#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fat n ASN 2 N 0.00 -1.99 -4.87 6.43 4.05 -1.04 -4.93 115.26 112.91 1fat n ASN 2 Ca 0.00 -3.11 -0.31 0.00 0.45 0.00 0.00 54.58 51.62 1fat n ASN 2 Cb 0.00 1.08 0.00 0.00 1.23 0.00 0.00 39.78 42.09 1fat n ASN 2 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 177.26 172.40 1fat s ASP 3 N -1.46 6.29 -0.08 1.20 1.01 -1.26 -3.77 116.67 118.60 1fat s ASP 3 Ca 0.33 1.37 -0.21 0.00 0.71 0.00 0.00 52.55 54.75 1fat s ASP 3 Cb 0.20 -2.44 0.05 0.00 1.01 0.00 0.00 42.92 41.74 1fat s ASP 3 CO -0.20 -0.79 0.49 -0.51 0.21 0.00 0.00 175.17 174.37 1fat s ILE 4 N -3.04 0.02 -0.24 0.77 1.10 -0.90 -5.01 121.20 113.91 1fat s ILE 4 Ca 0.54 -0.19 -0.26 0.00 -0.51 0.00 0.00 60.65 60.23 1fat s ILE 4 Cb -0.11 -0.77 0.09 0.00 0.15 0.00 0.00 42.46 41.83 1fat s ILE 4 CO 0.49 -0.10 0.86 -0.47 -2.11 0.00 0.00 174.94 173.61 1fat s TYR 5 N -0.83 -0.62 0.17 3.50 5.04 -1.26 -1.96 117.35 121.39 1fat s TYR 5 Ca -0.09 1.42 -0.19 0.00 -2.44 0.00 0.00 57.07 55.78 1fat s TYR 5 Cb -0.03 0.34 0.04 0.00 0.35 0.00 0.00 41.96 42.66 1fat s TYR 5 CO 0.05 -0.35 0.52 -0.59 -1.34 0.00 0.00 175.55 173.84 1fat s PHE 6 N -0.01 -0.26 -0.28 4.97 -0.12 -0.83 -5.00 117.98 116.46 1fat s PHE 6 Ca -0.00 -0.05 -0.03 0.00 -0.05 0.00 0.00 56.93 56.80 1fat s PHE 6 Cb -0.04 0.42 0.16 0.00 -0.63 0.00 0.00 43.02 42.93 1fat s PHE 6 CO -0.00 -0.86 0.54 1.21 -0.05 0.00 0.00 175.22 176.05 1fat s ASN 7 N -2.82 -0.88 -0.29 1.98 2.47 -1.26 -2.04 114.94 112.09 1fat s ASN 7 Ca 0.05 0.80 -0.09 0.00 0.42 0.00 0.00 52.86 54.05 1fat s ASN 7 Cb -0.00 1.87 -0.02 0.00 -1.45 0.00 0.00 41.25 41.65 1fat s ASN 7 CO -0.07 -0.26 0.12 -0.36 -3.72 0.00 0.00 177.10 172.81 1fat s PHE 8 N 2.77 3.15 -2.66 0.43 0.08 -0.04 -4.91 117.98 116.79 1fat s PHE 8 Ca 0.15 -0.49 0.25 0.00 0.12 0.00 0.00 56.93 56.95 1fat s PHE 8 Cb -0.15 -2.31 0.59 0.00 -0.57 0.00 0.00 43.02 40.59 1fat s PHE 8 CO -0.19 -0.41 1.49 1.04 -0.10 0.00 0.00 175.22 177.05 1fat n GLN 9 N 4.96 2.04 -3.64 0.44 6.02 -1.26 -2.21 117.38 123.74 1fat n GLN 9 Ca -0.15 -1.53 -0.07 0.00 -0.01 0.00 0.00 57.00 55.25 1fat n GLN 9 Cb 0.50 -1.47 -0.07 0.00 1.02 0.00 0.00 30.24 30.23 1fat n GLN 9 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 1fat s ARG 10 N -1.91 0.56 0.32 -1.09 1.70 -1.26 -4.81 118.95 112.46 1fat s ARG 10 Ca 0.33 0.85 -0.09 0.00 -0.47 0.00 0.00 55.73 56.36 1fat s ARG 10 Cb 0.20 0.17 -0.06 0.00 -0.57 0.00 0.00 34.95 34.69 1fat s ARG 10 CO 0.31 -0.10 0.65 -0.06 -1.08 0.00 0.00 175.30 175.02 1fat s PHE 11 N 1.08 3.46 -0.07 5.89 0.40 0.13 -5.04 117.98 123.82 1fat s PHE 11 Ca -0.06 0.88 -0.06 0.00 -0.60 0.00 0.00 56.93 57.09 1fat s PHE 11 Cb -0.04 -2.29 0.02 0.00 0.51 0.00 0.00 43.02 41.21 1fat s PHE 11 CO -0.13 0.08 0.19 1.21 0.70 0.00 0.00 175.22 177.27 1fat s ASN 12 N -2.95 -0.20 0.00 1.36 3.84 -1.26 -4.38 114.94 111.36 1fat s ASN 12 Ca 0.48 0.39 0.16 0.00 0.21 0.00 0.00 52.86 54.10 1fat s ASN 12 Cb -0.11 0.37 0.90 0.00 -0.55 0.00 0.00 41.25 41.87 1fat s ASN 12 CO 0.28 -0.08 1.44 -1.84 -2.79 0.00 0.00 177.10 174.11 1fat n GLU 13 N 3.14 0.37 0.17 0.43 0.00 -1.26 -3.72 120.64 119.77 1fat n GLU 13 Ca -0.14 0.07 0.05 0.00 0.00 0.00 0.00 57.16 57.14 1fat n GLU 13 Cb 0.58 -1.50 0.20 0.00 0.00 0.00 0.00 31.44 30.72 1fat n GLU 13 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.13 178.92 1fat h THR 14 N 0.00 0.79 -0.31 3.84 1.35 -2.03 -3.16 112.91 113.38 1fat h THR 14 Ca 0.00 -1.79 -0.15 0.00 -0.55 0.00 0.00 66.41 63.92 1fat h THR 14 Cb 0.08 2.16 -0.09 0.00 -1.73 0.00 0.00 68.15 68.57 1fat h THR 14 CO 0.00 0.40 -0.11 -0.46 -0.25 0.00 0.00 175.52 175.09 1fat n ASN 15 N -3.33 2.49 -4.19 5.36 6.94 -1.24 -4.99 115.26 116.29 1fat n ASN 15 Ca 0.01 -3.73 -0.21 0.00 -0.02 0.00 0.00 54.58 50.63 1fat n ASN 15 Cb 0.61 -0.62 -0.13 0.00 -2.36 0.00 0.00 39.78 37.29 1fat n ASN 15 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1fat s LEU 16 N -3.22 2.25 -0.28 -4.53 1.02 -1.20 -1.73 118.68 111.00 1fat s LEU 16 Ca 0.44 -0.58 -0.08 0.00 0.02 0.00 0.00 54.13 53.92 1fat s LEU 16 Cb 0.40 -0.65 -0.01 0.00 0.02 0.00 0.00 46.19 45.94 1fat s LEU 16 CO -0.00 -0.00 0.10 -0.63 0.02 0.00 0.00 176.35 175.84 1fat s ILE 17 N -1.10 4.33 -0.11 -0.59 1.01 0.49 -4.82 121.20 120.41 1fat s ILE 17 Ca 0.01 -0.38 -0.02 0.00 0.00 0.00 0.00 60.65 60.27 1fat s ILE 17 Cb -0.09 -3.14 -0.03 0.00 0.01 0.00 0.00 42.46 39.21 1fat s ILE 17 CO 0.02 0.19 -0.02 -0.76 0.00 0.00 0.00 174.94 174.37 1fat s LEU 18 N 1.59 3.42 -0.03 2.97 1.43 -1.26 -1.21 118.68 125.59 1fat s LEU 18 Ca 0.05 0.04 0.05 0.00 -1.03 0.00 0.00 54.13 53.24 1fat s LEU 18 Cb -0.16 -1.79 -0.01 0.00 0.03 0.00 0.00 46.19 44.26 1fat s LEU 18 CO 0.04 0.31 -0.19 -1.10 0.23 0.00 0.00 176.35 175.64 1fat s GLN 19 N -0.47 1.73 6.77 1.70 -0.21 0.30 -4.98 119.66 124.51 1fat s GLN 19 Ca 0.08 -0.68 0.00 0.00 0.02 0.00 0.00 55.36 54.78 1fat s GLN 19 Cb -0.12 -1.59 0.00 0.00 1.00 0.00 0.00 33.01 32.30 1fat s GLN 19 CO 0.02 0.35 0.00 0.54 -2.12 0.00 0.00 175.29 174.09 1fat n ARG 20 N 2.82 0.00 0.00 2.91 5.12 -1.26 -2.02 116.66 124.23 1fat n ARG 20 Ca -0.16 0.00 0.10 0.00 -1.93 0.00 0.00 57.85 55.85 1fat n ARG 20 Cb 0.53 0.00 0.54 0.00 -1.16 0.00 0.00 32.46 32.37 1fat n ARG 20 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 1fat n ASP 21 N 4.66 0.00 -4.75 0.55 8.00 -0.78 -4.86 116.55 119.36 1fat n ASP 21 Ca 0.00 -0.36 -0.38 0.00 0.71 0.00 0.00 54.79 54.76 1fat n ASP 21 Cb 0.00 -0.12 0.03 0.00 -0.02 0.00 0.00 41.12 41.01 1fat n ASP 21 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1fat s ALA 22 N -2.23 2.84 -0.00 2.24 0.00 -1.12 -4.33 121.76 119.14 1fat s ALA 22 Ca 0.25 1.23 -0.28 0.00 0.00 0.00 0.00 51.96 53.16 1fat s ALA 22 Cb 0.13 -3.52 0.10 0.00 0.00 0.00 0.00 23.12 19.83 1fat s ALA 22 CO 0.25 -1.21 0.86 -1.54 0.00 0.00 0.00 175.76 174.12 1fat s SER 23 N -1.08 -0.40 -0.18 0.00 1.04 -0.58 -4.74 113.70 107.77 1fat s SER 23 Ca 0.70 0.06 -0.04 0.00 0.48 0.00 0.00 55.95 57.15 1fat s SER 23 Cb -0.37 0.40 -0.02 0.00 0.10 0.00 0.00 66.02 66.13 1fat s SER 23 CO 0.44 -0.63 -0.02 -0.69 0.98 0.00 0.00 173.24 173.32 1fat s VAL 24 N -2.94 3.88 0.86 5.02 1.01 -1.26 0.18 120.40 127.15 1fat s VAL 24 Ca 0.03 -0.35 -0.12 0.00 0.00 0.00 0.00 61.98 61.55 1fat s VAL 24 Cb -0.01 -2.73 0.11 0.00 0.00 0.00 0.00 36.38 33.75 1fat s VAL 24 CO -0.08 0.45 1.12 -0.94 0.00 0.00 0.00 175.10 175.65 1fat s SER 25 N 0.79 3.90 0.62 3.32 1.04 0.07 -4.87 113.70 118.57 1fat s SER 25 Ca -0.00 1.15 0.34 0.00 0.48 0.00 0.00 55.95 57.92 1fat s SER 25 Cb -0.14 -1.80 1.96 0.00 0.10 0.00 0.00 66.02 66.14 1fat s SER 25 CO 0.02 -2.33 2.22 0.77 0.98 0.00 0.00 173.24 174.90 1fat h SER 26 N -1.34 0.00 -0.37 7.02 4.64 -1.97 0.46 113.55 121.98 1fat h SER 26 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 1fat h SER 26 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 1fat h SER 26 CO 0.60 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 175.02 1fat n SER 27 N -3.50 2.35 -1.78 4.97 3.41 -1.26 -4.95 113.62 112.86 1fat n SER 27 Ca -0.02 -1.92 -0.11 0.00 -0.26 0.00 0.00 58.87 56.56 1fat n SER 27 Cb 0.17 -0.25 0.03 0.00 -0.26 0.00 0.00 64.21 63.90 1fat n SER 27 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1fat n GLY 28 N 1.23 0.23 3.56 5.00 0.00 0.16 -4.84 105.19 110.53 1fat n GLY 28 Ca 0.16 -0.29 -0.34 0.00 0.00 0.00 0.00 46.02 45.55 1fat n GLY 28 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1fat s GLN 29 N -5.43 2.90 -0.38 1.61 -0.21 -1.25 -0.69 119.66 116.20 1fat s GLN 29 Ca 0.23 -0.55 -0.28 0.00 0.02 0.00 0.00 55.36 54.77 1fat s GLN 29 Cb -0.10 -2.63 0.02 0.00 1.00 0.00 0.00 33.01 31.30 1fat s GLN 29 CO 0.28 0.58 1.07 -1.17 -2.12 0.00 0.00 175.29 173.94 1fat s LEU 30 N -0.59 3.84 -0.40 2.90 2.96 -0.53 -0.75 118.68 126.11 1fat s LEU 30 Ca 0.09 0.78 -0.09 0.00 -0.22 0.00 0.00 54.13 54.69 1fat s LEU 30 Cb -0.12 -3.50 0.07 0.00 0.50 0.00 0.00 46.19 43.14 1fat s LEU 30 CO 0.02 -1.00 0.23 -0.13 -1.32 0.00 0.00 176.35 174.14 1fat s ARG 31 N 3.89 2.59 0.43 1.98 0.52 0.13 -1.18 118.95 127.31 1fat s ARG 31 Ca 0.45 -1.41 0.20 0.00 -0.52 0.00 0.00 55.73 54.46 1fat s ARG 31 Cb -0.10 -3.72 0.96 0.00 0.52 0.00 0.00 34.95 32.61 1fat s ARG 31 CO 0.21 -0.90 1.88 -0.07 0.02 0.00 0.00 175.30 176.44 1fat h LEU 32 N 8.36 0.00 -8.52 2.53 3.38 -1.51 -1.53 115.31 118.02 1fat h LEU 32 Ca -0.23 0.00 -0.40 0.00 0.09 0.00 0.00 57.88 57.35 1fat h LEU 32 Cb 1.08 0.00 -0.19 0.00 0.09 0.00 0.00 40.66 41.64 1fat h LEU 32 CO 0.72 0.28 -0.76 0.42 0.09 0.00 0.00 178.44 179.19 1fat s THR 33 N -3.97 1.19 0.85 0.22 -4.23 -1.26 -2.63 115.64 105.82 1fat s THR 33 Ca -0.02 -1.57 -0.12 0.00 -1.18 0.00 0.00 61.69 58.80 1fat s THR 33 Cb 0.13 -1.36 0.11 0.00 1.34 0.00 0.00 72.50 72.72 1fat s THR 33 CO 0.66 -0.38 1.17 0.20 -0.54 0.00 0.00 174.62 175.73 1fat s ASN 34 N -2.22 3.38 0.05 3.99 0.01 -1.26 -4.75 114.94 114.14 1fat s ASN 34 Ca 0.05 2.23 0.08 0.00 -0.71 0.00 0.00 52.86 54.51 1fat s ASN 34 Cb -0.06 -2.57 -0.03 0.00 0.41 0.00 0.00 41.25 38.99 1fat s ASN 34 CO 0.02 -2.80 -0.21 -0.76 -1.51 0.00 0.00 177.10 171.84 1fat s LEU 35 N -6.12 2.46 -0.11 0.60 1.43 -1.26 -1.25 118.68 114.43 1fat s LEU 35 Ca 0.69 -0.50 0.08 0.00 -1.03 0.00 0.00 54.13 53.37 1fat s LEU 35 Cb -0.25 -1.43 0.43 0.00 0.03 0.00 0.00 46.19 44.97 1fat s LEU 35 CO 0.54 0.25 1.20 -0.46 0.23 0.00 0.00 176.35 178.10 1fat n ASN 36 N 1.54 3.30 0.00 2.29 6.94 0.65 -4.62 115.26 125.37 1fat n ASN 36 Ca -0.16 -2.41 0.00 0.00 -0.02 0.00 0.00 54.58 51.98 1fat n ASN 36 Cb 0.52 -0.54 0.00 0.00 -2.36 0.00 0.00 39.78 37.40 1fat n ASN 36 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1fat n GLY 37 N 0.48 2.79 0.12 4.83 0.00 -1.26 -4.70 105.19 107.45 1fat n GLY 37 Ca 0.15 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.21 1fat n GLY 37 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1fat n ASN 38 N 0.49 0.36 -0.22 1.61 5.03 -1.26 -4.77 115.26 116.50 1fat n ASN 38 Ca 0.00 -1.79 -0.02 0.00 0.87 0.00 0.00 54.58 53.63 1fat n ASN 38 Cb 0.00 -0.04 -0.01 0.00 -1.02 0.00 0.00 39.78 38.72 1fat n ASN 38 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1fat n GLY 39 N 0.71 0.47 3.53 7.41 0.00 -1.26 -5.02 105.19 111.04 1fat n GLY 39 Ca 0.07 -0.91 -0.32 0.00 0.00 0.00 0.00 46.02 44.86 1fat n GLY 39 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fat s GLU 40 N -2.83 2.49 0.08 1.61 0.41 -1.26 -4.88 118.70 114.31 1fat s GLU 40 Ca 0.00 -0.73 -0.33 0.00 -0.41 0.00 0.00 54.97 53.51 1fat s GLU 40 Cb 0.00 -2.43 -0.12 0.00 -1.78 0.00 0.00 34.13 29.81 1fat s GLU 40 CO 0.00 0.61 1.79 -2.30 -0.49 0.00 0.00 175.26 174.87 1fat n PRO 41 N 1.89 2.50 -2.23 0.39 -0.02 -1.26 0.24 135.00 136.50 1fat n PRO 41 Ca -0.16 0.91 -0.38 0.00 -2.02 0.00 0.00 63.50 61.85 1fat n PRO 41 Cb 0.52 -2.77 -0.01 0.00 -0.02 0.00 0.00 33.50 31.23 1fat n PRO 41 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1fat s ARG 42 N 2.67 3.83 0.30 -0.52 3.52 -0.38 -4.62 118.95 123.75 1fat s ARG 42 Ca 0.84 1.83 -0.27 0.00 -0.13 0.00 0.00 55.73 58.00 1fat s ARG 42 Cb -0.58 -2.49 -0.10 0.00 -1.56 0.00 0.00 34.95 30.22 1fat s ARG 42 CO 0.41 -0.51 0.96 0.08 -0.81 0.00 0.00 175.30 175.43 1fat s VAL 43 N -1.48 4.08 -1.18 7.11 1.01 -1.26 -3.86 120.40 124.82 1fat s VAL 43 Ca 0.62 1.84 0.00 0.00 0.00 0.00 0.00 61.98 64.44 1fat s VAL 43 Cb -0.30 -4.08 0.00 0.00 0.00 0.00 0.00 36.38 32.00 1fat s VAL 43 CO 0.37 0.26 0.00 0.61 0.00 0.00 0.00 175.10 176.34 1fat n GLY 44 N 0.88 -0.18 3.83 4.51 0.00 -0.50 -5.00 105.19 108.73 1fat n GLY 44 Ca 0.01 -0.31 -0.33 0.00 0.00 0.00 0.00 46.02 45.39 1fat n GLY 44 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1fat s SER 45 N -2.38 6.89 -0.11 1.61 0.15 -1.25 -4.87 113.70 113.73 1fat s SER 45 Ca 0.00 1.46 -0.05 0.00 0.70 0.00 0.00 55.95 58.07 1fat s SER 45 Cb 0.00 -2.45 0.06 0.00 -1.71 0.00 0.00 66.02 61.92 1fat s SER 45 CO 0.00 -0.23 0.24 -0.22 1.20 0.00 0.00 173.24 174.23 1fat s LEU 46 N -2.90 0.01 -0.04 3.45 0.20 -1.26 -1.59 118.68 116.55 1fat s LEU 46 Ca 0.56 0.53 -0.03 0.00 0.69 0.00 0.00 54.13 55.87 1fat s LEU 46 Cb -0.11 0.64 0.01 0.00 -0.43 0.00 0.00 46.19 46.31 1fat s LEU 46 CO 0.17 -0.21 0.10 -0.83 -0.29 0.00 0.00 176.35 175.28 1fat s GLY 47 N 1.96 -0.07 0.12 7.98 0.00 -0.74 -1.87 107.32 114.70 1fat s GLY 47 Ca -0.03 0.31 0.07 0.00 0.00 0.00 0.00 44.72 45.08 1fat s GLY 47 CO -0.08 0.31 -0.18 0.50 0.00 0.00 0.00 173.10 173.65 1fat s ARG 48 N 0.17 1.09 -0.11 2.90 0.52 -0.86 -1.93 118.95 120.73 1fat s ARG 48 Ca -0.01 -1.21 -0.06 0.00 -0.52 0.00 0.00 55.73 53.93 1fat s ARG 48 Cb -0.02 -1.18 0.04 0.00 0.52 0.00 0.00 34.95 34.31 1fat s ARG 48 CO -0.00 0.26 0.26 0.00 0.02 0.00 0.00 175.30 175.83 1fat s ALA 49 N -1.61 -0.61 0.11 2.13 0.00 -0.59 -0.54 121.76 120.66 1fat s ALA 49 Ca 0.08 0.99 0.04 0.00 0.00 0.00 0.00 51.96 53.07 1fat s ALA 49 Cb -0.08 -0.62 -0.04 0.00 0.00 0.00 0.00 23.12 22.39 1fat s ALA 49 CO 0.04 -0.19 -0.11 -0.06 0.00 0.00 0.00 175.76 175.45 1fat s PHE 50 N 1.06 1.16 0.24 0.00 0.08 -0.35 -0.81 117.98 119.37 1fat s PHE 50 Ca -0.08 -0.67 -0.30 0.00 0.12 0.00 0.00 56.93 56.00 1fat s PHE 50 Cb -0.09 -0.62 -0.09 0.00 -0.57 0.00 0.00 43.02 41.66 1fat s PHE 50 CO -0.07 0.04 1.19 -0.47 -0.10 0.00 0.00 175.22 175.80 1fat s TYR 51 N -2.66 3.41 0.32 0.36 5.04 -0.55 -0.38 117.35 122.91 1fat s TYR 51 Ca 0.09 1.51 0.38 0.00 -2.44 0.00 0.00 57.07 56.61 1fat s TYR 51 Cb -0.02 -3.43 1.83 0.00 0.35 0.00 0.00 41.96 40.70 1fat s TYR 51 CO 0.00 -1.11 2.14 0.66 -1.34 0.00 0.00 175.55 175.90 1fat h SER 52 N 4.42 0.00 -3.27 4.32 4.64 -1.65 -3.40 113.55 118.61 1fat h SER 52 Ca -0.46 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.26 1fat h SER 52 Cb 1.21 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 63.18 1fat h SER 52 CO 0.70 0.00 -0.51 0.00 -0.87 0.00 0.00 176.83 176.16 1fat s ALA 53 N -3.87 3.62 0.64 5.18 0.00 -1.26 -5.03 121.76 121.05 1fat s ALA 53 Ca -0.02 -0.70 -0.18 0.00 0.00 0.00 0.00 51.96 51.06 1fat s ALA 53 Cb 0.11 -2.10 -0.01 0.00 0.00 0.00 0.00 23.12 21.11 1fat s ALA 53 CO 0.46 0.17 1.27 -2.14 0.00 0.00 0.00 175.76 175.53 1fat s PRO 54 N 0.34 2.61 -0.01 0.00 0.02 -1.26 -4.79 135.00 131.91 1fat s PRO 54 Ca 0.07 2.00 0.06 0.00 0.02 0.00 0.00 61.00 63.14 1fat s PRO 54 Cb -0.11 -1.86 -0.03 0.00 0.02 0.00 0.00 34.50 32.52 1fat s PRO 54 CO -0.01 -1.54 -0.17 0.42 -0.33 0.00 0.00 177.00 175.37 1fat s ILE 55 N -1.47 2.83 -0.40 2.83 -1.09 0.71 -4.94 121.20 119.66 1fat s ILE 55 Ca 0.81 -0.97 -0.19 0.00 -2.23 0.00 0.00 60.65 58.06 1fat s ILE 55 Cb -0.36 -2.13 0.01 0.00 -1.58 0.00 0.00 42.46 38.41 1fat s ILE 55 CO 0.39 0.48 0.57 -1.58 -1.23 0.00 0.00 174.94 173.56 1fat s GLN 56 N -1.04 3.40 0.09 2.79 0.74 -1.26 -0.49 119.66 123.89 1fat s GLN 56 Ca 0.13 -0.32 0.12 0.00 0.05 0.00 0.00 55.36 55.34 1fat s GLN 56 Cb -0.10 -3.89 -0.15 0.00 1.10 0.00 0.00 33.01 29.97 1fat s GLN 56 CO 0.03 -0.84 1.03 0.97 -0.55 0.00 0.00 175.29 175.92 1fat h ILE 57 N 5.75 1.01 -2.85 -2.34 6.09 0.16 -3.45 117.51 121.88 1fat h ILE 57 Ca -0.26 -2.64 0.06 0.00 -1.37 0.00 0.00 64.86 60.64 1fat h ILE 57 Cb 1.11 2.45 -0.08 0.00 0.47 0.00 0.00 36.82 40.76 1fat h ILE 57 CO 0.83 0.58 0.28 -1.66 -3.07 0.00 0.00 178.15 175.11 1fat s TRP 58 N -2.78 -0.30 -0.13 2.19 1.48 -1.03 -0.48 118.94 117.89 1fat s TRP 58 Ca -0.01 -0.03 0.01 0.00 -1.06 0.00 0.00 56.10 55.00 1fat s TRP 58 Cb 0.09 0.64 0.02 0.00 -1.16 0.00 0.00 33.47 33.06 1fat s TRP 58 CO 0.81 -1.01 -0.13 0.34 -4.06 0.00 0.00 176.95 172.90 1fat s ASP 59 N -2.84 2.52 0.34 -2.66 -1.08 0.42 -4.50 116.67 108.87 1fat s ASP 59 Ca 0.08 -0.44 0.15 0.00 -0.52 0.00 0.00 52.55 51.82 1fat s ASP 59 Cb -0.03 -1.09 0.57 0.00 -1.46 0.00 0.00 42.92 40.90 1fat s ASP 59 CO -0.01 -0.05 1.70 -1.13 0.52 0.00 0.00 175.17 176.21 1fat h ASN 60 N 7.89 0.00 0.55 -0.34 -1.24 -1.94 0.57 115.58 121.06 1fat h ASN 60 Ca -0.35 0.00 -0.20 0.00 0.71 0.00 0.00 56.30 56.47 1fat h ASN 60 Cb 1.15 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 40.19 1fat h ASN 60 CO 0.50 0.47 -0.86 0.71 -1.29 0.00 0.00 177.43 176.96 1fat h THR 61 N 0.00 1.48 0.00 -3.57 1.35 -1.97 -3.23 112.91 106.96 1fat h THR 61 Ca -0.00 -2.55 0.00 0.00 -0.55 0.00 0.00 66.41 63.30 1fat h THR 61 Cb 0.93 2.42 0.00 0.00 -1.73 0.00 0.00 68.15 69.77 1fat h THR 61 CO 0.06 0.75 -1.53 0.35 -0.25 0.00 0.00 175.52 174.90 1fat n THR 62 N -3.68 0.02 -1.16 6.82 -2.24 -1.18 -4.97 114.28 107.89 1fat n THR 62 Ca -0.04 -0.28 -0.05 0.00 -2.27 0.00 0.00 64.05 61.40 1fat n THR 62 Cb 0.79 0.41 -0.02 0.00 -2.10 0.00 0.00 70.33 69.41 1fat n THR 62 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fat n GLY 63 N 1.36 0.78 3.93 3.38 0.00 0.20 -5.01 105.19 109.83 1fat n GLY 63 Ca -0.00 -0.50 -0.27 0.00 0.00 0.00 0.00 46.02 45.25 1fat n GLY 63 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1fat s THR 64 N -2.10 5.19 0.13 2.61 -4.23 -1.09 -4.89 115.64 111.26 1fat s THR 64 Ca 0.00 -0.36 0.08 0.00 -1.18 0.00 0.00 61.69 60.23 1fat s THR 64 Cb 0.00 -3.74 -0.04 0.00 1.34 0.00 0.00 72.50 70.06 1fat s THR 64 CO 0.00 -0.21 -0.19 -0.69 -0.54 0.00 0.00 174.62 172.99 1fat s VAL 65 N -1.91 1.74 0.25 2.29 1.01 -1.26 -0.44 120.40 122.08 1fat s VAL 65 Ca 0.39 -1.72 -0.09 0.00 0.00 0.00 0.00 61.98 60.56 1fat s VAL 65 Cb -0.11 -1.68 -0.07 0.00 0.00 0.00 0.00 36.38 34.52 1fat s VAL 65 CO 0.29 -0.19 0.56 0.00 0.00 0.00 0.00 175.10 175.76 1fat s ALA 66 N -1.61 3.56 0.22 5.51 0.00 0.37 -4.46 121.76 125.35 1fat s ALA 66 Ca 0.11 -0.30 0.01 0.00 0.00 0.00 0.00 51.96 51.77 1fat s ALA 66 Cb -0.08 -2.44 -0.04 0.00 0.00 0.00 0.00 23.12 20.57 1fat s ALA 66 CO 0.05 0.44 0.40 -1.12 0.00 0.00 0.00 175.76 175.53 1fat s SER 67 N -2.51 6.36 0.28 0.00 0.01 -0.93 -4.44 113.70 112.47 1fat s SER 67 Ca 0.47 0.33 -0.16 0.00 1.31 0.00 0.00 55.95 57.90 1fat s SER 67 Cb -0.11 -1.98 0.01 0.00 0.21 0.00 0.00 66.02 64.15 1fat s SER 67 CO 0.23 -0.08 0.61 0.72 0.41 0.00 0.00 173.24 175.13 1fat s PHE 68 N -1.94 0.16 0.01 2.43 -0.12 -0.82 -1.59 117.98 116.11 1fat s PHE 68 Ca 0.37 -0.59 -0.26 0.00 -0.05 0.00 0.00 56.93 56.41 1fat s PHE 68 Cb -0.10 0.45 0.06 0.00 -0.63 0.00 0.00 43.02 42.79 1fat s PHE 68 CO 0.30 -1.16 0.59 0.00 -0.05 0.00 0.00 175.22 174.90 1fat s ALA 69 N -3.74 -1.53 0.10 1.99 0.00 -0.49 -1.64 121.76 116.45 1fat s ALA 69 Ca 0.18 0.91 -0.18 0.00 0.00 0.00 0.00 51.96 52.86 1fat s ALA 69 Cb -0.03 0.24 0.04 0.00 0.00 0.00 0.00 23.12 23.37 1fat s ALA 69 CO 0.09 -0.46 0.44 -0.08 0.00 0.00 0.00 175.76 175.75 1fat s THR 70 N -1.93 0.06 -0.10 0.00 -1.32 -0.65 -1.58 115.64 110.11 1fat s THR 70 Ca -0.08 -0.45 -0.16 0.00 -1.21 0.00 0.00 61.69 59.79 1fat s THR 70 Cb -0.01 -1.08 0.04 0.00 -1.51 0.00 0.00 72.50 69.94 1fat s THR 70 CO 0.03 -0.25 0.40 -0.94 -2.21 0.00 0.00 174.62 171.65 1fat s SER 71 N -2.53 -0.38 0.15 8.08 1.04 -0.18 -2.12 113.70 117.77 1fat s SER 71 Ca 0.00 0.59 -0.18 0.00 0.48 0.00 0.00 55.95 56.84 1fat s SER 71 Cb 0.01 0.66 0.04 0.00 0.10 0.00 0.00 66.02 66.83 1fat s SER 71 CO -0.09 -0.28 0.48 0.72 0.98 0.00 0.00 173.24 175.06 1fat s PHE 72 N -0.38 -0.25 -0.15 5.02 -0.71 -1.10 -1.13 117.98 119.28 1fat s PHE 72 Ca -0.05 -0.05 0.02 0.00 -1.04 0.00 0.00 56.93 55.81 1fat s PHE 72 Cb -0.03 0.37 0.01 0.00 -1.21 0.00 0.00 43.02 42.16 1fat s PHE 72 CO 0.02 -0.80 -0.21 0.99 -1.34 0.00 0.00 175.22 173.88 1fat s THR 73 N -3.81 2.03 0.27 -4.49 2.01 -0.84 -1.69 115.64 109.12 1fat s THR 73 Ca 0.04 -0.95 0.09 0.00 0.31 0.00 0.00 61.69 61.19 1fat s THR 73 Cb 0.00 -1.81 -0.05 0.00 0.01 0.00 0.00 72.50 70.65 1fat s THR 73 CO -0.09 0.54 -0.14 0.72 -0.69 0.00 0.00 174.62 174.95 1fat s PHE 74 N 1.00 2.08 -0.05 4.92 -0.12 -0.69 -0.51 117.98 124.60 1fat s PHE 74 Ca -0.03 -0.49 -0.02 0.00 -0.05 0.00 0.00 56.93 56.34 1fat s PHE 74 Cb -0.15 -1.01 0.03 0.00 -0.63 0.00 0.00 43.02 41.26 1fat s PHE 74 CO -0.06 0.52 0.05 1.21 -0.05 0.00 0.00 175.22 176.89 1fat s ASN 75 N -3.46 1.25 -0.16 1.98 3.84 0.36 -1.06 114.94 117.69 1fat s ASN 75 Ca 0.28 0.04 -0.02 0.00 0.21 0.00 0.00 52.86 53.36 1fat s ASN 75 Cb -0.01 -0.21 -0.02 0.00 -0.55 0.00 0.00 41.25 40.47 1fat s ASN 75 CO 0.12 -0.24 -0.07 -0.63 -2.79 0.00 0.00 177.10 173.49 1fat s ILE 76 N 2.13 3.43 -0.10 -5.21 1.01 -1.26 -2.18 121.20 119.02 1fat s ILE 76 Ca 0.05 -0.51 0.02 0.00 0.00 0.00 0.00 60.65 60.21 1fat s ILE 76 Cb -0.12 -2.50 0.01 0.00 0.01 0.00 0.00 42.46 39.86 1fat s ILE 76 CO -0.04 0.48 -0.17 -1.58 0.00 0.00 0.00 174.94 173.64 1fat s GLN 77 N 0.68 2.32 -0.17 2.79 0.74 -1.21 -1.41 119.66 123.39 1fat s GLN 77 Ca -0.04 -0.61 -0.07 0.00 0.05 0.00 0.00 55.36 54.69 1fat s GLN 77 Cb -0.15 -1.90 -0.04 0.00 1.10 0.00 0.00 33.01 32.02 1fat s GLN 77 CO 0.02 0.01 0.06 0.08 -0.55 0.00 0.00 175.29 174.91 1fat s VAL 78 N 0.78 4.76 0.70 1.34 1.01 -1.26 -1.36 120.40 126.36 1fat s VAL 78 Ca -0.11 -0.05 -0.14 0.00 0.00 0.00 0.00 61.98 61.68 1fat s VAL 78 Cb -0.16 -3.13 0.02 0.00 0.00 0.00 0.00 36.38 33.11 1fat s VAL 78 CO 0.02 0.48 1.13 -2.16 0.00 0.00 0.00 175.10 174.57 1fat s PRO 79 N 0.20 2.52 0.32 2.72 0.04 -1.26 -4.95 135.00 134.59 1fat s PRO 79 Ca 0.04 1.46 -0.28 0.00 0.04 0.00 0.00 61.00 62.26 1fat s PRO 79 Cb -0.12 -1.91 -0.13 0.00 0.04 0.00 0.00 34.50 32.38 1fat s PRO 79 CO 0.00 -1.48 1.28 0.09 0.04 0.00 0.00 177.00 176.94 1fat n ASN 80 N -2.67 2.64 -3.37 6.66 3.02 -1.26 -3.00 115.26 117.29 1fat n ASN 80 Ca 0.11 1.20 -0.19 0.00 -0.03 0.00 0.00 54.58 55.67 1fat n ASN 80 Cb 0.52 -1.46 0.05 0.00 -0.61 0.00 0.00 39.78 38.28 1fat n ASN 80 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1fat n ASN 81 N 1.01 -6.35 -3.65 6.41 3.02 -1.26 -5.01 115.26 109.42 1fat n ASN 81 Ca 0.06 -0.75 -0.06 0.00 -0.03 0.00 0.00 54.58 53.80 1fat n ASN 81 Cb 0.35 -4.62 -0.02 0.00 -0.61 0.00 0.00 39.78 34.88 1fat n ASN 81 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1fat s ALA 82 N -3.37 -1.67 0.15 5.41 0.00 -1.16 -5.01 121.76 116.11 1fat s ALA 82 Ca 0.41 0.42 0.07 0.00 0.00 0.00 0.00 51.96 52.86 1fat s ALA 82 Cb -0.09 0.60 -0.04 0.00 0.00 0.00 0.00 23.12 23.60 1fat s ALA 82 CO 0.78 -0.90 -0.16 0.20 0.00 0.00 0.00 175.76 175.68 1fat s GLY 83 N -2.77 1.26 0.38 0.00 0.00 0.95 -4.85 107.32 102.29 1fat s GLY 83 Ca 0.09 -1.44 -0.28 0.00 0.00 0.00 0.00 44.72 43.09 1fat s GLY 83 CO -0.02 -1.50 1.44 -4.14 0.00 0.00 0.00 173.10 168.88 1fat s PRO 84 N -2.90 4.10 -0.30 2.90 0.02 -1.26 -1.31 135.00 136.24 1fat s PRO 84 Ca 0.14 2.47 -0.25 0.00 0.02 0.00 0.00 61.00 63.38 1fat s PRO 84 Cb -0.04 -2.94 0.20 0.00 0.02 0.00 0.00 34.50 31.73 1fat s PRO 84 CO 0.05 -0.50 1.47 0.00 -0.33 0.00 0.00 177.00 177.69 1fat s ALA 85 N -1.14 -2.24 -0.06 -1.55 0.00 -1.26 -4.50 121.76 111.01 1fat s ALA 85 Ca 0.53 1.68 0.10 0.00 0.00 0.00 0.00 51.96 54.26 1fat s ALA 85 Cb -0.45 -1.80 -0.14 0.00 0.00 0.00 0.00 23.12 20.74 1fat s ALA 85 CO 0.60 -0.10 0.13 -3.47 0.00 0.00 0.00 175.76 172.92 1fat n ASP 86 N 1.47 2.59 0.00 0.00 -0.08 -0.94 -2.87 116.55 116.73 1fat n ASP 86 Ca -0.09 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.19 1fat n ASP 86 Cb 0.57 1.09 0.00 0.00 2.34 0.00 0.00 41.12 45.12 1fat n ASP 86 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1fat n GLY 87 N 2.17 -0.65 3.00 0.27 0.00 -1.24 -2.50 105.19 106.23 1fat n GLY 87 Ca -0.09 -1.63 -0.10 0.00 0.00 0.00 0.00 46.02 44.19 1fat n GLY 87 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1fat s LEU 88 N 0.00 1.95 -0.06 0.99 0.20 -0.62 -2.76 118.68 118.38 1fat s LEU 88 Ca 0.00 -0.28 -0.09 0.00 0.69 0.00 0.00 54.13 54.45 1fat s LEU 88 Cb 0.00 0.27 0.02 0.00 -0.43 0.00 0.00 46.19 46.05 1fat s LEU 88 CO 0.00 -0.25 0.23 0.00 -0.29 0.00 0.00 176.35 176.04 1fat s ALA 89 N -1.08 -0.57 -0.07 5.97 0.00 -0.00 -0.20 121.76 125.81 1fat s ALA 89 Ca -0.12 0.43 -0.14 0.00 0.00 0.00 0.00 51.96 52.13 1fat s ALA 89 Cb -0.07 -0.20 -0.05 0.00 0.00 0.00 0.00 23.12 22.80 1fat s ALA 89 CO -0.00 -0.16 0.36 0.12 0.00 0.00 0.00 175.76 176.08 1fat s PHE 90 N -0.48 3.62 0.04 0.00 5.36 -0.86 -1.06 117.98 124.61 1fat s PHE 90 Ca -0.06 0.83 -0.00 0.00 -0.96 0.00 0.00 56.93 56.74 1fat s PHE 90 Cb -0.04 -2.30 -0.03 0.00 -0.34 0.00 0.00 43.02 40.31 1fat s PHE 90 CO 0.01 0.50 -0.03 0.00 -1.46 0.00 0.00 175.22 174.23 1fat s ALA 91 N -0.48 0.41 -0.20 11.12 0.00 0.11 -1.59 121.76 131.14 1fat s ALA 91 Ca 0.21 -1.00 -0.00 0.00 0.00 0.00 0.00 51.96 51.17 1fat s ALA 91 Cb -0.15 0.22 0.02 0.00 0.00 0.00 0.00 23.12 23.20 1fat s ALA 91 CO 0.10 -0.28 -0.14 -0.51 0.00 0.00 0.00 175.76 174.93 1fat s LEU 92 N -2.39 2.52 0.23 0.00 1.02 -0.19 -1.94 118.68 117.92 1fat s LEU 92 Ca -0.01 -0.66 0.04 0.00 0.02 0.00 0.00 54.13 53.51 1fat s LEU 92 Cb 0.01 -1.57 -0.05 0.00 0.02 0.00 0.00 46.19 44.60 1fat s LEU 92 CO -0.06 -0.03 -0.01 -0.69 0.02 0.00 0.00 176.35 175.58 1fat s VAL 93 N 1.33 1.05 0.60 -1.59 1.01 -0.95 -2.51 120.40 119.33 1fat s VAL 93 Ca 0.04 -2.04 -0.18 0.00 0.00 0.00 0.00 61.98 59.80 1fat s VAL 93 Cb -0.14 -2.34 -0.03 0.00 0.00 0.00 0.00 36.38 33.87 1fat s VAL 93 CO -0.09 -0.33 1.17 -2.84 0.00 0.00 0.00 175.10 173.01 1fat s PRO 94 N -3.86 2.97 0.16 2.72 0.02 -1.26 -1.26 135.00 134.48 1fat s PRO 94 Ca 0.28 1.71 -0.24 0.00 0.02 0.00 0.00 61.00 62.76 1fat s PRO 94 Cb 0.06 -1.94 0.03 0.00 0.02 0.00 0.00 34.50 32.66 1fat s PRO 94 CO 0.09 -1.18 1.60 0.28 -0.33 0.00 0.00 177.00 177.45 1fat h VAL 95 N 0.74 0.22 -0.40 3.83 2.07 -1.90 -0.88 116.25 119.93 1fat h VAL 95 Ca -0.50 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.02 1fat h VAL 95 Cb 1.28 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.27 1fat h VAL 95 CO 0.55 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.75 1fat n GLY 96 N -1.42 2.14 3.54 2.17 0.00 -1.26 -4.75 105.19 105.61 1fat n GLY 96 Ca -0.00 -0.58 -0.52 0.00 0.00 0.00 0.00 46.02 44.92 1fat n GLY 96 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1fat n SER 97 N 0.53 0.68 -4.78 1.61 2.88 -0.33 -4.99 113.62 109.23 1fat n SER 97 Ca 0.17 1.14 -0.23 0.00 -1.33 0.00 0.00 58.87 58.62 1fat n SER 97 Cb 0.74 -1.10 -0.05 0.00 -0.75 0.00 0.00 64.21 63.05 1fat n SER 97 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 1fat s GLN 98 N -0.23 2.79 0.68 -1.46 -1.52 -1.26 -5.03 119.66 113.63 1fat s GLN 98 Ca 0.78 -1.08 -0.17 0.00 -1.95 0.00 0.00 55.36 52.95 1fat s GLN 98 Cb -0.99 -2.50 -0.01 0.00 -0.22 0.00 0.00 33.01 29.29 1fat s GLN 98 CO 0.53 0.41 1.06 -2.30 -0.25 0.00 0.00 175.29 174.74 1fat n PRO 99 N -0.91 0.73 0.00 2.91 -0.02 -1.26 -5.03 135.00 131.40 1fat n PRO 99 Ca -0.08 0.30 0.00 0.00 -2.02 0.00 0.00 63.50 61.70 1fat n PRO 99 Cb 0.57 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 1fat n PRO 99 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1fat n LYS 100 N -1.75 2.73 -1.65 -0.52 4.76 0.11 -5.03 118.16 116.81 1fat n LYS 100 Ca 0.14 0.00 -0.32 0.00 -2.87 0.00 0.00 58.31 55.26 1fat n LYS 100 Cb 0.49 0.00 0.05 0.00 -1.84 0.00 0.00 35.03 33.72 1fat n LYS 100 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1fat s ASP 101 N 0.08 5.27 0.85 4.39 1.11 -0.64 -4.73 116.67 123.00 1fat s ASP 101 Ca 0.00 1.75 -0.04 0.00 0.18 0.00 0.00 52.55 54.45 1fat s ASP 101 Cb 0.00 -2.52 0.06 0.00 1.07 0.00 0.00 42.92 41.53 1fat s ASP 101 CO 0.00 -1.52 0.37 0.29 1.18 0.00 0.00 175.17 175.50 1fat n LYS 102 N -2.85 -0.16 0.00 8.23 5.02 -1.26 -0.75 118.16 126.38 1fat n LYS 102 Ca 0.08 -0.67 0.00 0.00 -2.02 0.00 0.00 58.31 55.70 1fat n LYS 102 Cb 0.53 -0.35 0.00 0.00 -0.02 0.00 0.00 35.03 35.19 1fat n LYS 102 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1fat n GLY 103 N 2.48 2.89 0.34 0.72 0.00 -1.25 -2.36 105.19 108.00 1fat n GLY 103 Ca 0.05 -0.01 0.13 0.00 0.00 0.00 0.00 46.02 46.19 1fat n GLY 103 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1fat h GLY 104 N 0.00 0.00 0.57 -0.02 0.00 -1.91 0.22 103.07 101.92 1fat h GLY 104 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1fat h GLY 104 CO 0.00 0.00 -0.02 0.69 0.00 0.00 0.00 176.54 177.21 1fat n PHE 105 N -2.86 0.00 -1.28 5.60 3.72 -1.00 -4.92 117.46 116.73 1fat n PHE 105 Ca -0.01 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.27 1fat n PHE 105 Cb 0.52 -0.04 -0.05 0.00 -0.94 0.00 0.00 39.48 38.97 1fat n PHE 105 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1fat n LEU 106 N -0.65 -0.72 0.00 4.37 4.77 0.77 -1.33 117.00 124.21 1fat n LEU 106 Ca 0.21 0.29 0.00 0.00 -0.03 0.00 0.00 56.01 56.47 1fat n LEU 106 Cb 0.22 -2.08 0.00 0.00 -2.33 0.00 0.00 43.42 39.22 1fat n LEU 106 CO 0.19 -0.74 0.00 0.61 -1.33 0.00 0.00 177.39 176.11 1fat n GLY 107 N -0.09 2.76 0.09 -0.72 0.00 0.07 -3.83 105.19 103.47 1fat n GLY 107 Ca -0.12 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.84 1fat n GLY 107 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1fat n LEU 108 N 0.00 0.42 -4.50 0.99 4.77 -0.44 0.04 117.00 118.28 1fat n LEU 108 Ca 0.00 0.19 -0.24 0.00 -0.03 0.00 0.00 56.01 55.94 1fat n LEU 108 Cb 0.00 0.28 -0.10 0.00 -2.33 0.00 0.00 43.42 41.27 1fat n LEU 108 CO 0.00 0.36 -0.26 -0.36 -1.33 0.00 0.00 177.39 175.80 1fat s PHE 109 N -2.68 1.99 -0.03 -1.77 0.08 -0.98 -4.78 117.98 109.80 1fat s PHE 109 Ca -0.07 -0.98 0.01 0.00 0.12 0.00 0.00 56.93 56.01 1fat s PHE 109 Cb 0.08 -1.34 -0.03 0.00 -0.57 0.00 0.00 43.02 41.16 1fat s PHE 109 CO 0.83 0.02 -0.02 -0.25 -0.10 0.00 0.00 175.22 175.71 1fat n ASP 110 N -0.86 3.94 0.00 1.36 8.00 -1.26 -1.62 116.55 126.11 1fat n ASP 110 Ca -0.04 -0.01 0.00 0.00 0.71 0.00 0.00 54.79 55.45 1fat n ASP 110 Cb 0.66 0.21 0.00 0.00 -0.02 0.00 0.00 41.12 41.97 1fat n ASP 110 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1fat n GLY 111 N 3.10 0.83 0.71 0.44 0.00 -1.26 -4.94 105.19 104.07 1fat n GLY 111 Ca -0.06 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.92 1fat n GLY 111 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1fat n SER 112 N 0.00 0.35 -1.15 1.61 3.41 -1.26 -5.03 113.62 111.54 1fat n SER 112 Ca 0.00 -1.26 -0.00 0.00 -0.26 0.00 0.00 58.87 57.35 1fat n SER 112 Cb 0.00 -0.09 0.23 0.00 -0.26 0.00 0.00 64.21 64.09 1fat n SER 112 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1fat n ASN 113 N -2.90 3.25 -4.77 4.04 3.02 -1.26 -4.98 115.26 111.66 1fat n ASN 113 Ca 0.03 -3.42 -0.38 0.00 -0.03 0.00 0.00 54.58 50.78 1fat n ASN 113 Cb 0.11 -0.62 -0.02 0.00 -0.61 0.00 0.00 39.78 38.64 1fat n ASN 113 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1fat s SER 114 N -2.14 6.58 -0.22 6.41 0.01 -1.26 -4.96 113.70 118.13 1fat s SER 114 Ca 0.45 2.28 -0.28 0.00 1.31 0.00 0.00 55.95 59.71 1fat s SER 114 Cb 0.39 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 64.01 1fat s SER 114 CO 0.05 -0.63 0.99 0.21 0.41 0.00 0.00 173.24 174.27 1fat s ASN 115 N -1.22 7.06 0.00 2.44 3.04 -1.26 -4.90 114.94 120.10 1fat s ASN 115 Ca 0.57 1.32 0.25 0.00 0.04 0.00 0.00 52.86 55.03 1fat s ASN 115 Cb -0.29 -2.52 0.45 0.00 -1.54 0.00 0.00 41.25 37.36 1fat s ASN 115 CO 0.36 -0.61 1.37 0.49 -3.04 0.00 0.00 177.10 175.68 1fat n PHE 116 N 6.08 0.00 -4.02 0.43 3.72 -1.26 -4.96 117.46 117.45 1fat n PHE 116 Ca 0.10 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.22 1fat n PHE 116 Cb 0.47 -0.19 -0.02 0.00 -0.94 0.00 0.00 39.48 38.80 1fat n PHE 116 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 1fat n HIS 117 N -1.28 -1.71 -4.39 1.38 8.25 -1.26 -4.68 115.22 111.53 1fat n HIS 117 Ca 0.07 0.77 -0.23 0.00 -0.26 0.00 0.00 57.72 58.07 1fat n HIS 117 Cb 0.34 -3.57 -0.13 0.00 1.12 0.00 0.00 29.99 27.76 1fat n HIS 117 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1fat s THR 118 N -3.76 1.51 -0.01 1.59 2.01 -1.26 -4.16 115.64 111.56 1fat s THR 118 Ca 0.22 -1.31 0.01 0.00 0.31 0.00 0.00 61.69 60.92 1fat s THR 118 Cb -0.12 -1.36 0.00 0.00 0.01 0.00 0.00 72.50 71.04 1fat s THR 118 CO 0.89 0.01 -0.03 -0.69 -0.69 0.00 0.00 174.62 174.12 1fat s VAL 119 N -1.01 0.25 0.15 3.82 1.01 -1.05 -1.60 120.40 121.98 1fat s VAL 119 Ca 0.05 -0.11 -0.16 0.00 0.00 0.00 0.00 61.98 61.75 1fat s VAL 119 Cb -0.09 -0.23 0.03 0.00 0.00 0.00 0.00 36.38 36.09 1fat s VAL 119 CO 0.03 0.08 0.44 0.00 0.00 0.00 0.00 175.10 175.65 1fat s ALA 120 N 0.07 -0.91 -0.18 5.51 0.00 -0.53 -1.03 121.76 124.69 1fat s ALA 120 Ca -0.00 -0.13 0.01 0.00 0.00 0.00 0.00 51.96 51.84 1fat s ALA 120 Cb -0.03 0.77 0.03 0.00 0.00 0.00 0.00 23.12 23.88 1fat s ALA 120 CO -0.00 -0.70 -0.16 0.08 0.00 0.00 0.00 175.76 174.98 1fat s VAL 121 N -3.83 1.85 0.22 0.00 1.01 -0.62 -0.70 120.40 118.34 1fat s VAL 121 Ca 0.06 -0.93 0.05 0.00 0.00 0.00 0.00 61.98 61.16 1fat s VAL 121 Cb 0.01 -1.76 -0.03 0.00 0.00 0.00 0.00 36.38 34.59 1fat s VAL 121 CO -0.08 0.39 0.27 -1.83 0.00 0.00 0.00 175.10 173.85 1fat s GLU 122 N 1.35 3.21 -0.46 2.72 -1.05 0.48 -2.03 118.70 122.91 1fat s GLU 122 Ca 0.02 -0.85 0.02 0.00 -0.15 0.00 0.00 54.97 54.02 1fat s GLU 122 Cb -0.14 -2.76 0.14 0.00 -0.44 0.00 0.00 34.13 30.93 1fat s GLU 122 CO -0.11 0.44 0.27 -0.06 0.95 0.00 0.00 175.26 176.75 1fat s PHE 123 N -1.98 2.07 -0.27 4.83 0.40 0.73 -1.35 117.98 122.41 1fat s PHE 123 Ca 0.33 -2.51 -0.25 0.00 -0.60 0.00 0.00 56.93 53.91 1fat s PHE 123 Cb -0.09 -1.90 0.00 0.00 0.51 0.00 0.00 43.02 41.54 1fat s PHE 123 CO 0.27 -0.77 0.86 0.34 0.70 0.00 0.00 175.22 176.62 1fat s ASP 124 N 0.18 6.81 0.00 1.36 -1.08 -0.61 -1.59 116.67 121.73 1fat s ASP 124 Ca 0.19 0.95 0.19 0.00 -0.52 0.00 0.00 52.55 53.37 1fat s ASP 124 Cb -0.21 -2.45 0.25 0.00 -1.46 0.00 0.00 42.92 39.06 1fat s ASP 124 CO -0.03 -0.60 1.21 0.35 0.52 0.00 0.00 175.17 176.63 1fat n THR 125 N 5.41 0.25 -3.78 1.71 -2.24 -1.04 -2.77 114.28 111.83 1fat n THR 125 Ca 0.06 -0.63 -0.13 0.00 -2.27 0.00 0.00 64.05 61.08 1fat n THR 125 Cb 0.48 1.18 -0.14 0.00 -2.10 0.00 0.00 70.33 69.74 1fat n THR 125 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1fat s LEU 126 N -1.48 1.01 0.03 3.22 2.96 -1.24 -4.48 118.68 118.70 1fat s LEU 126 Ca 0.28 0.25 -0.30 0.00 -0.22 0.00 0.00 54.13 54.14 1fat s LEU 126 Cb 0.18 0.33 -0.05 0.00 0.50 0.00 0.00 46.19 47.14 1fat s LEU 126 CO 0.25 -0.11 1.25 -0.47 -1.32 0.00 0.00 176.35 175.95 1fat s TYR 127 N 0.82 3.27 -0.36 5.38 5.04 -1.26 -5.00 117.35 125.25 1fat s TYR 127 Ca -0.06 1.17 0.01 0.00 -2.44 0.00 0.00 57.07 55.74 1fat s TYR 127 Cb -0.08 -3.49 0.10 0.00 0.35 0.00 0.00 41.96 38.84 1fat s TYR 127 CO -0.04 -1.60 0.10 -0.80 -1.34 0.00 0.00 175.55 171.87 1fat s ASN 128 N 1.28 4.94 0.13 4.32 -0.87 -1.26 -5.00 114.94 118.49 1fat s ASN 128 Ca 0.60 -2.03 -0.04 0.00 -1.57 0.00 0.00 52.86 49.82 1fat s ASN 128 Cb -0.30 -1.70 0.22 0.00 -0.02 0.00 0.00 41.25 39.45 1fat s ASN 128 CO 0.27 -0.43 0.76 1.17 -2.57 0.00 0.00 177.10 176.30 1fat n LYS 129 N 4.41 -0.05 0.28 -0.60 3.00 -1.26 -1.03 118.16 122.91 1fat n LYS 129 Ca -0.00 0.75 0.17 0.00 -0.00 0.00 0.00 58.31 59.24 1fat n LYS 129 Cb 0.42 -1.13 0.94 0.00 0.00 0.00 0.00 35.03 35.26 1fat n LYS 129 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.40 176.96 1fat h ASP 130 N 0.00 0.00 0.00 3.14 5.19 -2.01 -3.37 116.42 119.36 1fat h ASP 130 Ca 0.23 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.64 1fat h ASP 130 Cb 0.35 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.86 1fat h ASP 130 CO -0.50 0.00 0.00 -2.67 -3.12 0.00 0.00 179.24 172.95 1fat n TRP 131 N -3.64 0.00 -2.89 4.55 2.14 -0.52 -5.13 117.44 111.95 1fat n TRP 131 Ca -0.01 0.00 -0.31 0.00 2.07 0.00 0.00 57.50 59.25 1fat n TRP 131 Cb 0.18 0.00 -0.04 0.00 -0.81 0.00 0.00 31.31 30.64 1fat n TRP 131 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 1fat s ASP 132 N 0.00 6.59 0.90 -0.67 1.01 -0.19 -4.78 116.67 119.52 1fat s ASP 132 Ca 0.00 1.20 -0.12 0.00 0.71 0.00 0.00 52.55 54.34 1fat s ASP 132 Cb 0.00 -2.35 0.13 0.00 1.01 0.00 0.00 42.92 41.71 1fat s ASP 132 CO 0.00 -0.37 1.14 -2.16 0.21 0.00 0.00 175.17 173.99 1fat s PRO 133 N -3.66 1.25 0.29 8.23 0.04 -1.26 -4.77 135.00 135.13 1fat s PRO 133 Ca 0.52 0.30 0.03 0.00 0.04 0.00 0.00 61.00 61.90 1fat s PRO 133 Cb -0.10 -1.85 0.45 0.00 0.04 0.00 0.00 34.50 33.04 1fat s PRO 133 CO 0.28 -2.12 1.75 1.15 0.04 0.00 0.00 177.00 178.10 1fat h THR 134 N -1.45 1.25 -2.35 1.26 2.02 -1.97 -3.44 112.91 108.23 1fat h THR 134 Ca -0.50 -1.17 -0.51 0.00 0.77 0.00 0.00 66.41 65.00 1fat h THR 134 Cb 1.33 1.27 -0.04 0.00 -1.74 0.00 0.00 68.15 68.97 1fat h THR 134 CO 0.62 0.37 -0.50 -1.61 0.37 0.00 0.00 175.52 174.78 1fat s GLU 135 N -4.59 3.14 0.21 6.66 2.02 -1.26 -4.83 118.70 120.06 1fat s GLU 135 Ca -0.07 -0.87 -0.32 0.00 0.02 0.00 0.00 54.97 53.73 1fat s GLU 135 Cb 0.14 -2.73 -0.13 0.00 0.10 0.00 0.00 34.13 31.51 1fat s GLU 135 CO 0.78 0.44 1.52 0.54 0.02 0.00 0.00 175.26 178.57 1fat n ARG 136 N -0.99 2.22 -4.19 1.61 1.74 -1.26 -4.87 116.66 110.92 1fat n ARG 136 Ca -0.08 0.80 -0.11 0.00 -0.77 0.00 0.00 57.85 57.68 1fat n ARG 136 Cb 0.56 -2.53 -0.10 0.00 -1.02 0.00 0.00 32.46 29.38 1fat n ARG 136 CO 0.00 0.00 0.00 -3.38 -1.52 0.00 0.00 177.63 172.73 1fat s HIS 137 N 0.42 1.07 -0.10 -1.55 -3.43 -1.11 -0.40 115.29 110.18 1fat s HIS 137 Ca 0.72 -1.30 -0.03 0.00 -0.80 0.00 0.00 55.06 53.65 1fat s HIS 137 Cb -0.63 -0.55 -0.03 0.00 -1.43 0.00 0.00 32.58 29.93 1fat s HIS 137 CO 0.44 -0.56 0.02 0.42 -2.00 0.00 0.00 174.74 173.06 1fat s ILE 138 N -4.08 4.50 -0.01 -5.38 1.01 -0.73 -1.58 121.20 114.93 1fat s ILE 138 Ca 0.33 -0.17 -0.13 0.00 0.00 0.00 0.00 60.65 60.68 1fat s ILE 138 Cb 0.07 -2.91 0.02 0.00 0.01 0.00 0.00 42.46 39.65 1fat s ILE 138 CO 0.08 0.60 0.26 -0.83 0.00 0.00 0.00 174.94 175.05 1fat s GLY 139 N -0.83 -0.10 -0.38 6.18 0.00 -0.46 -2.13 107.32 109.61 1fat s GLY 139 Ca 0.13 0.20 -0.14 0.00 0.00 0.00 0.00 44.72 44.91 1fat s GLY 139 CO 0.02 0.01 0.27 -0.42 0.00 0.00 0.00 173.10 172.98 1fat s ILE 140 N -1.36 5.24 -0.20 0.90 1.01 -0.79 -0.39 121.20 125.61 1fat s ILE 140 Ca -0.14 -0.47 -0.09 0.00 0.00 0.00 0.00 60.65 59.94 1fat s ILE 140 Cb -0.06 -3.82 -0.05 0.00 0.01 0.00 0.00 42.46 38.54 1fat s ILE 140 CO 0.03 -0.18 0.12 -1.81 0.00 0.00 0.00 174.94 173.11 1fat s ASP 141 N 1.69 6.06 -0.36 3.58 1.01 0.13 -0.89 116.67 127.89 1fat s ASP 141 Ca 0.05 0.17 0.02 0.00 0.71 0.00 0.00 52.55 53.51 1fat s ASP 141 Cb -0.18 -2.06 0.11 0.00 1.01 0.00 0.00 42.92 41.79 1fat s ASP 141 CO 0.10 0.16 0.11 -0.69 0.21 0.00 0.00 175.17 175.06 1fat s VAL 142 N 0.48 1.71 0.00 -1.27 1.01 -1.26 -1.45 120.40 119.61 1fat s VAL 142 Ca 0.07 -2.14 0.00 0.00 0.00 0.00 0.00 61.98 59.91 1fat s VAL 142 Cb -0.12 -2.25 0.00 0.00 0.00 0.00 0.00 36.38 34.01 1fat s VAL 142 CO -0.01 -0.68 0.00 0.59 0.00 0.00 0.00 175.10 175.00 1fat n ASN 143 N 4.26 -2.04 -3.69 3.32 3.02 -0.62 -4.96 115.26 114.54 1fat n ASN 143 Ca 0.03 0.00 -0.14 0.00 -0.03 0.00 0.00 54.58 54.43 1fat n ASN 143 Cb 0.40 -1.57 -0.08 0.00 -0.61 0.00 0.00 39.78 37.92 1fat n ASN 143 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1fat s SER 144 N -2.28 -0.39 0.00 6.41 0.15 -1.26 -4.70 113.70 111.63 1fat s SER 144 Ca 0.00 0.52 0.17 0.00 0.70 0.00 0.00 55.95 57.34 1fat s SER 144 Cb 0.00 0.59 0.96 0.00 -1.71 0.00 0.00 66.02 65.86 1fat s SER 144 CO 0.00 -0.38 1.42 0.00 1.20 0.00 0.00 173.24 175.48 1fat n ILE 145 N 1.74 0.12 -3.18 6.45 0.13 -1.26 -4.22 119.36 119.14 1fat n ILE 145 Ca -0.18 0.03 -0.45 0.00 -1.10 0.00 0.00 62.75 61.04 1fat n ILE 145 Cb 0.56 -0.77 -0.03 0.00 -0.84 0.00 0.00 39.64 38.56 1fat n ILE 145 CO 0.00 0.00 0.00 -0.60 2.80 0.00 0.00 176.55 178.75 1fat s ARG 146 N -2.13 3.30 0.17 9.51 3.52 -1.26 -4.91 118.95 127.14 1fat s ARG 146 Ca 0.23 -1.81 -0.34 0.00 -0.13 0.00 0.00 55.73 53.68 1fat s ARG 146 Cb 0.11 -4.43 -0.15 0.00 -1.56 0.00 0.00 34.95 28.93 1fat s ARG 146 CO 0.21 -1.47 1.40 0.43 -0.81 0.00 0.00 175.30 175.06 1fat n SER 147 N 5.45 2.34 0.16 -2.12 7.64 -1.26 -4.70 113.62 121.13 1fat n SER 147 Ca 0.02 1.12 0.12 0.00 1.01 0.00 0.00 58.87 61.14 1fat n SER 147 Cb 0.44 -1.33 0.57 0.00 -1.01 0.00 0.00 64.21 62.88 1fat n SER 147 CO 0.00 0.00 0.00 -0.29 -3.01 0.00 0.00 175.04 171.74 1fat h ILE 148 N 3.21 0.00 -1.31 0.44 -0.00 -1.34 -3.45 117.51 115.06 1fat h ILE 148 Ca -0.45 -0.15 0.21 0.00 -0.00 0.00 0.00 64.86 64.47 1fat h ILE 148 Cb 1.30 0.80 -0.23 0.00 -0.00 0.00 0.00 36.82 38.68 1fat h ILE 148 CO 0.79 0.00 0.82 -0.75 -0.00 0.00 0.00 178.15 179.01 1fat s LYS 149 N -3.46 0.26 0.27 2.19 2.20 -1.25 -5.01 119.74 114.94 1fat s LYS 149 Ca 0.01 0.00 -0.02 0.00 -0.36 0.00 0.00 55.97 55.60 1fat s LYS 149 Cb 0.08 0.12 0.01 0.00 -1.51 0.00 0.00 37.83 36.53 1fat s LYS 149 CO 0.32 -0.09 0.38 0.25 -0.36 0.00 0.00 175.35 175.85 1fat n THR 150 N 0.35 0.00 -3.60 3.43 -2.24 -1.26 -1.89 114.28 109.07 1fat n THR 150 Ca -0.02 -1.31 -0.16 0.00 -2.27 0.00 0.00 64.05 60.30 1fat n THR 150 Cb 0.58 0.82 -0.07 0.00 -2.10 0.00 0.00 70.33 69.57 1fat n THR 150 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1fat s THR 151 N -2.70 0.00 0.28 4.28 -1.32 -0.90 -4.97 115.64 110.30 1fat s THR 151 Ca 0.21 -0.03 -0.30 0.00 -1.21 0.00 0.00 61.69 60.37 1fat s THR 151 Cb -0.01 -0.94 -0.10 0.00 -1.51 0.00 0.00 72.50 69.94 1fat s THR 151 CO 0.15 -0.02 1.46 -0.60 -2.21 0.00 0.00 174.62 173.41 1fat s ARG 152 N -0.38 4.23 -0.13 7.08 3.52 -1.26 -1.78 118.95 130.23 1fat s ARG 152 Ca -0.05 2.37 -0.00 0.00 -0.13 0.00 0.00 55.73 57.92 1fat s ARG 152 Cb -0.03 -3.08 0.03 0.00 -1.56 0.00 0.00 34.95 30.31 1fat s ARG 152 CO 0.05 -0.45 -0.09 -0.46 -0.81 0.00 0.00 175.30 173.54 1fat s TRP 153 N -0.22 1.70 -1.07 5.12 -0.00 0.46 -4.80 118.94 120.14 1fat s TRP 153 Ca 0.58 -0.92 -0.18 0.00 -0.00 0.00 0.00 56.10 55.59 1fat s TRP 153 Cb -0.43 -1.34 0.13 0.00 -0.00 0.00 0.00 33.47 31.82 1fat s TRP 153 CO 0.47 -0.57 1.33 -0.51 -0.00 0.00 0.00 176.95 177.67 1fat s ASP 154 N 1.64 6.78 -0.14 5.86 1.01 -1.26 -4.46 116.67 126.09 1fat s ASP 154 Ca 0.04 -2.32 -0.36 0.00 0.71 0.00 0.00 52.55 50.62 1fat s ASP 154 Cb -0.13 -2.44 -0.13 0.00 1.01 0.00 0.00 42.92 41.23 1fat s ASP 154 CO -0.09 -1.03 1.80 0.33 0.21 0.00 0.00 175.17 176.40 1fat n PHE 155 N 6.73 2.20 -4.09 4.23 7.35 -1.26 -4.96 117.46 127.66 1fat n PHE 155 Ca 0.32 0.22 -0.35 0.00 -0.76 0.00 0.00 57.45 56.88 1fat n PHE 155 Cb 0.47 -2.58 -0.13 0.00 0.35 0.00 0.00 39.48 37.59 1fat n PHE 155 CO 0.00 0.00 0.00 0.08 -0.76 0.00 0.00 176.76 176.08 1fat s VAL 156 N 3.62 3.72 0.13 -2.13 1.01 -1.26 -5.09 120.40 120.40 1fat s VAL 156 Ca 0.94 -0.39 -0.30 0.00 0.00 0.00 0.00 61.98 62.23 1fat s VAL 156 Cb -0.84 -2.68 -0.07 0.00 0.00 0.00 0.00 36.38 32.80 1fat s VAL 156 CO 0.56 0.43 1.17 0.21 0.00 0.00 0.00 175.10 177.48 1fat s ASN 157 N 1.07 7.13 0.00 3.32 3.04 -1.26 -3.79 114.94 124.45 1fat s ASN 157 Ca 0.02 2.10 0.00 0.00 0.04 0.00 0.00 52.86 55.02 1fat s ASN 157 Cb -0.14 -2.59 0.00 0.00 -1.54 0.00 0.00 41.25 36.97 1fat s ASN 157 CO 0.01 -0.38 0.00 0.61 -3.04 0.00 0.00 177.10 174.30 1fat n GLY 158 N 2.59 0.57 3.91 1.21 0.00 -0.50 -4.99 105.19 107.98 1fat n GLY 158 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 1fat n GLY 158 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fat s GLU 159 N -0.42 3.50 0.09 1.61 0.41 -1.25 -4.93 118.70 117.72 1fat s GLU 159 Ca 0.00 -0.30 -0.30 0.00 -0.41 0.00 0.00 54.97 53.95 1fat s GLU 159 Cb 0.00 -2.99 -0.05 0.00 -1.78 0.00 0.00 34.13 29.31 1fat s GLU 159 CO 0.00 0.57 1.03 -0.80 -0.49 0.00 0.00 175.26 175.58 1fat s ASN 160 N -2.40 7.35 -0.11 -0.19 0.01 -1.26 -4.44 114.94 113.90 1fat s ASN 160 Ca 0.36 1.86 -0.02 0.00 -0.71 0.00 0.00 52.86 54.35 1fat s ASN 160 Cb -0.13 -2.59 -0.03 0.00 0.41 0.00 0.00 41.25 38.92 1fat s ASN 160 CO 0.26 -0.21 -0.03 0.00 -1.51 0.00 0.00 177.10 175.60 1fat s ALA 161 N 0.37 3.09 -0.38 0.60 0.00 -0.23 -4.39 121.76 120.82 1fat s ALA 161 Ca 0.51 -0.84 -0.06 0.00 0.00 0.00 0.00 51.96 51.57 1fat s ALA 161 Cb -0.25 -1.44 0.07 0.00 0.00 0.00 0.00 23.12 21.51 1fat s ALA 161 CO 0.30 0.44 0.18 -1.21 0.00 0.00 0.00 175.76 175.48 1fat s GLU 162 N -0.38 2.46 0.20 0.00 2.02 -0.56 -1.71 118.70 120.73 1fat s GLU 162 Ca 0.06 -1.45 -0.09 0.00 0.02 0.00 0.00 54.97 53.51 1fat s GLU 162 Cb -0.12 -3.60 -0.07 0.00 0.10 0.00 0.00 34.13 30.44 1fat s GLU 162 CO 0.02 -0.88 0.51 0.08 0.02 0.00 0.00 175.26 175.02 1fat s VAL 163 N 1.34 4.97 -0.18 2.63 1.01 -0.68 -1.94 120.40 127.55 1fat s VAL 163 Ca 0.02 0.44 -0.04 0.00 0.00 0.00 0.00 61.98 62.40 1fat s VAL 163 Cb -0.22 -3.63 0.09 0.00 0.00 0.00 0.00 36.38 32.62 1fat s VAL 163 CO 0.01 0.00 0.27 -0.22 0.00 0.00 0.00 175.10 175.16 1fat s LEU 164 N -2.65 -0.29 -0.05 3.92 2.96 -0.80 -2.69 118.68 119.08 1fat s LEU 164 Ca 0.45 0.22 0.05 0.00 -0.22 0.00 0.00 54.13 54.62 1fat s LEU 164 Cb -0.12 0.66 -0.02 0.00 0.50 0.00 0.00 46.19 47.21 1fat s LEU 164 CO 0.21 -0.28 -0.19 -0.63 -1.32 0.00 0.00 176.35 174.14 1fat s ILE 165 N 2.41 2.62 -0.01 6.68 1.01 -0.90 -1.88 121.20 131.13 1fat s ILE 165 Ca 0.05 -0.88 -0.03 0.00 0.00 0.00 0.00 60.65 59.79 1fat s ILE 165 Cb -0.14 -1.99 -0.00 0.00 0.01 0.00 0.00 42.46 40.33 1fat s ILE 165 CO -0.11 0.58 0.07 0.42 0.00 0.00 0.00 174.94 175.90 1fat s THR 166 N -0.54 0.06 -0.05 2.92 -4.23 -0.86 -1.64 115.64 111.30 1fat s THR 166 Ca 0.07 -0.48 0.03 0.00 -1.18 0.00 0.00 61.69 60.14 1fat s THR 166 Cb -0.11 -0.26 0.01 0.00 1.34 0.00 0.00 72.50 73.47 1fat s THR 166 CO 0.01 -0.26 -0.12 -0.47 -0.54 0.00 0.00 174.62 173.23 1fat s TYR 167 N -0.83 1.38 -0.26 3.99 5.04 -0.65 -0.88 117.35 125.14 1fat s TYR 167 Ca -0.09 -0.45 -0.01 0.00 -2.44 0.00 0.00 57.07 54.08 1fat s TYR 167 Cb -0.05 -0.99 0.04 0.00 0.35 0.00 0.00 41.96 41.30 1fat s TYR 167 CO 0.00 -0.21 -0.06 0.34 -1.34 0.00 0.00 175.55 174.28 1fat s ASP 168 N 0.43 4.47 0.26 4.32 -1.08 -0.83 -1.94 116.67 122.31 1fat s ASP 168 Ca -0.10 -1.10 -0.02 0.00 -0.52 0.00 0.00 52.55 50.81 1fat s ASP 168 Cb -0.13 -1.65 0.52 0.00 -1.46 0.00 0.00 42.92 40.20 1fat s ASP 168 CO 0.03 -0.18 1.72 0.28 0.52 0.00 0.00 175.17 177.53 1fat h SER 169 N 7.96 0.26 0.15 -0.34 0.02 -1.87 0.59 113.55 120.31 1fat h SER 169 Ca -0.27 0.12 -0.01 0.00 -0.84 0.00 0.00 61.79 60.80 1fat h SER 169 Cb 1.08 0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.73 1fat h SER 169 CO 0.54 0.06 -0.07 0.77 -1.14 0.00 0.00 176.83 177.00 1fat h SER 170 N 0.42 -0.17 0.35 3.07 4.64 -1.95 -3.25 113.55 116.65 1fat h SER 170 Ca 0.45 -0.15 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 1fat h SER 170 Cb 0.73 0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 1fat h SER 170 CO -0.45 0.06 -0.35 0.35 -0.87 0.00 0.00 176.83 175.57 1fat n THR 171 N -5.09 0.00 -1.58 2.95 -2.24 -1.05 -4.93 114.28 102.33 1fat n THR 171 Ca -0.09 -0.07 -0.19 0.00 -2.27 0.00 0.00 64.05 61.43 1fat n THR 171 Cb 0.17 0.33 -0.08 0.00 -2.10 0.00 0.00 70.33 68.65 1fat n THR 171 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1fat n ASN 172 N -1.00 -4.94 -4.66 3.42 3.02 0.21 -4.90 115.26 106.41 1fat n ASN 172 Ca 0.10 0.44 -0.42 0.00 -0.03 0.00 0.00 54.58 54.67 1fat n ASN 172 Cb 0.34 -4.40 -0.04 0.00 -0.61 0.00 0.00 39.78 35.07 1fat n ASN 172 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1fat s LEU 173 N -4.54 4.13 -0.18 3.41 0.20 -1.17 -0.72 118.68 119.81 1fat s LEU 173 Ca 0.00 1.09 -0.07 0.00 0.69 0.00 0.00 54.13 55.84 1fat s LEU 173 Cb 0.00 -3.20 -0.04 0.00 -0.43 0.00 0.00 46.19 42.52 1fat s LEU 173 CO 0.00 -0.45 0.06 -0.22 -0.29 0.00 0.00 176.35 175.45 1fat s LEU 174 N 2.48 3.77 -0.14 -0.68 2.96 0.21 -1.96 118.68 125.33 1fat s LEU 174 Ca 0.36 0.06 -0.02 0.00 -0.22 0.00 0.00 54.13 54.31 1fat s LEU 174 Cb -0.16 -1.95 0.04 0.00 0.50 0.00 0.00 46.19 44.62 1fat s LEU 174 CO 0.10 0.16 0.01 -0.69 -1.32 0.00 0.00 176.35 174.61 1fat s VAL 175 N 0.44 0.53 -0.09 1.68 1.01 -0.06 -1.62 120.40 122.30 1fat s VAL 175 Ca 0.03 -0.29 0.00 0.00 0.00 0.00 0.00 61.98 61.73 1fat s VAL 175 Cb -0.13 -0.86 -0.03 0.00 0.00 0.00 0.00 36.38 35.37 1fat s VAL 175 CO 0.01 0.03 -0.08 0.00 0.00 0.00 0.00 175.10 175.05 1fat s ALA 176 N 1.88 2.89 0.11 5.51 0.00 -0.23 -2.04 121.76 129.88 1fat s ALA 176 Ca 0.02 -0.89 0.03 0.00 0.00 0.00 0.00 51.96 51.11 1fat s ALA 176 Cb -0.15 -1.24 -0.04 0.00 0.00 0.00 0.00 23.12 21.69 1fat s ALA 176 CO -0.07 0.47 -0.08 -1.54 0.00 0.00 0.00 175.76 174.55 1fat s SER 177 N -0.47 1.36 -0.07 0.00 1.04 -0.79 -0.40 113.70 114.36 1fat s SER 177 Ca 0.07 -0.98 -0.11 0.00 0.48 0.00 0.00 55.95 55.40 1fat s SER 177 Cb -0.12 0.06 0.02 0.00 0.10 0.00 0.00 66.02 66.08 1fat s SER 177 CO 0.02 -0.40 0.28 -0.22 0.98 0.00 0.00 173.24 173.90 1fat s LEU 178 N -3.01 0.95 -0.04 2.42 0.20 -0.33 -1.91 118.68 116.96 1fat s LEU 178 Ca 0.12 0.35 -0.07 0.00 0.69 0.00 0.00 54.13 55.22 1fat s LEU 178 Cb 0.04 1.05 0.01 0.00 -0.43 0.00 0.00 46.19 46.85 1fat s LEU 178 CO -0.03 -0.23 0.18 0.68 -0.29 0.00 0.00 176.35 176.66 1fat s VAL 179 N -0.46 0.03 -0.51 1.68 -7.23 -0.82 -1.09 120.40 112.00 1fat s VAL 179 Ca -0.06 -0.26 -0.11 0.00 -1.81 0.00 0.00 61.98 59.74 1fat s VAL 179 Cb -0.04 -0.35 0.13 0.00 0.56 0.00 0.00 36.38 36.69 1fat s VAL 179 CO 0.02 -0.14 0.41 -0.31 -0.31 0.00 0.00 175.10 174.77 1fat s TYR 180 N -0.48 3.40 0.44 2.82 2.02 -0.55 -1.49 117.35 123.50 1fat s TYR 180 Ca -0.06 -1.76 0.19 0.00 -0.37 0.00 0.00 57.07 55.08 1fat s TYR 180 Cb -0.04 -3.59 1.14 0.00 -0.40 0.00 0.00 41.96 39.08 1fat s TYR 180 CO 0.01 -1.00 1.87 -1.35 -1.57 0.00 0.00 175.55 173.52 1fat h PRO 181 N 8.48 0.33 -0.40 -1.71 0.11 -1.85 0.85 132.00 137.80 1fat h PRO 181 Ca -0.21 -0.02 -0.14 0.00 0.11 0.00 0.00 66.00 65.74 1fat h PRO 181 Cb 1.07 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.10 1fat h PRO 181 CO 0.90 0.22 -0.29 0.66 -0.21 0.00 0.00 178.00 179.28 1fat h SER 182 N 0.34 0.90 0.61 -2.05 4.64 -1.92 -3.26 113.55 112.80 1fat h SER 182 Ca 0.44 -0.36 -0.04 0.00 -0.47 0.00 0.00 61.79 61.35 1fat h SER 182 Cb 1.19 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 63.02 1fat h SER 182 CO -0.14 1.12 -1.43 0.00 -0.87 0.00 0.00 176.83 175.51 1fat n GLN 183 N -4.08 0.63 -1.76 4.77 1.13 -0.43 -4.97 117.38 112.66 1fat n GLN 183 Ca -0.01 0.04 -0.10 0.00 -1.94 0.00 0.00 57.00 54.99 1fat n GLN 183 Cb 0.48 -1.72 -0.02 0.00 0.11 0.00 0.00 30.24 29.09 1fat n GLN 183 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1fat n LYS 184 N -2.59 -0.74 -3.36 -1.09 5.02 0.28 -5.01 118.16 110.67 1fat n LYS 184 Ca -0.04 0.65 -0.22 0.00 -2.02 0.00 0.00 58.31 56.67 1fat n LYS 184 Cb 0.63 -4.64 -0.01 0.00 -0.02 0.00 0.00 35.03 31.00 1fat n LYS 184 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1fat s THR 185 N -2.43 4.66 0.02 -0.18 -4.23 -1.20 -4.91 115.64 107.36 1fat s THR 185 Ca 0.00 -0.62 -0.22 0.00 -1.18 0.00 0.00 61.69 59.67 1fat s THR 185 Cb 0.00 -3.69 0.05 0.00 1.34 0.00 0.00 72.50 70.20 1fat s THR 185 CO 0.00 -0.41 0.49 -0.94 -0.54 0.00 0.00 174.62 173.22 1fat s SER 186 N -4.10 -0.41 -0.02 3.99 1.04 -1.26 -1.48 113.70 111.46 1fat s SER 186 Ca 0.42 0.22 -0.10 0.00 0.48 0.00 0.00 55.95 56.98 1fat s SER 186 Cb -0.10 0.46 0.01 0.00 0.10 0.00 0.00 66.02 66.49 1fat s SER 186 CO 0.35 -0.64 0.21 -0.36 0.98 0.00 0.00 173.24 173.78 1fat s PHE 187 N -2.04 -0.09 0.04 5.02 0.40 -0.25 -4.97 117.98 116.10 1fat s PHE 187 Ca -0.08 0.14 -0.05 0.00 -0.60 0.00 0.00 56.93 56.34 1fat s PHE 187 Cb -0.01 0.02 -0.01 0.00 0.51 0.00 0.00 43.02 43.53 1fat s PHE 187 CO 0.01 -0.29 0.07 -1.50 0.70 0.00 0.00 175.22 174.21 1fat s ILE 188 N -1.09 0.14 -0.02 0.64 2.07 -1.26 -1.19 121.20 120.50 1fat s ILE 188 Ca -0.12 -1.15 -0.12 0.00 -1.41 0.00 0.00 60.65 57.86 1fat s ILE 188 Cb -0.06 -0.89 0.02 0.00 0.13 0.00 0.00 42.46 41.65 1fat s ILE 188 CO 0.02 -0.63 0.26 -0.69 -1.91 0.00 0.00 174.94 171.99 1fat s VAL 189 N -2.63 0.06 -0.24 4.00 1.01 0.46 -4.85 120.40 118.21 1fat s VAL 189 Ca -0.05 -0.49 -0.21 0.00 0.00 0.00 0.00 61.98 61.23 1fat s VAL 189 Cb -0.01 -0.54 0.06 0.00 0.00 0.00 0.00 36.38 35.89 1fat s VAL 189 CO -0.05 -0.27 0.62 -0.94 0.00 0.00 0.00 175.10 174.47 1fat s SER 190 N -1.20 -0.67 0.23 3.32 1.04 -1.26 -1.07 113.70 114.08 1fat s SER 190 Ca -0.13 1.27 -0.18 0.00 0.48 0.00 0.00 55.95 57.40 1fat s SER 190 Cb -0.06 1.27 0.02 0.00 0.10 0.00 0.00 66.02 67.35 1fat s SER 190 CO 0.03 -0.22 0.57 -0.62 0.98 0.00 0.00 173.24 173.98 1fat s ASP 191 N 0.50 -0.24 -0.08 7.02 2.15 -0.64 -4.99 116.67 120.38 1fat s ASP 191 Ca -0.01 -0.58 -0.13 0.00 0.43 0.00 0.00 52.55 52.26 1fat s ASP 191 Cb -0.05 0.62 -0.05 0.00 -0.30 0.00 0.00 42.92 43.15 1fat s ASP 191 CO -0.02 -1.15 0.32 0.42 -0.17 0.00 0.00 175.17 174.58 1fat s THR 192 N -3.91 5.23 -0.00 1.71 -4.23 -1.26 -0.61 115.64 112.56 1fat s THR 192 Ca 0.12 0.62 0.03 0.00 -1.18 0.00 0.00 61.69 61.28 1fat s THR 192 Cb -0.02 -3.63 -0.01 0.00 1.34 0.00 0.00 72.50 70.18 1fat s THR 192 CO 0.02 0.51 -0.08 -0.69 -0.54 0.00 0.00 174.62 173.83 1fat s VAL 193 N -0.46 0.66 -0.49 2.29 1.01 0.10 -4.92 120.40 118.60 1fat s VAL 193 Ca 0.20 -0.43 -0.11 0.00 0.00 0.00 0.00 61.98 61.64 1fat s VAL 193 Cb -0.14 -0.57 0.12 0.00 0.00 0.00 0.00 36.38 35.79 1fat s VAL 193 CO 0.08 0.14 0.38 -0.62 0.00 0.00 0.00 175.10 175.08 1fat s ASP 194 N -0.33 5.83 0.30 3.32 2.15 -1.26 -4.68 116.67 122.00 1fat s ASP 194 Ca 0.02 -1.88 0.00 0.00 0.43 0.00 0.00 52.55 51.12 1fat s ASP 194 Cb -0.04 -2.06 0.52 0.00 -0.30 0.00 0.00 42.92 41.04 1fat s ASP 194 CO -0.00 -0.74 1.93 -0.07 -0.17 0.00 0.00 175.17 176.12 1fat h LEU 195 N 8.56 0.90 -1.68 -1.34 4.07 -1.97 -1.76 115.31 122.09 1fat h LEU 195 Ca -0.23 -0.00 0.04 0.00 0.08 0.00 0.00 57.88 57.77 1fat h LEU 195 Cb 1.08 -0.20 -0.02 0.00 1.08 0.00 0.00 40.66 42.60 1fat h LEU 195 CO 0.91 0.60 0.29 0.11 -1.08 0.00 0.00 178.44 179.26 1fat h LYS 196 N 1.04 0.39 -0.28 1.13 1.57 -1.93 0.16 116.57 118.65 1fat h LYS 196 Ca 0.36 -0.02 -0.16 0.00 -1.87 0.00 0.00 60.65 58.96 1fat h LYS 196 Cb 0.12 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 1fat h LYS 196 CO -0.12 0.26 -0.47 0.77 -0.57 0.00 0.00 179.45 179.32 1fat h SER 197 N 0.40 0.80 0.00 0.86 0.02 -1.75 -3.38 113.55 110.50 1fat h SER 197 Ca 0.18 -0.39 -0.29 0.00 -0.84 0.00 0.00 61.79 60.45 1fat h SER 197 Cb 0.20 -0.23 -0.05 0.00 0.14 0.00 0.00 62.40 62.46 1fat h SER 197 CO -0.04 1.14 -2.09 0.55 -1.14 0.00 0.00 176.83 175.24 1fat n VAL 198 N -4.01 1.10 -3.65 2.27 3.14 -1.01 -5.04 118.33 111.13 1fat n VAL 198 Ca -0.03 -0.58 -0.32 0.00 -2.96 0.00 0.00 64.34 60.46 1fat n VAL 198 Cb 0.57 -0.82 -0.05 0.00 -1.06 0.00 0.00 33.84 32.48 1fat n VAL 198 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 1fat s LEU 199 N -5.54 4.26 0.68 6.55 1.43 0.52 -4.37 118.68 122.22 1fat s LEU 199 Ca -0.15 0.62 -0.11 0.00 -1.03 0.00 0.00 54.13 53.46 1fat s LEU 199 Cb 0.05 -3.33 -0.00 0.00 0.03 0.00 0.00 46.19 42.94 1fat s LEU 199 CO 0.57 0.05 1.07 -2.16 0.23 0.00 0.00 176.35 176.11 1fat s PRO 200 N -2.64 3.10 0.37 1.29 0.04 -1.26 -4.69 135.00 131.21 1fat s PRO 200 Ca 0.41 0.60 0.08 0.00 0.04 0.00 0.00 61.00 62.13 1fat s PRO 200 Cb -0.12 -2.04 0.82 0.00 0.04 0.00 0.00 34.50 33.20 1fat s PRO 200 CO 0.24 -0.89 1.92 0.93 0.04 0.00 0.00 177.00 179.24 1fat h GLU 201 N -0.55 0.66 -5.96 4.56 5.08 -1.96 -3.42 114.58 112.98 1fat h GLU 201 Ca -0.45 -0.04 -0.68 0.00 -1.00 0.00 0.00 59.36 57.19 1fat h GLU 201 Cb 1.23 -0.15 -0.27 0.00 0.50 0.00 0.00 28.75 30.06 1fat h GLU 201 CO 0.63 0.44 -0.81 -1.58 -1.00 0.00 0.00 179.01 176.68 1fat s TRP 202 N -5.63 2.63 0.06 4.33 0.52 -1.26 0.84 118.94 120.42 1fat s TRP 202 Ca -0.09 -0.49 -0.04 0.00 0.02 0.00 0.00 56.10 55.50 1fat s TRP 202 Cb 0.20 -1.67 -0.03 0.00 -1.15 0.00 0.00 33.47 30.83 1fat s TRP 202 CO 0.78 -0.06 0.05 0.14 0.02 0.00 0.00 176.95 177.87 1fat s VAL 203 N -0.25 0.19 0.26 4.03 -7.23 0.36 -4.16 120.40 113.60 1fat s VAL 203 Ca 0.00 -1.53 -0.04 0.00 -1.81 0.00 0.00 61.98 58.60 1fat s VAL 203 Cb -0.13 -1.37 -0.05 0.00 0.56 0.00 0.00 36.38 35.39 1fat s VAL 203 CO 0.03 -0.85 0.51 -0.44 -0.31 0.00 0.00 175.10 174.04 1fat s SER 204 N -2.79 6.44 -0.01 4.85 0.01 -0.39 -0.21 113.70 121.60 1fat s SER 204 Ca 0.05 0.64 0.04 0.00 1.31 0.00 0.00 55.95 57.99 1fat s SER 204 Cb 0.06 -2.11 -0.01 0.00 0.21 0.00 0.00 66.02 64.17 1fat s SER 204 CO -0.10 -0.15 -0.12 -0.69 0.41 0.00 0.00 173.24 172.60 1fat s VAL 205 N -2.01 0.94 -0.19 3.43 1.01 -1.26 -2.24 120.40 120.07 1fat s VAL 205 Ca 0.43 -0.50 0.00 0.00 0.00 0.00 0.00 61.98 61.90 1fat s VAL 205 Cb -0.11 -0.79 0.00 0.00 0.00 0.00 0.00 36.38 35.48 1fat s VAL 205 CO 0.29 0.27 0.00 0.61 0.00 0.00 0.00 175.10 176.27 1fat n GLY 206 N 2.82 -0.85 3.26 4.51 0.00 -0.82 -1.48 105.19 112.63 1fat n GLY 206 Ca -0.14 -0.14 -0.16 0.00 0.00 0.00 0.00 46.02 45.58 1fat n GLY 206 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1fat s PHE 207 N -4.00 1.35 -0.03 1.61 0.08 0.01 -0.71 117.98 116.30 1fat s PHE 207 Ca 0.00 -0.67 -0.08 0.00 0.12 0.00 0.00 56.93 56.30 1fat s PHE 207 Cb 0.00 -0.68 0.01 0.00 -0.57 0.00 0.00 43.02 41.78 1fat s PHE 207 CO 0.00 0.14 0.18 0.45 -0.10 0.00 0.00 175.22 175.89 1fat s SER 208 N -2.95 -0.08 0.07 1.36 0.15 -0.22 -1.54 113.70 110.48 1fat s SER 208 Ca 0.15 0.04 -0.26 0.00 0.70 0.00 0.00 55.95 56.58 1fat s SER 208 Cb -0.00 0.29 0.07 0.00 -1.71 0.00 0.00 66.02 64.67 1fat s SER 208 CO 0.02 -0.27 0.66 0.00 1.20 0.00 0.00 173.24 174.85 1fat s ALA 209 N -0.85 -1.69 0.13 5.45 0.00 -0.81 -0.82 121.76 123.17 1fat s ALA 209 Ca -0.09 0.84 -0.06 0.00 0.00 0.00 0.00 51.96 52.65 1fat s ALA 209 Cb -0.05 0.50 -0.02 0.00 0.00 0.00 0.00 23.12 23.55 1fat s ALA 209 CO 0.01 -0.62 0.17 0.95 0.00 0.00 0.00 175.76 176.28 1fat s THR 210 N -2.77 0.10 0.30 0.00 -4.23 -1.11 -1.80 115.64 106.13 1fat s THR 210 Ca -0.03 -1.54 0.10 0.00 -1.18 0.00 0.00 61.69 59.05 1fat s THR 210 Cb -0.01 -1.78 -0.05 0.00 1.34 0.00 0.00 72.50 72.00 1fat s THR 210 CO -0.05 -0.47 -0.06 0.42 -0.54 0.00 0.00 174.62 173.92 1fat s THR 211 N -3.97 2.85 0.62 3.99 -4.23 -0.62 -2.21 115.64 112.07 1fat s THR 211 Ca 0.16 -2.09 -0.18 0.00 -1.18 0.00 0.00 61.69 58.40 1fat s THR 211 Cb 0.05 -2.66 -0.04 0.00 1.34 0.00 0.00 72.50 71.19 1fat s THR 211 CO -0.02 -0.32 1.04 0.61 -0.54 0.00 0.00 174.62 175.39 1fat n GLY 212 N -0.83 -0.11 0.42 3.99 0.00 -0.18 -3.96 105.19 104.52 1fat n GLY 212 Ca -0.05 -0.15 0.10 0.00 0.00 0.00 0.00 46.02 45.92 1fat n GLY 212 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1fat n ILE 213 N -1.80 0.16 -4.53 -0.61 -5.35 -1.26 -1.41 119.36 104.56 1fat n ILE 213 Ca 0.14 -0.26 -0.22 0.00 -0.27 0.00 0.00 62.75 62.14 1fat n ILE 213 Cb 0.48 0.22 -0.15 0.00 -1.74 0.00 0.00 39.64 38.44 1fat n ILE 213 CO 0.00 0.00 0.00 0.20 -1.76 0.00 0.00 176.55 174.99 1fat s ASN 214 N -1.57 1.48 0.00 7.28 0.01 -1.26 -4.73 114.94 116.14 1fat s ASN 214 Ca 0.31 -0.23 0.00 0.00 -0.71 0.00 0.00 52.86 52.23 1fat s ASN 214 Cb 0.16 -0.35 0.00 0.00 0.41 0.00 0.00 41.25 41.48 1fat s ASN 214 CO 0.25 0.11 0.00 0.29 -1.51 0.00 0.00 177.10 176.24 1fat n LYS 215 N 3.14 0.00 -0.05 -0.60 5.02 -1.26 -1.16 118.16 123.25 1fat n LYS 215 Ca -0.17 0.00 0.01 0.00 -2.02 0.00 0.00 58.31 56.13 1fat n LYS 215 Cb 0.54 0.00 0.04 0.00 -0.02 0.00 0.00 35.03 35.59 1fat n LYS 215 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1fat n GLY 216 N -0.40 -0.28 2.97 0.72 0.00 -1.26 -4.57 105.19 102.36 1fat n GLY 216 Ca 0.00 -0.09 -0.31 0.00 0.00 0.00 0.00 46.02 45.63 1fat n GLY 216 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1fat s ASN 217 N -0.86 4.41 0.02 1.61 0.02 -0.31 -0.04 114.94 119.80 1fat s ASN 217 Ca 0.05 -2.97 -0.11 0.00 -1.02 0.00 0.00 52.86 48.82 1fat s ASN 217 Cb 0.03 -1.66 0.01 0.00 0.02 0.00 0.00 41.25 39.65 1fat s ASN 217 CO 0.03 -0.25 0.22 0.68 0.02 0.00 0.00 177.10 177.81 1fat s VAL 218 N -0.22 0.09 0.18 1.60 -7.23 -0.43 -1.01 120.40 113.39 1fat s VAL 218 Ca 0.17 -0.75 -0.16 0.00 -1.81 0.00 0.00 61.98 59.42 1fat s VAL 218 Cb -0.25 -0.78 0.02 0.00 0.56 0.00 0.00 36.38 35.93 1fat s VAL 218 CO -0.01 -0.41 0.48 -1.83 -0.31 0.00 0.00 175.10 173.02 1fat s GLU 219 N -2.15 1.31 0.22 4.82 -1.05 -1.14 -4.35 118.70 116.37 1fat s GLU 219 Ca -0.08 -0.88 -0.04 0.00 -0.15 0.00 0.00 54.97 53.82 1fat s GLU 219 Cb -0.03 0.50 -0.05 0.00 -0.44 0.00 0.00 34.13 34.11 1fat s GLU 219 CO -0.01 -0.54 0.46 0.95 0.95 0.00 0.00 175.26 177.06 1fat s THR 220 N -3.88 5.10 -0.41 1.83 -4.23 -0.47 -4.80 115.64 108.80 1fat s THR 220 Ca 0.09 -0.04 0.02 0.00 -1.18 0.00 0.00 61.69 60.58 1fat s THR 220 Cb -0.00 -3.70 0.13 0.00 1.34 0.00 0.00 72.50 70.27 1fat s THR 220 CO -0.04 -0.17 0.21 0.20 -0.54 0.00 0.00 174.62 174.28 1fat s ASN 221 N -2.93 3.74 -0.05 3.99 0.01 -1.26 -3.36 114.94 115.09 1fat s ASN 221 Ca 0.42 -2.43 0.06 0.00 -0.71 0.00 0.00 52.86 50.20 1fat s ASN 221 Cb -0.11 -1.01 -0.02 0.00 0.41 0.00 0.00 41.25 40.52 1fat s ASN 221 CO 0.28 -0.30 -0.23 -1.81 -1.51 0.00 0.00 177.10 173.53 1fat s ASP 222 N 0.61 3.27 -0.15 -1.22 1.01 -0.93 -1.49 116.67 117.77 1fat s ASP 222 Ca 0.16 -0.44 -0.03 0.00 0.71 0.00 0.00 52.55 52.95 1fat s ASP 222 Cb -0.23 -0.72 -0.02 0.00 1.01 0.00 0.00 42.92 42.95 1fat s ASP 222 CO -0.04 0.28 -0.06 -0.69 0.21 0.00 0.00 175.17 174.87 1fat s VAL 223 N -0.37 3.67 -0.26 -1.27 1.01 -0.32 -0.49 120.40 122.37 1fat s VAL 223 Ca 0.03 -0.43 0.20 0.00 0.00 0.00 0.00 61.98 61.77 1fat s VAL 223 Cb -0.12 -2.60 -0.28 0.00 0.00 0.00 0.00 36.38 33.38 1fat s VAL 223 CO 0.02 0.50 0.54 0.18 0.00 0.00 0.00 175.10 176.34 1fat n LEU 224 N 3.56 0.24 -3.57 3.92 4.77 0.33 -1.45 117.00 124.80 1fat n LEU 224 Ca -0.18 -0.13 -0.09 0.00 -0.03 0.00 0.00 56.01 55.58 1fat n LEU 224 Cb 0.52 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.57 1fat n LEU 224 CO 0.32 0.06 0.81 -0.94 -1.33 0.00 0.00 177.39 176.31 1fat s SER 225 N -3.92 -0.32 -0.05 -1.43 1.04 -1.24 -4.54 113.70 103.23 1fat s SER 225 Ca -0.03 0.26 -0.22 0.00 0.48 0.00 0.00 55.95 56.44 1fat s SER 225 Cb 0.13 0.28 0.05 0.00 0.10 0.00 0.00 66.02 66.58 1fat s SER 225 CO 0.82 -0.36 0.49 0.86 0.98 0.00 0.00 173.24 176.03 1fat s TRP 226 N -1.59 -0.42 -0.14 5.02 -0.00 -0.94 -1.98 118.94 118.88 1fat s TRP 226 Ca 0.01 0.75 -0.09 0.00 -0.00 0.00 0.00 56.10 56.78 1fat s TRP 226 Cb -0.01 0.24 0.05 0.00 -0.00 0.00 0.00 33.47 33.75 1fat s TRP 226 CO -0.02 -0.47 0.35 -1.54 -0.00 0.00 0.00 176.95 175.27 1fat s SER 227 N -1.10 -0.41 0.17 5.86 1.04 -0.29 -0.86 113.70 118.12 1fat s SER 227 Ca -0.11 0.74 0.07 0.00 0.48 0.00 0.00 55.95 57.13 1fat s SER 227 Cb -0.03 0.65 -0.04 0.00 0.10 0.00 0.00 66.02 66.70 1fat s SER 227 CO 0.06 -0.17 -0.14 0.12 0.98 0.00 0.00 173.24 174.09 1fat s PHE 228 N 1.09 1.59 -0.28 5.02 5.36 -0.87 -1.01 117.98 128.88 1fat s PHE 228 Ca -0.07 -0.59 -0.20 0.00 -0.96 0.00 0.00 56.93 55.11 1fat s PHE 228 Cb -0.08 -0.77 0.09 0.00 -0.34 0.00 0.00 43.02 41.93 1fat s PHE 228 CO -0.09 0.27 0.79 0.00 -1.46 0.00 0.00 175.22 174.73 1fat s ALA 229 N -2.75 -1.93 -0.07 11.12 0.00 -0.62 -1.96 121.76 125.54 1fat s ALA 229 Ca 0.18 2.21 -0.06 0.00 0.00 0.00 0.00 51.96 54.30 1fat s ALA 229 Cb -0.02 -1.41 0.03 0.00 0.00 0.00 0.00 23.12 21.71 1fat s ALA 229 CO 0.05 -0.35 0.19 0.45 0.00 0.00 0.00 175.76 176.10 1fat s SER 230 N 1.07 -0.19 -0.16 0.00 0.15 -0.83 -1.40 113.70 112.35 1fat s SER 230 Ca -0.06 0.38 -0.00 0.00 0.70 0.00 0.00 55.95 56.98 1fat s SER 230 Cb -0.05 0.35 0.03 0.00 -1.71 0.00 0.00 66.02 64.65 1fat s SER 230 CO -0.12 -0.09 -0.08 -0.75 1.20 0.00 0.00 173.24 173.40 1fat s LYS 231 N 0.44 1.73 -0.23 5.44 2.20 -0.62 -2.12 119.74 126.58 1fat s LYS 231 Ca -0.03 -0.54 -0.07 0.00 -0.36 0.00 0.00 55.97 54.98 1fat s LYS 231 Cb -0.04 -2.02 -0.03 0.00 -1.51 0.00 0.00 37.83 34.23 1fat s LYS 231 CO -0.02 -0.36 0.04 -1.17 -0.36 0.00 0.00 175.35 173.48 1fat s LEU 232 N 1.57 3.37 0.00 5.43 2.96 -1.25 -2.19 118.68 128.58 1fat s LEU 232 Ca 0.02 -0.21 0.00 0.00 -0.22 0.00 0.00 54.13 53.72 1fat s LEU 232 Cb -0.14 -1.89 0.00 0.00 0.50 0.00 0.00 46.19 44.66 1fat s LEU 232 CO -0.08 -0.00 0.00 -0.24 -1.32 0.00 0.00 176.35 174.70