#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ofi s THR 2 N 0.00 -0.62 -0.21 12.58 2.01 -1.26 -0.75 115.64 127.40 1ofi s THR 2 Ca 0.00 0.00 -0.00 0.00 0.31 0.00 0.00 61.69 62.00 1ofi s THR 2 Cb 0.00 -1.00 0.05 0.00 0.01 0.00 0.00 72.50 71.56 1ofi s THR 2 CO 0.00 0.00 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.26 1ofi s ILE 3 N 2.43 1.26 -0.05 1.82 -1.09 -0.95 -3.49 121.20 121.14 1ofi s ILE 3 Ca -0.06 -0.93 0.05 0.00 -2.23 0.00 0.00 60.65 57.48 1ofi s ILE 3 Cb -0.09 -1.52 -0.01 0.00 -1.58 0.00 0.00 42.46 39.26 1ofi s ILE 3 CO -0.19 -0.03 -0.21 0.54 -1.23 0.00 0.00 174.94 173.83 1ofi s VAL 4 N 1.53 1.70 0.01 2.92 0.11 -1.09 -1.42 120.40 124.17 1ofi s VAL 4 Ca -0.03 -0.87 0.08 0.00 -2.93 0.00 0.00 61.98 58.23 1ofi s VAL 4 Cb -0.17 -1.45 -0.02 0.00 -1.53 0.00 0.00 36.38 33.21 1ofi s VAL 4 CO -0.07 0.48 -0.24 -0.55 -3.33 0.00 0.00 175.10 171.39 1ofi s SER 5 N -0.08 2.85 -0.02 3.54 0.15 0.16 -3.29 113.70 117.00 1ofi s SER 5 Ca -0.03 -0.49 0.02 0.00 0.70 0.00 0.00 55.95 56.15 1ofi s SER 5 Cb -0.12 -0.29 0.00 0.00 -1.71 0.00 0.00 66.02 63.90 1ofi s SER 5 CO 0.03 0.26 -0.07 -0.69 1.20 0.00 0.00 173.24 173.96 1ofi s VAL 6 N -0.67 0.66 -0.21 4.45 1.01 -0.86 -1.99 120.40 122.79 1ofi s VAL 6 Ca 0.10 -0.29 0.00 0.00 0.00 0.00 0.00 61.98 61.78 1ofi s VAL 6 Cb -0.09 -0.60 0.02 0.00 0.00 0.00 0.00 36.38 35.71 1ofi s VAL 6 CO 0.00 0.21 -0.14 -0.60 0.00 0.00 0.00 175.10 174.58 1ofi s ARG 7 N 0.22 2.87 -0.26 2.72 3.52 -1.23 -1.47 118.95 125.33 1ofi s ARG 7 Ca -0.03 -0.93 -0.20 0.00 -0.13 0.00 0.00 55.73 54.44 1ofi s ARG 7 Cb -0.08 -2.76 0.07 0.00 -1.56 0.00 0.00 34.95 30.62 1ofi s ARG 7 CO 0.00 -0.31 0.67 0.50 -0.81 0.00 0.00 175.30 175.35 1ofi s ARG 8 N 1.29 0.74 -1.12 5.12 3.52 -0.03 -4.83 118.95 123.64 1ofi s ARG 8 Ca 0.02 1.03 -0.22 0.00 -0.13 0.00 0.00 55.73 56.43 1ofi s ARG 8 Cb -0.15 0.28 0.01 0.00 -1.56 0.00 0.00 34.95 33.53 1ofi s ARG 8 CO -0.09 -0.12 0.75 0.09 -0.81 0.00 0.00 175.30 175.13 1ofi n ASN 9 N 3.34 -5.10 -1.45 -2.12 4.13 -1.26 -0.90 115.26 111.90 1ofi n ASN 9 Ca -0.16 -1.05 -0.16 0.00 1.68 0.00 0.00 54.58 54.88 1ofi n ASN 9 Cb 0.57 -2.87 -0.07 0.00 -1.54 0.00 0.00 39.78 35.86 1ofi n ASN 9 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1ofi n GLY 10 N -1.79 1.55 3.24 7.41 0.00 -1.26 -4.93 105.19 109.40 1ofi n GLY 10 Ca -0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.59 1ofi n GLY 10 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ofi s GLN 11 N -3.37 3.09 -0.20 1.61 -1.52 -0.08 -4.72 119.66 114.48 1ofi s GLN 11 Ca 0.00 -0.85 0.00 0.00 -1.95 0.00 0.00 55.36 52.56 1ofi s GLN 11 Cb 0.00 -2.35 0.02 0.00 -0.22 0.00 0.00 33.01 30.46 1ofi s GLN 11 CO 0.00 0.17 -0.16 0.08 -0.25 0.00 0.00 175.29 175.13 1ofi s VAL 12 N 0.37 2.34 -0.06 1.09 1.01 -1.26 -0.85 120.40 123.03 1ofi s VAL 12 Ca -0.17 -0.93 0.05 0.00 0.00 0.00 0.00 61.98 60.93 1ofi s VAL 12 Cb -0.18 -2.04 -0.02 0.00 0.00 0.00 0.00 36.38 34.14 1ofi s VAL 12 CO 0.08 0.46 -0.19 -0.69 0.00 0.00 0.00 175.10 174.75 1ofi s VAL 13 N 1.31 2.57 -0.16 2.92 1.01 -0.54 -1.61 120.40 125.90 1ofi s VAL 13 Ca 0.04 -0.89 -0.04 0.00 0.00 0.00 0.00 61.98 61.09 1ofi s VAL 13 Cb -0.14 -1.98 0.08 0.00 0.00 0.00 0.00 36.38 34.34 1ofi s VAL 13 CO -0.10 0.57 0.24 -0.69 0.00 0.00 0.00 175.10 175.12 1ofi s VAL 14 N -0.35 -0.36 0.11 2.92 1.01 -1.05 -2.02 120.40 120.65 1ofi s VAL 14 Ca 0.03 0.11 -0.06 0.00 0.00 0.00 0.00 61.98 62.06 1ofi s VAL 14 Cb -0.12 -0.54 -0.02 0.00 0.00 0.00 0.00 36.38 35.70 1ofi s VAL 14 CO 0.02 -0.02 0.15 -0.83 0.00 0.00 0.00 175.10 174.42 1ofi s GLY 15 N 2.37 0.44 0.11 4.51 0.00 -1.21 -2.35 107.32 111.19 1ofi s GLY 15 Ca 0.04 -0.96 -0.01 0.00 0.00 0.00 0.00 44.72 43.79 1ofi s GLY 15 CO -0.10 -1.01 0.16 0.61 0.00 0.00 0.00 173.10 172.76 1ofi n GLY 16 N -0.08 2.78 0.00 0.20 0.00 -0.65 -2.65 105.19 104.79 1ofi n GLY 16 Ca -0.11 -1.44 0.00 0.00 0.00 0.00 0.00 46.02 44.47 1ofi n GLY 16 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1ofi n ASP 17 N -1.95 0.00 -2.43 1.61 5.75 -1.23 -1.16 116.55 117.14 1ofi n ASP 17 Ca 0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 54.79 54.76 1ofi n ASP 17 Cb 0.19 0.00 0.08 0.00 -1.03 0.00 0.00 41.12 40.36 1ofi n ASP 17 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ofi n GLY 18 N 5.00 1.75 3.24 6.12 0.00 -0.86 -4.04 105.19 116.40 1ofi n GLY 18 Ca 0.00 -0.35 -0.40 0.00 0.00 0.00 0.00 46.02 45.27 1ofi n GLY 18 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ofi s GLN 19 N -0.67 2.51 -0.53 1.61 0.74 -1.26 -1.93 119.66 120.13 1ofi s GLN 19 Ca 0.12 -1.58 -0.25 0.00 0.05 0.00 0.00 55.36 53.70 1ofi s GLN 19 Cb 0.36 -3.80 0.04 0.00 1.10 0.00 0.00 33.01 30.71 1ofi s GLN 19 CO -0.10 -1.04 0.95 0.08 -0.55 0.00 0.00 175.29 174.64 1ofi s VAL 20 N 1.38 4.39 0.31 1.34 1.01 -0.55 -4.62 120.40 123.66 1ofi s VAL 20 Ca 0.04 0.42 -0.06 0.00 0.00 0.00 0.00 61.98 62.38 1ofi s VAL 20 Cb -0.24 -4.52 -0.05 0.00 0.00 0.00 0.00 36.38 31.56 1ofi s VAL 20 CO 0.01 -1.06 0.59 -0.44 0.00 0.00 0.00 175.10 174.20 1ofi s SER 21 N 2.71 6.45 -0.28 3.32 0.01 -1.26 -1.42 113.70 123.24 1ofi s SER 21 Ca 0.32 0.78 -0.00 0.00 1.31 0.00 0.00 55.95 58.37 1ofi s SER 21 Cb -0.12 -2.17 0.14 0.00 0.21 0.00 0.00 66.02 64.08 1ofi s SER 21 CO 0.21 -0.24 0.35 -0.22 0.41 0.00 0.00 173.24 173.76 1ofi s LEU 22 N -3.63 -0.52 0.00 2.44 2.96 -1.14 -4.80 118.68 113.99 1ofi s LEU 22 Ca 0.45 -0.39 0.00 0.00 -0.22 0.00 0.00 54.13 53.97 1ofi s LEU 22 Cb -0.11 0.85 0.00 0.00 0.50 0.00 0.00 46.19 47.43 1ofi s LEU 22 CO 0.30 -0.35 0.00 0.61 -1.32 0.00 0.00 176.35 175.59 1ofi n GLY 23 N 5.34 1.60 0.00 7.98 0.00 -1.26 -2.15 105.19 116.69 1ofi n GLY 23 Ca -0.02 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1ofi n GLY 23 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ofi n ASN 24 N 10.14 0.19 -4.99 1.61 4.13 -1.26 -5.05 115.26 120.04 1ofi n ASN 24 Ca 0.00 -1.10 -0.19 0.00 1.68 0.00 0.00 54.58 54.97 1ofi n ASN 24 Cb 0.00 0.00 0.02 0.00 -1.54 0.00 0.00 39.78 38.26 1ofi n ASN 24 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 1ofi s THR 25 N -0.10 2.63 -0.27 3.41 -4.23 -0.92 -5.10 115.64 111.07 1ofi s THR 25 Ca 0.00 -1.09 -0.00 0.00 -1.18 0.00 0.00 61.69 59.42 1ofi s THR 25 Cb 0.00 -2.72 0.05 0.00 1.34 0.00 0.00 72.50 71.17 1ofi s THR 25 CO 0.00 0.00 -0.05 -0.69 -0.54 0.00 0.00 174.62 173.34 1ofi s VAL 26 N -2.48 2.70 0.01 2.29 1.01 -1.26 -2.88 120.40 119.78 1ofi s VAL 26 Ca 0.54 -1.34 -0.04 0.00 0.00 0.00 0.00 61.98 61.14 1ofi s VAL 26 Cb -0.07 -2.50 -0.02 0.00 0.00 0.00 0.00 36.38 33.79 1ofi s VAL 26 CO 0.33 0.02 1.00 -0.03 0.00 0.00 0.00 175.10 176.42 1ofi h MET 27 N 7.94 -0.15 -5.45 2.72 4.05 -1.55 -3.46 114.93 119.02 1ofi h MET 27 Ca -0.24 0.01 -0.47 0.00 -0.28 0.00 0.00 59.70 58.71 1ofi h MET 27 Cb 1.07 0.03 -0.26 0.00 -0.80 0.00 0.00 31.60 31.65 1ofi h MET 27 CO 0.53 -0.10 -0.80 0.21 0.23 0.00 0.00 176.91 176.97 1ofi s LYS 28 N -3.21 1.05 -0.19 0.39 2.20 -1.15 -5.00 119.74 113.82 1ofi s LYS 28 Ca -0.02 -0.75 0.17 0.00 -0.36 0.00 0.00 55.97 55.01 1ofi s LYS 28 Cb 0.00 -1.07 -0.24 0.00 -1.51 0.00 0.00 37.83 35.02 1ofi s LYS 28 CO 0.07 0.27 0.06 0.41 -0.36 0.00 0.00 175.35 175.80 1ofi n GLY 29 N 2.02 -0.94 3.08 5.54 0.00 -1.25 -1.48 105.19 112.16 1ofi n GLY 29 Ca -0.17 -0.32 -0.39 0.00 0.00 0.00 0.00 46.02 45.14 1ofi n GLY 29 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ofi n ASN 30 N -2.72 5.02 -4.83 1.61 0.23 -1.19 -4.19 115.26 109.19 1ofi n ASN 30 Ca -0.32 -3.20 -0.22 0.00 -0.53 0.00 0.00 54.58 50.31 1ofi n ASN 30 Cb 1.12 -1.15 -0.04 0.00 -2.08 0.00 0.00 39.78 37.63 1ofi n ASN 30 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1ofi s ALA 31 N -1.80 3.63 -0.59 -2.53 0.00 -0.82 -5.02 121.76 114.64 1ofi s ALA 31 Ca 0.31 -1.46 0.03 0.00 0.00 0.00 0.00 51.96 50.84 1ofi s ALA 31 Cb -0.03 -1.28 0.15 0.00 0.00 0.00 0.00 23.12 21.95 1ofi s ALA 31 CO -0.05 0.21 0.36 1.03 0.00 0.00 0.00 175.76 177.31 1ofi s ARG 32 N -3.87 2.22 0.22 0.00 0.52 -1.26 -4.05 118.95 112.73 1ofi s ARG 32 Ca 0.34 -2.79 0.25 0.00 -0.52 0.00 0.00 55.73 53.02 1ofi s ARG 32 Cb -0.08 -3.43 0.87 0.00 0.52 0.00 0.00 34.95 32.83 1ofi s ARG 32 CO 0.25 -1.16 1.76 1.63 0.02 0.00 0.00 175.30 177.80 1ofi n LYS 33 N 2.89 0.24 -5.08 3.54 5.02 -1.26 -4.70 118.16 118.81 1ofi n LYS 33 Ca 0.09 0.27 -0.32 0.00 -2.02 0.00 0.00 58.31 56.33 1ofi n LYS 33 Cb 0.34 -1.81 -0.16 0.00 -0.02 0.00 0.00 35.03 33.37 1ofi n LYS 33 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1ofi s VAL 34 N -3.16 2.33 0.12 -0.18 1.01 -1.26 -1.65 120.40 117.60 1ofi s VAL 34 Ca 0.09 -0.92 -0.06 0.00 0.00 0.00 0.00 61.98 61.09 1ofi s VAL 34 Cb 0.12 -1.92 -0.02 0.00 0.00 0.00 0.00 36.38 34.56 1ofi s VAL 34 CO 0.54 0.55 0.16 -0.13 0.00 0.00 0.00 175.10 176.22 1ofi s ARG 35 N 0.36 0.92 0.08 2.72 0.52 -0.62 -4.94 118.95 117.99 1ofi s ARG 35 Ca -0.16 -1.17 -0.02 0.00 -0.52 0.00 0.00 55.73 53.86 1ofi s ARG 35 Cb -0.17 0.31 -0.04 0.00 0.52 0.00 0.00 34.95 35.56 1ofi s ARG 35 CO 0.08 -0.29 0.26 1.03 0.02 0.00 0.00 175.30 176.40 1ofi s ARG 36 N -3.94 3.50 0.03 3.54 0.52 -1.26 -0.93 118.95 120.41 1ofi s ARG 36 Ca 0.13 -0.31 0.01 0.00 -0.52 0.00 0.00 55.73 55.04 1ofi s ARG 36 Cb 0.05 -2.99 -0.00 0.00 0.52 0.00 0.00 34.95 32.53 1ofi s ARG 36 CO -0.05 0.58 0.02 1.28 0.02 0.00 0.00 175.30 177.15 1ofi n LEU 37 N 0.32 0.00 -1.64 2.53 4.77 0.16 -4.87 117.00 118.28 1ofi n LEU 37 Ca -0.05 -0.29 -0.01 0.00 -0.03 0.00 0.00 56.01 55.63 1ofi n LEU 37 Cb 0.51 0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.73 1ofi n LEU 37 CO 0.50 -0.05 -0.21 0.00 -1.33 0.00 0.00 177.39 176.30 1ofi n TYR 38 N -0.07 -0.04 -0.20 -1.77 4.19 -1.26 0.15 117.16 118.16 1ofi n TYR 38 Ca 0.00 0.01 0.00 0.00 3.31 0.00 0.00 57.90 61.23 1ofi n TYR 38 Cb 0.06 -0.43 0.00 0.00 0.49 0.00 0.00 39.34 39.46 1ofi n TYR 38 CO 0.00 0.00 0.00 0.09 0.91 0.00 0.00 176.86 177.86 1ofi n ASN 39 N 1.38 0.00 0.00 2.98 3.02 -1.26 -0.43 115.26 120.95 1ofi n ASN 39 Ca -0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1ofi n ASN 39 Cb 0.21 -1.66 0.00 0.00 -0.61 0.00 0.00 39.78 37.72 1ofi n ASN 39 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ofi n GLY 40 N -1.60 0.66 0.45 7.41 0.00 0.41 -4.99 105.19 107.53 1ofi n GLY 40 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 1ofi n GLY 40 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ofi n LYS 41 N -1.65 1.58 -4.14 1.61 5.02 0.43 -4.64 118.16 116.36 1ofi n LYS 41 Ca 0.00 -0.88 -0.16 0.00 -2.02 0.00 0.00 58.31 55.25 1ofi n LYS 41 Cb 0.00 -1.32 -0.15 0.00 -0.02 0.00 0.00 35.03 33.55 1ofi n LYS 41 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1ofi s VAL 42 N -1.77 0.40 -0.04 -0.18 -7.23 -1.17 -4.39 120.40 106.02 1ofi s VAL 42 Ca 0.27 -0.20 0.04 0.00 -1.81 0.00 0.00 61.98 60.28 1ofi s VAL 42 Cb 0.14 -0.35 -0.03 0.00 0.56 0.00 0.00 36.38 36.70 1ofi s VAL 42 CO 0.21 0.12 -0.14 -0.76 -0.31 0.00 0.00 175.10 174.22 1ofi s LEU 43 N -0.02 2.78 -0.11 1.32 1.02 0.14 0.40 118.68 124.22 1ofi s LEU 43 Ca 0.01 -0.21 -0.05 0.00 0.02 0.00 0.00 54.13 53.90 1ofi s LEU 43 Cb -0.03 -1.58 0.05 0.00 0.02 0.00 0.00 46.19 44.65 1ofi s LEU 43 CO -0.00 0.33 0.24 0.00 0.02 0.00 0.00 176.35 176.93 1ofi s ALA 44 N -0.78 -0.50 -0.08 4.21 0.00 -0.11 0.13 121.76 124.62 1ofi s ALA 44 Ca 0.12 0.92 0.01 0.00 0.00 0.00 0.00 51.96 53.01 1ofi s ALA 44 Cb -0.11 -0.75 -0.03 0.00 0.00 0.00 0.00 23.12 22.24 1ofi s ALA 44 CO 0.02 -0.36 -0.09 0.20 0.00 0.00 0.00 175.76 175.53 1ofi s GLY 45 N 1.68 1.64 -0.05 0.00 0.00 0.23 -1.59 107.32 109.23 1ofi s GLY 45 Ca -0.05 -0.90 0.03 0.00 0.00 0.00 0.00 44.72 43.80 1ofi s GLY 45 CO -0.08 -0.54 -0.15 -0.11 0.00 0.00 0.00 173.10 172.22 1ofi s PHE 46 N -0.47 1.59 0.43 1.90 -0.71 -0.66 0.19 117.98 120.26 1ofi s PHE 46 Ca 0.07 -0.52 0.06 0.00 -1.04 0.00 0.00 56.93 55.49 1ofi s PHE 46 Cb -0.12 -1.11 -0.06 0.00 -1.21 0.00 0.00 43.02 40.52 1ofi s PHE 46 CO 0.02 -0.22 0.01 0.00 -1.34 0.00 0.00 175.22 173.69 1ofi s ALA 47 N 0.32 3.40 0.00 1.99 0.00 -0.84 -4.88 121.76 121.75 1ofi s ALA 47 Ca -0.09 -1.83 0.00 0.00 0.00 0.00 0.00 51.96 50.03 1ofi s ALA 47 Cb -0.13 0.14 0.00 0.00 0.00 0.00 0.00 23.12 23.13 1ofi s ALA 47 CO 0.03 -0.10 0.00 0.41 0.00 0.00 0.00 175.76 176.10 1ofi n GLY 48 N -1.04 0.34 3.47 0.00 0.00 -1.26 -2.26 105.19 104.44 1ofi n GLY 48 Ca -0.08 -1.65 -0.36 0.00 0.00 0.00 0.00 46.02 43.93 1ofi n GLY 48 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ofi s GLY 49 N 0.00 1.77 0.00 -0.02 0.00 -1.10 -4.95 107.32 103.02 1ofi s GLY 49 Ca 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 44.72 43.68 1ofi s GLY 49 CO 0.00 0.39 0.17 2.41 0.00 0.00 0.00 173.10 176.07 1ofi n THR 50 N 4.56 0.00 0.00 0.90 -1.04 -1.26 0.47 114.28 117.91 1ofi n THR 50 Ca -0.16 0.27 0.00 0.00 -2.04 0.00 0.00 64.05 62.11 1ofi n THR 50 Cb 0.52 -0.36 0.00 0.00 -1.82 0.00 0.00 70.33 68.66 1ofi n THR 50 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ofi n ALA 51 N -1.80 0.00 -0.27 2.41 0.00 -1.26 -1.00 120.51 118.59 1ofi n ALA 51 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 1ofi n ALA 51 Cb 0.00 0.36 0.06 0.00 0.00 0.00 0.00 19.45 19.87 1ofi n ALA 51 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1ofi h ASP 52 N 0.00 0.89 -0.34 0.00 5.19 -1.51 -2.65 116.42 118.01 1ofi h ASP 52 Ca 0.00 -0.06 0.07 0.00 -0.62 0.00 0.00 57.03 56.43 1ofi h ASP 52 Cb 0.00 -0.22 -0.08 0.00 0.18 0.00 0.00 39.33 39.20 1ofi h ASP 52 CO 0.00 0.69 -0.26 0.00 -3.12 0.00 0.00 179.24 176.55 1ofi h ALA 53 N 1.24 -0.09 0.03 3.45 0.00 0.15 0.46 119.26 124.50 1ofi h ALA 53 Ca 0.27 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.28 1ofi h ALA 53 Cb -0.04 0.57 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1ofi h ALA 53 CO -0.05 -0.66 -0.02 0.74 0.00 0.00 0.00 179.25 179.26 1ofi h PHE 54 N -0.22 -0.04 -0.67 0.00 -1.00 -0.91 0.06 116.94 114.15 1ofi h PHE 54 Ca 0.17 -0.00 0.02 0.00 2.81 0.00 0.00 57.97 60.97 1ofi h PHE 54 Cb 0.48 0.01 -0.04 0.00 3.61 0.00 0.00 35.95 40.02 1ofi h PHE 54 CO -0.46 0.02 0.43 0.00 -1.61 0.00 0.00 178.31 176.70 1ofi h THR 55 N -0.10 1.12 -0.37 -1.55 1.03 -1.09 0.48 112.91 112.42 1ofi h THR 55 Ca -0.00 -0.29 0.06 0.00 -0.01 0.00 0.00 66.41 66.16 1ofi h THR 55 Cb 0.08 0.19 -0.05 0.00 -1.07 0.00 0.00 68.15 67.30 1ofi h THR 55 CO 0.01 0.16 0.08 0.25 -0.01 0.00 0.00 175.52 176.00 1ofi h LEU 56 N 0.85 0.02 0.21 0.00 7.12 0.11 0.40 115.31 124.03 1ofi h LEU 56 Ca 0.26 0.06 -0.01 0.00 0.13 0.00 0.00 57.88 58.32 1ofi h LEU 56 Cb -0.02 0.08 -0.00 0.00 -0.53 0.00 0.00 40.66 40.19 1ofi h LEU 56 CO -0.09 0.05 -0.13 0.15 -0.13 0.00 0.00 178.44 178.29 1ofi h PHE 57 N 0.20 -0.34 -0.77 1.25 3.04 -0.08 -2.75 116.94 117.49 1ofi h PHE 57 Ca 0.18 -0.00 0.13 0.00 3.98 0.00 0.00 57.97 62.25 1ofi h PHE 57 Cb 0.20 0.12 -0.13 0.00 2.56 0.00 0.00 35.95 38.70 1ofi h PHE 57 CO -0.19 -0.19 -0.37 0.93 -2.02 0.00 0.00 178.31 176.47 1ofi h GLU 58 N -0.32 -0.09 -0.44 1.11 5.08 0.08 -0.75 114.58 119.25 1ofi h GLU 58 Ca -0.03 0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.43 1ofi h GLU 58 Cb 0.25 0.02 -0.10 0.00 0.50 0.00 0.00 28.75 29.43 1ofi h GLU 58 CO 0.03 -0.06 -0.27 -0.07 -1.00 0.00 0.00 179.01 177.64 1ofi h LEU 59 N -0.09 -0.90 -1.58 1.33 4.07 -0.92 0.73 115.31 117.95 1ofi h LEU 59 Ca 0.28 0.18 0.15 0.00 0.08 0.00 0.00 57.88 58.57 1ofi h LEU 59 Cb 0.57 0.45 -0.05 0.00 1.08 0.00 0.00 40.66 42.72 1ofi h LEU 59 CO -0.82 -0.28 0.50 0.15 -1.08 0.00 0.00 178.44 176.92 1ofi h PHE 60 N -0.18 0.49 0.63 1.13 3.57 -0.86 -1.66 116.94 120.06 1ofi h PHE 60 Ca 0.20 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.69 1ofi h PHE 60 Cb 0.50 -0.15 0.01 0.00 2.79 0.00 0.00 35.95 39.09 1ofi h PHE 60 CO -0.51 0.19 -0.30 1.49 -2.23 0.00 0.00 178.31 176.94 1ofi h GLU 61 N 0.42 -0.82 0.00 1.11 4.81 0.12 -1.12 114.58 119.10 1ofi h GLU 61 Ca 0.37 0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.65 1ofi h GLU 61 Cb 0.84 0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.40 1ofi h GLU 61 CO -0.12 -0.54 0.65 0.00 -0.73 0.00 0.00 179.01 178.27 1ofi h ARG 62 N -1.08 0.00 0.02 1.92 2.47 -0.03 0.71 114.38 118.39 1ofi h ARG 62 Ca -0.09 0.00 -0.25 0.00 -1.26 0.00 0.00 59.98 58.38 1ofi h ARG 62 Cb 0.65 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 28.94 1ofi h ARG 62 CO 0.14 0.00 -1.35 -0.22 0.56 0.00 0.00 179.97 179.10 1ofi h LYS 63 N 0.00 0.05 -0.63 0.04 1.63 -0.61 -3.33 116.57 113.73 1ofi h LYS 63 Ca 0.00 -0.09 0.12 0.00 -0.85 0.00 0.00 60.65 59.84 1ofi h LYS 63 Cb 1.30 0.03 -0.09 0.00 -0.60 0.00 0.00 32.23 32.87 1ofi h LYS 63 CO 0.00 1.04 0.12 -0.07 -3.45 0.00 0.00 179.45 177.09 1ofi h LEU 64 N -0.81 -0.03 -0.35 5.20 3.38 0.16 -1.05 115.31 121.82 1ofi h LEU 64 Ca -0.35 0.12 0.07 0.00 0.09 0.00 0.00 57.88 57.82 1ofi h LEU 64 Cb 1.43 0.18 -0.07 0.00 0.09 0.00 0.00 40.66 42.29 1ofi h LEU 64 CO -0.15 -0.02 -0.11 -0.33 0.09 0.00 0.00 178.44 177.92 1ofi h GLU 65 N 0.24 -0.03 -0.14 1.13 4.39 -1.64 0.63 114.58 119.16 1ofi h GLU 65 Ca 0.34 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.96 1ofi h GLU 65 Cb 0.52 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.17 1ofi h GLU 65 CO -0.44 -0.02 -0.26 0.52 -1.16 0.00 0.00 179.01 177.65 1ofi h MET 66 N -0.04 0.25 -1.35 2.33 2.86 -1.35 -3.15 114.93 114.48 1ofi h MET 66 Ca 0.17 -0.08 -0.65 0.00 -2.06 0.00 0.00 59.70 57.08 1ofi h MET 66 Cb 0.30 -0.02 -0.35 0.00 0.06 0.00 0.00 31.60 31.58 1ofi h MET 66 CO -0.38 0.49 0.09 0.72 1.06 0.00 0.00 176.91 178.89 1ofi n HIS 67 N -4.16 3.11 -3.55 -0.22 8.25 -0.51 -4.93 115.22 113.20 1ofi n HIS 67 Ca -0.01 -2.68 -0.23 0.00 -0.26 0.00 0.00 57.72 54.54 1ofi n HIS 67 Cb 0.36 -0.75 -0.04 0.00 1.12 0.00 0.00 29.99 30.68 1ofi n HIS 67 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1ofi n GLN 68 N -0.65 -1.68 -2.90 -0.41 6.02 -0.85 -1.44 117.38 115.47 1ofi n GLN 68 Ca 0.50 0.08 -0.16 0.00 -0.01 0.00 0.00 57.00 57.40 1ofi n GLN 68 Cb 0.62 -4.44 0.03 0.00 1.02 0.00 0.00 30.24 27.47 1ofi n GLN 68 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ofi n GLY 69 N -0.79 -0.17 3.47 1.08 0.00 0.21 -4.94 105.19 104.05 1ofi n GLY 69 Ca 0.06 -0.10 -0.44 0.00 0.00 0.00 0.00 46.02 45.55 1ofi n GLY 69 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ofi s HIS 70 N -3.05 3.17 0.15 1.61 3.76 -0.52 -4.88 115.29 115.54 1ofi s HIS 70 Ca 0.26 -1.59 -0.08 0.00 -0.15 0.00 0.00 55.06 53.50 1ofi s HIS 70 Cb -0.11 -4.35 0.20 0.00 1.11 0.00 0.00 32.58 29.42 1ofi s HIS 70 CO 0.32 -1.51 0.94 -0.11 -0.85 0.00 0.00 174.74 173.53 1ofi n LEU 71 N 6.54 -0.32 0.40 0.89 -0.00 -1.26 -0.20 117.00 123.05 1ofi n LEU 71 Ca 0.30 1.05 -0.16 0.00 -0.00 0.00 0.00 56.01 57.20 1ofi n LEU 71 Cb 0.47 -0.27 -0.07 0.00 -0.00 0.00 0.00 43.42 43.55 1ofi n LEU 71 CO 0.57 -0.97 0.46 0.25 -0.00 0.00 0.00 177.39 177.70 1ofi h LEU 72 N 0.00 -0.87 -0.14 -1.96 7.12 -1.95 -2.98 115.31 114.54 1ofi h LEU 72 Ca 0.24 0.03 0.04 0.00 0.13 0.00 0.00 57.88 58.32 1ofi h LEU 72 Cb 0.39 0.22 -0.04 0.00 -0.53 0.00 0.00 40.66 40.71 1ofi h LEU 72 CO -0.61 -0.55 -0.09 0.50 -0.13 0.00 0.00 178.44 177.56 1ofi h LYS 73 N -1.15 -0.09 -0.15 1.25 3.64 -0.98 -2.62 116.57 116.47 1ofi h LYS 73 Ca -0.10 0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.32 1ofi h LYS 73 Cb 0.78 0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 32.56 1ofi h LYS 73 CO 0.17 -0.06 -0.44 0.77 -2.27 0.00 0.00 179.45 177.63 1ofi h SER 74 N -0.09 -1.38 -0.70 4.20 0.02 -0.73 -1.33 113.55 113.54 1ofi h SER 74 Ca 0.08 0.18 0.13 0.00 -0.84 0.00 0.00 61.79 61.35 1ofi h SER 74 Cb 0.22 0.56 -0.13 0.00 0.14 0.00 0.00 62.40 63.18 1ofi h SER 74 CO -0.19 -0.43 -0.25 0.00 -1.14 0.00 0.00 176.83 174.82 1ofi h ALA 75 N 0.09 0.29 -0.29 3.77 0.00 -1.35 -0.85 119.26 120.91 1ofi h ALA 75 Ca 0.07 0.25 0.04 0.00 0.00 0.00 0.00 54.91 55.27 1ofi h ALA 75 Cb 0.63 0.66 -0.08 0.00 0.00 0.00 0.00 17.79 19.01 1ofi h ALA 75 CO -0.41 -0.51 -0.54 0.28 0.00 0.00 0.00 179.25 178.06 1ofi h VAL 76 N -0.06 0.01 -0.05 0.00 2.07 -0.89 0.10 116.25 117.44 1ofi h VAL 76 Ca 0.31 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.87 1ofi h VAL 76 Cb 0.55 0.01 -0.06 0.00 -1.52 0.00 0.00 31.29 30.27 1ofi h VAL 76 CO -0.75 0.00 -0.36 -0.33 0.02 0.00 0.00 177.57 176.15 1ofi h GLU 77 N -0.47 -0.47 -1.14 1.57 4.39 -0.65 0.14 114.58 117.96 1ofi h GLU 77 Ca 0.06 0.03 0.33 0.00 0.34 0.00 0.00 59.36 60.13 1ofi h GLU 77 Cb 0.63 0.11 -0.11 0.00 -0.10 0.00 0.00 28.75 29.28 1ofi h GLU 77 CO -0.53 -0.31 0.72 1.25 -1.16 0.00 0.00 179.01 178.98 1ofi h LEU 78 N -0.49 0.38 -0.22 1.33 5.85 -0.60 0.97 115.31 122.54 1ofi h LEU 78 Ca 0.07 0.12 -0.05 0.00 0.84 0.00 0.00 57.88 58.85 1ofi h LEU 78 Cb 0.59 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.69 1ofi h LEU 78 CO -0.32 -0.04 -0.08 0.00 -0.34 0.00 0.00 178.44 177.66 1ofi h ALA 79 N 1.64 0.30 -0.94 1.25 0.00 0.12 -3.17 119.26 118.46 1ofi h ALA 79 Ca 0.69 -0.28 0.23 0.00 0.00 0.00 0.00 54.91 55.56 1ofi h ALA 79 Cb 1.92 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 19.57 1ofi h ALA 79 CO -0.38 0.11 0.63 0.87 0.00 0.00 0.00 179.25 180.48 1ofi h LYS 80 N 0.15 0.33 0.00 0.00 6.56 0.25 -1.28 116.57 122.57 1ofi h LYS 80 Ca 0.05 -0.02 -0.00 0.00 -1.06 0.00 0.00 60.65 59.62 1ofi h LYS 80 Cb 0.55 -0.07 -0.00 0.00 -0.57 0.00 0.00 32.23 32.14 1ofi h LYS 80 CO 0.03 0.22 -0.02 -0.44 -2.06 0.00 0.00 179.45 177.17 1ofi h ASP 81 N 0.34 0.00 0.16 0.86 3.45 -1.44 -2.64 116.42 117.15 1ofi h ASP 81 Ca 0.49 0.00 -0.35 0.00 0.43 0.00 0.00 57.03 57.60 1ofi h ASP 81 Cb 1.35 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 40.12 1ofi h ASP 81 CO -0.17 0.02 -1.80 -0.50 -1.57 0.00 0.00 179.24 175.22 1ofi h TRP 82 N 0.00 0.62 -1.28 4.55 6.55 -1.41 -3.41 115.95 121.57 1ofi h TRP 82 Ca -0.00 -0.45 -0.73 0.00 0.95 0.00 0.00 58.89 58.66 1ofi h TRP 82 Cb 0.06 -0.02 -0.13 0.00 -0.86 0.00 0.00 29.16 28.21 1ofi h TRP 82 CO 0.00 1.71 2.05 0.54 -1.05 0.00 0.00 178.44 181.69 1ofi n ARG 83 N -3.60 3.33 0.00 0.49 1.74 -0.99 -4.72 116.66 112.91 1ofi n ARG 83 Ca -0.27 -3.42 0.00 0.00 -0.77 0.00 0.00 57.85 53.39 1ofi n ARG 83 Cb 1.05 -3.13 0.00 0.00 -1.02 0.00 0.00 32.46 29.36 1ofi n ARG 83 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1ofi n THR 84 N 4.59 0.00 0.07 0.55 -2.24 -1.26 -4.89 114.28 111.10 1ofi n THR 84 Ca 0.43 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 62.30 1ofi n THR 84 Cb 0.40 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.59 1ofi n THR 84 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1ofi n ASP 85 N 0.00 0.70 -4.20 3.42 5.68 -1.26 -4.79 116.55 116.09 1ofi n ASP 85 Ca 0.00 0.28 -0.34 0.00 -0.50 0.00 0.00 54.79 54.22 1ofi n ASP 85 Cb 0.00 0.67 -0.14 0.00 -1.14 0.00 0.00 41.12 40.50 1ofi n ASP 85 CO 0.00 0.00 0.00 -0.60 -1.33 0.00 0.00 177.20 175.27 1ofi s ARG 86 N -3.32 2.91 1.02 0.11 6.06 -1.26 -5.11 118.95 119.37 1ofi s ARG 86 Ca -0.02 -0.92 -0.16 0.00 -2.50 0.00 0.00 55.73 52.13 1ofi s ARG 86 Cb 0.10 -2.94 0.04 0.00 0.06 0.00 0.00 34.95 32.21 1ofi s ARG 86 CO 0.81 -0.35 0.07 0.00 -2.50 0.00 0.00 175.30 173.33 1ofi n ALA 87 N 4.68 -3.58 -3.19 6.12 0.00 -1.26 -4.87 120.51 118.40 1ofi n ALA 87 Ca -0.17 -0.92 -0.23 0.00 0.00 0.00 0.00 53.44 52.12 1ofi n ALA 87 Cb 0.48 -1.59 -0.06 0.00 0.00 0.00 0.00 19.45 18.27 1ofi n ALA 87 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1ofi n LEU 88 N -0.88 0.34 0.00 0.00 -0.00 -1.26 -5.02 117.00 110.19 1ofi n LEU 88 Ca 0.03 -4.77 0.00 0.00 -0.00 0.00 0.00 56.01 51.28 1ofi n LEU 88 Cb 0.58 0.65 0.00 0.00 -0.00 0.00 0.00 43.42 44.65 1ofi n LEU 88 CO 0.51 2.12 0.00 -1.14 -0.00 0.00 0.00 177.39 178.88 1ofi n ARG 89 N 1.15 0.00 0.00 1.96 0.63 -1.26 -4.64 116.66 114.51 1ofi n ARG 89 Ca 0.22 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.15 1ofi n ARG 89 Cb 0.56 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.47 1ofi n ARG 89 CO 0.00 0.00 0.00 1.17 -2.51 0.00 0.00 177.63 176.29 1ofi n LYS 90 N 9.92 0.00 -2.31 -0.14 4.81 -1.26 -5.10 118.16 124.07 1ofi n LYS 90 Ca 0.00 0.00 -0.39 0.00 -0.87 0.00 0.00 58.31 57.05 1ofi n LYS 90 Cb 0.00 0.00 -0.02 0.00 0.02 0.00 0.00 35.03 35.03 1ofi n LYS 90 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1ofi s LEU 91 N 0.00 4.27 -0.92 3.14 2.01 -0.86 -4.96 118.68 121.36 1ofi s LEU 91 Ca 0.00 2.36 0.00 0.00 0.01 0.00 0.00 54.13 56.50 1ofi s LEU 91 Cb 0.00 -3.93 0.32 0.00 0.01 0.00 0.00 46.19 42.59 1ofi s LEU 91 CO 0.00 -0.57 1.58 1.21 1.01 0.00 0.00 176.35 179.58 1ofi n GLU 92 N 0.31 4.81 -3.57 1.70 0.00 -1.26 -4.19 120.64 118.44 1ofi n GLU 92 Ca 0.03 -4.71 -0.11 0.00 0.00 0.00 0.00 57.16 52.37 1ofi n GLU 92 Cb 0.46 -2.42 -0.05 0.00 0.00 0.00 0.00 31.44 29.43 1ofi n GLU 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1ofi s ALA 93 N -3.98 -1.91 0.49 4.31 0.00 -1.26 -2.73 121.76 116.69 1ofi s ALA 93 Ca 0.41 1.58 0.07 0.00 0.00 0.00 0.00 51.96 54.01 1ofi s ALA 93 Cb 0.20 -0.67 0.02 0.00 0.00 0.00 0.00 23.12 22.67 1ofi s ALA 93 CO -0.11 -0.31 0.46 -1.64 0.00 0.00 0.00 175.76 174.16 1ofi s MET 94 N -1.00 2.39 -0.10 0.00 -1.94 -0.96 -2.72 119.30 114.96 1ofi s MET 94 Ca -0.03 -1.74 -0.14 0.00 -1.71 0.00 0.00 55.69 52.07 1ofi s MET 94 Cb -0.01 -2.32 0.03 0.00 2.01 0.00 0.00 34.83 34.55 1ofi s MET 94 CO 0.02 -0.48 0.37 -1.17 -0.01 0.00 0.00 175.02 173.75 1ofi s LEU 95 N -4.28 0.60 -0.31 -0.03 0.20 0.13 -1.99 118.68 113.00 1ofi s LEU 95 Ca 0.45 0.55 -0.01 0.00 0.69 0.00 0.00 54.13 55.81 1ofi s LEU 95 Cb -0.03 1.34 0.06 0.00 -0.43 0.00 0.00 46.19 47.12 1ofi s LEU 95 CO 0.27 -0.25 0.01 -0.63 -0.29 0.00 0.00 176.35 175.47 1ofi s ILE 96 N -0.33 2.95 -0.08 6.68 1.01 0.52 0.60 121.20 132.55 1ofi s ILE 96 Ca -0.05 -1.49 0.00 0.00 0.00 0.00 0.00 60.65 59.11 1ofi s ILE 96 Cb -0.03 -2.74 -0.03 0.00 0.01 0.00 0.00 42.46 39.66 1ofi s ILE 96 CO 0.02 -0.17 -0.07 0.68 0.00 0.00 0.00 174.94 175.40 1ofi s VAL 97 N 1.22 3.72 -0.06 2.92 -7.23 -0.08 0.75 120.40 121.65 1ofi s VAL 97 Ca -0.04 -0.47 -0.16 0.00 -1.81 0.00 0.00 61.98 59.51 1ofi s VAL 97 Cb -0.20 -2.53 0.03 0.00 0.56 0.00 0.00 36.38 34.24 1ofi s VAL 97 CO -0.02 0.59 0.37 0.00 -0.31 0.00 0.00 175.10 175.73 1ofi s ALA 98 N -0.68 -0.94 0.37 1.32 0.00 0.34 -0.27 121.76 121.90 1ofi s ALA 98 Ca 0.10 0.67 -0.07 0.00 0.00 0.00 0.00 51.96 52.65 1ofi s ALA 98 Cb -0.11 -0.16 0.03 0.00 0.00 0.00 0.00 23.12 22.88 1ofi s ALA 98 CO 0.02 -0.25 0.62 -0.40 0.00 0.00 0.00 175.76 175.75 1ofi n ASP 99 N 1.74 -1.76 0.00 0.00 3.85 0.79 0.29 116.55 121.45 1ofi n ASP 99 Ca -0.19 -2.78 0.00 0.00 -0.71 0.00 0.00 54.79 51.11 1ofi n ASP 99 Cb 0.56 3.10 0.00 0.00 -1.35 0.00 0.00 41.12 43.43 1ofi n ASP 99 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 1ofi n GLU 100 N -0.56 0.00 -2.63 0.11 4.71 -1.26 -1.02 120.64 119.99 1ofi n GLU 100 Ca -0.03 0.00 -0.04 0.00 -0.01 0.00 0.00 57.16 57.08 1ofi n GLU 100 Cb 0.59 0.00 0.04 0.00 -1.01 0.00 0.00 31.44 31.07 1ofi n GLU 100 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 1ofi n LYS 101 N -1.90 1.99 -3.64 3.49 4.76 -1.26 -5.02 118.16 116.59 1ofi n LYS 101 Ca 0.00 -3.57 -0.11 0.00 -2.87 0.00 0.00 58.31 51.76 1ofi n LYS 101 Cb 0.00 -1.67 -0.07 0.00 -1.84 0.00 0.00 35.03 31.45 1ofi n LYS 101 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1ofi s GLU 102 N -3.63 0.78 -0.04 1.97 0.41 -0.19 -5.09 118.70 112.91 1ofi s GLU 102 Ca 0.32 1.10 0.02 0.00 -0.41 0.00 0.00 54.97 55.99 1ofi s GLU 102 Cb 0.34 0.29 0.01 0.00 -1.78 0.00 0.00 34.13 32.99 1ofi s GLU 102 CO -0.03 -0.12 -0.07 -1.12 -0.49 0.00 0.00 175.26 173.42 1ofi s SER 103 N 0.93 1.16 0.05 -0.19 0.01 -1.26 -0.15 113.70 114.25 1ofi s SER 103 Ca -0.04 -0.18 -0.09 0.00 1.31 0.00 0.00 55.95 56.95 1ofi s SER 103 Cb -0.05 -0.47 -0.00 0.00 0.21 0.00 0.00 66.02 65.71 1ofi s SER 103 CO -0.08 0.00 0.18 -0.76 0.41 0.00 0.00 173.24 172.99 1ofi s LEU 104 N 0.61 1.46 -0.15 2.44 1.43 0.63 -4.50 118.68 120.59 1ofi s LEU 104 Ca -0.09 -0.45 -0.01 0.00 -1.03 0.00 0.00 54.13 52.54 1ofi s LEU 104 Cb -0.13 0.91 -0.01 0.00 0.03 0.00 0.00 46.19 46.99 1ofi s LEU 104 CO 0.01 -0.58 -0.10 -0.51 0.23 0.00 0.00 176.35 175.40 1ofi s ILE 105 N -2.83 3.22 -0.05 -0.59 2.07 -0.94 -0.90 121.20 121.17 1ofi s ILE 105 Ca -0.03 -0.59 0.04 0.00 -1.41 0.00 0.00 60.65 58.66 1ofi s ILE 105 Cb 0.00 -2.38 -0.02 0.00 0.13 0.00 0.00 42.46 40.19 1ofi s ILE 105 CO -0.05 0.50 -0.16 -0.63 -1.91 0.00 0.00 174.94 172.69 1ofi s ILE 106 N 0.56 2.89 0.29 2.00 1.01 0.20 -1.76 121.20 126.39 1ofi s ILE 106 Ca -0.07 -0.79 0.09 0.00 0.00 0.00 0.00 60.65 59.89 1ofi s ILE 106 Cb -0.15 -2.11 -0.04 0.00 0.01 0.00 0.00 42.46 40.16 1ofi s ILE 106 CO 0.03 0.59 0.03 0.42 0.00 0.00 0.00 174.94 176.01 1ofi s THR 107 N -0.68 3.32 -0.24 2.92 -4.23 -1.18 0.22 115.64 115.77 1ofi s THR 107 Ca 0.11 -1.87 0.01 0.00 -1.18 0.00 0.00 61.69 58.76 1ofi s THR 107 Cb -0.11 -2.87 0.29 0.00 1.34 0.00 0.00 72.50 71.15 1ofi s THR 107 CO 0.00 -0.32 1.58 0.61 -0.54 0.00 0.00 174.62 175.95 1ofi n GLY 108 N -0.95 3.40 0.00 3.99 0.00 -1.10 -3.56 105.19 106.97 1ofi n GLY 108 Ca -0.06 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.31 1ofi n GLY 108 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1ofi n ILE 109 N -0.11 0.00 0.00 -0.61 -5.35 -1.26 -2.02 119.36 110.01 1ofi n ILE 109 Ca 0.28 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.76 1ofi n ILE 109 Cb 0.93 -0.08 0.00 0.00 -1.74 0.00 0.00 39.64 38.74 1ofi n ILE 109 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ofi n GLY 110 N 2.58 0.92 3.40 3.28 0.00 -1.23 -4.70 105.19 109.43 1ofi n GLY 110 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 1ofi n GLY 110 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1ofi s ASP 111 N -1.12 -0.51 0.07 1.61 3.84 -1.26 -4.81 116.67 114.49 1ofi s ASP 111 Ca 0.00 0.91 0.02 0.00 -0.00 0.00 0.00 52.55 53.48 1ofi s ASP 111 Cb 0.00 0.93 -0.04 0.00 -1.38 0.00 0.00 42.92 42.43 1ofi s ASP 111 CO 0.00 -0.24 0.11 0.68 -0.00 0.00 0.00 175.17 175.72 1ofi s VAL 112 N -0.01 4.76 -0.03 2.11 -7.23 -1.26 -3.09 120.40 115.65 1ofi s VAL 112 Ca -0.02 -0.65 0.00 0.00 -1.81 0.00 0.00 61.98 59.50 1ofi s VAL 112 Cb -0.03 -3.29 0.03 0.00 0.56 0.00 0.00 36.38 33.64 1ofi s VAL 112 CO 0.02 0.14 0.01 -0.69 -0.31 0.00 0.00 175.10 174.27 1ofi s VAL 113 N -1.40 0.14 0.12 1.32 1.01 -0.72 -4.98 120.40 115.89 1ofi s VAL 113 Ca 0.30 0.12 -0.12 0.00 0.00 0.00 0.00 61.98 62.28 1ofi s VAL 113 Cb -0.12 -0.26 -0.06 0.00 0.00 0.00 0.00 36.38 35.93 1ofi s VAL 113 CO 0.23 0.15 0.49 -1.10 0.00 0.00 0.00 175.10 174.86 1ofi s GLN 114 N 1.16 3.89 0.00 2.72 -0.21 -1.26 -2.22 119.66 123.73 1ofi s GLN 114 Ca -0.08 0.36 0.00 0.00 0.02 0.00 0.00 55.36 55.66 1ofi s GLN 114 Cb -0.13 -2.96 0.00 0.00 1.00 0.00 0.00 33.01 30.92 1ofi s GLN 114 CO -0.02 0.51 0.00 -2.30 -2.12 0.00 0.00 175.29 171.36 1ofi n PRO 115 N 0.84 0.87 0.00 2.91 -0.02 -1.26 -5.03 135.00 133.31 1ofi n PRO 115 Ca -0.06 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.42 1ofi n PRO 115 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.00 1ofi n PRO 115 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1ofi n GLU 116 N -0.09 0.00 0.00 -0.52 1.02 -1.26 -5.00 120.64 114.79 1ofi n GLU 116 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1ofi n GLU 116 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1ofi n GLU 116 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1ofi n GLU 117 N -1.11 0.00 0.00 3.49 -0.58 -1.26 -4.77 120.64 116.41 1ofi n GLU 117 Ca 0.00 0.00 0.05 0.00 -0.42 0.00 0.00 57.16 56.79 1ofi n GLU 117 Cb 0.00 -0.36 0.28 0.00 -0.57 0.00 0.00 31.44 30.79 1ofi n GLU 117 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 1ofi n ASP 118 N -1.74 0.00 -2.12 1.62 5.68 -1.26 -4.80 116.55 113.93 1ofi n ASP 118 Ca 0.00 -0.40 -0.12 0.00 -0.50 0.00 0.00 54.79 53.77 1ofi n ASP 118 Cb 0.00 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 39.96 1ofi n ASP 118 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1ofi n GLN 119 N -0.92 -1.97 -3.97 0.11 1.13 -1.26 -4.58 117.38 105.93 1ofi n GLN 119 Ca 0.07 0.60 -0.31 0.00 -1.94 0.00 0.00 57.00 55.42 1ofi n GLN 119 Cb 0.03 -5.09 -0.05 0.00 0.11 0.00 0.00 30.24 25.24 1ofi n GLN 119 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1ofi s ILE 120 N -2.41 5.10 -0.08 5.09 1.01 -1.26 -3.47 121.20 125.17 1ofi s ILE 120 Ca 0.00 -0.50 -0.11 0.00 0.00 0.00 0.00 60.65 60.03 1ofi s ILE 120 Cb 0.00 -3.47 0.03 0.00 0.01 0.00 0.00 42.46 39.03 1ofi s ILE 120 CO 0.00 0.15 0.30 -0.76 0.00 0.00 0.00 174.94 174.62 1ofi s LEU 121 N -2.43 0.89 -0.21 2.97 1.43 -0.84 -4.66 118.68 115.83 1ofi s LEU 121 Ca 0.33 0.43 -0.09 0.00 -1.03 0.00 0.00 54.13 53.76 1ofi s LEU 121 Cb -0.13 1.08 0.08 0.00 0.03 0.00 0.00 46.19 47.25 1ofi s LEU 121 CO 0.25 -0.21 0.47 0.00 0.23 0.00 0.00 176.35 177.09 1ofi s ALA 122 N -0.31 -1.28 0.24 4.21 0.00 -1.26 0.35 121.76 123.72 1ofi s ALA 122 Ca -0.04 1.70 0.11 0.00 0.00 0.00 0.00 51.96 53.73 1ofi s ALA 122 Cb -0.03 -1.21 -0.05 0.00 0.00 0.00 0.00 23.12 21.83 1ofi s ALA 122 CO 0.01 -0.52 -0.21 0.96 0.00 0.00 0.00 175.76 176.00 1ofi s ILE 123 N 2.02 2.35 0.00 0.00 -4.36 -0.51 -4.58 121.20 116.12 1ofi s ILE 123 Ca -0.06 -2.24 0.00 0.00 -0.26 0.00 0.00 60.65 58.09 1ofi s ILE 123 Cb -0.10 -2.20 0.00 0.00 1.25 0.00 0.00 42.46 41.42 1ofi s ILE 123 CO -0.14 -0.31 0.00 0.61 0.24 0.00 0.00 174.94 175.34 1ofi n GLY 124 N -0.24 1.75 0.29 6.27 0.00 -1.26 -2.23 105.19 109.78 1ofi n GLY 124 Ca -0.08 -2.02 0.05 0.00 0.00 0.00 0.00 46.02 43.98 1ofi n GLY 124 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ofi h SER 125 N 0.00 0.46 -0.37 1.61 4.64 -1.98 0.33 113.55 118.24 1ofi h SER 125 Ca 0.00 0.09 -0.07 0.00 -0.47 0.00 0.00 61.79 61.34 1ofi h SER 125 Cb 0.00 0.02 -0.04 0.00 -0.31 0.00 0.00 62.40 62.07 1ofi h SER 125 CO 0.00 0.21 0.08 0.61 -0.87 0.00 0.00 176.83 176.86 1ofi n GLY 126 N -1.32 2.57 0.00 -0.77 0.00 0.07 -4.61 105.19 101.13 1ofi n GLY 126 Ca 0.15 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.64 1ofi n GLY 126 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ofi n GLY 127 N 0.17 -2.90 0.55 -0.02 0.00 0.12 -2.05 105.19 101.05 1ofi n GLY 127 Ca 0.20 0.00 0.38 0.00 0.00 0.00 0.00 46.02 46.60 1ofi n GLY 127 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1ofi h ASN 128 N 0.00 0.06 0.39 1.61 2.35 -1.81 0.43 115.58 118.60 1ofi h ASN 128 Ca 0.00 0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.75 1ofi h ASN 128 Cb 0.00 0.01 0.00 0.00 0.05 0.00 0.00 38.32 38.38 1ofi h ASN 128 CO 0.00 -0.00 -0.19 1.88 -1.65 0.00 0.00 177.43 177.47 1ofi h TYR 129 N 0.04 -0.48 -0.55 1.19 0.99 -1.85 0.13 116.97 116.44 1ofi h TYR 129 Ca 0.65 -0.01 -0.07 0.00 2.00 0.00 0.00 58.73 61.31 1ofi h TYR 129 Cb 2.51 0.16 -0.02 0.00 1.00 0.00 0.00 36.73 40.37 1ofi h TYR 129 CO -0.00 -0.22 0.07 0.00 -0.00 0.00 0.00 178.16 178.01 1ofi h ALA 130 N -0.10 1.09 -2.87 3.88 0.00 -0.06 -3.08 119.26 118.12 1ofi h ALA 130 Ca -0.05 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1ofi h ALA 130 Cb 0.47 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1ofi h ALA 130 CO 0.09 0.59 0.00 -0.11 0.00 0.00 0.00 179.25 179.82 1ofi n LEU 131 N -4.23 0.00 -0.05 0.00 7.94 0.12 -0.90 117.00 119.88 1ofi n LEU 131 Ca 0.04 0.52 -0.01 0.00 -1.11 0.00 0.00 56.01 55.44 1ofi n LEU 131 Cb 0.27 -0.02 -0.01 0.00 0.53 0.00 0.00 43.42 44.19 1ofi n LEU 131 CO 0.41 -0.02 0.17 -1.20 -1.11 0.00 0.00 177.39 175.64 1ofi n SER 132 N -0.77 -0.12 0.00 1.96 7.64 0.41 0.27 113.62 123.02 1ofi n SER 132 Ca 0.00 0.43 0.00 0.00 1.01 0.00 0.00 58.87 60.31 1ofi n SER 132 Cb 0.00 -0.14 0.00 0.00 -1.01 0.00 0.00 64.21 63.06 1ofi n SER 132 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ofi n ALA 133 N -2.80 0.00 -0.22 -0.43 0.00 -1.15 -0.22 120.51 115.69 1ofi n ALA 133 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 1ofi n ALA 133 Cb 0.03 0.35 -0.09 0.00 0.00 0.00 0.00 19.45 19.74 1ofi n ALA 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ofi h ALA 134 N -1.37 -0.68 -1.12 0.00 0.00 0.17 0.48 119.26 116.74 1ofi h ALA 134 Ca 0.00 0.04 0.34 0.00 0.00 0.00 0.00 54.91 55.29 1ofi h ALA 134 Cb 0.00 1.19 -0.13 0.00 0.00 0.00 0.00 17.79 18.86 1ofi h ALA 134 CO 0.00 -0.98 0.69 0.00 0.00 0.00 0.00 179.25 178.96 1ofi h ARG 135 N -0.25 0.26 0.00 0.00 2.47 0.51 -2.13 114.38 115.24 1ofi h ARG 135 Ca 0.10 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.80 1ofi h ARG 135 Cb 0.51 -0.06 0.00 0.00 -1.65 0.00 0.00 29.97 28.77 1ofi h ARG 135 CO -0.68 0.17 -0.02 0.00 0.56 0.00 0.00 179.97 180.01 1ofi h ALA 136 N 1.70 0.00 0.00 0.04 0.00 0.21 -3.26 119.26 117.95 1ofi h ALA 136 Ca 0.72 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.61 1ofi h ALA 136 Cb 1.93 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.73 1ofi h ALA 136 CO -0.45 0.02 0.00 -0.11 0.00 0.00 0.00 179.25 178.71 1ofi n LEU 137 N -4.68 0.95 0.00 0.00 7.94 0.14 -1.49 117.00 119.86 1ofi n LEU 137 Ca -0.00 -0.43 0.00 0.00 -1.11 0.00 0.00 56.01 54.47 1ofi n LEU 137 Cb 0.01 -0.20 0.00 0.00 0.53 0.00 0.00 43.42 43.76 1ofi n LEU 137 CO 0.00 0.18 0.00 0.52 -1.11 0.00 0.00 177.39 176.98 1ofi n VAL 138 N 1.87 0.00 1.86 1.96 0.31 -1.04 -4.64 118.33 118.66 1ofi n VAL 138 Ca 0.00 0.00 0.04 0.00 -0.01 0.00 0.00 64.34 64.37 1ofi n VAL 138 Cb 0.09 -0.37 0.21 0.00 -0.91 0.00 0.00 33.84 32.86 1ofi n VAL 138 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1ofi n GLU 139 N -2.26 1.11 -0.87 5.55 1.02 -0.55 -3.57 120.64 121.06 1ofi n GLU 139 Ca 0.00 -0.16 -0.01 0.00 -0.02 0.00 0.00 57.16 56.96 1ofi n GLU 139 Cb 0.00 -1.13 -0.02 0.00 -0.02 0.00 0.00 31.44 30.27 1ofi n GLU 139 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1ofi n ASN 140 N -0.46 -0.12 -3.87 1.62 3.02 -1.16 -5.11 115.26 109.18 1ofi n ASN 140 Ca 0.06 -1.72 -0.09 0.00 -0.03 0.00 0.00 54.58 52.81 1ofi n ASN 140 Cb 0.06 -0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.19 1ofi n ASN 140 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1ofi s THR 141 N 0.00 0.01 -0.48 3.41 2.01 -1.23 -4.99 115.64 114.37 1ofi s THR 141 Ca 0.07 -1.08 0.04 0.00 0.31 0.00 0.00 61.69 61.03 1ofi s THR 141 Cb 0.08 -1.91 0.04 0.00 0.01 0.00 0.00 72.50 70.72 1ofi s THR 141 CO -0.04 -0.05 0.66 -0.62 -0.69 0.00 0.00 174.62 173.89 1ofi n GLU 142 N -0.38 -0.16 -1.67 4.92 -0.58 -1.26 -4.74 120.64 116.77 1ofi n GLU 142 Ca -0.05 -0.82 -0.44 0.00 -0.42 0.00 0.00 57.16 55.43 1ofi n GLU 142 Cb 0.61 -1.08 -0.02 0.00 -0.57 0.00 0.00 31.44 30.39 1ofi n GLU 142 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1ofi n LEU 143 N 0.19 3.09 -4.67 -4.62 4.77 -1.26 -4.94 117.00 109.56 1ofi n LEU 143 Ca 0.02 1.17 -0.30 0.00 -0.03 0.00 0.00 56.01 56.88 1ofi n LEU 143 Cb 0.12 -1.43 0.16 0.00 -2.33 0.00 0.00 43.42 39.94 1ofi n LEU 143 CO 0.02 -0.62 0.65 -0.55 -1.33 0.00 0.00 177.39 175.56 1ofi s SER 144 N -0.06 2.98 0.21 -1.43 0.15 -1.26 -4.67 113.70 109.61 1ofi s SER 144 Ca 0.62 1.68 -0.09 0.00 0.70 0.00 0.00 55.95 58.85 1ofi s SER 144 Cb -0.63 -2.31 0.24 0.00 -1.71 0.00 0.00 66.02 61.61 1ofi s SER 144 CO 0.56 -2.98 1.80 0.00 1.20 0.00 0.00 173.24 173.83 1ofi h ALA 145 N -1.78 0.88 -0.86 5.45 0.00 -1.90 -1.12 119.26 119.93 1ofi h ALA 145 Ca -0.50 0.02 0.16 0.00 0.00 0.00 0.00 54.91 54.59 1ofi h ALA 145 Cb 1.28 -0.11 -0.10 0.00 0.00 0.00 0.00 17.79 18.87 1ofi h ALA 145 CO 0.51 0.03 0.43 1.25 0.00 0.00 0.00 179.25 181.47 1ofi h HIS 146 N 0.66 0.75 0.25 0.00 -0.00 -1.91 0.73 115.15 115.63 1ofi h HIS 146 Ca 0.30 0.04 -0.01 0.00 -0.00 0.00 0.00 60.37 60.69 1ofi h HIS 146 Cb 0.20 -0.20 0.00 0.00 -0.00 0.00 0.00 27.41 27.41 1ofi h HIS 146 CO -0.08 0.15 -0.12 0.93 -0.00 0.00 0.00 177.93 178.81 1ofi h GLU 147 N 0.60 -0.32 -0.96 5.26 5.08 -1.70 -2.22 114.58 120.32 1ofi h GLU 147 Ca 0.48 0.02 0.13 0.00 -1.00 0.00 0.00 59.36 58.99 1ofi h GLU 147 Cb 0.71 0.07 -0.14 0.00 0.50 0.00 0.00 28.75 29.88 1ofi h GLU 147 CO -0.38 -0.21 -0.42 -0.89 -1.00 0.00 0.00 179.01 176.10 1ofi n ILE 148 N -3.72 -0.54 0.18 3.13 5.41 -0.50 0.10 119.36 123.42 1ofi n ILE 148 Ca -0.04 2.27 -0.16 0.00 1.00 0.00 0.00 62.75 65.82 1ofi n ILE 148 Cb 0.13 -2.95 -0.09 0.00 -0.71 0.00 0.00 39.64 36.02 1ofi n ILE 148 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 1ofi h VAL 149 N 0.00 0.00 -0.85 1.39 2.07 -0.97 0.47 116.25 118.36 1ofi h VAL 149 Ca 0.29 0.00 0.22 0.00 0.82 0.00 0.00 66.70 68.03 1ofi h VAL 149 Cb 0.53 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 30.15 1ofi h VAL 149 CO -0.94 0.00 0.11 -0.08 0.02 0.00 0.00 177.57 176.68 1ofi h GLU 150 N -0.82 0.13 -0.20 1.57 4.22 0.39 0.19 114.58 120.07 1ofi h GLU 150 Ca -0.03 -0.01 -0.10 0.00 0.08 0.00 0.00 59.36 59.30 1ofi h GLU 150 Cb 0.76 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.98 1ofi h GLU 150 CO -0.18 0.09 -0.28 0.87 -2.18 0.00 0.00 179.01 177.33 1ofi h LYS 151 N 0.13 0.54 0.02 1.92 1.57 0.18 -2.77 116.57 118.15 1ofi h LYS 151 Ca 0.51 -0.32 -0.00 0.00 -1.87 0.00 0.00 60.65 58.97 1ofi h LYS 151 Cb 0.99 0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.33 1ofi h LYS 151 CO -0.71 0.92 -0.01 0.77 -0.57 0.00 0.00 179.45 179.85 1ofi h SER 152 N 0.20 -0.02 -0.98 0.86 0.02 0.81 -1.72 113.55 112.72 1ofi h SER 152 Ca 0.02 -0.35 0.32 0.00 -0.84 0.00 0.00 61.79 60.94 1ofi h SER 152 Cb 0.86 0.00 -0.15 0.00 0.14 0.00 0.00 62.40 63.25 1ofi h SER 152 CO 0.07 0.34 0.50 -0.07 -1.14 0.00 0.00 176.83 176.53 1ofi h LEU 153 N -0.38 0.38 0.34 5.07 3.38 -0.73 0.56 115.31 123.94 1ofi h LEU 153 Ca -0.00 0.20 -0.02 0.00 0.09 0.00 0.00 57.88 58.16 1ofi h LEU 153 Cb 0.37 0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1ofi h LEU 153 CO 0.00 -0.19 -0.16 -0.09 0.09 0.00 0.00 178.44 178.09 1ofi h ARG 154 N 0.25 -0.44 -1.17 1.13 2.43 -1.27 -2.57 114.38 112.74 1ofi h ARG 154 Ca 0.72 0.03 0.43 0.00 -0.81 0.00 0.00 59.98 60.35 1ofi h ARG 154 Cb 1.66 0.10 -0.14 0.00 -0.42 0.00 0.00 29.97 31.17 1ofi h ARG 154 CO -0.65 -0.30 0.72 -0.89 -1.51 0.00 0.00 179.97 177.34 1ofi n ILE 155 N -4.41 -0.29 0.39 1.20 5.41 -0.10 0.73 119.36 122.30 1ofi n ILE 155 Ca -0.06 1.74 -0.16 0.00 1.00 0.00 0.00 62.75 65.28 1ofi n ILE 155 Cb 0.18 -2.85 -0.08 0.00 -0.71 0.00 0.00 39.64 36.18 1ofi n ILE 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1ofi h ALA 156 N 1.60 -1.01 -0.56 -1.39 0.00 0.09 -2.59 119.26 115.39 1ofi h ALA 156 Ca 0.81 -0.22 0.16 0.00 0.00 0.00 0.00 54.91 55.66 1ofi h ALA 156 Cb 2.46 0.39 -0.02 0.00 0.00 0.00 0.00 17.79 20.62 1ofi h ALA 156 CO -0.53 -0.95 0.58 0.78 0.00 0.00 0.00 179.25 179.14 1ofi h GLY 157 N -1.26 0.00 1.11 0.00 0.00 0.74 0.85 103.07 104.52 1ofi h GLY 157 Ca -0.10 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.13 1ofi h GLY 157 CO 0.17 0.00 0.02 -0.55 0.00 0.00 0.00 176.54 176.18 1ofi h ASP 158 N 0.00 1.04 0.07 0.19 3.45 -0.60 -3.32 116.42 117.25 1ofi h ASP 158 Ca 0.27 -0.28 -0.30 0.00 0.43 0.00 0.00 57.03 57.15 1ofi h ASP 158 Cb 1.42 -0.28 -0.02 0.00 -0.56 0.00 0.00 39.33 39.89 1ofi h ASP 158 CO -0.00 1.08 -1.60 0.40 -1.57 0.00 0.00 179.24 177.54 1ofi h ILE 159 N 0.98 0.80 -3.37 0.35 2.04 0.82 -3.46 117.51 115.67 1ofi h ILE 159 Ca 0.18 -2.28 -0.60 0.00 1.00 0.00 0.00 64.86 63.16 1ofi h ILE 159 Cb 0.53 2.41 -0.09 0.00 -0.74 0.00 0.00 36.82 38.92 1ofi h ILE 159 CO 0.03 0.62 0.44 0.00 0.00 0.00 0.00 178.15 179.24 1ofi h VAL 161 N 5.54 0.62 -0.06 0.00 -1.51 -1.88 -1.85 116.25 117.10 1ofi h VAL 161 Ca -0.24 -0.45 0.00 0.00 -1.23 0.00 0.00 66.70 64.78 1ofi h VAL 161 Cb 1.09 1.28 0.00 0.00 -2.13 0.00 0.00 31.29 31.54 1ofi h VAL 161 CO 0.88 0.10 0.00 0.49 -1.23 0.00 0.00 177.57 177.82 1ofi n PHE 162 N -3.75 0.07 -4.53 5.19 3.72 -1.26 -4.78 117.46 112.13 1ofi n PHE 162 Ca -0.02 -0.04 -0.31 0.00 -0.05 0.00 0.00 57.45 57.04 1ofi n PHE 162 Cb 0.21 0.00 -0.17 0.00 -0.94 0.00 0.00 39.48 38.59 1ofi n PHE 162 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 1ofi s THR 163 N -1.93 1.77 0.25 4.37 2.01 -0.70 -0.70 115.64 120.73 1ofi s THR 163 Ca 0.35 -0.81 0.02 0.00 0.31 0.00 0.00 61.69 61.57 1ofi s THR 163 Cb 0.18 -1.59 0.05 0.00 0.01 0.00 0.00 72.50 71.14 1ofi s THR 163 CO 0.29 0.49 0.35 -0.46 -0.69 0.00 0.00 174.62 174.60 1ofi n ASN 164 N 4.18 0.67 -0.53 3.53 2.04 -1.26 -4.36 115.26 119.52 1ofi n ASN 164 Ca -0.19 -1.52 0.11 0.00 -0.44 0.00 0.00 54.58 52.54 1ofi n ASN 164 Cb 0.51 -0.21 0.02 0.00 -2.53 0.00 0.00 39.78 37.58 1ofi n ASN 164 CO 0.00 0.00 0.00 0.35 -0.44 0.00 0.00 177.26 177.17 1ofi n THR 165 N -1.72 0.00 -2.25 5.53 -2.24 -1.26 -4.60 114.28 107.74 1ofi n THR 165 Ca 0.06 -0.28 -0.32 0.00 -2.27 0.00 0.00 64.05 61.24 1ofi n THR 165 Cb 0.23 1.24 -0.04 0.00 -2.10 0.00 0.00 70.33 69.66 1ofi n THR 165 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1ofi s ASN 166 N -2.43 5.67 0.55 3.42 0.01 -1.26 -4.95 114.94 115.95 1ofi s ASN 166 Ca 0.20 -0.97 -0.08 0.00 -0.71 0.00 0.00 52.86 51.29 1ofi s ASN 166 Cb 0.18 -2.56 -0.04 0.00 0.41 0.00 0.00 41.25 39.24 1ofi s ASN 166 CO 0.54 -2.26 0.90 -0.36 -1.51 0.00 0.00 177.10 174.41 1ofi s PHE 167 N 8.09 3.59 -0.20 2.20 2.99 -1.26 -2.02 117.98 131.37 1ofi s PHE 167 Ca 0.61 1.05 -0.04 0.00 0.00 0.00 0.00 56.93 58.55 1ofi s PHE 167 Cb -0.04 -2.51 0.09 0.00 0.00 0.00 0.00 43.02 40.56 1ofi s PHE 167 CO -0.04 -0.47 0.22 0.99 -0.00 0.00 0.00 175.22 175.91 1ofi s THR 168 N -2.94 -0.31 -0.04 0.64 2.01 -0.31 -4.97 115.64 109.72 1ofi s THR 168 Ca 0.51 -0.12 0.06 0.00 0.31 0.00 0.00 61.69 62.45 1ofi s THR 168 Cb -0.11 -0.68 -0.01 0.00 0.01 0.00 0.00 72.50 71.72 1ofi s THR 168 CO 0.49 -0.21 -0.21 -0.63 -0.69 0.00 0.00 174.62 173.37 1ofi s ILE 169 N 2.32 1.72 -0.05 1.82 1.01 -1.26 -1.64 121.20 125.12 1ofi s ILE 169 Ca 0.07 -0.90 0.03 0.00 0.00 0.00 0.00 60.65 59.85 1ofi s ILE 169 Cb -0.16 -1.46 0.01 0.00 0.01 0.00 0.00 42.46 40.86 1ofi s ILE 169 CO -0.12 0.49 -0.13 -1.61 0.00 0.00 0.00 174.94 173.57 1ofi s GLU 170 N -0.20 1.57 0.02 2.79 0.41 -0.99 -5.00 118.70 117.31 1ofi s GLU 170 Ca -0.00 -0.45 0.08 0.00 -0.41 0.00 0.00 54.97 54.19 1ofi s GLU 170 Cb -0.11 -1.34 -0.03 0.00 -1.78 0.00 0.00 34.13 30.87 1ofi s GLU 170 CO 0.02 0.11 -0.23 -1.83 -0.49 0.00 0.00 175.26 172.84 1ofi s GLU 171 N 0.37 1.99 -0.61 1.61 -1.05 -1.26 -2.52 118.70 117.22 1ofi s GLU 171 Ca -0.09 -1.01 -0.27 0.00 -0.15 0.00 0.00 54.97 53.46 1ofi s GLU 171 Cb -0.13 -2.09 0.03 0.00 -0.44 0.00 0.00 34.13 31.51 1ofi s GLU 171 CO 0.03 0.54 1.16 -1.17 0.95 0.00 0.00 175.26 176.76 1ofi s LEU 172 N -1.15 3.55 0.34 1.83 0.20 -0.63 -4.87 118.68 117.95 1ofi s LEU 172 Ca 0.12 -0.14 0.15 0.00 0.69 0.00 0.00 54.13 54.95 1ofi s LEU 172 Cb -0.10 -2.95 1.14 0.00 -0.43 0.00 0.00 46.19 43.85 1ofi s LEU 172 CO 0.02 -1.51 1.55 -0.81 -0.29 0.00 0.00 176.35 175.31 1ofi n PRO 173 N 8.43 -0.07 0.00 0.98 -0.04 -1.26 -4.30 135.00 138.74 1ofi n PRO 173 Ca 0.06 1.40 0.00 0.00 -0.04 0.00 0.00 63.50 64.91 1ofi n PRO 173 Cb 0.49 -2.41 0.00 0.00 -0.04 0.00 0.00 33.50 31.54 1ofi n PRO 173 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73