#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 -1.69 -4.87 6.43 4.05 -0.82 -4.92 115.26 113.44 1fat n ASN 2 Ca 0.00 -3.06 -0.31 0.00 0.45 0.00 0.00 54.58 51.66 1fat n ASN 2 Cb 0.00 0.86 0.01 0.00 1.23 0.00 0.00 39.78 41.88 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 -1.48 6.16 -0.04 1.20 1.01 -1.26 -3.56 116.67 118.69 1fat s ASP 3 Ca 0.33 1.44 -0.20 0.00 0.71 0.00 0.00 52.55 54.82 1fat s ASP 3 Cb 0.20 -2.47 0.04 0.00 1.01 0.00 0.00 42.92 41.70 1fat s ASP 3 CO -0.19 -0.92 0.45 -0.51 0.21 0.00 0.00 175.17 174.21 1fat s ILE 4 N -3.17 0.03 -0.28 0.77 1.10 -0.73 -5.01 121.20 113.92 1fat s ILE 4 Ca 0.55 -0.27 -0.24 0.00 -0.51 0.00 0.00 60.65 60.18 1fat s ILE 4 Cb -0.11 -0.75 0.10 0.00 0.15 0.00 0.00 42.46 41.85 1fat s ILE 4 CO 0.54 -0.15 0.91 -0.47 -2.11 0.00 0.00 174.94 173.67 1fat s TYR 5 N -1.12 -0.60 0.18 3.50 5.04 -1.26 -2.00 117.35 121.08 1fat s TYR 5 Ca -0.11 1.45 -0.17 0.00 -2.44 0.00 0.00 57.07 55.79 1fat s TYR 5 Cb -0.03 0.34 0.03 0.00 0.35 0.00 0.00 41.96 42.65 1fat s TYR 5 CO 0.06 -0.29 0.50 -0.59 -1.34 0.00 0.00 175.55 173.88 1fat s PHE 6 N 0.35 -0.16 -0.29 4.97 -0.12 -0.83 -5.01 117.98 116.89 1fat s PHE 6 Ca 0.01 -0.17 -0.04 0.00 -0.05 0.00 0.00 56.93 56.68 1fat s PHE 6 Cb -0.05 0.36 0.16 0.00 -0.63 0.00 0.00 43.02 42.87 1fat s PHE 6 CO -0.04 -0.86 0.59 1.21 -0.05 0.00 0.00 175.22 176.07 1fat s ASN 7 N -2.85 -1.13 -0.26 1.98 2.47 -1.26 -2.18 114.94 111.70 1fat s ASN 7 Ca 0.07 1.06 -0.07 0.00 0.42 0.00 0.00 52.86 54.35 1fat s ASN 7 Cb -0.00 2.09 -0.01 0.00 -1.45 0.00 0.00 41.25 41.88 1fat s ASN 7 CO -0.06 -0.25 0.06 -0.36 -3.72 0.00 0.00 177.10 172.78 1fat s PHE 8 N 2.84 3.09 -2.68 0.43 0.08 -0.12 -4.92 117.98 116.71 1fat s PHE 8 Ca 0.10 -0.68 0.25 0.00 0.12 0.00 0.00 56.93 56.73 1fat s PHE 8 Cb -0.14 -2.24 0.63 0.00 -0.57 0.00 0.00 43.02 40.70 1fat s PHE 8 CO -0.20 -0.46 1.50 1.04 -0.10 0.00 0.00 175.22 177.01 1fat n GLN 9 N 4.89 2.01 -3.64 0.44 6.02 -1.26 -2.25 117.38 123.59 1fat n GLN 9 Ca -0.16 -1.48 -0.05 0.00 -0.01 0.00 0.00 57.00 55.31 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 -1.94 0.54 0.31 -1.09 1.70 -1.26 -4.80 118.95 112.41 1fat s ARG 10 Ca 0.34 0.89 -0.14 0.00 -0.47 0.00 0.00 55.73 56.35 1fat s ARG 10 Cb 0.20 0.13 -0.09 0.00 -0.57 0.00 0.00 34.95 34.63 1fat s ARG 10 CO 0.31 -0.11 0.71 -0.06 -1.08 0.00 0.00 175.30 175.07 1fat s PHE 11 N 1.33 3.38 -0.09 5.89 0.40 -0.07 -5.03 117.98 123.79 1fat s PHE 11 Ca -0.08 1.16 -0.07 0.00 -0.60 0.00 0.00 56.93 57.34 1fat s PHE 11 Cb -0.04 -2.49 0.03 0.00 0.51 0.00 0.00 43.02 41.02 1fat s PHE 11 CO -0.16 0.11 0.22 1.21 0.70 0.00 0.00 175.22 177.31 1fat s ASN 12 N -2.31 -0.23 0.00 1.36 3.84 -1.26 -4.37 114.94 111.97 1fat s ASN 12 Ca 0.53 0.45 0.17 0.00 0.21 0.00 0.00 52.86 54.22 1fat s ASN 12 Cb -0.10 0.43 1.00 0.00 -0.55 0.00 0.00 41.25 42.03 1fat s ASN 12 CO 0.18 -0.09 1.42 -1.84 -2.79 0.00 0.00 177.10 173.97 1fat n GLU 13 N 3.22 0.51 0.20 0.43 0.00 -1.26 -3.79 120.64 119.95 1fat n GLU 13 Ca -0.15 0.01 0.09 0.00 0.00 0.00 0.00 57.16 57.11 1fat n GLU 13 Cb 0.57 -1.50 0.15 0.00 0.00 0.00 0.00 31.44 30.66 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 0.28 -0.25 3.84 1.35 -2.03 -3.20 112.91 112.91 1fat h THR 14 Ca 0.00 -1.36 -0.13 0.00 -0.55 0.00 0.00 66.41 64.37 1fat h THR 14 Cb 0.01 2.11 -0.08 0.00 -1.73 0.00 0.00 68.15 68.46 1fat h THR 14 CO 0.00 0.16 -0.20 -0.46 -0.25 0.00 0.00 175.52 174.77 1fat n ASN 15 N -3.15 2.26 -4.19 5.36 0.23 -1.25 -5.00 115.26 109.52 1fat n ASN 15 Ca 0.03 -3.81 -0.21 0.00 -0.53 0.00 0.00 54.58 50.06 1fat n ASN 15 Cb 0.58 -0.60 -0.13 0.00 -2.08 0.00 0.00 39.78 37.55 1fat n ASN 15 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 1fat s LEU 16 N -3.24 2.23 -0.29 -4.53 1.02 -1.21 -1.30 118.68 111.35 1fat s LEU 16 Ca 0.43 -0.56 -0.07 0.00 0.02 0.00 0.00 54.13 53.95 1fat s LEU 16 Cb 0.40 -0.67 0.00 0.00 0.02 0.00 0.00 46.19 45.94 1fat s LEU 16 CO -0.02 0.02 0.09 -0.63 0.02 0.00 0.00 176.35 175.83 1fat s ILE 17 N -1.04 4.09 -0.11 -0.59 1.01 0.63 -4.80 121.20 120.39 1fat s ILE 17 Ca 0.02 -0.62 -0.03 0.00 0.00 0.00 0.00 60.65 60.03 1fat s ILE 17 Cb -0.09 -3.09 -0.03 0.00 0.01 0.00 0.00 42.46 39.26 1fat s ILE 17 CO 0.02 0.09 -0.01 -0.76 0.00 0.00 0.00 174.94 174.28 1fat s LEU 18 N 1.53 3.47 -0.04 2.97 1.43 -1.26 -0.91 118.68 125.86 1fat s LEU 18 Ca 0.03 0.04 0.05 0.00 -1.03 0.00 0.00 54.13 53.22 1fat s LEU 18 Cb -0.17 -1.81 -0.01 0.00 0.03 0.00 0.00 46.19 44.23 1fat s LEU 18 CO 0.03 0.30 -0.19 -1.10 0.23 0.00 0.00 176.35 175.62 1fat s GLN 19 N -0.40 1.87 7.99 1.70 -0.21 0.67 -4.98 119.66 126.30 1fat s GLN 19 Ca 0.07 -0.67 0.00 0.00 0.02 0.00 0.00 55.36 54.78 1fat s GLN 19 Cb -0.12 -1.65 0.00 0.00 1.00 0.00 0.00 33.01 32.24 1fat s GLN 19 CO 0.02 0.30 0.00 0.54 -2.12 0.00 0.00 175.29 174.03 1fat n ARG 20 N 3.01 0.00 0.00 2.91 5.12 -1.26 -1.78 116.66 124.66 1fat n ARG 20 Ca -0.17 0.00 0.13 0.00 -1.93 0.00 0.00 57.85 55.88 1fat n ARG 20 Cb 0.53 0.00 0.78 0.00 -1.16 0.00 0.00 32.46 32.61 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 6.50 0.00 -4.76 0.55 8.00 -0.85 -4.86 116.55 121.12 1fat n ASP 21 Ca 0.00 -1.04 -0.39 0.00 0.71 0.00 0.00 54.79 54.07 1fat n ASP 21 Cb 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.11 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 -2.00 3.03 0.01 2.24 0.00 -1.12 -4.28 121.76 119.64 1fat s ALA 22 Ca 0.39 1.22 -0.28 0.00 0.00 0.00 0.00 51.96 53.30 1fat s ALA 22 Cb 0.18 -3.50 0.09 0.00 0.00 0.00 0.00 23.12 19.89 1fat s ALA 22 CO 0.30 -1.02 0.79 -1.54 0.00 0.00 0.00 175.76 174.29 1fat s SER 23 N -0.94 -0.47 -0.21 0.00 1.04 -0.60 -4.72 113.70 107.80 1fat s SER 23 Ca 0.64 0.19 -0.06 0.00 0.48 0.00 0.00 55.95 57.20 1fat s SER 23 Cb -0.37 0.46 -0.03 0.00 0.10 0.00 0.00 66.02 66.18 1fat s SER 23 CO 0.46 -0.67 0.03 -0.69 0.98 0.00 0.00 173.24 173.35 1fat s VAL 24 N -2.64 4.23 0.83 5.02 1.01 -1.26 -0.01 120.40 127.58 1fat s VAL 24 Ca 0.00 -0.22 -0.12 0.00 0.00 0.00 0.00 61.98 61.65 1fat s VAL 24 Cb -0.01 -2.93 0.09 0.00 0.00 0.00 0.00 36.38 33.53 1fat s VAL 24 CO -0.05 0.42 1.10 -0.94 0.00 0.00 0.00 175.10 175.63 1fat s SER 25 N 0.97 4.23 0.65 3.32 1.04 -0.24 -4.86 113.70 118.82 1fat s SER 25 Ca 0.03 1.26 0.39 0.00 0.48 0.00 0.00 55.95 58.11 1fat s SER 25 Cb -0.14 -1.97 2.15 0.00 0.10 0.00 0.00 66.02 66.16 1fat s SER 25 CO 0.02 -2.13 2.25 0.77 0.98 0.00 0.00 173.24 175.13 1fat h SER 26 N -1.20 0.00 -0.48 7.02 4.64 -1.97 0.69 113.55 122.25 1fat h SER 26 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1fat h SER 26 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1fat h SER 26 CO 0.59 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 175.01 1fat n SER 27 N -3.19 2.91 -1.82 4.97 3.41 -1.26 -4.94 113.62 113.69 1fat n SER 27 Ca -0.02 -1.96 -0.11 0.00 -0.26 0.00 0.00 58.87 56.52 1fat n SER 27 Cb 0.16 -0.32 0.03 0.00 -0.26 0.00 0.00 64.21 63.82 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 1.38 0.27 3.55 5.00 0.00 0.24 -4.85 105.19 110.79 1fat n GLY 28 Ca 0.19 -0.28 -0.34 0.00 0.00 0.00 0.00 46.02 45.59 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 -5.51 2.92 -0.41 1.61 -0.21 -1.25 -0.90 119.66 115.91 1fat s GLN 29 Ca 0.24 -0.56 -0.27 0.00 0.02 0.00 0.00 55.36 54.79 1fat s GLN 29 Cb -0.11 -2.63 0.02 0.00 1.00 0.00 0.00 33.01 31.29 1fat s GLN 29 CO 0.30 0.57 1.03 -1.17 -2.12 0.00 0.00 175.29 173.90 1fat s LEU 30 N -0.55 3.87 -0.45 2.90 2.96 -0.50 -1.08 118.68 125.83 1fat s LEU 30 Ca 0.08 0.58 -0.11 0.00 -0.22 0.00 0.00 54.13 54.46 1fat s LEU 30 Cb -0.12 -3.40 0.09 0.00 0.50 0.00 0.00 46.19 43.26 1fat s LEU 30 CO 0.02 -1.02 0.32 -0.13 -1.32 0.00 0.00 176.35 174.22 1fat s ARG 31 N 3.87 2.67 0.48 1.98 0.52 0.99 -0.75 118.95 128.71 1fat s ARG 31 Ca 0.43 -1.53 0.25 0.00 -0.52 0.00 0.00 55.73 54.36 1fat s ARG 31 Cb -0.10 -3.91 1.21 0.00 0.52 0.00 0.00 34.95 32.67 1fat s ARG 31 CO 0.23 -1.05 1.96 -0.07 0.02 0.00 0.00 175.30 176.40 1fat h LEU 32 N 8.51 0.00 -8.44 2.53 3.38 -1.40 -1.61 115.31 118.29 1fat h LEU 32 Ca -0.24 0.00 -0.38 0.00 0.09 0.00 0.00 57.88 57.35 1fat h LEU 32 Cb 1.09 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 41.64 1fat h LEU 32 CO 0.82 0.18 -0.76 0.42 0.09 0.00 0.00 178.44 179.19 1fat s THR 33 N -3.99 1.06 1.40 0.22 -4.23 -1.26 -2.81 115.64 106.04 1fat s THR 33 Ca -0.02 -1.46 -0.21 0.00 -1.18 0.00 0.00 61.69 58.82 1fat s THR 33 Cb 0.12 -1.20 0.36 0.00 1.34 0.00 0.00 72.50 73.12 1fat s THR 33 CO 0.61 -0.37 0.92 0.59 -0.54 0.00 0.00 174.62 175.84 1fat n ASN 34 N 0.95 -3.47 -0.79 3.99 3.02 -1.26 -4.75 115.26 112.94 1fat n ASN 34 Ca -0.19 -0.67 0.00 0.00 -0.03 0.00 0.00 54.58 53.70 1fat n ASN 34 Cb 0.56 -1.09 0.00 0.00 -0.61 0.00 0.00 39.78 38.64 1fat n ASN 34 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1fat n LEU 35 N -5.62 0.00 0.00 3.41 4.77 -1.26 -1.97 117.00 116.33 1fat n LEU 35 Ca 0.10 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 1fat n LEU 35 Cb 0.59 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.68 1fat n LEU 35 CO 0.46 0.00 0.00 -0.46 -1.33 0.00 0.00 177.39 176.06 1fat n ASN 36 N -2.34 0.00 0.00 -1.43 0.23 -0.88 -4.41 115.26 106.43 1fat n ASN 36 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.05 1fat n ASN 36 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 1fat n ASN 36 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1fat n ASN 38 N 0.00 0.00 0.00 0.53 3.02 -1.26 -4.71 115.26 112.84 1fat n ASN 38 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1fat n ASN 38 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 1fat n ASN 38 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1fat n GLY 39 N 0.00 1.42 3.53 7.41 0.00 -1.26 -5.10 105.19 111.19 1fat n GLY 39 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.40 2.49 0.03 1.61 0.41 -1.26 -5.06 118.70 116.51 1fat s GLU 40 Ca 0.00 -0.73 -0.34 0.00 -0.41 0.00 0.00 54.97 53.49 1fat s GLU 40 Cb 0.00 -2.43 -0.13 0.00 -1.78 0.00 0.00 34.13 29.80 1fat s GLU 40 CO 0.00 0.61 1.74 -2.30 -0.49 0.00 0.00 175.26 174.82 1fat n PRO 41 N 1.90 2.15 -2.20 0.39 -0.02 -1.26 -2.07 135.00 133.88 1fat n PRO 41 Ca -0.16 0.78 -0.37 0.00 -2.02 0.00 0.00 63.50 61.73 1fat n PRO 41 Cb 0.52 -2.59 -0.00 0.00 -0.02 0.00 0.00 33.50 31.41 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 2.59 3.65 0.30 -0.52 3.52 -0.83 -4.85 118.95 122.82 1fat s ARG 42 Ca 0.86 1.82 -0.23 0.00 -0.13 0.00 0.00 55.73 58.05 1fat s ARG 42 Cb -0.69 -2.36 -0.09 0.00 -1.56 0.00 0.00 34.95 30.25 1fat s ARG 42 CO 0.45 -0.65 0.87 0.08 -0.81 0.00 0.00 175.30 175.24 1fat s VAL 43 N -1.53 4.36 -1.22 7.11 1.01 -1.26 -3.80 120.40 125.07 1fat s VAL 43 Ca 0.65 1.58 -0.01 0.00 0.00 0.00 0.00 61.98 64.21 1fat s VAL 43 Cb -0.30 -3.90 0.00 0.00 0.00 0.00 0.00 36.38 32.18 1fat s VAL 43 CO 0.36 0.10 0.07 0.61 0.00 0.00 0.00 175.10 176.24 1fat n GLY 44 N 0.44 -0.22 3.83 4.51 0.00 -0.59 -4.99 105.19 108.16 1fat n GLY 44 Ca 0.01 -0.25 -0.34 0.00 0.00 0.00 0.00 46.02 45.44 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 -2.42 6.94 -0.11 1.61 0.15 -1.25 -4.86 113.70 113.77 1fat s SER 45 Ca 0.04 1.45 -0.04 0.00 0.70 0.00 0.00 55.95 58.09 1fat s SER 45 Cb -0.02 -2.44 0.05 0.00 -1.71 0.00 0.00 66.02 61.91 1fat s SER 45 CO 0.04 -0.15 0.22 -0.22 1.20 0.00 0.00 173.24 174.33 1fat s LEU 46 N -2.64 0.04 -0.08 3.45 0.20 -1.26 -0.88 118.68 117.51 1fat s LEU 46 Ca 0.52 0.49 -0.05 0.00 0.69 0.00 0.00 54.13 55.77 1fat s LEU 46 Cb -0.13 0.57 0.03 0.00 -0.43 0.00 0.00 46.19 46.24 1fat s LEU 46 CO 0.18 -0.21 0.20 -0.83 -0.29 0.00 0.00 176.35 175.40 1fat s GLY 47 N 1.97 -0.11 0.12 7.98 0.00 -0.58 -2.01 107.32 114.68 1fat s GLY 47 Ca -0.02 0.73 0.08 0.00 0.00 0.00 0.00 44.72 45.51 1fat s GLY 47 CO -0.08 0.86 -0.19 0.50 0.00 0.00 0.00 173.10 174.19 1fat s ARG 48 N 0.77 1.14 -0.09 2.90 0.52 -0.74 -2.18 118.95 121.27 1fat s ARG 48 Ca -0.05 -1.22 -0.05 0.00 -0.52 0.00 0.00 55.73 53.88 1fat s ARG 48 Cb -0.07 -1.32 0.04 0.00 0.52 0.00 0.00 34.95 34.12 1fat s ARG 48 CO -0.04 0.29 0.22 0.00 0.02 0.00 0.00 175.30 175.79 1fat s ALA 49 N -1.47 -0.49 0.13 2.13 0.00 -0.52 -0.24 121.76 121.30 1fat s ALA 49 Ca 0.09 0.86 0.05 0.00 0.00 0.00 0.00 51.96 52.96 1fat s ALA 49 Cb -0.09 -0.55 -0.04 0.00 0.00 0.00 0.00 23.12 22.45 1fat s ALA 49 CO 0.05 -0.17 -0.11 -0.06 0.00 0.00 0.00 175.76 175.46 1fat s PHE 50 N 1.05 1.25 0.20 0.00 0.08 -0.09 -1.03 117.98 119.44 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 -0.65 -0.08 0.00 -0.57 0.00 0.00 43.02 41.63 1fat s PHE 50 CO -0.07 0.08 1.14 -0.47 -0.10 0.00 0.00 175.22 175.80 1fat s TYR 51 N -2.76 3.52 0.53 0.36 5.04 -0.38 -0.27 117.35 123.39 1fat s TYR 51 Ca 0.11 1.55 0.41 0.00 -2.44 0.00 0.00 57.07 56.70 1fat s TYR 51 Cb -0.01 -3.34 2.15 0.00 0.35 0.00 0.00 41.96 41.11 1fat s TYR 51 CO 0.01 -0.83 2.27 0.66 -1.34 0.00 0.00 175.55 176.32 1fat h SER 52 N 4.96 0.00 -3.15 4.32 4.64 -1.51 -3.41 113.55 119.42 1fat h SER 52 Ca -0.45 0.00 -0.62 0.00 -0.47 0.00 0.00 61.79 60.25 1fat h SER 52 Cb 1.21 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.18 1fat h SER 52 CO 0.72 0.00 -0.51 0.00 -0.87 0.00 0.00 176.83 176.17 1fat s ALA 53 N -4.06 3.63 0.60 5.18 0.00 -1.26 -5.03 121.76 120.83 1fat s ALA 53 Ca -0.04 -0.70 -0.19 0.00 0.00 0.00 0.00 51.96 51.03 1fat s ALA 53 Cb 0.12 -2.03 -0.03 0.00 0.00 0.00 0.00 23.12 21.18 1fat s ALA 53 CO 0.45 0.28 1.28 -2.14 0.00 0.00 0.00 175.76 175.63 1fat s PRO 54 N 0.01 2.87 -0.02 0.00 0.02 -1.26 -4.80 135.00 131.82 1fat s PRO 54 Ca 0.08 2.02 0.04 0.00 0.02 0.00 0.00 61.00 63.17 1fat s PRO 54 Cb -0.12 -1.99 -0.03 0.00 0.02 0.00 0.00 34.50 32.39 1fat s PRO 54 CO -0.00 -1.34 -0.13 0.42 -0.33 0.00 0.00 177.00 175.62 1fat s ILE 55 N -1.44 3.17 -0.38 2.83 -1.09 -0.12 -4.94 121.20 119.23 1fat s ILE 55 Ca 0.78 -0.83 -0.18 0.00 -2.23 0.00 0.00 60.65 58.19 1fat s ILE 55 Cb -0.36 -2.30 0.01 0.00 -1.58 0.00 0.00 42.46 38.23 1fat s ILE 55 CO 0.39 0.49 0.50 -1.58 -1.23 0.00 0.00 174.94 173.51 1fat s GLN 56 N -1.05 3.44 0.10 2.79 0.74 -1.26 -1.00 119.66 123.42 1fat s GLN 56 Ca 0.14 -0.35 0.12 0.00 0.05 0.00 0.00 55.36 55.31 1fat s GLN 56 Cb -0.11 -3.87 -0.14 0.00 1.10 0.00 0.00 33.01 29.99 1fat s GLN 56 CO 0.03 -0.74 1.07 0.97 -0.55 0.00 0.00 175.29 176.08 1fat h ILE 57 N 5.67 1.09 -3.00 -2.34 6.09 0.85 -3.45 117.51 122.42 1fat h ILE 57 Ca -0.27 -2.72 0.05 0.00 -1.37 0.00 0.00 64.86 60.55 1fat h ILE 57 Cb 1.12 2.50 -0.06 0.00 0.47 0.00 0.00 36.82 40.84 1fat h ILE 57 CO 0.79 0.62 0.23 -1.66 -3.07 0.00 0.00 178.15 175.05 1fat s TRP 58 N -2.77 -0.25 -0.12 2.19 1.48 -0.97 -0.54 118.94 117.95 1fat s TRP 58 Ca -0.01 -0.16 -0.00 0.00 -1.06 0.00 0.00 56.10 54.87 1fat s TRP 58 Cb 0.09 0.68 0.02 0.00 -1.16 0.00 0.00 33.47 33.10 1fat s TRP 58 CO 0.80 -1.17 -0.10 0.34 -4.06 0.00 0.00 176.95 172.76 1fat s ASP 59 N -2.89 2.36 0.33 -2.66 -1.08 0.08 -4.51 116.67 108.30 1fat s ASP 59 Ca 0.09 -0.37 0.13 0.00 -0.52 0.00 0.00 52.55 51.88 1fat s ASP 59 Cb -0.05 -0.97 0.54 0.00 -1.46 0.00 0.00 42.92 40.98 1fat s ASP 59 CO 0.03 -0.09 1.70 -1.13 0.52 0.00 0.00 175.17 176.21 1fat h ASN 60 N 8.07 0.00 0.24 -0.34 -1.24 -1.94 0.61 115.58 120.98 1fat h ASN 60 Ca -0.33 0.00 -0.18 0.00 0.71 0.00 0.00 56.30 56.50 1fat h ASN 60 Cb 1.14 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 40.18 1fat h ASN 60 CO 0.46 0.49 -0.69 0.71 -1.29 0.00 0.00 177.43 177.11 1fat h THR 61 N 0.00 1.37 0.00 -3.57 1.35 -1.97 -3.19 112.91 106.91 1fat h THR 61 Ca -0.00 -2.08 0.00 0.00 -0.55 0.00 0.00 66.41 63.78 1fat h THR 61 Cb 0.93 2.06 0.00 0.00 -1.73 0.00 0.00 68.15 69.40 1fat h THR 61 CO 0.06 0.63 -1.64 0.35 -0.25 0.00 0.00 175.52 174.67 1fat n THR 62 N -3.86 0.05 -1.19 6.82 -2.24 -1.14 -4.97 114.28 107.75 1fat n THR 62 Ca -0.04 -0.37 -0.06 0.00 -2.27 0.00 0.00 64.05 61.31 1fat n THR 62 Cb 0.68 0.22 -0.03 0.00 -2.10 0.00 0.00 70.33 69.11 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 1.32 0.87 3.93 3.38 0.00 0.21 -5.02 105.19 109.89 1fat n GLY 63 Ca -0.02 -0.56 -0.26 0.00 0.00 0.00 0.00 46.02 45.18 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 -2.17 5.18 0.13 2.61 -4.23 -1.12 -4.89 115.64 111.15 1fat s THR 64 Ca 0.00 -0.44 0.08 0.00 -1.18 0.00 0.00 61.69 60.15 1fat s THR 64 Cb 0.00 -3.77 -0.04 0.00 1.34 0.00 0.00 72.50 70.03 1fat s THR 64 CO 0.00 -0.28 -0.20 -0.69 -0.54 0.00 0.00 174.62 172.92 1fat s VAL 65 N -1.98 1.75 0.29 2.29 1.01 -1.26 -0.74 120.40 121.76 1fat s VAL 65 Ca 0.38 -1.72 -0.09 0.00 0.00 0.00 0.00 61.98 60.55 1fat s VAL 65 Cb -0.10 -1.69 -0.07 0.00 0.00 0.00 0.00 36.38 34.52 1fat s VAL 65 CO 0.30 -0.18 0.61 0.00 0.00 0.00 0.00 175.10 175.84 1fat s ALA 66 N -1.58 3.51 0.22 5.51 0.00 0.30 -4.42 121.76 125.30 1fat s ALA 66 Ca 0.11 -0.28 0.02 0.00 0.00 0.00 0.00 51.96 51.81 1fat s ALA 66 Cb -0.08 -2.50 -0.04 0.00 0.00 0.00 0.00 23.12 20.51 1fat s ALA 66 CO 0.05 0.34 0.38 -1.12 0.00 0.00 0.00 175.76 175.41 1fat s SER 67 N -2.66 6.34 0.27 0.00 0.01 -0.82 -4.43 113.70 112.40 1fat s SER 67 Ca 0.48 0.24 -0.17 0.00 1.31 0.00 0.00 55.95 57.82 1fat s SER 67 Cb -0.11 -1.94 0.01 0.00 0.21 0.00 0.00 66.02 64.19 1fat s SER 67 CO 0.24 -0.07 0.60 0.72 0.41 0.00 0.00 173.24 175.15 1fat s PHE 68 N -1.94 0.10 0.02 2.43 -0.12 -0.67 -1.73 117.98 116.07 1fat s PHE 68 Ca 0.36 -0.51 -0.24 0.00 -0.05 0.00 0.00 56.93 56.49 1fat s PHE 68 Cb -0.10 0.46 0.05 0.00 -0.63 0.00 0.00 43.02 42.80 1fat s PHE 68 CO 0.30 -1.13 0.55 0.00 -0.05 0.00 0.00 175.22 174.88 1fat s ALA 69 N -3.91 -1.40 0.10 1.99 0.00 -0.27 -0.99 121.76 117.27 1fat s ALA 69 Ca 0.17 0.75 -0.19 0.00 0.00 0.00 0.00 51.96 52.69 1fat s ALA 69 Cb -0.03 0.29 0.04 0.00 0.00 0.00 0.00 23.12 23.42 1fat s ALA 69 CO 0.08 -0.46 0.46 -0.08 0.00 0.00 0.00 175.76 175.76 1fat s THR 70 N -2.10 0.05 -0.11 0.00 -1.32 -0.55 -1.32 115.64 110.29 1fat s THR 70 Ca -0.07 -0.39 -0.17 0.00 -1.21 0.00 0.00 61.69 59.84 1fat s THR 70 Cb -0.01 -1.06 0.04 0.00 -1.51 0.00 0.00 72.50 69.96 1fat s THR 70 CO 0.01 -0.22 0.44 -0.94 -2.21 0.00 0.00 174.62 171.70 1fat s SER 71 N -2.46 -0.41 0.17 8.08 1.04 -0.28 -2.21 113.70 117.63 1fat s SER 71 Ca -0.01 0.63 -0.19 0.00 0.48 0.00 0.00 55.95 56.86 1fat s SER 71 Cb 0.00 0.68 0.04 0.00 0.10 0.00 0.00 66.02 66.85 1fat s SER 71 CO -0.08 -0.31 0.52 0.72 0.98 0.00 0.00 173.24 175.07 1fat s PHE 72 N -0.44 -0.27 -0.12 5.02 -0.71 -1.11 -0.93 117.98 119.42 1fat s PHE 72 Ca -0.06 -0.03 0.01 0.00 -1.04 0.00 0.00 56.93 55.81 1fat s PHE 72 Cb -0.03 0.42 0.02 0.00 -1.21 0.00 0.00 43.02 42.21 1fat s PHE 72 CO 0.03 -0.85 -0.15 0.99 -1.34 0.00 0.00 175.22 173.89 1fat s THR 73 N -3.82 1.57 0.23 -4.49 2.01 -0.90 -1.06 115.64 109.18 1fat s THR 73 Ca 0.05 -0.67 0.06 0.00 0.31 0.00 0.00 61.69 61.45 1fat s THR 73 Cb -0.00 -1.44 -0.05 0.00 0.01 0.00 0.00 72.50 71.01 1fat s THR 73 CO -0.08 0.46 -0.09 0.72 -0.69 0.00 0.00 174.62 174.94 1fat s PHE 74 N 1.13 1.75 -0.04 4.92 -0.12 -0.67 -0.15 117.98 124.80 1fat s PHE 74 Ca -0.03 -0.69 -0.02 0.00 -0.05 0.00 0.00 56.93 56.15 1fat s PHE 74 Cb -0.14 -0.93 0.03 0.00 -0.63 0.00 0.00 43.02 41.35 1fat s PHE 74 CO -0.04 0.25 0.05 1.21 -0.05 0.00 0.00 175.22 176.64 1fat s ASN 75 N -3.35 1.17 -0.18 1.98 3.84 0.53 -0.79 114.94 118.13 1fat s ASN 75 Ca 0.26 0.05 -0.03 0.00 0.21 0.00 0.00 52.86 53.35 1fat s ASN 75 Cb 0.02 -0.18 -0.02 0.00 -0.55 0.00 0.00 41.25 40.52 1fat s ASN 75 CO 0.09 -0.24 -0.06 -0.63 -2.79 0.00 0.00 177.10 173.47 1fat s ILE 76 N 2.10 3.51 -0.11 -5.21 1.01 -1.26 -2.19 121.20 119.04 1fat s ILE 76 Ca 0.04 -0.47 0.02 0.00 0.00 0.00 0.00 60.65 60.24 1fat s ILE 76 Cb -0.12 -2.55 0.02 0.00 0.01 0.00 0.00 42.46 39.81 1fat s ILE 76 CO -0.03 0.47 -0.15 -1.58 0.00 0.00 0.00 174.94 173.64 1fat s GLN 77 N 0.84 2.27 -0.16 2.79 0.74 -1.22 -0.88 119.66 124.04 1fat s GLN 77 Ca -0.02 -0.57 -0.07 0.00 0.05 0.00 0.00 55.36 54.75 1fat s GLN 77 Cb -0.15 -1.94 -0.04 0.00 1.10 0.00 0.00 33.01 31.99 1fat s GLN 77 CO 0.01 -0.08 0.08 0.08 -0.55 0.00 0.00 175.29 174.83 1fat s VAL 78 N 1.03 4.93 0.66 1.34 1.01 -1.26 -1.44 120.40 126.66 1fat s VAL 78 Ca -0.05 0.01 -0.15 0.00 0.00 0.00 0.00 61.98 61.78 1fat s VAL 78 Cb -0.15 -3.19 -0.00 0.00 0.00 0.00 0.00 36.38 33.04 1fat s VAL 78 CO -0.03 0.51 1.12 -2.16 0.00 0.00 0.00 175.10 174.55 1fat s PRO 79 N -0.09 2.77 0.31 2.72 0.04 -1.26 -4.95 135.00 134.53 1fat s PRO 79 Ca 0.07 1.45 -0.29 0.00 0.04 0.00 0.00 61.00 62.27 1fat s PRO 79 Cb -0.12 -1.94 -0.13 0.00 0.04 0.00 0.00 34.50 32.35 1fat s PRO 79 CO 0.01 -1.28 1.25 0.09 0.04 0.00 0.00 177.00 177.11 1fat n ASN 80 N -2.36 2.42 -3.38 6.66 3.02 -1.26 -2.98 115.26 117.38 1fat n ASN 80 Ca 0.11 1.19 -0.16 0.00 -0.03 0.00 0.00 54.58 55.68 1fat n ASN 80 Cb 0.52 -1.43 0.03 0.00 -0.61 0.00 0.00 39.78 38.29 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 1.18 -6.42 -3.65 6.41 3.02 -1.26 -5.01 115.26 109.53 1fat n ASN 81 Ca 0.07 -0.63 -0.05 0.00 -0.03 0.00 0.00 54.58 53.95 1fat n ASN 81 Cb 0.34 -4.27 -0.01 0.00 -0.61 0.00 0.00 39.78 35.22 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 -3.24 -1.78 0.10 5.41 0.00 -1.16 -5.02 121.76 116.07 1fat s ALA 82 Ca 0.27 0.53 0.07 0.00 0.00 0.00 0.00 51.96 52.82 1fat s ALA 82 Cb -0.07 0.51 -0.03 0.00 0.00 0.00 0.00 23.12 23.53 1fat s ALA 82 CO 0.80 -0.91 -0.17 0.20 0.00 0.00 0.00 175.76 175.68 1fat s GLY 83 N -2.77 1.08 0.41 0.00 0.00 0.85 -4.85 107.32 102.05 1fat s GLY 83 Ca 0.10 -1.20 -0.27 0.00 0.00 0.00 0.00 44.72 43.36 1fat s GLY 83 CO -0.02 -1.23 1.45 -1.05 0.00 0.00 0.00 173.10 172.25 1fat n PRO 84 N 0.94 2.44 -3.65 2.90 -0.02 -1.26 -1.21 135.00 135.14 1fat n PRO 84 Ca -0.18 0.86 -0.02 0.00 -2.02 0.00 0.00 63.50 62.13 1fat n PRO 84 Cb 0.55 -2.63 -0.06 0.00 -0.02 0.00 0.00 33.50 31.34 1fat n PRO 84 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1fat s ALA 85 N -1.15 -2.22 -0.09 3.55 0.00 -1.26 -4.51 121.76 116.09 1fat s ALA 85 Ca 0.57 1.71 0.10 0.00 0.00 0.00 0.00 51.96 54.34 1fat s ALA 85 Cb -0.47 -1.76 -0.14 0.00 0.00 0.00 0.00 23.12 20.75 1fat s ALA 85 CO 0.61 -0.12 0.08 -3.47 0.00 0.00 0.00 175.76 172.86 1fat n ASP 86 N 1.36 2.40 0.00 0.00 -0.08 -0.69 -2.93 116.55 116.61 1fat n ASP 86 Ca -0.08 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.20 1fat n ASP 86 Cb 0.57 0.92 0.00 0.00 2.34 0.00 0.00 41.12 44.95 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 2.25 -1.30 3.06 0.27 0.00 -1.22 -2.19 105.19 106.07 1fat n GLY 87 Ca -0.14 -1.47 -0.11 0.00 0.00 0.00 0.00 46.02 44.30 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 1.73 -0.07 0.99 0.20 -0.42 -2.79 118.68 118.32 1fat s LEU 88 Ca 0.00 -0.24 -0.14 0.00 0.69 0.00 0.00 54.13 54.44 1fat s LEU 88 Cb 0.00 0.50 0.03 0.00 -0.43 0.00 0.00 46.19 46.29 1fat s LEU 88 CO 0.00 -0.32 0.33 0.00 -0.29 0.00 0.00 176.35 176.07 1fat s ALA 89 N -1.27 -0.83 -0.12 5.97 0.00 0.38 0.10 121.76 125.99 1fat s ALA 89 Ca -0.14 0.64 -0.15 0.00 0.00 0.00 0.00 51.96 52.31 1fat s ALA 89 Cb -0.08 -0.22 -0.05 0.00 0.00 0.00 0.00 23.12 22.78 1fat s ALA 89 CO 0.01 -0.22 0.35 0.12 0.00 0.00 0.00 175.76 176.02 1fat s PHE 90 N -0.64 3.53 0.06 0.00 5.36 -0.60 -1.12 117.98 124.57 1fat s PHE 90 Ca -0.07 0.73 0.02 0.00 -0.96 0.00 0.00 56.93 56.65 1fat s PHE 90 Cb -0.04 -2.36 -0.03 0.00 -0.34 0.00 0.00 43.02 40.25 1fat s PHE 90 CO 0.03 0.32 -0.07 0.00 -1.46 0.00 0.00 175.22 174.03 1fat s ALA 91 N 0.16 0.64 -0.21 11.12 0.00 0.17 -1.52 121.76 132.11 1fat s ALA 91 Ca 0.20 -0.92 -0.02 0.00 0.00 0.00 0.00 51.96 51.22 1fat s ALA 91 Cb -0.14 0.09 0.01 0.00 0.00 0.00 0.00 23.12 23.08 1fat s ALA 91 CO 0.07 -0.10 -0.09 -0.51 0.00 0.00 0.00 175.76 175.13 1fat s LEU 92 N -2.01 2.71 0.20 0.00 1.02 -0.33 -2.03 118.68 118.25 1fat s LEU 92 Ca -0.04 -0.55 0.03 0.00 0.02 0.00 0.00 54.13 53.59 1fat s LEU 92 Cb -0.05 -1.65 -0.05 0.00 0.02 0.00 0.00 46.19 44.46 1fat s LEU 92 CO -0.01 -0.03 -0.01 0.54 0.02 0.00 0.00 176.35 176.85 1fat s VAL 93 N 1.40 0.91 0.60 -1.59 0.11 -0.82 -2.60 120.40 118.41 1fat s VAL 93 Ca 0.05 -2.02 -0.18 0.00 -2.93 0.00 0.00 61.98 56.90 1fat s VAL 93 Cb -0.14 -2.23 -0.03 0.00 -1.53 0.00 0.00 36.38 32.45 1fat s VAL 93 CO -0.06 -0.40 1.19 -2.84 -3.33 0.00 0.00 175.10 169.65 1fat s PRO 94 N -3.88 2.95 0.18 1.54 0.02 -1.26 -0.69 135.00 133.86 1fat s PRO 94 Ca 0.26 1.76 -0.18 0.00 0.02 0.00 0.00 61.00 62.86 1fat s PRO 94 Cb 0.06 -1.93 0.13 0.00 0.02 0.00 0.00 34.50 32.77 1fat s PRO 94 CO 0.06 -1.21 1.62 0.28 -0.33 0.00 0.00 177.00 177.43 1fat h VAL 95 N 0.78 0.34 -0.51 3.83 2.07 -1.90 -1.06 116.25 119.81 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 1.29 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.40 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 -1.41 1.36 3.17 2.17 0.00 -1.26 -4.75 105.19 104.47 1fat n GLY 96 Ca 0.04 -0.55 -0.52 0.00 0.00 0.00 0.00 46.02 44.99 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 0.97 -0.15 -4.78 1.61 2.88 -0.40 -4.98 113.62 108.77 1fat n SER 97 Ca 0.17 1.05 -0.22 0.00 -1.33 0.00 0.00 58.87 58.54 1fat n SER 97 Cb 0.43 -0.84 -0.05 0.00 -0.75 0.00 0.00 64.21 63.00 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 -0.12 2.72 0.71 -1.46 -1.52 -1.26 -5.03 119.66 113.71 1fat s GLN 98 Ca 0.80 -1.19 -0.16 0.00 -1.95 0.00 0.00 55.36 52.85 1fat s GLN 98 Cb -1.11 -2.44 0.02 0.00 -0.22 0.00 0.00 33.01 29.26 1fat s GLN 98 CO 0.52 0.35 1.16 -2.30 -0.25 0.00 0.00 175.29 174.77 1fat n PRO 99 N -1.12 0.69 0.00 2.91 -0.02 -1.26 -5.04 135.00 131.16 1fat n PRO 99 Ca -0.07 0.30 0.00 0.00 -2.02 0.00 0.00 63.50 61.71 1fat n PRO 99 Cb 0.58 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.67 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 -2.19 3.13 -1.51 -0.52 4.76 0.75 -5.03 118.16 117.55 1fat n LYS 100 Ca 0.14 0.00 -0.31 0.00 -2.87 0.00 0.00 58.31 55.27 1fat n LYS 100 Cb 0.49 0.00 0.06 0.00 -1.84 0.00 0.00 35.03 33.74 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 0.06 5.10 0.82 4.39 1.11 -0.60 -4.74 116.67 122.81 1fat s ASP 101 Ca 0.00 1.72 -0.03 0.00 0.18 0.00 0.00 52.55 54.42 1fat s ASP 101 Cb 0.00 -2.51 0.05 0.00 1.07 0.00 0.00 42.92 41.53 1fat s ASP 101 CO 0.00 -1.63 0.33 0.29 1.18 0.00 0.00 175.17 175.33 1fat n LYS 102 N -3.15 -0.08 0.00 8.23 5.02 -1.26 -0.88 118.16 126.04 1fat n LYS 102 Ca 0.08 -0.61 0.00 0.00 -2.02 0.00 0.00 58.31 55.76 1fat n LYS 102 Cb 0.53 -0.30 0.00 0.00 -0.02 0.00 0.00 35.03 35.24 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 2.77 2.62 0.37 0.72 0.00 -1.25 -1.89 105.19 108.54 1fat n GLY 103 Ca 0.04 0.07 0.15 0.00 0.00 0.00 0.00 46.02 46.28 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 0.51 -0.02 0.00 -1.91 0.15 103.07 101.79 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 0.00 0.69 0.00 0.00 0.00 176.54 177.23 1fat n PHE 105 N -3.02 0.01 -1.17 5.60 3.72 -0.79 -4.91 117.46 116.89 1fat n PHE 105 Ca 0.04 -0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.34 1fat n PHE 105 Cb 0.74 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 39.24 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 -0.62 -0.49 0.00 4.37 4.77 0.53 -1.10 117.00 124.46 1fat n LEU 106 Ca 0.22 0.24 0.00 0.00 -0.03 0.00 0.00 56.01 56.43 1fat n LEU 106 Cb 0.18 -2.01 0.00 0.00 -2.33 0.00 0.00 43.42 39.26 1fat n LEU 106 CO 0.17 -0.71 0.00 0.61 -1.33 0.00 0.00 177.39 176.12 1fat n GLY 107 N 0.03 2.72 0.09 -0.72 0.00 -0.06 -3.66 105.19 103.59 1fat n GLY 107 Ca -0.10 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.86 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 0.35 -4.58 0.99 4.77 -0.26 -0.18 117.00 118.09 1fat n LEU 108 Ca 0.00 0.16 -0.27 0.00 -0.03 0.00 0.00 56.01 55.88 1fat n LEU 108 Cb 0.00 0.31 -0.10 0.00 -2.33 0.00 0.00 43.42 41.30 1fat n LEU 108 CO 0.00 0.37 -0.26 -0.36 -1.33 0.00 0.00 177.39 175.81 1fat s PHE 109 N -2.68 2.11 -0.05 -1.77 0.08 -0.85 -4.77 117.98 110.06 1fat s PHE 109 Ca -0.07 -0.90 0.01 0.00 0.12 0.00 0.00 56.93 56.08 1fat s PHE 109 Cb 0.08 -1.50 -0.03 0.00 -0.57 0.00 0.00 43.02 40.99 1fat s PHE 109 CO 0.83 0.16 -0.03 -0.25 -0.10 0.00 0.00 175.22 175.83 1fat n ASP 110 N -0.98 3.71 0.00 1.36 8.00 -1.26 -1.56 116.55 125.82 1fat n ASP 110 Ca -0.07 -0.02 0.00 0.00 0.71 0.00 0.00 54.79 55.41 1fat n ASP 110 Cb 0.67 0.06 0.00 0.00 -0.02 0.00 0.00 41.12 41.82 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 3.17 0.82 0.18 0.44 0.00 -1.26 -4.94 105.19 103.59 1fat n GLY 111 Ca -0.08 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.93 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 0.07 -1.47 1.61 3.41 -1.26 -5.03 113.62 110.94 1fat n SER 112 Ca 0.00 -1.06 -0.12 0.00 -0.26 0.00 0.00 58.87 57.43 1fat n SER 112 Cb 0.00 -0.03 0.11 0.00 -0.26 0.00 0.00 64.21 64.03 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 -2.99 3.73 -4.78 4.04 3.02 -1.26 -4.99 115.26 112.03 1fat n ASN 113 Ca 0.01 -3.81 -0.37 0.00 -0.03 0.00 0.00 54.58 50.37 1fat n ASN 113 Cb 0.03 -0.48 -0.06 0.00 -0.61 0.00 0.00 39.78 38.65 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 -3.22 7.33 -0.21 6.41 0.01 -1.26 -4.98 113.70 117.77 1fat s SER 114 Ca 0.47 1.77 -0.29 0.00 1.31 0.00 0.00 55.95 59.21 1fat s SER 114 Cb 0.40 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 64.08 1fat s SER 114 CO -0.00 -0.01 1.10 0.21 0.41 0.00 0.00 173.24 174.94 1fat s ASN 115 N -1.56 7.06 0.00 2.44 3.04 -1.26 -4.88 114.94 119.78 1fat s ASN 115 Ca 0.47 1.47 0.25 0.00 0.04 0.00 0.00 52.86 55.09 1fat s ASN 115 Cb -0.19 -2.54 0.44 0.00 -1.54 0.00 0.00 41.25 37.42 1fat s ASN 115 CO 0.24 -0.69 1.37 0.49 -3.04 0.00 0.00 177.10 175.47 1fat n PHE 116 N 6.38 0.00 -4.08 0.43 3.72 -1.26 -4.95 117.46 117.70 1fat n PHE 116 Ca 0.12 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.23 1fat n PHE 116 Cb 0.46 -0.13 -0.03 0.00 -0.94 0.00 0.00 39.48 38.83 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 -0.95 -1.65 -4.46 1.38 8.25 -1.26 -4.70 115.22 111.82 1fat n HIS 117 Ca 0.09 0.75 -0.26 0.00 -0.26 0.00 0.00 57.72 58.04 1fat n HIS 117 Cb 0.36 -3.37 -0.13 0.00 1.12 0.00 0.00 29.99 27.96 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 1.84 -0.02 1.59 2.01 -1.26 -4.15 115.64 111.89 1fat s THR 118 Ca 0.27 -1.47 0.01 0.00 0.31 0.00 0.00 61.69 60.80 1fat s THR 118 Cb -0.14 -1.63 0.02 0.00 0.01 0.00 0.00 72.50 70.75 1fat s THR 118 CO 0.91 0.08 -0.01 -0.69 -0.69 0.00 0.00 174.62 174.23 1fat s VAL 119 N -1.01 0.15 0.09 3.82 1.01 -1.07 -1.74 120.40 121.66 1fat s VAL 119 Ca 0.09 0.02 -0.16 0.00 0.00 0.00 0.00 61.98 61.93 1fat s VAL 119 Cb -0.10 -0.20 0.03 0.00 0.00 0.00 0.00 36.38 36.11 1fat s VAL 119 CO 0.04 0.10 0.37 0.00 0.00 0.00 0.00 175.10 175.61 1fat s ALA 120 N 0.57 -0.87 -0.19 5.51 0.00 -0.37 -1.19 121.76 125.23 1fat s ALA 120 Ca -0.05 0.02 0.01 0.00 0.00 0.00 0.00 51.96 51.94 1fat s ALA 120 Cb -0.08 0.52 0.02 0.00 0.00 0.00 0.00 23.12 23.59 1fat s ALA 120 CO -0.01 -0.55 -0.18 0.08 0.00 0.00 0.00 175.76 175.10 1fat s VAL 121 N -3.25 2.16 0.16 0.00 1.01 -0.58 -0.63 120.40 119.26 1fat s VAL 121 Ca -0.00 -1.02 0.04 0.00 0.00 0.00 0.00 61.98 61.00 1fat s VAL 121 Cb 0.01 -1.96 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 1fat s VAL 121 CO -0.08 0.45 0.18 -1.83 0.00 0.00 0.00 175.10 173.82 1fat s GLU 122 N 1.27 3.07 -0.49 2.72 -1.05 0.21 -1.56 118.70 122.87 1fat s GLU 122 Ca 0.03 -0.79 0.03 0.00 -0.15 0.00 0.00 54.97 54.09 1fat s GLU 122 Cb -0.14 -2.74 0.14 0.00 -0.44 0.00 0.00 34.13 30.95 1fat s GLU 122 CO -0.11 0.49 0.29 -0.06 0.95 0.00 0.00 175.26 176.82 1fat s PHE 123 N -1.75 2.35 -0.22 4.83 0.40 0.12 -1.24 117.98 122.47 1fat s PHE 123 Ca 0.32 -2.69 -0.26 0.00 -0.60 0.00 0.00 56.93 53.70 1fat s PHE 123 Cb -0.10 -2.08 -0.00 0.00 0.51 0.00 0.00 43.02 41.34 1fat s PHE 123 CO 0.25 -0.74 0.89 0.34 0.70 0.00 0.00 175.22 176.66 1fat s ASP 124 N -0.07 6.95 0.00 1.36 -1.08 -0.76 -1.30 116.67 121.76 1fat s ASP 124 Ca 0.20 1.17 0.16 0.00 -0.52 0.00 0.00 52.55 53.57 1fat s ASP 124 Cb -0.19 -2.47 0.23 0.00 -1.46 0.00 0.00 42.92 39.03 1fat s ASP 124 CO -0.04 -0.52 1.13 0.35 0.52 0.00 0.00 175.17 176.60 1fat n THR 125 N 5.12 0.30 -3.77 1.71 -2.24 -0.93 -3.03 114.28 111.43 1fat n THR 125 Ca 0.07 -0.65 -0.14 0.00 -2.27 0.00 0.00 64.05 61.06 1fat n THR 125 Cb 0.47 1.09 -0.14 0.00 -2.10 0.00 0.00 70.33 69.65 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 -1.25 1.00 0.12 3.22 2.96 -1.24 -4.49 118.68 119.00 1fat s LEU 126 Ca 0.24 0.23 -0.31 0.00 -0.22 0.00 0.00 54.13 54.07 1fat s LEU 126 Cb 0.15 0.28 -0.07 0.00 0.50 0.00 0.00 46.19 47.05 1fat s LEU 126 CO 0.21 -0.12 1.27 -0.47 -1.32 0.00 0.00 176.35 175.93 1fat s TYR 127 N 0.89 3.35 -0.33 5.38 5.04 -1.26 -5.00 117.35 125.41 1fat s TYR 127 Ca -0.07 1.20 0.03 0.00 -2.44 0.00 0.00 57.07 55.79 1fat s TYR 127 Cb -0.09 -3.53 0.10 0.00 0.35 0.00 0.00 41.96 38.79 1fat s TYR 127 CO -0.04 -1.70 0.05 -0.80 -1.34 0.00 0.00 175.55 171.72 1fat s ASN 128 N 0.82 4.64 0.13 4.32 -0.87 -1.26 -5.00 114.94 117.72 1fat s ASN 128 Ca 0.59 -2.05 -0.06 0.00 -1.57 0.00 0.00 52.86 49.77 1fat s ASN 128 Cb -0.33 -1.51 0.18 0.00 -0.02 0.00 0.00 41.25 39.57 1fat s ASN 128 CO 0.32 -0.38 0.78 1.17 -2.57 0.00 0.00 177.10 176.42 1fat n LYS 129 N 4.35 -0.08 0.23 -0.60 3.00 -1.26 -0.42 118.16 123.38 1fat n LYS 129 Ca 0.03 0.78 0.16 0.00 -0.00 0.00 0.00 58.31 59.28 1fat n LYS 129 Cb 0.42 -1.16 0.85 0.00 0.00 0.00 0.00 35.03 35.14 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 -3.36 116.42 119.38 1fat h ASP 130 Ca 0.21 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.62 1fat h ASP 130 Cb 0.34 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.85 1fat h ASP 130 CO -0.51 0.00 0.00 -2.67 -3.12 0.00 0.00 179.24 172.94 1fat n TRP 131 N -3.82 0.00 -3.04 4.55 2.14 -0.40 -5.13 117.44 111.75 1fat n TRP 131 Ca 0.00 0.00 -0.31 0.00 2.07 0.00 0.00 57.50 59.26 1fat n TRP 131 Cb 0.25 0.00 -0.05 0.00 -0.81 0.00 0.00 31.31 30.71 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 6.66 0.97 -0.67 1.11 0.43 -4.80 116.67 120.38 1fat s ASP 132 Ca 0.00 1.20 -0.14 0.00 0.18 0.00 0.00 52.55 53.79 1fat s ASP 132 Cb 0.00 -2.34 0.18 0.00 1.07 0.00 0.00 42.92 41.82 1fat s ASP 132 CO 0.00 -0.28 1.17 -2.16 1.18 0.00 0.00 175.17 175.08 1fat s PRO 133 N -3.33 0.61 0.21 8.23 0.04 -1.26 -4.74 135.00 134.75 1fat s PRO 133 Ca 0.53 0.09 -0.04 0.00 0.04 0.00 0.00 61.00 61.62 1fat s PRO 133 Cb -0.10 -1.80 0.17 0.00 0.04 0.00 0.00 34.50 32.81 1fat s PRO 133 CO 0.23 -2.52 1.60 1.15 0.04 0.00 0.00 177.00 177.51 1fat h THR 134 N -1.72 1.28 -2.21 1.26 2.02 -1.97 -3.44 112.91 108.12 1fat h THR 134 Ca -0.48 -1.42 -0.47 0.00 0.77 0.00 0.00 66.41 64.80 1fat h THR 134 Cb 1.31 1.33 -0.02 0.00 -1.74 0.00 0.00 68.15 69.02 1fat h THR 134 CO 0.52 0.47 -0.45 -1.61 0.37 0.00 0.00 175.52 174.82 1fat s GLU 135 N -4.48 3.33 0.22 6.66 2.02 -1.26 -4.80 118.70 120.39 1fat s GLU 135 Ca -0.09 -0.81 -0.32 0.00 0.02 0.00 0.00 54.97 53.77 1fat s GLU 135 Cb 0.13 -2.83 -0.13 0.00 0.10 0.00 0.00 34.13 31.40 1fat s GLU 135 CO 0.84 0.43 1.59 0.54 0.02 0.00 0.00 175.26 178.67 1fat n ARG 136 N -1.32 2.43 -4.20 1.61 1.74 -1.26 -4.88 116.66 110.77 1fat n ARG 136 Ca -0.09 0.87 -0.12 0.00 -0.77 0.00 0.00 57.85 57.74 1fat n ARG 136 Cb 0.57 -2.64 -0.10 0.00 -1.02 0.00 0.00 32.46 29.27 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 0.57 1.10 -0.10 -1.55 -3.43 -1.17 -0.21 115.29 110.50 1fat s HIS 137 Ca 0.72 -1.25 -0.02 0.00 -0.80 0.00 0.00 55.06 53.71 1fat s HIS 137 Cb -0.58 -0.59 -0.03 0.00 -1.43 0.00 0.00 32.58 29.95 1fat s HIS 137 CO 0.41 -0.50 -0.02 0.42 -2.00 0.00 0.00 174.74 173.05 1fat s ILE 138 N -4.00 4.11 -0.01 -5.38 1.01 -0.58 -1.84 121.20 114.51 1fat s ILE 138 Ca 0.31 -0.31 -0.09 0.00 0.00 0.00 0.00 60.65 60.56 1fat s ILE 138 Cb 0.07 -2.74 0.01 0.00 0.01 0.00 0.00 42.46 39.81 1fat s ILE 138 CO 0.07 0.57 0.18 -0.83 0.00 0.00 0.00 174.94 174.93 1fat s GLY 139 N -0.53 -0.01 -0.40 6.18 0.00 -0.37 -1.72 107.32 110.47 1fat s GLY 139 Ca 0.09 0.03 -0.19 0.00 0.00 0.00 0.00 44.72 44.64 1fat s GLY 139 CO 0.02 -0.11 0.58 -0.42 0.00 0.00 0.00 173.10 173.17 1fat s ILE 140 N -1.22 4.92 -0.18 0.90 1.01 -0.87 -0.62 121.20 125.13 1fat s ILE 140 Ca -0.13 0.20 -0.08 0.00 0.00 0.00 0.00 60.65 60.64 1fat s ILE 140 Cb -0.06 -4.10 -0.04 0.00 0.01 0.00 0.00 42.46 38.27 1fat s ILE 140 CO 0.02 -0.42 0.09 -1.81 0.00 0.00 0.00 174.94 172.82 1fat s ASP 141 N 1.88 5.86 -0.41 3.58 1.01 0.19 -0.37 116.67 128.41 1fat s ASP 141 Ca 0.21 0.16 0.02 0.00 0.71 0.00 0.00 52.55 53.64 1fat s ASP 141 Cb -0.15 -2.00 0.12 0.00 1.01 0.00 0.00 42.92 41.90 1fat s ASP 141 CO 0.16 0.19 0.19 -0.69 0.21 0.00 0.00 175.17 175.24 1fat s VAL 142 N 0.26 1.56 0.00 -1.27 1.01 -1.26 -1.24 120.40 119.46 1fat s VAL 142 Ca 0.06 -2.41 0.00 0.00 0.00 0.00 0.00 61.98 59.62 1fat s VAL 142 Cb -0.12 -2.11 0.00 0.00 0.00 0.00 0.00 36.38 34.15 1fat s VAL 142 CO -0.00 -0.81 0.00 0.59 0.00 0.00 0.00 175.10 174.88 1fat n ASN 143 N 3.82 -3.27 -3.62 3.32 3.02 -0.71 -4.98 115.26 112.84 1fat n ASN 143 Ca 0.05 0.00 -0.15 0.00 -0.03 0.00 0.00 54.58 54.46 1fat n ASN 143 Cb 0.36 -1.15 -0.07 0.00 -0.61 0.00 0.00 39.78 38.31 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 -2.09 -0.69 0.00 6.41 0.15 -1.26 -4.69 113.70 111.53 1fat s SER 144 Ca 0.00 1.20 0.08 0.00 0.70 0.00 0.00 55.95 57.93 1fat s SER 144 Cb 0.00 1.18 0.39 0.00 -1.71 0.00 0.00 66.02 65.89 1fat s SER 144 CO 0.00 -0.32 1.07 0.00 1.20 0.00 0.00 173.24 175.19 1fat n ILE 145 N 2.29 0.71 -3.12 6.45 0.13 -1.26 -4.09 119.36 120.47 1fat n ILE 145 Ca -0.15 0.18 -0.45 0.00 -1.10 0.00 0.00 62.75 61.22 1fat n ILE 145 Cb 0.56 -1.05 -0.02 0.00 -0.84 0.00 0.00 39.64 38.28 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 -2.47 3.62 0.13 9.51 3.52 -1.26 -4.94 118.95 127.05 1fat s ARG 146 Ca 0.08 -2.13 -0.34 0.00 -0.13 0.00 0.00 55.73 53.21 1fat s ARG 146 Cb 0.05 -4.68 -0.17 0.00 -1.56 0.00 0.00 34.95 28.59 1fat s ARG 146 CO 0.11 -1.54 1.06 0.43 -0.81 0.00 0.00 175.30 174.56 1fat n SER 147 N 5.26 0.66 0.16 -2.12 7.64 -1.26 -4.74 113.62 119.22 1fat n SER 147 Ca 0.19 1.14 0.12 0.00 1.01 0.00 0.00 58.87 61.34 1fat n SER 147 Cb 0.48 -1.10 0.56 0.00 -1.01 0.00 0.00 64.21 63.14 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 2.57 0.00 -1.56 0.44 -0.00 -1.03 -3.45 117.51 114.48 1fat h ILE 148 Ca -0.43 -0.16 0.22 0.00 -0.00 0.00 0.00 64.86 64.48 1fat h ILE 148 Cb 1.38 0.83 -0.20 0.00 -0.00 0.00 0.00 36.82 38.84 1fat h ILE 148 CO 0.68 0.00 0.75 -0.75 -0.00 0.00 0.00 178.15 178.83 1fat s LYS 149 N -3.45 0.38 0.38 2.19 2.20 -1.25 -5.01 119.74 115.19 1fat s LYS 149 Ca 0.01 -0.10 -0.07 0.00 -0.36 0.00 0.00 55.97 55.45 1fat s LYS 149 Cb 0.08 0.18 0.03 0.00 -1.51 0.00 0.00 37.83 36.61 1fat s LYS 149 CO 0.34 -0.16 0.62 0.95 -0.36 0.00 0.00 175.35 176.73 1fat s THR 150 N -2.27 0.00 -0.16 3.43 -4.23 -1.26 -2.06 115.64 109.09 1fat s THR 150 Ca 0.08 -1.36 -0.22 0.00 -1.18 0.00 0.00 61.69 59.01 1fat s THR 150 Cb -0.01 -2.82 0.06 0.00 1.34 0.00 0.00 72.50 71.07 1fat s THR 150 CO -0.05 0.00 0.58 0.28 -0.54 0.00 0.00 174.62 174.89 1fat s THR 151 N -2.57 0.01 0.28 3.99 -1.32 -0.70 -4.98 115.64 110.35 1fat s THR 151 Ca 0.25 -0.06 -0.30 0.00 -1.21 0.00 0.00 61.69 60.37 1fat s THR 151 Cb -0.02 -0.84 -0.10 0.00 -1.51 0.00 0.00 72.50 70.02 1fat s THR 151 CO 0.18 -0.03 1.47 -0.60 -2.21 0.00 0.00 174.62 173.43 1fat s ARG 152 N -0.23 4.22 -0.10 7.08 3.52 -1.26 -1.53 118.95 130.66 1fat s ARG 152 Ca -0.04 2.39 0.00 0.00 -0.13 0.00 0.00 55.73 57.95 1fat s ARG 152 Cb -0.03 -3.07 0.02 0.00 -1.56 0.00 0.00 34.95 30.31 1fat s ARG 152 CO 0.03 -0.46 -0.09 -0.46 -0.81 0.00 0.00 175.30 173.51 1fat s TRP 153 N -0.21 1.48 -1.11 5.12 -0.00 0.71 -4.79 118.94 120.13 1fat s TRP 153 Ca 0.59 -0.68 -0.15 0.00 -0.00 0.00 0.00 56.10 55.86 1fat s TRP 153 Cb -0.44 -1.18 0.17 0.00 -0.00 0.00 0.00 33.47 32.02 1fat s TRP 153 CO 0.47 -0.44 1.30 -0.51 -0.00 0.00 0.00 176.95 177.77 1fat s ASP 154 N 1.38 6.96 -0.07 5.86 1.01 -1.26 -4.43 116.67 126.12 1fat s ASP 154 Ca -0.01 -2.76 -0.36 0.00 0.71 0.00 0.00 52.55 50.13 1fat s ASP 154 Cb -0.14 -2.38 -0.14 0.00 1.01 0.00 0.00 42.92 41.28 1fat s ASP 154 CO -0.05 -0.80 1.72 0.33 0.21 0.00 0.00 175.17 176.58 1fat n PHE 155 N 5.63 2.14 -4.05 4.23 7.35 -1.26 -4.96 117.46 126.54 1fat n PHE 155 Ca 0.31 0.28 -0.35 0.00 -0.76 0.00 0.00 57.45 56.93 1fat n PHE 155 Cb 0.44 -2.54 -0.13 0.00 0.35 0.00 0.00 39.48 37.60 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 2.85 3.72 0.09 -2.13 1.01 -1.26 -5.09 120.40 119.60 1fat s VAL 156 Ca 0.90 -0.39 -0.30 0.00 0.00 0.00 0.00 61.98 62.19 1fat s VAL 156 Cb -0.83 -2.68 -0.06 0.00 0.00 0.00 0.00 36.38 32.81 1fat s VAL 156 CO 0.52 0.43 1.20 0.21 0.00 0.00 0.00 175.10 177.46 1fat s ASN 157 N 1.14 7.09 0.00 3.32 3.04 -1.26 -3.75 114.94 124.52 1fat s ASN 157 Ca 0.02 2.06 0.00 0.00 0.04 0.00 0.00 52.86 54.99 1fat s ASN 157 Cb -0.14 -2.58 0.00 0.00 -1.54 0.00 0.00 41.25 36.98 1fat s ASN 157 CO 0.01 -0.44 0.00 0.61 -3.04 0.00 0.00 177.10 174.23 1fat n GLY 158 N 2.99 1.14 3.89 1.21 0.00 -0.06 -4.99 105.19 109.37 1fat n GLY 158 Ca 0.08 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.13 3.69 0.01 1.61 0.41 -1.25 -4.90 118.70 118.15 1fat s GLU 159 Ca 0.00 0.08 -0.30 0.00 -0.41 0.00 0.00 54.97 54.34 1fat s GLU 159 Cb 0.00 -2.71 -0.03 0.00 -1.78 0.00 0.00 34.13 29.61 1fat s GLU 159 CO 0.00 0.33 1.00 -0.80 -0.49 0.00 0.00 175.26 175.30 1fat s ASN 160 N -2.64 7.35 -0.11 -0.19 0.01 -1.26 -4.39 114.94 113.71 1fat s ASN 160 Ca 0.44 1.70 -0.02 0.00 -0.71 0.00 0.00 52.86 54.26 1fat s ASN 160 Cb -0.11 -2.57 -0.03 0.00 0.41 0.00 0.00 41.25 38.94 1fat s ASN 160 CO 0.25 -0.27 -0.01 0.00 -1.51 0.00 0.00 177.10 175.56 1fat s ALA 161 N 0.98 3.19 -0.36 0.60 0.00 0.03 -4.36 121.76 121.84 1fat s ALA 161 Ca 0.52 -0.81 -0.06 0.00 0.00 0.00 0.00 51.96 51.61 1fat s ALA 161 Cb -0.22 -1.51 0.06 0.00 0.00 0.00 0.00 23.12 21.45 1fat s ALA 161 CO 0.28 0.46 0.14 -1.21 0.00 0.00 0.00 175.76 175.43 1fat s GLU 162 N -0.45 2.51 0.14 0.00 2.02 -0.25 -1.67 118.70 121.00 1fat s GLU 162 Ca 0.08 -1.34 -0.06 0.00 0.02 0.00 0.00 54.97 53.67 1fat s GLU 162 Cb -0.12 -3.51 -0.06 0.00 0.10 0.00 0.00 34.13 30.54 1fat s GLU 162 CO 0.02 -0.78 0.39 0.08 0.02 0.00 0.00 175.26 175.00 1fat s VAL 163 N 1.35 5.14 -0.18 2.63 1.01 -0.23 -2.03 120.40 128.10 1fat s VAL 163 Ca 0.00 0.12 -0.04 0.00 0.00 0.00 0.00 61.98 62.06 1fat s VAL 163 Cb -0.21 -3.62 0.09 0.00 0.00 0.00 0.00 36.38 32.64 1fat s VAL 163 CO 0.01 0.05 0.24 -0.22 0.00 0.00 0.00 175.10 175.19 1fat s LEU 164 N -2.59 -0.21 -0.08 3.92 2.96 -0.88 -2.73 118.68 119.07 1fat s LEU 164 Ca 0.41 0.09 0.04 0.00 -0.22 0.00 0.00 54.13 54.45 1fat s LEU 164 Cb -0.12 0.54 -0.02 0.00 0.50 0.00 0.00 46.19 47.09 1fat s LEU 164 CO 0.24 -0.29 -0.19 -0.63 -1.32 0.00 0.00 176.35 174.15 1fat s ILE 165 N 2.37 2.56 0.02 6.68 1.01 -0.94 -1.50 121.20 131.41 1fat s ILE 165 Ca 0.06 -0.88 0.01 0.00 0.00 0.00 0.00 60.65 59.84 1fat s ILE 165 Cb -0.14 -1.99 -0.01 0.00 0.01 0.00 0.00 42.46 40.32 1fat s ILE 165 CO -0.11 0.56 -0.05 0.42 0.00 0.00 0.00 174.94 175.76 1fat s THR 166 N -0.16 0.34 -0.07 2.92 -4.23 -0.90 -1.48 115.64 112.05 1fat s THR 166 Ca -0.02 -0.65 0.02 0.00 -1.18 0.00 0.00 61.69 59.86 1fat s THR 166 Cb -0.14 -0.38 0.01 0.00 1.34 0.00 0.00 72.50 73.34 1fat s THR 166 CO 0.04 -0.21 -0.13 -0.47 -0.54 0.00 0.00 174.62 173.31 1fat s TYR 167 N -0.84 1.55 -0.29 3.99 5.04 -0.16 -1.33 117.35 125.30 1fat s TYR 167 Ca -0.06 -0.60 -0.02 0.00 -2.44 0.00 0.00 57.07 53.95 1fat s TYR 167 Cb -0.06 -1.13 0.04 0.00 0.35 0.00 0.00 41.96 41.16 1fat s TYR 167 CO -0.00 -0.31 0.00 0.34 -1.34 0.00 0.00 175.55 174.24 1fat s ASP 168 N 0.72 4.83 0.27 4.32 -1.08 -0.97 -1.67 116.67 123.08 1fat s ASP 168 Ca -0.13 -1.15 -0.01 0.00 -0.52 0.00 0.00 52.55 50.74 1fat s ASP 168 Cb -0.16 -1.73 0.57 0.00 -1.46 0.00 0.00 42.92 40.15 1fat s ASP 168 CO 0.03 -0.24 1.72 0.28 0.52 0.00 0.00 175.17 177.48 1fat h SER 169 N 8.03 0.32 0.12 -0.34 0.02 -1.87 0.59 113.55 120.43 1fat h SER 169 Ca -0.24 0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 60.83 1fat h SER 169 Cb 1.08 0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.72 1fat h SER 169 CO 0.55 0.08 -0.06 0.77 -1.14 0.00 0.00 176.83 177.03 1fat h SER 170 N 0.45 -0.14 0.18 3.07 4.64 -1.95 -3.24 113.55 116.56 1fat h SER 170 Ca 0.48 -0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.66 1fat h SER 170 Cb 0.79 0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.92 1fat h SER 170 CO -0.45 0.06 -0.26 0.35 -0.87 0.00 0.00 176.83 175.65 1fat n THR 171 N -5.08 0.00 -1.38 2.95 -2.24 -1.07 -4.93 114.28 102.52 1fat n THR 171 Ca -0.08 -0.16 -0.14 0.00 -2.27 0.00 0.00 64.05 61.40 1fat n THR 171 Cb 0.16 0.53 -0.06 0.00 -2.10 0.00 0.00 70.33 68.86 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 -0.48 -4.08 -4.68 3.42 3.02 0.21 -4.90 115.26 107.77 1fat n ASN 172 Ca 0.12 0.35 -0.43 0.00 -0.03 0.00 0.00 54.58 54.59 1fat n ASN 172 Cb 0.37 -3.61 -0.02 0.00 -0.61 0.00 0.00 39.78 35.90 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 -3.67 4.22 -0.17 3.41 0.20 -1.18 -0.85 118.68 120.64 1fat s LEU 173 Ca 0.00 1.51 -0.05 0.00 0.69 0.00 0.00 54.13 56.28 1fat s LEU 173 Cb 0.00 -3.55 -0.03 0.00 -0.43 0.00 0.00 46.19 42.17 1fat s LEU 173 CO 0.00 -0.50 0.01 -0.22 -0.29 0.00 0.00 176.35 175.35 1fat s LEU 174 N 2.27 3.47 -0.17 -0.68 2.96 0.63 -2.29 118.68 124.87 1fat s LEU 174 Ca 0.48 -0.06 -0.02 0.00 -0.22 0.00 0.00 54.13 54.31 1fat s LEU 174 Cb -0.18 -1.86 0.05 0.00 0.50 0.00 0.00 46.19 44.70 1fat s LEU 174 CO 0.16 0.16 0.01 -0.69 -1.32 0.00 0.00 176.35 174.66 1fat s VAL 175 N 0.45 0.64 -0.09 1.68 1.01 -0.44 -1.39 120.40 122.26 1fat s VAL 175 Ca -0.01 -0.47 -0.01 0.00 0.00 0.00 0.00 61.98 61.50 1fat s VAL 175 Cb -0.14 -1.01 -0.03 0.00 0.00 0.00 0.00 36.38 35.20 1fat s VAL 175 CO 0.02 -0.06 -0.05 0.00 0.00 0.00 0.00 175.10 175.01 1fat s ALA 176 N 1.82 3.04 0.10 5.51 0.00 -0.05 -2.12 121.76 130.06 1fat s ALA 176 Ca 0.00 -0.86 0.02 0.00 0.00 0.00 0.00 51.96 51.12 1fat s ALA 176 Cb -0.16 -1.34 -0.04 0.00 0.00 0.00 0.00 23.12 21.58 1fat s ALA 176 CO -0.07 0.50 -0.06 -1.54 0.00 0.00 0.00 175.76 174.58 1fat s SER 177 N -0.57 1.14 -0.13 0.00 1.04 -0.56 -0.56 113.70 114.06 1fat s SER 177 Ca 0.09 -1.01 -0.13 0.00 0.48 0.00 0.00 55.95 55.37 1fat s SER 177 Cb -0.12 0.10 0.04 0.00 0.10 0.00 0.00 66.02 66.14 1fat s SER 177 CO 0.02 -0.47 0.38 -0.22 0.98 0.00 0.00 173.24 173.93 1fat s LEU 178 N -3.05 0.56 -0.01 2.42 0.20 -0.08 -2.08 118.68 116.63 1fat s LEU 178 Ca 0.12 0.72 -0.04 0.00 0.69 0.00 0.00 54.13 55.62 1fat s LEU 178 Cb 0.05 1.32 0.00 0.00 -0.43 0.00 0.00 46.19 47.13 1fat s LEU 178 CO -0.04 -0.16 0.09 0.68 -0.29 0.00 0.00 176.35 176.62 1fat s VAL 179 N 0.08 0.05 -0.47 1.68 -7.23 -0.86 -1.12 120.40 112.53 1fat s VAL 179 Ca -0.01 -0.40 -0.10 0.00 -1.81 0.00 0.00 61.98 59.66 1fat s VAL 179 Cb -0.03 -0.26 0.12 0.00 0.56 0.00 0.00 36.38 36.77 1fat s VAL 179 CO 0.01 -0.22 0.35 -0.31 -0.31 0.00 0.00 175.10 174.62 1fat s TYR 180 N -0.70 3.39 0.56 2.82 2.02 -0.58 -1.09 117.35 123.77 1fat s TYR 180 Ca -0.08 -1.75 0.27 0.00 -0.37 0.00 0.00 57.07 55.14 1fat s TYR 180 Cb -0.05 -3.47 1.48 0.00 -0.40 0.00 0.00 41.96 39.53 1fat s TYR 180 CO 0.00 -0.98 2.01 -1.35 -1.57 0.00 0.00 175.55 173.67 1fat h PRO 181 N 8.50 0.00 -0.13 -1.71 0.11 -1.85 1.03 132.00 137.95 1fat h PRO 181 Ca -0.22 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 65.65 1fat h PRO 181 Cb 1.08 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.20 1fat h PRO 181 CO 0.87 0.00 -0.82 0.66 -0.21 0.00 0.00 178.00 178.50 1fat h SER 182 N 0.00 0.93 0.66 -2.05 4.64 -1.92 -3.29 113.55 112.53 1fat h SER 182 Ca 0.19 -0.63 -0.02 0.00 -0.47 0.00 0.00 61.79 60.85 1fat h SER 182 Cb 0.86 -0.28 -0.00 0.00 -0.31 0.00 0.00 62.40 62.67 1fat h SER 182 CO -0.00 1.44 -1.35 0.00 -0.87 0.00 0.00 176.83 176.04 1fat n GLN 183 N -3.92 0.62 -1.71 4.77 1.13 -0.57 -4.96 117.38 112.75 1fat n GLN 183 Ca -0.08 0.04 -0.09 0.00 -1.94 0.00 0.00 57.00 54.92 1fat n GLN 183 Cb 0.77 -1.73 -0.02 0.00 0.11 0.00 0.00 30.24 29.37 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 -2.58 -0.69 -3.21 -1.09 5.02 0.35 -5.01 118.16 110.95 1fat n LYS 184 Ca -0.03 0.64 -0.23 0.00 -2.02 0.00 0.00 58.31 56.67 1fat n LYS 184 Cb 0.59 -4.59 -0.00 0.00 -0.02 0.00 0.00 35.03 31.01 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 -2.40 4.60 -0.01 -0.18 -4.23 -1.18 -4.92 115.64 107.33 1fat s THR 185 Ca 0.00 -0.49 -0.20 0.00 -1.18 0.00 0.00 61.69 59.82 1fat s THR 185 Cb 0.00 -3.68 0.04 0.00 1.34 0.00 0.00 72.50 70.19 1fat s THR 185 CO 0.00 -0.45 0.43 -0.94 -0.54 0.00 0.00 174.62 173.12 1fat s SER 186 N -4.12 -0.34 -0.06 3.99 1.04 -1.26 -1.52 113.70 111.43 1fat s SER 186 Ca 0.44 0.23 -0.09 0.00 0.48 0.00 0.00 55.95 57.01 1fat s SER 186 Cb -0.10 0.40 0.02 0.00 0.10 0.00 0.00 66.02 66.44 1fat s SER 186 CO 0.37 -0.54 0.23 -0.36 0.98 0.00 0.00 173.24 173.91 1fat s PHE 187 N -1.58 -0.19 0.02 5.02 0.40 -0.27 -4.97 117.98 116.40 1fat s PHE 187 Ca -0.11 0.45 -0.01 0.00 -0.60 0.00 0.00 56.93 56.65 1fat s PHE 187 Cb -0.03 0.06 -0.02 0.00 0.51 0.00 0.00 43.02 43.55 1fat s PHE 187 CO 0.04 -0.19 -0.00 -1.50 0.70 0.00 0.00 175.22 174.27 1fat s ILE 188 N -0.33 0.12 0.00 0.64 2.07 -1.26 -0.91 121.20 121.53 1fat s ILE 188 Ca -0.04 -0.96 -0.07 0.00 -1.41 0.00 0.00 60.65 58.16 1fat s ILE 188 Cb -0.03 -0.41 0.00 0.00 0.13 0.00 0.00 42.46 42.15 1fat s ILE 188 CO 0.01 -0.53 0.14 -0.69 -1.91 0.00 0.00 174.94 171.96 1fat s VAL 189 N -1.69 0.08 -0.26 4.00 1.01 0.28 -4.85 120.40 118.96 1fat s VAL 189 Ca -0.14 -0.68 -0.21 0.00 0.00 0.00 0.00 61.98 60.96 1fat s VAL 189 Cb -0.08 -0.43 0.07 0.00 0.00 0.00 0.00 36.38 35.94 1fat s VAL 189 CO -0.02 -0.37 0.68 -0.94 0.00 0.00 0.00 175.10 174.45 1fat s SER 190 N -1.36 -0.77 0.21 3.32 1.04 -1.26 -0.87 113.70 114.00 1fat s SER 190 Ca -0.14 1.40 -0.16 0.00 0.48 0.00 0.00 55.95 57.53 1fat s SER 190 Cb -0.07 1.37 0.02 0.00 0.10 0.00 0.00 66.02 67.43 1fat s SER 190 CO 0.02 -0.24 0.50 -0.62 0.98 0.00 0.00 173.24 173.88 1fat s ASP 191 N 0.76 -0.19 -0.07 7.02 2.15 -0.48 -4.98 116.67 120.87 1fat s ASP 191 Ca -0.03 -0.61 -0.15 0.00 0.43 0.00 0.00 52.55 52.19 1fat s ASP 191 Cb -0.05 0.57 -0.05 0.00 -0.30 0.00 0.00 42.92 43.10 1fat s ASP 191 CO -0.06 -1.07 0.38 0.42 -0.17 0.00 0.00 175.17 174.67 1fat s THR 192 N -3.91 5.16 -0.00 1.71 -4.23 -1.26 -0.27 115.64 112.84 1fat s THR 192 Ca 0.12 0.75 0.03 0.00 -1.18 0.00 0.00 61.69 61.41 1fat s THR 192 Cb -0.01 -3.69 -0.01 0.00 1.34 0.00 0.00 72.50 70.13 1fat s THR 192 CO 0.00 0.48 -0.09 -0.69 -0.54 0.00 0.00 174.62 173.78 1fat s VAL 193 N -0.34 0.74 -0.50 2.29 1.01 -0.03 -4.91 120.40 118.67 1fat s VAL 193 Ca 0.22 -0.45 -0.10 0.00 0.00 0.00 0.00 61.98 61.64 1fat s VAL 193 Cb -0.15 -0.63 0.13 0.00 0.00 0.00 0.00 36.38 35.73 1fat s VAL 193 CO 0.10 0.17 0.39 -0.62 0.00 0.00 0.00 175.10 175.14 1fat s ASP 194 N -0.32 5.81 0.28 3.32 2.15 -1.26 -4.68 116.67 121.98 1fat s ASP 194 Ca 0.03 -1.93 -0.02 0.00 0.43 0.00 0.00 52.55 51.06 1fat s ASP 194 Cb -0.04 -2.05 0.43 0.00 -0.30 0.00 0.00 42.92 40.96 1fat s ASP 194 CO -0.00 -0.72 1.92 -0.07 -0.17 0.00 0.00 175.17 176.13 1fat h LEU 195 N 8.49 1.00 -1.55 -1.34 4.07 -1.97 -2.14 115.31 121.86 1fat h LEU 195 Ca -0.21 -0.01 0.07 0.00 0.08 0.00 0.00 57.88 57.81 1fat h LEU 195 Cb 1.07 -0.22 -0.04 0.00 1.08 0.00 0.00 40.66 42.56 1fat h LEU 195 CO 0.89 0.67 0.40 0.11 -1.08 0.00 0.00 178.44 179.43 1fat h LYS 196 N 1.15 0.53 -0.39 1.13 1.57 -1.93 0.42 116.57 119.05 1fat h LYS 196 Ca 0.38 -0.03 -0.14 0.00 -1.87 0.00 0.00 60.65 58.99 1fat h LYS 196 Cb 0.07 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 1fat h LYS 196 CO -0.13 0.35 -0.30 0.77 -0.57 0.00 0.00 179.45 179.58 1fat h SER 197 N 0.54 0.88 0.00 0.86 0.02 -1.82 -3.38 113.55 110.66 1fat h SER 197 Ca 0.26 -0.36 -0.29 0.00 -0.84 0.00 0.00 61.79 60.56 1fat h SER 197 Cb 0.33 -0.24 -0.05 0.00 0.14 0.00 0.00 62.40 62.57 1fat h SER 197 CO -0.08 1.11 -2.10 0.55 -1.14 0.00 0.00 176.83 175.18 1fat n VAL 198 N -4.08 1.10 -3.77 2.27 3.14 -1.01 -5.04 118.33 110.94 1fat n VAL 198 Ca -0.01 -0.61 -0.32 0.00 -2.96 0.00 0.00 64.34 60.44 1fat n VAL 198 Cb 0.49 -0.74 -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 -5.41 4.33 0.66 6.55 1.43 0.11 -4.32 118.68 122.02 1fat s LEU 199 Ca -0.13 0.49 -0.11 0.00 -1.03 0.00 0.00 54.13 53.35 1fat s LEU 199 Cb 0.05 -2.99 -0.02 0.00 0.03 0.00 0.00 46.19 43.26 1fat s LEU 199 CO 0.60 0.15 1.05 -2.16 0.23 0.00 0.00 176.35 176.22 1fat s PRO 200 N -2.31 3.29 0.35 1.29 0.04 -1.26 -4.67 135.00 131.73 1fat s PRO 200 Ca 0.35 0.77 0.08 0.00 0.04 0.00 0.00 61.00 62.24 1fat s PRO 200 Cb -0.13 -2.04 0.80 0.00 0.04 0.00 0.00 34.50 33.17 1fat s PRO 200 CO 0.23 -0.80 1.87 0.93 0.04 0.00 0.00 177.00 179.26 1fat h GLU 201 N -0.49 0.69 -5.94 4.56 5.08 -1.96 -3.41 114.58 113.10 1fat h GLU 201 Ca -0.44 -0.04 -0.68 0.00 -1.00 0.00 0.00 59.36 57.20 1fat h GLU 201 Cb 1.21 -0.15 -0.26 0.00 0.50 0.00 0.00 28.75 30.04 1fat h GLU 201 CO 0.61 0.45 -0.79 -1.58 -1.00 0.00 0.00 179.01 176.70 1fat s TRP 202 N -5.69 2.68 0.04 4.33 0.52 -1.26 0.13 118.94 119.70 1fat s TRP 202 Ca -0.10 -0.42 -0.06 0.00 0.02 0.00 0.00 56.10 55.54 1fat s TRP 202 Cb 0.22 -1.69 -0.01 0.00 -1.15 0.00 0.00 33.47 30.84 1fat s TRP 202 CO 0.79 -0.02 0.10 0.14 0.02 0.00 0.00 176.95 177.98 1fat s VAL 203 N -0.27 0.13 0.40 4.03 -7.23 -0.17 -4.13 120.40 113.16 1fat s VAL 203 Ca 0.01 -1.11 -0.05 0.00 -1.81 0.00 0.00 61.98 59.03 1fat s VAL 203 Cb -0.13 -0.94 -0.04 0.00 0.56 0.00 0.00 36.38 35.83 1fat s VAL 203 CO 0.03 -0.61 0.69 -0.44 -0.31 0.00 0.00 175.10 174.45 1fat s SER 204 N -2.19 6.35 -0.01 4.85 0.01 0.13 -0.94 113.70 121.89 1fat s SER 204 Ca -0.04 0.81 0.01 0.00 1.31 0.00 0.00 55.95 58.04 1fat s SER 204 Cb -0.01 -2.19 0.01 0.00 0.21 0.00 0.00 66.02 64.04 1fat s SER 204 CO -0.05 -0.41 -0.03 -0.69 0.41 0.00 0.00 173.24 172.46 1fat s VAL 205 N -2.46 0.32 0.00 3.43 1.01 -1.26 -1.94 120.40 119.49 1fat s VAL 205 Ca 0.46 -0.12 0.00 0.00 0.00 0.00 0.00 61.98 62.32 1fat s VAL 205 Cb -0.10 -0.31 0.00 0.00 0.00 0.00 0.00 36.38 35.97 1fat s VAL 205 CO 0.38 0.12 0.00 0.61 0.00 0.00 0.00 175.10 176.21 1fat n GLY 206 N 3.33 -0.78 3.22 4.51 0.00 -0.86 -1.25 105.19 113.35 1fat n GLY 206 Ca -0.17 -0.07 -0.14 0.00 0.00 0.00 0.00 46.02 45.63 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 -3.21 1.17 -0.03 1.61 0.08 -0.19 -0.66 117.98 116.75 1fat s PHE 207 Ca 0.00 -0.73 -0.09 0.00 0.12 0.00 0.00 56.93 56.23 1fat s PHE 207 Cb 0.00 -0.62 0.01 0.00 -0.57 0.00 0.00 43.02 41.85 1fat s PHE 207 CO 0.00 0.04 0.20 0.45 -0.10 0.00 0.00 175.22 175.81 1fat s SER 208 N -2.88 -0.10 -0.00 1.36 0.15 -0.27 -1.44 113.70 110.51 1fat s SER 208 Ca 0.12 0.07 -0.28 0.00 0.70 0.00 0.00 55.95 56.56 1fat s SER 208 Cb 0.01 0.31 0.09 0.00 -1.71 0.00 0.00 66.02 64.72 1fat s SER 208 CO -0.00 -0.29 0.79 0.00 1.20 0.00 0.00 173.24 174.94 1fat s ALA 209 N -0.89 -1.78 0.08 5.45 0.00 -0.93 -0.47 121.76 123.22 1fat s ALA 209 Ca -0.10 1.05 -0.10 0.00 0.00 0.00 0.00 51.96 52.82 1fat s ALA 209 Cb -0.05 0.23 0.00 0.00 0.00 0.00 0.00 23.12 23.31 1fat s ALA 209 CO 0.02 -0.57 0.21 0.95 0.00 0.00 0.00 175.76 176.37 1fat s THR 210 N -2.49 0.13 0.25 0.00 -4.23 -1.12 -1.53 115.64 106.66 1fat s THR 210 Ca -0.01 -1.06 0.08 0.00 -1.18 0.00 0.00 61.69 59.52 1fat s THR 210 Cb -0.01 -1.23 -0.04 0.00 1.34 0.00 0.00 72.50 72.56 1fat s THR 210 CO -0.04 -0.59 0.08 0.42 -0.54 0.00 0.00 174.62 173.96 1fat s THR 211 N -3.56 3.90 0.52 3.99 -4.23 -0.06 -1.71 115.64 114.49 1fat s THR 211 Ca 0.02 -1.67 -0.21 0.00 -1.18 0.00 0.00 61.69 58.66 1fat s THR 211 Cb 0.03 -3.09 -0.08 0.00 1.34 0.00 0.00 72.50 70.71 1fat s THR 211 CO -0.09 -0.35 0.96 0.61 -0.54 0.00 0.00 174.62 175.21 1fat n GLY 212 N -0.98 -0.33 0.39 3.99 0.00 -0.41 -3.89 105.19 103.97 1fat n GLY 212 Ca -0.07 -0.02 0.10 0.00 0.00 0.00 0.00 46.02 46.04 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 -1.16 0.14 -4.67 -0.61 -5.35 -1.26 -1.55 119.36 104.89 1fat n ILE 213 Ca 0.11 -0.24 -0.24 0.00 -0.27 0.00 0.00 62.75 62.11 1fat n ILE 213 Cb 0.44 0.18 -0.16 0.00 -1.74 0.00 0.00 39.64 38.36 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 -1.60 1.82 0.00 7.28 0.01 -1.26 -4.75 114.94 116.44 1fat s ASN 214 Ca 0.32 -0.29 0.00 0.00 -0.71 0.00 0.00 52.86 52.17 1fat s ASN 214 Cb 0.16 -0.52 0.00 0.00 0.41 0.00 0.00 41.25 41.31 1fat s ASN 214 CO 0.25 0.12 0.00 0.29 -1.51 0.00 0.00 177.10 176.25 1fat n LYS 215 N 3.23 0.00 -0.00 -0.60 5.02 -1.26 -1.04 118.16 123.50 1fat n LYS 215 Ca -0.18 0.00 0.04 0.00 -2.02 0.00 0.00 58.31 56.15 1fat n LYS 215 Cb 0.53 0.00 0.26 0.00 -0.02 0.00 0.00 35.03 35.80 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 -0.46 -0.94 3.03 0.72 0.00 -1.26 -4.58 105.19 101.70 1fat n GLY 216 Ca 0.00 -0.07 -0.33 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 -1.27 4.79 0.03 1.61 0.02 -0.21 -0.10 114.94 119.81 1fat s ASN 217 Ca 0.13 -2.67 -0.14 0.00 -1.02 0.00 0.00 52.86 49.16 1fat s ASN 217 Cb 0.06 -1.72 0.02 0.00 0.02 0.00 0.00 41.25 39.63 1fat s ASN 217 CO 0.10 -0.34 0.31 0.68 0.02 0.00 0.00 177.10 177.87 1fat s VAL 218 N 0.20 0.08 0.18 1.60 -7.23 -0.35 -1.28 120.40 113.59 1fat s VAL 218 Ca 0.15 -0.63 -0.17 0.00 -1.81 0.00 0.00 61.98 59.52 1fat s VAL 218 Cb -0.23 -0.87 0.03 0.00 0.56 0.00 0.00 36.38 35.87 1fat s VAL 218 CO -0.03 -0.35 0.48 -1.83 -0.31 0.00 0.00 175.10 173.07 1fat s GLU 219 N -2.30 1.29 0.21 4.82 -1.05 -1.15 -4.31 118.70 116.21 1fat s GLU 219 Ca -0.07 -0.83 -0.06 0.00 -0.15 0.00 0.00 54.97 53.86 1fat s GLU 219 Cb -0.02 0.50 -0.06 0.00 -0.44 0.00 0.00 34.13 34.12 1fat s GLU 219 CO -0.02 -0.53 0.48 0.95 0.95 0.00 0.00 175.26 177.09 1fat s THR 220 N -3.86 5.05 -0.42 1.83 -4.23 -0.52 -4.80 115.64 108.69 1fat s THR 220 Ca 0.08 0.16 0.02 0.00 -1.18 0.00 0.00 61.69 60.76 1fat s THR 220 Cb -0.00 -3.66 0.13 0.00 1.34 0.00 0.00 72.50 70.31 1fat s THR 220 CO -0.05 -0.11 0.22 0.20 -0.54 0.00 0.00 174.62 174.33 1fat s ASN 221 N -2.66 3.75 -0.06 3.99 0.01 -1.26 -3.40 114.94 115.32 1fat s ASN 221 Ca 0.44 -2.50 0.05 0.00 -0.71 0.00 0.00 52.86 50.14 1fat s ASN 221 Cb -0.11 -1.05 -0.02 0.00 0.41 0.00 0.00 41.25 40.48 1fat s ASN 221 CO 0.25 -0.29 -0.20 -1.81 -1.51 0.00 0.00 177.10 173.54 1fat s ASP 222 N 0.51 3.49 -0.14 -1.22 1.01 -0.93 -1.17 116.67 118.22 1fat s ASP 222 Ca 0.16 -0.38 -0.03 0.00 0.71 0.00 0.00 52.55 53.02 1fat s ASP 222 Cb -0.24 -0.83 -0.03 0.00 1.01 0.00 0.00 42.92 42.84 1fat s ASP 222 CO -0.03 0.29 -0.03 -0.69 0.21 0.00 0.00 175.17 174.91 1fat s VAL 223 N -0.39 3.94 -0.21 -1.27 1.01 0.07 -0.35 120.40 123.20 1fat s VAL 223 Ca 0.03 -0.35 0.18 0.00 0.00 0.00 0.00 61.98 61.84 1fat s VAL 223 Cb -0.12 -2.71 -0.26 0.00 0.00 0.00 0.00 36.38 33.29 1fat s VAL 223 CO 0.02 0.51 0.48 0.18 0.00 0.00 0.00 175.10 176.29 1fat n LEU 224 N 3.29 0.19 -3.57 3.92 4.77 0.79 -1.42 117.00 124.97 1fat n LEU 224 Ca -0.17 -0.12 -0.08 0.00 -0.03 0.00 0.00 56.01 55.61 1fat n LEU 224 Cb 0.53 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.58 1fat n LEU 224 CO 0.32 0.05 0.83 -0.94 -1.33 0.00 0.00 177.39 176.32 1fat s SER 225 N -3.74 -0.30 -0.04 -1.43 1.04 -1.25 -4.57 113.70 103.41 1fat s SER 225 Ca -0.04 0.23 -0.22 0.00 0.48 0.00 0.00 55.95 56.40 1fat s SER 225 Cb 0.12 0.27 0.05 0.00 0.10 0.00 0.00 66.02 66.55 1fat s SER 225 CO 0.74 -0.35 0.49 0.86 0.98 0.00 0.00 173.24 175.96 1fat s TRP 226 N -1.69 -0.42 -0.16 5.02 -0.00 -0.95 -2.13 118.94 118.61 1fat s TRP 226 Ca 0.02 0.73 -0.09 0.00 -0.00 0.00 0.00 56.10 56.76 1fat s TRP 226 Cb -0.01 0.24 0.06 0.00 -0.00 0.00 0.00 33.47 33.76 1fat s TRP 226 CO -0.02 -0.48 0.39 -1.54 -0.00 0.00 0.00 176.95 175.30 1fat s SER 227 N -1.17 -0.48 0.21 5.86 1.04 -0.11 -0.94 113.70 118.11 1fat s SER 227 Ca -0.12 0.85 0.09 0.00 0.48 0.00 0.00 55.95 57.26 1fat s SER 227 Cb -0.03 0.74 -0.05 0.00 0.10 0.00 0.00 66.02 66.79 1fat s SER 227 CO 0.07 -0.18 -0.18 0.12 0.98 0.00 0.00 173.24 174.05 1fat s PHE 228 N 1.24 1.93 -0.27 5.02 5.36 -0.93 -1.12 117.98 129.20 1fat s PHE 228 Ca -0.08 -0.47 -0.17 0.00 -0.96 0.00 0.00 56.93 55.25 1fat s PHE 228 Cb -0.08 -0.90 0.08 0.00 -0.34 0.00 0.00 43.02 41.78 1fat s PHE 228 CO -0.11 0.45 0.68 0.00 -1.46 0.00 0.00 175.22 174.79 1fat s ALA 229 N -2.52 -1.83 -0.03 11.12 0.00 -0.44 -1.97 121.76 126.10 1fat s ALA 229 Ca 0.22 2.35 -0.02 0.00 0.00 0.00 0.00 51.96 54.52 1fat s ALA 229 Cb -0.04 -1.38 0.02 0.00 0.00 0.00 0.00 23.12 21.72 1fat s ALA 229 CO 0.09 -0.37 0.07 0.45 0.00 0.00 0.00 175.76 176.00 1fat s SER 230 N 1.50 -0.04 -0.17 0.00 0.15 -0.85 -1.11 113.70 113.18 1fat s SER 230 Ca -0.09 0.13 0.00 0.00 0.70 0.00 0.00 55.95 56.70 1fat s SER 230 Cb -0.05 0.09 0.04 0.00 -1.71 0.00 0.00 66.02 64.38 1fat s SER 230 CO -0.18 -0.07 -0.10 -0.75 1.20 0.00 0.00 173.24 173.35 1fat s LYS 231 N 0.47 1.94 -0.25 5.44 2.20 -0.70 -1.78 119.74 127.06 1fat s LYS 231 Ca -0.04 -0.67 -0.07 0.00 -0.36 0.00 0.00 55.97 54.84 1fat s LYS 231 Cb -0.05 -2.20 -0.02 0.00 -1.51 0.00 0.00 37.83 34.05 1fat s LYS 231 CO -0.02 -0.37 0.05 -1.17 -0.36 0.00 0.00 175.35 173.49 1fat s LEU 232 N 1.49 3.42 0.00 5.43 2.96 -1.23 -1.95 118.68 128.79 1fat s LEU 232 Ca 0.01 -0.31 0.00 0.00 -0.22 0.00 0.00 54.13 53.61 1fat s LEU 232 Cb -0.15 -1.89 0.00 0.00 0.50 0.00 0.00 46.19 44.65 1fat s LEU 232 CO -0.09 -0.06 0.00 -0.24 -1.32 0.00 0.00 176.35 174.65