 0.34 -0.10 0.00 0.00 175.22 175.04 1loe s ASP 121 N 0.10 5.60 0.00 1.36 -1.08 0.02 -1.59 116.67 121.09 1loe s ASP 121 Ca 0.15 -0.17 0.21 0.00 -0.52 0.00 0.00 52.55 52.22 1loe s ASP 121 Cb -0.24 -2.03 0.48 0.00 -1.46 0.00 0.00 42.92 39.68 1loe s ASP 121 CO -0.03 -0.07 1.41 0.35 0.52 0.00 0.00 175.17 177.36 1loe n THR 122 N 5.00 0.76 -3.72 1.71 -2.24 -0.95 -2.11 114.28 112.74 1loe n THR 122 Ca -0.15 -0.88 -0.15 0.00 -2.27 0.00 0.00 64.05 60.60 1loe n THR 122 Cb 0.51 0.72 -0.15 0.00 -2.10 0.00 0.00 70.33 69.32 1loe n THR 122 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1loe s PHE 123 N -1.18 -0.15 -0.19 4.78 5.36 -1.24 -4.48 117.98 120.88 1loe s PHE 123 Ca 0.40 0.50 -0.29 0.00 -0.96 0.00 0.00 56.93 56.57 1loe s PHE 123 Cb 0.22 -0.17 -0.00 0.00 -0.34 0.00 0.00 43.02 42.72 1loe s PHE 123 CO 0.29 -0.20 1.11 -0.47 -1.46 0.00 0.00 175.22 174.49 1loe s TYR 124 N 1.59 3.21 -0.33 10.12 5.04 -1.26 -5.00 117.35 130.72 1loe s TYR 124 Ca -0.04 1.33 -0.06 0.00 -2.44 0.00 0.00 57.07 55.86 1loe s TYR 124 Cb -0.12 -3.34 0.03 0.00 0.35 0.00 0.00 41.96 38.89 1loe s TYR 124 CO -0.06 -0.86 0.09 -0.80 -1.34 0.00 0.00 175.55 172.58 1loe s ASN 125 N 1.43 5.23 0.26 4.32 -0.87 -1.26 -4.99 114.94 119.05 1loe s ASN 125 Ca 0.48 -1.07 -0.03 0.00 -1.57 0.00 0.00 52.86 50.68 1loe s ASN 125 Cb -0.18 -1.86 0.53 0.00 -0.02 0.00 0.00 41.25 39.73 1loe s ASN 125 CO 0.11 -0.29 1.68 0.71 -2.57 0.00 0.00 177.10 176.74 1loe h THR 126 N 6.14 0.48 -1.14 1.60 1.35 -1.94 -0.66 112.91 118.73 1loe h THR 126 Ca -0.25 -0.10 0.32 0.00 -0.55 0.00 0.00 66.41 65.84 1loe h THR 126 Cb 1.09 0.17 -0.10 0.00 -1.73 0.00 0.00 68.15 67.58 1loe h THR 126 CO 0.60 0.05 0.75 0.00 -0.25 0.00 0.00 175.52 176.67 1loe h ALA 127 N 1.65 2.49 0.00 6.62 0.00 -2.02 -3.36 119.26 124.63 1loe h ALA 127 Ca 0.45 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.43 1loe h ALA 127 Cb 0.81 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1loe h ALA 127 CO -0.53 -0.95 0.00 -2.67 0.00 0.00 0.00 179.25 175.10 1loe n TRP 128 N -4.59 0.00 -2.08 0.00 2.14 -1.02 -5.11 117.44 106.78 1loe n TRP 128 Ca 0.29 0.00 -0.32 0.00 2.07 0.00 0.00 57.50 59.54 1loe n TRP 128 Cb 1.08 0.00 -0.00 0.00 -0.81 0.00 0.00 31.31 31.58 1loe n TRP 128 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 1loe s ASP 129 N 0.00 6.26 -0.00 -0.67 1.01 -0.29 -4.71 116.67 118.27 1loe s ASP 129 Ca 0.00 1.54 -0.35 0.00 0.71 0.00 0.00 52.55 54.45 1loe s ASP 129 Cb 0.00 -2.49 -0.13 0.00 1.01 0.00 0.00 42.92 41.30 1loe s ASP 129 CO 0.00 -0.84 1.72 -2.65 0.21 0.00 0.00 175.17 173.61 1loe n PRO 130 N -2.23 2.00 -0.18 8.23 -0.02 -1.26 -4.83 135.00 136.70 1loe n PRO 130 Ca 0.07 0.73 0.27 0.00 -2.02 0.00 0.00 63.50 62.54 1loe n PRO 130 Cb 0.54 -2.52 0.69 0.00 -0.02 0.00 0.00 33.50 32.19 1loe n PRO 130 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1loe h SER 131 N 7.52 0.07 0.00 2.55 4.64 -1.92 -0.30 113.55 126.12 1loe h SER 131 Ca -0.47 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1loe h SER 131 Cb 1.27 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1loe h SER 131 CO 0.92 0.03 0.34 -0.55 -0.87 0.00 0.00 176.83 176.69 1loe h ASN 132 N 0.07 0.00 0.00 4.97 7.08 -2.03 -3.45 115.58 122.23 1loe h ASN 132 Ca 0.43 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.65 1loe h ASN 132 Cb 1.60 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.84 1loe h ASN 132 CO -0.04 0.00 0.00 0.61 -2.08 0.00 0.00 177.43 175.92 1loe n GLY 133 N -1.25 0.83 3.86 9.14 0.00 -0.12 -5.02 105.19 112.63 1loe n GLY 133 Ca -0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 1loe n GLY 133 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1loe s ASP 134 N -2.68 6.46 0.69 1.61 1.01 -1.26 -4.71 116.67 117.78 1loe s ASP 134 Ca 0.00 1.41 -0.14 0.00 0.71 0.00 0.00 52.55 54.53 1loe s ASP 134 Cb 0.00 -2.45 0.01 0.00 1.01 0.00 0.00 42.92 41.49 1loe s ASP 134 CO 0.00 -0.65 1.10 -0.13 0.21 0.00 0.00 175.17 175.70 1loe s ARG 135 N -4.44 2.68 0.05 8.23 0.52 -1.26 -4.87 118.95 119.86 1loe s ARG 135 Ca 0.56 1.31 -0.27 0.00 -0.52 0.00 0.00 55.73 56.81 1loe s ARG 135 Cb -0.10 -1.94 0.09 0.00 0.52 0.00 0.00 34.95 33.52 1loe s ARG 135 CO 0.39 -1.33 0.79 -3.38 0.02 0.00 0.00 175.30 171.79 1loe s HIS 136 N -2.51 -0.41 -0.11 -0.53 -3.43 -0.90 -1.56 115.29 105.84 1loe s HIS 136 Ca 0.65 0.26 -0.13 0.00 -0.80 0.00 0.00 55.06 55.04 1loe s HIS 136 Cb -0.19 0.54 -0.05 0.00 -1.43 0.00 0.00 32.58 31.45 1loe s HIS 136 CO 0.45 -0.64 0.30 0.42 -2.00 0.00 0.00 174.74 173.27 1loe s ILE 137 N -3.30 5.26 0.08 -5.38 1.01 -0.69 -0.80 121.20 117.38 1loe s ILE 137 Ca 0.03 0.58 0.02 0.00 0.00 0.00 0.00 60.65 61.28 1loe s ILE 137 Cb -0.01 -3.62 -0.04 0.00 0.01 0.00 0.00 42.46 38.81 1loe s ILE 137 CO -0.10 0.48 -0.06 -0.83 0.00 0.00 0.00 174.94 174.43 1loe s GLY 138 N -0.25 0.66 -0.22 6.18 0.00 -0.59 -1.65 107.32 111.45 1loe s GLY 138 Ca 0.19 -1.18 -0.05 0.00 0.00 0.00 0.00 44.72 43.67 1loe s GLY 138 CO 0.07 -1.28 0.01 -0.42 0.00 0.00 0.00 173.10 171.48 1loe s ILE 139 N -3.09 3.88 -0.21 0.90 1.01 -0.70 -0.69 121.20 122.29 1loe s ILE 139 Ca 0.06 -0.33 -0.03 0.00 0.00 0.00 0.00 60.65 60.35 1loe s ILE 139 Cb 0.02 -2.77 -0.00 0.00 0.01 0.00 0.00 42.46 39.71 1loe s ILE 139 CO -0.04 0.40 -0.07 -1.81 0.00 0.00 0.00 174.94 173.42 1loe s ASP 140 N 1.33 4.13 -0.19 3.58 1.01 -0.00 -1.24 116.67 125.29 1loe s ASP 140 Ca 0.04 -0.43 0.01 0.00 0.71 0.00 0.00 52.55 52.89 1loe s ASP 140 Cb -0.15 -1.70 0.03 0.00 1.01 0.00 0.00 42.92 42.11 1loe s ASP 140 CO 0.01 -0.02 -0.16 0.68 0.21 0.00 0.00 175.17 175.89 1loe s VAL 141 N 1.44 1.91 -1.59 -1.27 -7.23 -1.26 -1.34 120.40 111.06 1loe s VAL 141 Ca 0.06 -0.99 0.00 0.00 -1.81 0.00 0.00 61.98 59.24 1loe s VAL 141 Cb -0.14 -1.82 0.00 0.00 0.56 0.00 0.00 36.38 34.98 1loe s VAL 141 CO -0.05 0.39 0.00 0.59 -0.31 0.00 0.00 175.10 175.72 1loe n ASN 142 N 4.63 -4.33 -3.54 4.85 5.03 -0.75 -4.90 115.26 116.27 1loe n ASN 142 Ca -0.18 0.31 -0.15 0.00 0.87 0.00 0.00 54.58 55.43 1loe n ASN 142 Cb 0.48 -3.85 -0.05 0.00 -1.02 0.00 0.00 39.78 35.34 1loe n ASN 142 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 1loe s SER 143 N -2.26 -0.52 0.04 6.41 0.15 -1.26 -1.81 113.70 114.45 1loe s SER 143 Ca 0.00 0.29 0.27 0.00 0.70 0.00 0.00 55.95 57.22 1loe s SER 143 Cb 0.00 0.52 0.94 0.00 -1.71 0.00 0.00 66.02 65.77 1loe s SER 143 CO 0.00 -0.73 1.74 0.00 1.20 0.00 0.00 173.24 175.46 1loe n ILE 144 N 0.43 0.11 -2.73 6.45 0.13 -0.73 -4.67 119.36 118.35 1loe n ILE 144 Ca -0.18 -0.06 -0.43 0.00 -1.10 0.00 0.00 62.75 60.98 1loe n ILE 144 Cb 0.60 -0.31 -0.03 0.00 -0.84 0.00 0.00 39.64 39.06 1loe n ILE 144 CO 0.00 0.00 0.00 -0.54 2.80 0.00 0.00 176.55 178.81 1loe s LYS 145 N -3.03 3.57 0.29 9.51 1.02 -1.26 -4.94 119.74 124.90 1loe s LYS 145 Ca 0.12 0.25 -0.30 0.00 0.02 0.00 0.00 55.97 56.06 1loe s LYS 145 Cb 0.17 -3.94 -0.12 0.00 -0.52 0.00 0.00 37.83 33.42 1loe s LYS 145 CO 0.59 -1.35 1.55 0.43 -0.92 0.00 0.00 175.35 175.65 1loe n SER 146 N 7.54 3.65 0.26 2.83 7.64 -1.26 -4.76 113.62 129.51 1loe n SER 146 Ca 0.08 1.15 0.14 0.00 1.01 0.00 0.00 58.87 61.25 1loe n SER 146 Cb 0.49 -1.57 0.64 0.00 -1.01 0.00 0.00 64.21 62.76 1loe n SER 146 CO 0.00 0.00 0.00 0.16 -3.01 0.00 0.00 175.04 172.19 1loe h ILE 147 N 3.24 0.36 -2.12 0.44 3.07 -1.55 -3.45 117.51 117.49 1loe h ILE 147 Ca -0.47 -0.73 -0.06 0.00 1.55 0.00 0.00 64.86 65.15 1loe h ILE 147 Cb 1.24 1.54 -0.20 0.00 -0.27 0.00 0.00 36.82 39.13 1loe h ILE 147 CO 0.77 0.12 0.11 0.21 -1.05 0.00 0.00 178.15 178.30 1loe s ASN 148 N -5.97 -0.64 0.12 2.16 2.47 -1.24 -5.00 114.94 106.84 1loe s ASN 148 Ca -0.00 0.94 -0.07 0.00 0.42 0.00 0.00 52.86 54.15 1loe s ASN 148 Cb 0.11 0.87 -0.02 0.00 -1.45 0.00 0.00 41.25 40.76 1loe s ASN 148 CO 0.58 -0.44 0.18 -0.89 -3.72 0.00 0.00 177.10 172.81 1loe s THR 149 N -0.55 0.11 -0.13 -5.21 2.01 -1.26 -1.73 115.64 108.89 1loe s THR 149 Ca -0.07 -1.46 -0.05 0.00 0.31 0.00 0.00 61.69 60.42 1loe s THR 149 Cb -0.02 -1.68 0.06 0.00 0.01 0.00 0.00 72.50 70.86 1loe s THR 149 CO 0.06 -0.52 0.28 -0.75 -0.69 0.00 0.00 174.62 173.00 1loe s LYS 150 N -3.94 0.20 0.57 4.92 2.47 -0.66 -4.98 119.74 118.33 1loe s LYS 150 Ca 0.13 0.69 -0.20 0.00 -1.56 0.00 0.00 55.97 55.03 1loe s LYS 150 Cb 0.05 -0.04 -0.04 0.00 -1.46 0.00 0.00 37.83 36.34 1loe s LYS 150 CO -0.04 -0.22 1.31 -1.12 0.16 0.00 0.00 175.35 175.43 1loe s SER 151 N 1.89 5.15 -0.02 1.43 0.01 -1.26 -1.71 113.70 119.19 1loe s SER 151 Ca -0.04 2.65 -0.00 0.00 1.31 0.00 0.00 55.95 59.87 1loe s SER 151 Cb -0.11 -2.62 0.03 0.00 0.21 0.00 0.00 66.02 63.52 1loe s SER 151 CO -0.09 -1.64 0.03 0.86 0.41 0.00 0.00 173.24 172.81 1loe s TRP 152 N -1.38 0.02 -0.33 2.43 -0.00 -0.60 -4.81 118.94 114.26 1loe s TRP 152 Ca 0.75 0.14 -0.18 0.00 -0.00 0.00 0.00 56.10 56.81 1loe s TRP 152 Cb -0.38 -0.22 -0.01 0.00 -0.00 0.00 0.00 33.47 32.86 1loe s TRP 152 CO 0.43 -0.09 0.50 0.00 -0.00 0.00 0.00 176.95 177.78 1loe s ALA 153 N 1.04 3.50 0.19 5.86 0.00 -1.26 -4.35 121.76 126.74 1loe s ALA 153 Ca -0.09 -0.95 -0.32 0.00 0.00 0.00 0.00 51.96 50.61 1loe s ALA 153 Cb -0.12 -2.97 -0.11 0.00 0.00 0.00 0.00 23.12 19.92 1loe s ALA 153 CO -0.03 -1.11 1.63 -1.17 0.00 0.00 0.00 175.76 175.08 1loe s LEU 154 N 2.34 4.37 -0.44 0.00 2.96 -1.26 -4.99 118.68 121.66 1loe s LEU 154 Ca 0.18 2.74 -0.09 0.00 -0.22 0.00 0.00 54.13 56.75 1loe s LEU 154 Cb -0.16 -3.60 0.10 0.00 0.50 0.00 0.00 46.19 43.04 1loe s LEU 154 CO 0.12 -0.89 0.30 -1.10 -1.32 0.00 0.00 176.35 173.47 1loe s GLN 155 N 1.01 2.52 0.22 1.98 -0.21 -1.26 -5.06 119.66 118.85 1loe s GLN 155 Ca 0.71 -1.63 -0.32 0.00 0.02 0.00 0.00 55.36 54.14 1loe s GLN 155 Cb -0.46 -3.85 -0.13 0.00 1.00 0.00 0.00 33.01 29.57 1loe s GLN 155 CO 0.33 -1.08 1.62 -1.71 -2.12 0.00 0.00 175.29 172.32 1loe n ASN 156 N 4.90 3.56 0.00 5.90 5.15 -1.26 -2.48 115.26 131.02 1loe n ASN 156 Ca -0.09 1.10 0.00 0.00 -0.60 0.00 0.00 54.58 54.99 1loe n ASN 156 Cb 0.42 -1.52 0.00 0.00 -0.53 0.00 0.00 39.78 38.15 1loe n ASN 156 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1loe n GLY 157 N 3.20 1.01 3.92 8.20 0.00 0.29 -5.00 105.19 116.81 1loe n GLY 157 Ca 0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 1loe n GLY 157 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1loe s LYS 158 N -0.18 3.45 -0.05 1.61 2.20 -1.04 -4.94 119.74 120.79 1loe s LYS 158 Ca 0.00 -0.45 -0.30 0.00 -0.36 0.00 0.00 55.97 54.86 1loe s LYS 158 Cb 0.00 -3.01 -0.04 0.00 -1.51 0.00 0.00 37.83 33.27 1loe s LYS 158 CO 0.00 0.58 1.28 -1.21 -0.36 0.00 0.00 175.35 175.64 1loe s GLU 159 N -2.67 4.32 -0.12 4.03 2.02 -1.26 -4.46 118.70 120.56 1loe s GLU 159 Ca 0.35 1.77 -0.05 0.00 0.02 0.00 0.00 54.97 57.06 1loe s GLU 159 Cb -0.13 -3.59 -0.04 0.00 0.10 0.00 0.00 34.13 30.48 1loe s GLU 159 CO 0.28 -0.52 0.07 0.00 0.02 0.00 0.00 175.26 175.11 1loe s ALA 160 N 2.42 3.57 -0.28 5.21 0.00 -0.79 -4.35 121.76 127.54 1loe s ALA 160 Ca 0.58 -0.72 -0.07 0.00 0.00 0.00 0.00 51.96 51.75 1loe s ALA 160 Cb -0.27 -1.76 -0.01 0.00 0.00 0.00 0.00 23.12 21.08 1loe s ALA 160 CO 0.23 0.54 0.09 -0.80 0.00 0.00 0.00 175.76 175.81 1loe s ASN 161 N -0.76 5.18 0.07 0.00 0.02 0.07 -2.02 114.94 117.50 1loe s ASN 161 Ca 0.13 -0.46 0.06 0.00 -1.02 0.00 0.00 52.86 51.57 1loe s ASN 161 Cb -0.12 -1.92 -0.04 0.00 0.02 0.00 0.00 41.25 39.20 1loe s ASN 161 CO 0.03 -0.12 -0.11 0.68 0.02 0.00 0.00 177.10 177.59 1loe s VAL 162 N 1.57 3.29 -0.12 1.60 -7.23 -0.04 -1.33 120.40 118.12 1loe s VAL 162 Ca 0.05 -1.15 0.01 0.00 -1.81 0.00 0.00 61.98 59.08 1loe s VAL 162 Cb -0.16 -2.48 0.02 0.00 0.56 0.00 0.00 36.38 34.31 1loe s VAL 162 CO 0.03 0.22 -0.15 -0.69 -0.31 0.00 0.00 175.10 174.20 1loe s VAL 163 N -1.10 1.53 -0.13 1.32 1.01 -0.59 -1.67 120.40 120.76 1loe s VAL 163 Ca 0.19 -0.65 -0.02 0.00 0.00 0.00 0.00 61.98 61.50 1loe s VAL 163 Cb -0.11 -1.41 -0.03 0.00 0.00 0.00 0.00 36.38 34.84 1loe s VAL 163 CO 0.10 0.45 -0.06 -0.63 0.00 0.00 0.00 175.10 174.96 1loe s ILE 164 N 1.12 3.68 0.00 2.22 1.01 -0.44 -1.11 121.20 127.69 1loe s ILE 164 Ca -0.03 -0.44 0.01 0.00 0.00 0.00 0.00 60.65 60.18 1loe s ILE 164 Cb -0.14 -2.58 -0.01 0.00 0.01 0.00 0.00 42.46 39.74 1loe s ILE 164 CO -0.04 0.52 -0.04 0.00 0.00 0.00 0.00 174.94 175.38 1loe s ALA 165 N 0.12 0.30 -0.15 9.38 0.00 -0.22 -1.62 121.76 129.57 1loe s ALA 165 Ca -0.02 -0.24 0.01 0.00 0.00 0.00 0.00 51.96 51.71 1loe s ALA 165 Cb -0.14 -0.05 0.02 0.00 0.00 0.00 0.00 23.12 22.95 1loe s ALA 165 CO 0.03 0.05 -0.17 0.12 0.00 0.00 0.00 175.76 175.79 1loe s PHE 166 N -0.30 2.38 -0.32 0.00 5.36 0.54 -0.88 117.98 124.76 1loe s PHE 166 Ca -0.01 -1.32 -0.10 0.00 -0.96 0.00 0.00 56.93 54.54 1loe s PHE 166 Cb -0.03 -1.69 -0.01 0.00 -0.34 0.00 0.00 43.02 40.96 1loe s PHE 166 CO -0.00 -0.67 0.17 1.21 -1.46 0.00 0.00 175.22 174.46 1loe s ASN 167 N 1.27 5.62 0.47 6.13 2.47 -0.43 -2.16 114.94 128.31 1loe s ASN 167 Ca 0.02 -0.55 0.18 0.00 0.42 0.00 0.00 52.86 52.93 1loe s ASN 167 Cb -0.13 -2.02 1.14 0.00 -1.45 0.00 0.00 41.25 38.79 1loe s ASN 167 CO -0.09 -0.21 2.01 0.00 -3.72 0.00 0.00 177.10 175.09 1loe h ALA 168 N 8.37 1.56 -0.21 1.71 0.00 -1.87 -0.52 119.26 128.31 1loe h ALA 168 Ca -0.32 -0.15 -0.09 0.00 0.00 0.00 0.00 54.91 54.35 1loe h ALA 168 Cb 1.14 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1loe h ALA 168 CO 0.62 0.21 -0.25 0.00 0.00 0.00 0.00 179.25 179.83 1loe h ALA 169 N 1.83 1.18 -0.00 0.00 0.00 -1.93 -3.31 119.26 117.03 1loe h ALA 169 Ca -0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1loe h ALA 169 Cb 0.33 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1loe h ALA 169 CO 0.02 0.53 -0.15 0.25 0.00 0.00 0.00 179.25 179.90 1loe n THR 170 N -4.13 0.00 -3.00 0.00 -2.24 -1.01 -4.98 114.28 98.93 1loe n THR 170 Ca -0.01 -0.42 -0.20 0.00 -2.27 0.00 0.00 64.05 61.15 1loe n THR 170 Cb 0.39 1.06 0.01 0.00 -2.10 0.00 0.00 70.33 69.69 1loe n THR 170 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1loe n ASN 171 N -0.48 -4.50 -4.71 3.42 5.03 -0.23 -4.96 115.26 108.83 1loe n ASN 171 Ca 0.02 -0.20 -0.39 0.00 0.87 0.00 0.00 54.58 54.88 1loe n ASN 171 Cb 0.12 -3.71 -0.05 0.00 -1.02 0.00 0.00 39.78 35.11 1loe n ASN 171 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1loe s VAL 172 N -2.92 5.10 -0.29 2.41 1.01 -1.15 -4.90 120.40 119.66 1loe s VAL 172 Ca 0.26 1.24 -0.10 0.00 0.00 0.00 0.00 61.98 63.38 1loe s VAL 172 Cb -0.13 -3.95 -0.02 0.00 0.00 0.00 0.00 36.38 32.28 1loe s VAL 172 CO 0.32 0.27 0.14 -0.22 0.00 0.00 0.00 175.10 175.61 1loe s LEU 173 N 0.85 3.93 -0.06 3.92 0.20 -1.26 -1.32 118.68 124.94 1loe s LEU 173 Ca 0.32 -0.31 0.03 0.00 0.69 0.00 0.00 54.13 54.86 1loe s LEU 173 Cb -0.17 -2.02 -0.03 0.00 -0.43 0.00 0.00 46.19 43.55 1loe s LEU 173 CO 0.14 -0.12 -0.14 -0.89 -0.29 0.00 0.00 176.35 175.06 1loe s THR 174 N 1.66 3.10 -0.06 3.68 2.01 -0.06 -4.96 115.64 121.01 1loe s THR 174 Ca 0.06 -0.70 0.03 0.00 0.31 0.00 0.00 61.69 61.38 1loe s THR 174 Cb -0.16 -2.22 0.01 0.00 0.01 0.00 0.00 72.50 70.13 1loe s THR 174 CO 0.07 0.59 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.76 1loe s VAL 175 N -0.65 1.22 -0.07 3.82 1.01 -1.26 -1.05 120.40 123.43 1loe s VAL 175 Ca 0.10 -0.55 0.01 0.00 0.00 0.00 0.00 61.98 61.53 1loe s VAL 175 Cb -0.11 -1.09 0.02 0.00 0.00 0.00 0.00 36.38 35.20 1loe s VAL 175 CO 0.01 0.37 -0.09 -0.55 0.00 0.00 0.00 175.10 174.84 1loe s SER 176 N 0.44 1.55 -0.02 3.32 0.15 -0.27 -5.00 113.70 113.87 1loe s SER 176 Ca -0.11 -0.24 0.05 0.00 0.70 0.00 0.00 55.95 56.36 1loe s SER 176 Cb -0.14 -0.69 -0.01 0.00 -1.71 0.00 0.00 66.02 63.47 1loe s SER 176 CO 0.03 -0.02 -0.18 -1.48 1.20 0.00 0.00 173.24 172.78 1loe s LEU 177 N 0.94 2.00 -0.03 3.45 0.05 -1.26 -1.54 118.68 122.29 1loe s LEU 177 Ca -0.10 -0.35 0.04 0.00 0.05 0.00 0.00 54.13 53.77 1loe s LEU 177 Cb -0.15 -0.98 -0.00 0.00 -2.05 0.00 0.00 46.19 43.01 1loe s LEU 177 CO 0.01 0.21 -0.14 0.42 -0.55 0.00 0.00 176.35 176.29 1loe s THR 178 N -0.30 1.19 -0.19 5.48 -4.23 -0.45 -4.95 115.64 112.20 1loe s THR 178 Ca 0.04 -0.61 -0.13 0.00 -1.18 0.00 0.00 61.69 59.82 1loe s THR 178 Cb -0.09 -1.02 -0.05 0.00 1.34 0.00 0.00 72.50 72.69 1loe s THR 178 CO 0.00 0.35 0.24 -0.31 -0.54 0.00 0.00 174.62 174.36 1loe s TYR 179 N -0.07 3.42 0.11 3.99 2.02 -1.26 -0.75 117.35 124.81 1loe s TYR 179 Ca -0.00 0.48 -0.31 0.00 -0.37 0.00 0.00 57.07 56.87 1loe s TYR 179 Cb -0.09 -2.31 -0.10 0.00 -0.40 0.00 0.00 41.96 39.06 1loe s TYR 179 CO 0.01 0.19 1.85 -1.25 -1.57 0.00 0.00 175.55 174.78 1loe s PRO 180 N 0.63 4.14 0.00 -1.71 0.04 -1.26 -5.05 135.00 131.79 1loe s PRO 180 Ca 0.13 2.60 0.00 0.00 0.04 0.00 0.00 61.00 63.77 1loe s PRO 180 Cb -0.13 -3.67 0.00 0.00 0.04 0.00 0.00 34.50 30.74 1loe s PRO 180 CO 0.03 -0.86 0.00 0.09 0.04 0.00 0.00 177.00 176.30