#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i4n n PHE 2 N 0.00 -0.09 -4.31 1.12 3.01 -1.26 -4.94 117.46 110.99 3i4n n PHE 2 Ca 0.00 0.04 -0.17 0.00 1.01 0.00 0.00 57.45 58.33 3i4n n PHE 2 Cb 0.00 -0.09 -0.05 0.00 -0.01 0.00 0.00 39.48 39.32 3i4n n PHE 2 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 3i4n n PHE 3 N -0.04 -0.10 -3.36 1.38 3.01 0.17 -4.98 117.46 113.53 3i4n n PHE 3 Ca 0.01 -1.92 -0.19 0.00 1.01 0.00 0.00 57.45 56.36 3i4n n PHE 3 Cb 0.02 0.06 -0.08 0.00 -0.01 0.00 0.00 39.48 39.47 3i4n n PHE 3 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 3i4n s ILE 4 N -2.74 -0.23 0.40 4.37 1.01 -1.26 -0.80 121.20 121.95 3i4n s ILE 4 Ca 0.19 -1.23 -0.02 0.00 0.00 0.00 0.00 60.65 59.59 3i4n s ILE 4 Cb 0.01 -0.75 -0.03 0.00 0.01 0.00 0.00 42.46 41.69 3i4n s ILE 4 CO 0.13 -0.68 0.64 -0.75 0.00 0.00 0.00 174.94 174.28 3i4n s LYS 5 N 1.24 3.49 -0.39 2.79 2.47 -1.11 -4.83 119.74 123.39 3i4n s LYS 5 Ca 0.19 -0.15 -0.14 0.00 -1.56 0.00 0.00 55.97 54.31 3i4n s LYS 5 Cb -0.15 -2.56 0.02 0.00 -1.46 0.00 0.00 37.83 33.68 3i4n s LYS 5 CO -0.03 0.01 0.26 -0.51 0.16 0.00 0.00 175.35 175.24 3i4n s ASP 6 N -4.07 5.99 0.50 1.43 1.01 -1.26 -2.65 116.67 117.62 3i4n s ASP 6 Ca 0.43 -0.85 0.04 0.00 0.71 0.00 0.00 52.55 52.88 3i4n s ASP 6 Cb -0.10 -2.12 -0.01 0.00 1.01 0.00 0.00 42.92 41.71 3i4n s ASP 6 CO 0.39 -0.40 0.15 -0.76 0.21 0.00 0.00 175.17 174.76 3i4n s LEU 7 N 1.65 2.57 0.19 1.23 1.43 -0.80 -4.99 118.68 119.97 3i4n s LEU 7 Ca 0.04 -1.44 -0.00 0.00 -1.03 0.00 0.00 54.13 51.70 3i4n s LEU 7 Cb -0.19 -0.98 -0.04 0.00 0.03 0.00 0.00 46.19 45.01 3i4n s LEU 7 CO 0.09 -0.86 0.10 -0.94 0.23 0.00 0.00 176.35 174.98 3i4n s SER 8 N -3.99 0.41 -0.28 2.29 1.04 -1.26 -1.13 113.70 110.78 3i4n s SER 8 Ca 0.21 -1.34 -0.19 0.00 0.48 0.00 0.00 55.95 55.10 3i4n s SER 8 Cb 0.01 0.31 0.08 0.00 0.10 0.00 0.00 66.02 66.53 3i4n s SER 8 CO 0.12 -0.79 0.72 -0.22 0.98 0.00 0.00 173.24 174.05 3i4n s LEU 9 N -3.16 -0.86 -0.52 2.42 2.96 -0.07 -4.96 118.68 114.50 3i4n s LEU 9 Ca 0.35 1.46 -0.17 0.00 -0.22 0.00 0.00 54.13 55.55 3i4n s LEU 9 Cb 0.07 2.39 0.09 0.00 0.50 0.00 0.00 46.19 49.24 3i4n s LEU 9 CO 0.10 -0.24 0.52 0.20 -1.32 0.00 0.00 176.35 175.61 3i4n s ASN 10 N 1.16 6.18 -0.20 3.68 0.01 -1.26 -0.65 114.94 123.86 3i4n s ASN 10 Ca -0.06 -1.38 -0.07 0.00 -0.71 0.00 0.00 52.86 50.64 3i4n s ASN 10 Cb -0.05 -2.23 -0.04 0.00 0.41 0.00 0.00 41.25 39.34 3i4n s ASN 10 CO -0.12 -0.83 0.06 -0.63 -1.51 0.00 0.00 177.10 174.07 3i4n s ILE 11 N 2.01 4.62 -0.21 0.60 1.01 -0.40 -4.91 121.20 123.92 3i4n s ILE 11 Ca 0.07 -0.09 -0.14 0.00 0.00 0.00 0.00 60.65 60.50 3i4n s ILE 11 Cb -0.25 -3.11 -0.04 0.00 0.01 0.00 0.00 42.46 39.08 3i4n s ILE 11 CO 0.07 0.42 0.32 -0.89 0.00 0.00 0.00 174.94 174.86 3i4n s THR 12 N 0.77 5.25 0.13 2.92 2.01 -1.26 -0.79 115.64 124.67 3i4n s THR 12 Ca 0.03 0.55 0.04 0.00 0.31 0.00 0.00 61.69 62.62 3i4n s THR 12 Cb -0.13 -3.66 -0.04 0.00 0.01 0.00 0.00 72.50 68.68 3i4n s THR 12 CO 0.02 0.29 0.11 -0.22 -0.69 0.00 0.00 174.62 174.13 3i4n s LEU 13 N 1.18 3.80 0.09 4.42 0.20 -0.35 -4.95 118.68 123.08 3i4n s LEU 13 Ca 0.16 -0.07 -0.23 0.00 0.69 0.00 0.00 54.13 54.67 3i4n s LEU 13 Cb -0.14 -2.45 -0.07 0.00 -0.43 0.00 0.00 46.19 43.10 3i4n s LEU 13 CO 0.07 0.12 0.70 -2.28 -0.29 0.00 0.00 176.35 174.66 3i4n s HIS 14 N -1.58 3.81 0.57 5.38 5.65 -1.26 -2.04 115.29 125.82 3i4n s HIS 14 Ca 0.30 1.45 0.30 0.00 0.25 0.00 0.00 55.06 57.37 3i4n s HIS 14 Cb -0.11 -2.69 1.45 0.00 -1.18 0.00 0.00 32.58 30.05 3i4n s HIS 14 CO 0.23 0.46 1.86 -1.35 -0.65 0.00 0.00 174.74 175.28 3i4n h PRO 15 N 4.86 0.00 -0.50 2.88 0.11 -1.93 -0.72 132.00 136.70 3i4n h PRO 15 Ca -0.47 0.00 0.05 0.00 0.11 0.00 0.00 66.00 65.69 3i4n h PRO 15 Cb 1.21 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.26 3i4n h PRO 15 CO 0.67 0.00 -0.30 0.45 -0.21 0.00 0.00 178.00 178.61 3i4n n SER 16 N -3.94 -0.53 -0.12 -2.05 2.88 -1.26 -0.04 113.62 108.55 3i4n n SER 16 Ca 0.14 1.39 0.00 0.00 -1.33 0.00 0.00 58.87 59.07 3i4n n SER 16 Cb 0.87 -0.36 0.00 0.00 -0.75 0.00 0.00 64.21 63.97 3i4n n SER 16 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 3i4n n PHE 17 N -4.13 0.00 -0.47 0.66 0.99 -0.28 -4.52 117.46 109.71 3i4n n PHE 17 Ca 0.01 0.00 -0.07 0.00 -0.00 0.00 0.00 57.45 57.39 3i4n n PHE 17 Cb 0.13 -0.02 -0.07 0.00 -1.00 0.00 0.00 39.48 38.52 3i4n n PHE 17 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.76 177.95 3i4n n PHE 18 N -0.34 0.09 -0.87 1.38 3.01 0.94 -4.62 117.46 117.05 3i4n n PHE 18 Ca 0.00 -0.77 0.00 0.00 1.01 0.00 0.00 57.45 57.69 3i4n n PHE 18 Cb 0.05 -0.99 0.00 0.00 -0.01 0.00 0.00 39.48 38.52 3i4n n PHE 18 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3i4n n GLY 19 N 2.86 1.89 0.12 1.37 0.00 -1.26 -5.05 105.19 105.12 3i4n n GLY 19 Ca 0.21 -1.88 -0.21 0.00 0.00 0.00 0.00 46.02 44.14 3i4n n GLY 19 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3i4n h PRO 20 N 0.00 0.18 -2.17 1.61 0.13 -2.00 -3.36 132.00 126.39 3i4n h PRO 20 Ca 0.00 -0.30 -0.35 0.00 -0.87 0.00 0.00 66.00 64.48 3i4n h PRO 20 Cb 0.00 0.11 -0.08 0.00 0.13 0.00 0.00 31.00 31.16 3i4n h PRO 20 CO 0.00 1.15 0.50 -2.13 -0.23 0.00 0.00 178.00 177.28 3i4n n ARG 21 N -3.93 2.45 -0.04 0.86 0.63 -1.26 -4.34 116.66 111.03 3i4n n ARG 21 Ca -0.29 -1.58 -0.00 0.00 -0.92 0.00 0.00 57.85 55.06 3i4n n ARG 21 Cb 0.88 -2.17 -0.00 0.00 0.45 0.00 0.00 32.46 31.62 3i4n n ARG 21 CO 0.00 0.00 0.00 1.98 -2.51 0.00 0.00 177.63 177.10 3i4n h MET 22 N 3.35 0.00 -0.95 -0.14 4.05 -1.82 -2.92 114.93 116.50 3i4n h MET 22 Ca 0.35 0.00 0.28 0.00 -0.28 0.00 0.00 59.70 60.05 3i4n h MET 22 Cb 1.12 0.00 -0.14 0.00 -0.80 0.00 0.00 31.60 31.77 3i4n h MET 22 CO 0.64 0.00 0.42 -0.22 0.23 0.00 0.00 176.91 177.98 3i4n h LYS 23 N -0.68 0.28 -0.01 0.39 3.64 -1.92 0.46 116.57 118.73 3i4n h LYS 23 Ca 0.00 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.39 3i4n h LYS 23 Cb 0.03 -0.06 -0.06 0.00 -0.41 0.00 0.00 32.23 31.73 3i4n h LYS 23 CO 0.00 0.19 -0.41 0.37 -2.27 0.00 0.00 179.45 177.33 3i4n h GLN 24 N 0.29 -0.54 -0.37 1.90 5.75 -1.86 -0.18 115.11 120.10 3i4n h GLN 24 Ca 0.65 0.04 -0.11 0.00 -0.15 0.00 0.00 58.65 59.07 3i4n h GLN 24 Cb 1.39 0.12 -0.01 0.00 1.07 0.00 0.00 27.48 30.05 3i4n h GLN 24 CO -0.62 -0.36 -0.19 -0.92 -2.65 0.00 0.00 178.83 174.09 3i4n h TYR 25 N -0.56 0.91 -0.02 3.99 3.20 -0.08 -2.57 116.97 121.83 3i4n h TYR 25 Ca 0.05 -0.23 0.01 0.00 3.14 0.00 0.00 58.73 61.70 3i4n h TYR 25 Cb 0.64 -0.21 -0.03 0.00 1.54 0.00 0.00 36.73 38.67 3i4n h TYR 25 CO -0.42 0.98 -0.32 -0.07 -1.64 0.00 0.00 178.16 176.68 3i4n h LEU 26 N 0.58 -1.00 -0.63 2.82 3.38 -0.11 0.31 115.31 120.66 3i4n h LEU 26 Ca 0.08 0.11 0.12 0.00 0.09 0.00 0.00 57.88 58.29 3i4n h LEU 26 Cb 0.75 0.38 -0.12 0.00 0.09 0.00 0.00 40.66 41.76 3i4n h LEU 26 CO 0.06 -0.31 -0.22 0.11 0.09 0.00 0.00 178.44 178.17 3i4n h LYS 27 N -0.39 -0.05 -0.47 1.13 1.57 -1.08 0.46 116.57 117.73 3i4n h LYS 27 Ca 0.01 0.00 0.10 0.00 -1.87 0.00 0.00 60.65 58.89 3i4n h LYS 27 Cb 0.43 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.72 3i4n h LYS 27 CO -0.23 -0.04 0.32 1.15 -0.57 0.00 0.00 179.45 180.09 3i4n h THR 28 N -0.06 0.87 0.17 -0.16 2.02 -0.91 -1.23 112.91 113.61 3i4n h THR 28 Ca 0.29 -0.07 -0.01 0.00 0.77 0.00 0.00 66.41 67.39 3i4n h THR 28 Cb 0.50 0.64 0.00 0.00 -1.74 0.00 0.00 68.15 67.55 3i4n h THR 28 CO -0.67 0.04 -0.08 0.50 0.37 0.00 0.00 175.52 175.68 3i4n h LYS 29 N 0.21 -0.22 -0.96 6.66 1.63 0.36 -2.89 116.57 121.36 3i4n h LYS 29 Ca 0.22 0.01 0.14 0.00 -0.85 0.00 0.00 60.65 60.18 3i4n h LYS 29 Cb 0.59 0.05 -0.15 0.00 -0.60 0.00 0.00 32.23 32.12 3i4n h LYS 29 CO -0.04 0.20 -0.41 1.25 -3.45 0.00 0.00 179.45 177.00 3i4n h LEU 30 N -0.85 -1.51 -1.08 5.20 5.85 -0.12 0.57 115.31 123.37 3i4n h LEU 30 Ca -0.02 0.31 0.12 0.00 0.84 0.00 0.00 57.88 59.13 3i4n h LEU 30 Cb 0.52 0.77 -0.08 0.00 0.37 0.00 0.00 40.66 42.24 3i4n h LEU 30 CO 0.04 -0.28 0.62 -0.07 -0.34 0.00 0.00 178.44 178.40 3i4n h LEU 31 N -0.02 0.86 -0.30 2.25 3.38 -1.29 -1.76 115.31 118.44 3i4n h LEU 31 Ca 0.31 0.05 -0.06 0.00 0.09 0.00 0.00 57.88 58.27 3i4n h LEU 31 Cb 0.57 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 3i4n h LEU 31 CO -0.96 0.46 -0.05 -0.33 0.09 0.00 0.00 178.44 177.65 3i4n h GLU 32 N 0.92 0.56 -0.91 1.13 5.08 0.30 -2.58 114.58 119.09 3i4n h GLU 32 Ca 0.48 -0.20 -0.02 0.00 -1.00 0.00 0.00 59.36 58.62 3i4n h GLU 32 Cb 0.54 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 3i4n h GLU 32 CO -0.25 0.74 0.02 0.39 -1.00 0.00 0.00 179.01 178.92 3i4n n GLU 33 N -4.51 1.85 0.10 2.33 1.02 -0.47 -4.52 120.64 116.43 3i4n n GLU 33 Ca -0.03 -0.76 0.00 0.00 -0.02 0.00 0.00 57.16 56.36 3i4n n GLU 33 Cb 0.30 -1.63 0.00 0.00 -0.02 0.00 0.00 31.44 30.09 3i4n n GLU 33 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3i4n n VAL 34 N 0.14 0.00 -1.52 2.62 0.31 -0.85 -4.93 118.33 114.09 3i4n n VAL 34 Ca 0.08 0.00 -0.45 0.00 -0.01 0.00 0.00 64.34 63.96 3i4n n VAL 34 Cb 0.53 -0.22 -0.05 0.00 -0.91 0.00 0.00 33.84 33.18 3i4n n VAL 34 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3i4n n GLU 35 N -3.07 1.37 0.00 5.55 1.02 -0.98 0.39 120.64 124.92 3i4n n GLU 35 Ca 0.00 0.32 0.00 0.00 -0.02 0.00 0.00 57.16 57.46 3i4n n GLU 35 Cb 0.00 -2.88 0.00 0.00 -0.02 0.00 0.00 31.44 28.54 3i4n n GLU 35 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3i4n n GLY 36 N 6.16 0.73 0.47 0.62 0.00 -0.83 -4.91 105.19 107.42 3i4n n GLY 36 Ca 0.37 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.36 3i4n n GLY 36 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3i4n n SER 37 N 0.00 -0.49 0.00 1.61 3.41 0.16 -4.87 113.62 113.45 3i4n n SER 37 Ca 0.00 -0.85 0.00 0.00 -0.26 0.00 0.00 58.87 57.76 3i4n n SER 37 Cb 0.00 -0.13 0.00 0.00 -0.26 0.00 0.00 64.21 63.82 3i4n n SER 37 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3i4n s THR 39 N -0.26 0.05 -0.74 0.00 2.01 -0.85 -4.41 115.64 111.43 3i4n s THR 39 Ca 0.00 -0.41 0.08 0.00 0.31 0.00 0.00 61.69 61.67 3i4n s THR 39 Cb 0.00 -0.34 0.08 0.00 0.01 0.00 0.00 72.50 72.24 3i4n s THR 39 CO 0.00 -0.22 1.24 0.61 -0.69 0.00 0.00 174.62 175.55 3i4n n GLY 40 N 2.10 -0.65 0.15 4.40 0.00 -1.26 0.20 105.19 110.13 3i4n n GLY 40 Ca -0.18 0.06 -0.23 0.00 0.00 0.00 0.00 46.02 45.67 3i4n n GLY 40 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3i4n h LYS 41 N 0.00 0.52 0.00 1.61 3.64 -2.02 -3.38 116.57 116.94 3i4n h LYS 41 Ca 0.00 -0.82 0.00 0.00 -1.27 0.00 0.00 60.65 58.56 3i4n h LYS 41 Cb 0.02 0.29 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 3i4n h LYS 41 CO 0.00 1.38 -0.42 1.19 -2.27 0.00 0.00 179.45 179.33 3i4n n PHE 42 N -3.83 0.00 -2.83 1.91 3.01 -1.00 -5.12 117.46 109.60 3i4n n PHE 42 Ca -0.15 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.31 3i4n n PHE 42 Cb 1.01 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.48 3i4n n PHE 42 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3i4n n GLY 43 N 1.60 0.25 3.62 1.37 0.00 0.53 -4.48 105.19 108.08 3i4n n GLY 43 Ca 0.00 -1.21 -0.43 0.00 0.00 0.00 0.00 46.02 44.39 3i4n n GLY 43 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3i4n s TYR 44 N 0.00 3.11 -0.11 1.61 1.51 -0.85 -2.00 117.35 120.62 3i4n s TYR 44 Ca 0.00 1.02 -0.25 0.00 -1.01 0.00 0.00 57.07 56.82 3i4n s TYR 44 Cb 0.00 -3.69 -0.02 0.00 -0.11 0.00 0.00 41.96 38.14 3i4n s TYR 44 CO 0.00 -0.80 0.81 0.42 -1.11 0.00 0.00 175.55 174.88 3i4n s ILE 45 N 3.60 4.93 -0.02 2.71 -1.09 -1.13 -2.01 121.20 128.19 3i4n s ILE 45 Ca 0.42 1.64 0.00 0.00 -2.23 0.00 0.00 60.65 60.49 3i4n s ILE 45 Cb -0.12 -4.14 -0.01 0.00 -1.58 0.00 0.00 42.46 36.61 3i4n s ILE 45 CO 0.17 0.12 -0.02 0.18 -1.23 0.00 0.00 174.94 174.16 3i4n n LEU 46 N 4.56 2.69 -3.64 2.97 4.77 -0.42 -1.97 117.00 125.95 3i4n n LEU 46 Ca 0.03 -0.01 -0.06 0.00 -0.03 0.00 0.00 56.01 55.94 3i4n n LEU 46 Cb 0.50 -0.07 -0.07 0.00 -2.33 0.00 0.00 43.42 41.45 3i4n n LEU 46 CO 0.48 0.48 0.35 0.00 -1.33 0.00 0.00 177.39 177.37 3i4n s VAL 48 N 1.76 4.64 0.35 0.00 1.01 -1.26 -0.91 120.40 125.98 3i4n s VAL 48 Ca -0.10 1.93 -0.15 0.00 0.00 0.00 0.00 61.98 63.67 3i4n s VAL 48 Cb -0.06 -4.24 -0.09 0.00 0.00 0.00 0.00 36.38 31.99 3i4n s VAL 48 CO -0.20 -0.05 0.76 -0.76 0.00 0.00 0.00 175.10 174.85 3i4n s LEU 49 N 2.41 4.01 -0.97 3.92 1.43 -0.76 -4.38 118.68 124.35 3i4n s LEU 49 Ca 0.49 1.28 -0.03 0.00 -1.03 0.00 0.00 54.13 54.84 3i4n s LEU 49 Cb -0.19 -4.10 -0.04 0.00 0.03 0.00 0.00 46.19 41.89 3i4n s LEU 49 CO 0.16 -0.25 0.83 -0.67 0.23 0.00 0.00 176.35 176.65 3i4n n ASP 50 N -0.56 -4.66 -0.32 2.29 -0.08 -1.26 -4.68 116.55 107.29 3i4n n ASP 50 Ca 0.04 -0.60 0.35 0.00 -1.51 0.00 0.00 54.79 53.07 3i4n n ASP 50 Cb 0.53 -4.63 0.74 0.00 2.34 0.00 0.00 41.12 40.10 3i4n n ASP 50 CO 0.00 0.00 0.00 0.22 0.12 0.00 0.00 177.20 177.54 3i4n h TYR 51 N -1.21 0.00 0.00 -0.67 3.20 -1.97 -3.11 116.97 113.21 3i4n h TYR 51 Ca -0.53 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.34 3i4n h TYR 51 Cb 1.28 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.55 3i4n h TYR 51 CO 0.31 0.00 0.00 -3.47 -1.64 0.00 0.00 178.16 173.36 3i4n n ASP 52 N -4.05 0.00 -2.19 -2.11 -0.08 -1.26 -4.04 116.55 102.82 3i4n n ASP 52 Ca 0.26 0.64 -0.11 0.00 -1.51 0.00 0.00 54.79 54.07 3i4n n ASP 52 Cb 1.29 -0.18 -0.12 0.00 2.34 0.00 0.00 41.12 44.44 3i4n n ASP 52 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 3i4n n ASN 53 N -1.04 4.28 -4.70 1.67 5.03 -1.17 -4.90 115.26 114.42 3i4n n ASN 53 Ca 0.00 -2.28 -0.42 0.00 0.87 0.00 0.00 54.58 52.75 3i4n n ASN 53 Cb 0.00 -1.12 -0.03 0.00 -1.02 0.00 0.00 39.78 37.61 3i4n n ASN 53 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 3i4n s ILE 54 N 1.54 4.81 0.03 2.41 1.01 -1.26 -5.01 121.20 124.73 3i4n s ILE 54 Ca 0.52 2.04 -0.29 0.00 0.00 0.00 0.00 60.65 62.92 3i4n s ILE 54 Cb 0.24 -4.31 -0.04 0.00 0.01 0.00 0.00 42.46 38.36 3i4n s ILE 54 CO -0.00 0.08 0.94 -0.62 0.00 0.00 0.00 174.94 175.33 3i4n s ASP 55 N 1.06 7.37 -0.04 3.58 -1.08 -1.19 -4.93 116.67 121.43 3i4n s ASP 55 Ca 0.50 1.65 0.01 0.00 -0.52 0.00 0.00 52.55 54.19 3i4n s ASP 55 Cb -0.20 -2.56 -0.03 0.00 -1.46 0.00 0.00 42.92 38.68 3i4n s ASP 55 CO 0.23 -0.16 -0.03 -0.38 0.52 0.00 0.00 175.17 175.34 3i4n n ILE 56 N 3.44 0.23 -1.09 4.11 5.41 -1.26 -2.10 119.36 128.09 3i4n n ILE 56 Ca 0.04 -0.09 0.14 0.00 1.00 0.00 0.00 62.75 63.83 3i4n n ILE 56 Cb 0.50 -0.66 -0.06 0.00 -0.71 0.00 0.00 39.64 38.71 3i4n n ILE 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3i4n n GLN 57 N -2.58 -2.44 -2.11 0.38 6.02 -1.26 -3.91 117.38 111.47 3i4n n GLN 57 Ca -0.07 1.91 -0.43 0.00 -0.01 0.00 0.00 57.00 58.40 3i4n n GLN 57 Cb 0.58 -2.89 -0.03 0.00 1.02 0.00 0.00 30.24 28.92 3i4n n GLN 57 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 3i4n s ARG 58 N -3.42 3.81 0.69 -1.09 0.52 -1.26 -4.85 118.95 113.34 3i4n s ARG 58 Ca 0.00 1.68 -0.11 0.00 -0.52 0.00 0.00 55.73 56.78 3i4n s ARG 58 Cb 0.00 -4.03 0.01 0.00 0.52 0.00 0.00 34.95 31.45 3i4n s ARG 58 CO 0.00 -1.28 1.07 0.20 0.02 0.00 0.00 175.30 175.31 3i4n s GLY 59 N 4.20 1.62 -0.08 -3.53 0.00 -1.26 -4.90 107.32 103.38 3i4n s GLY 59 Ca 0.71 -0.39 0.02 0.00 0.00 0.00 0.00 44.72 45.07 3i4n s GLY 59 CO 0.29 -0.03 -0.13 1.09 0.00 0.00 0.00 173.10 174.32 3i4n s ARG 60 N -5.31 2.80 0.04 2.90 1.70 -0.77 -4.88 118.95 115.43 3i4n s ARG 60 Ca 0.58 -0.68 -0.30 0.00 -0.47 0.00 0.00 55.73 54.85 3i4n s ARG 60 Cb -0.11 -2.48 -0.07 0.00 -0.57 0.00 0.00 34.95 31.72 3i4n s ARG 60 CO 0.51 0.50 1.51 0.42 -1.08 0.00 0.00 175.30 177.16 3i4n s ILE 61 N -0.41 3.40 0.52 4.99 1.01 -1.26 -1.30 121.20 128.13 3i4n s ILE 61 Ca 0.05 0.83 -0.09 0.00 0.00 0.00 0.00 60.65 61.44 3i4n s ILE 61 Cb -0.12 -3.53 0.13 0.00 0.01 0.00 0.00 42.46 38.95 3i4n s ILE 61 CO 0.02 0.00 0.40 0.18 0.00 0.00 0.00 174.94 175.54 3i4n n LEU 62 N 5.37 0.00 0.00 2.97 4.77 0.15 -4.94 117.00 125.31 3i4n n LEU 62 Ca 0.14 -0.42 0.00 0.00 -0.03 0.00 0.00 56.01 55.70 3i4n n LEU 62 Cb 0.42 -0.39 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 3i4n n LEU 62 CO 0.60 -1.66 0.00 -0.81 -1.33 0.00 0.00 177.39 174.20 3i4n n PRO 63 N -3.05 0.00 0.00 3.23 -0.04 -1.26 -4.78 135.00 129.09 3i4n n PRO 63 Ca 0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 3i4n n PRO 63 Cb 0.23 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.69 3i4n n PRO 63 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 3i4n n THR 64 N 0.00 0.00 -3.57 0.52 -1.04 -1.26 -4.20 114.28 104.73 3i4n n THR 64 Ca 0.00 0.00 -0.28 0.00 -2.04 0.00 0.00 64.05 61.73 3i4n n THR 64 Cb 0.00 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.48 3i4n n THR 64 CO 0.00 0.00 0.00 1.51 -0.64 0.00 0.00 175.07 175.94 3i4n s ASP 65 N -1.94 6.40 0.45 8.00 -4.77 -1.26 -5.02 116.67 118.53 3i4n s ASP 65 Ca 0.00 0.50 0.31 0.00 -3.30 0.00 0.00 52.55 50.07 3i4n s ASP 65 Cb 0.00 -2.05 1.45 0.00 -1.09 0.00 0.00 42.92 41.23 3i4n s ASP 65 CO 0.00 -0.10 1.93 1.23 0.70 0.00 0.00 175.17 178.93 3i4n h GLY 66 N 1.86 0.00 -4.30 2.12 0.00 -1.88 -3.40 103.07 97.48 3i4n h GLY 66 Ca -0.48 0.00 -0.62 0.00 0.00 0.00 0.00 47.33 46.23 3i4n h GLY 66 CO 0.67 0.00 -0.89 1.44 0.00 0.00 0.00 176.54 177.76 3i4n n SER 67 N -2.70 -2.67 -4.24 0.19 7.64 -1.26 -4.24 113.62 106.34 3i4n n SER 67 Ca -0.00 0.83 -0.31 0.00 1.01 0.00 0.00 58.87 60.39 3i4n n SER 67 Cb 0.19 -0.90 -0.17 0.00 -1.01 0.00 0.00 64.21 62.32 3i4n n SER 67 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3i4n s ALA 68 N -1.65 2.09 -0.19 -0.43 0.00 -0.87 0.31 121.76 121.03 3i4n s ALA 68 Ca 0.60 -0.98 -0.15 0.00 0.00 0.00 0.00 51.96 51.43 3i4n s ALA 68 Cb -0.64 -0.69 -0.04 0.00 0.00 0.00 0.00 23.12 21.75 3i4n s ALA 68 CO 0.62 0.37 0.34 -2.00 0.00 0.00 0.00 175.76 175.09 3i4n s GLU 69 N -0.00 4.20 -0.07 0.00 2.12 -0.42 -1.21 118.70 123.31 3i4n s GLU 69 Ca -0.08 0.13 0.01 0.00 0.36 0.00 0.00 54.97 55.39 3i4n s GLU 69 Cb -0.15 -3.50 -0.03 0.00 0.26 0.00 0.00 34.13 30.71 3i4n s GLU 69 CO 0.05 0.06 -0.07 -0.06 -0.54 0.00 0.00 175.26 174.70 3i4n s PHE 70 N 1.01 2.94 -0.42 5.30 0.40 0.03 -1.84 117.98 125.38 3i4n s PHE 70 Ca 0.17 0.01 -0.09 0.00 -0.60 0.00 0.00 56.93 56.43 3i4n s PHE 70 Cb -0.14 -1.72 0.09 0.00 0.51 0.00 0.00 43.02 41.76 3i4n s PHE 70 CO 0.06 0.32 0.27 1.21 0.70 0.00 0.00 175.22 177.78 3i4n s ASN 71 N -0.78 5.62 -0.19 1.36 3.84 -1.25 -1.28 114.94 122.27 3i4n s ASN 71 Ca 0.12 -1.58 -0.23 0.00 0.21 0.00 0.00 52.86 51.37 3i4n s ASN 71 Cb -0.11 -1.98 -0.02 0.00 -0.55 0.00 0.00 41.25 38.59 3i4n s ASN 71 CO 0.01 -0.56 0.75 -0.69 -2.79 0.00 0.00 177.10 173.83 3i4n s VAL 72 N 1.40 4.93 -0.42 -5.21 1.01 0.18 -4.57 120.40 117.72 3i4n s VAL 72 Ca 0.03 1.45 -0.13 0.00 0.00 0.00 0.00 61.98 63.33 3i4n s VAL 72 Cb -0.23 -4.06 0.04 0.00 0.00 0.00 0.00 36.38 32.13 3i4n s VAL 72 CO 0.01 0.05 0.30 -0.75 0.00 0.00 0.00 175.10 174.71 3i4n s LYS 73 N 2.11 2.89 0.00 2.72 2.47 -0.89 -0.89 119.74 128.14 3i4n s LYS 73 Ca 0.34 -1.19 0.00 0.00 -1.56 0.00 0.00 55.97 53.56 3i4n s LYS 73 Cb -0.16 -3.94 0.00 0.00 -1.46 0.00 0.00 37.83 32.27 3i4n s LYS 73 CO 0.11 -0.85 0.00 2.48 0.16 0.00 0.00 175.35 177.26 3i4n n TYR 74 N 5.10 0.00 -3.61 4.03 -0.00 -0.28 -3.19 117.16 119.21 3i4n n TYR 74 Ca -0.11 0.00 -0.16 0.00 -0.00 0.00 0.00 57.90 57.63 3i4n n TYR 74 Cb 0.45 0.00 -0.07 0.00 -0.00 0.00 0.00 39.34 39.72 3i4n n TYR 74 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.86 177.36 3i4n s ARG 75 N -1.40 0.89 0.24 -3.48 3.52 -1.26 -1.91 118.95 115.55 3i4n s ARG 75 Ca 0.00 0.23 -0.22 0.00 -0.13 0.00 0.00 55.73 55.61 3i4n s ARG 75 Cb 0.00 0.42 0.05 0.00 -1.56 0.00 0.00 34.95 33.85 3i4n s ARG 75 CO 0.00 -0.25 0.84 0.00 -0.81 0.00 0.00 175.30 175.09 3i4n s ALA 76 N -0.98 -1.33 -0.08 6.12 0.00 -1.08 -1.82 121.76 122.59 3i4n s ALA 76 Ca -0.10 -0.23 -0.20 0.00 0.00 0.00 0.00 51.96 51.43 3i4n s ALA 76 Cb -0.02 0.74 -0.04 0.00 0.00 0.00 0.00 23.12 23.80 3i4n s ALA 76 CO 0.07 -1.04 0.56 0.08 0.00 0.00 0.00 175.76 175.43 3i4n s VAL 77 N -3.29 5.09 0.18 0.00 1.01 -0.09 -2.77 120.40 120.54 3i4n s VAL 77 Ca 0.13 1.15 0.00 0.00 0.00 0.00 0.00 61.98 63.26 3i4n s VAL 77 Cb -0.04 -3.90 -0.04 0.00 0.00 0.00 0.00 36.38 32.40 3i4n s VAL 77 CO 0.06 0.33 0.06 0.68 0.00 0.00 0.00 175.10 176.23 3i4n s VAL 78 N 0.48 0.36 -0.16 2.92 -7.23 0.02 -1.30 120.40 115.49 3i4n s VAL 78 Ca 0.30 -1.97 -0.05 0.00 -1.81 0.00 0.00 61.98 58.45 3i4n s VAL 78 Cb -0.16 -2.27 0.08 0.00 0.56 0.00 0.00 36.38 34.58 3i4n s VAL 78 CO 0.14 -0.29 0.31 0.12 -0.31 0.00 0.00 175.10 175.07 3i4n s PHE 79 N -3.88 -0.54 -0.25 2.82 5.36 -0.85 0.44 117.98 121.08 3i4n s PHE 79 Ca 0.30 1.02 0.02 0.00 -0.96 0.00 0.00 56.93 57.30 3i4n s PHE 79 Cb 0.07 0.02 0.07 0.00 -0.34 0.00 0.00 43.02 42.83 3i4n s PHE 79 CO 0.07 -0.44 -0.05 0.21 -1.46 0.00 0.00 175.22 173.54 3i4n s LYS 80 N 2.47 1.74 1.22 10.12 2.20 -1.26 -2.01 119.74 134.22 3i4n s LYS 80 Ca 0.02 -1.17 -0.15 0.00 -0.36 0.00 0.00 55.97 54.32 3i4n s LYS 80 Cb -0.13 -2.70 0.29 0.00 -1.51 0.00 0.00 37.83 33.79 3i4n s LYS 80 CO -0.10 -0.64 0.89 -0.35 -0.36 0.00 0.00 175.35 174.79 3i4n n PRO 81 N 4.58 -2.79 -3.88 4.03 -0.04 -1.26 -4.97 135.00 130.67 3i4n n PRO 81 Ca -0.11 -0.79 -0.11 0.00 -0.04 0.00 0.00 63.50 62.45 3i4n n PRO 81 Cb 0.43 -2.08 -0.10 0.00 -0.04 0.00 0.00 33.50 31.71 3i4n n PRO 81 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3i4n s PHE 82 N -2.34 0.06 0.00 0.54 0.40 -1.26 -5.06 117.98 110.32 3i4n s PHE 82 Ca 0.67 -0.17 -0.30 0.00 -0.60 0.00 0.00 56.93 56.53 3i4n s PHE 82 Cb -0.23 -0.06 -0.08 0.00 0.51 0.00 0.00 43.02 43.16 3i4n s PHE 82 CO 0.65 -0.29 1.91 0.15 0.70 0.00 0.00 175.22 178.34 3i4n s LYS 83 N -1.47 4.09 0.00 0.44 1.02 -1.26 -1.36 119.74 121.20 3i4n s LYS 83 Ca -0.14 2.48 0.00 0.00 0.02 0.00 0.00 55.97 58.33 3i4n s LYS 83 Cb -0.07 -4.14 0.00 0.00 -0.52 0.00 0.00 37.83 33.10 3i4n s LYS 83 CO 0.01 -1.00 0.00 0.41 -0.92 0.00 0.00 175.35 173.85 3i4n n GLY 84 N 4.53 2.99 3.67 -3.33 0.00 0.86 -4.99 105.19 108.93 3i4n n GLY 84 Ca 0.20 -0.06 -0.48 0.00 0.00 0.00 0.00 46.02 45.68 3i4n n GLY 84 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3i4n n GLU 85 N 0.00 2.06 -3.35 1.61 2.13 -0.46 -4.42 120.64 118.21 3i4n n GLU 85 Ca 0.00 0.75 -0.38 0.00 0.66 0.00 0.00 57.16 58.19 3i4n n GLU 85 Cb 0.00 -2.55 -0.06 0.00 0.27 0.00 0.00 31.44 29.10 3i4n n GLU 85 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 3i4n s VAL 86 N 2.84 5.13 -0.05 6.31 1.01 -1.26 -1.92 120.40 132.45 3i4n s VAL 86 Ca 0.88 0.95 -0.14 0.00 0.00 0.00 0.00 61.98 63.67 3i4n s VAL 86 Cb -0.72 -3.80 0.03 0.00 0.00 0.00 0.00 36.38 31.88 3i4n s VAL 86 CO 0.48 0.39 0.32 0.68 0.00 0.00 0.00 175.10 176.97 3i4n s VAL 87 N 0.19 0.04 -0.09 2.92 -7.23 0.49 -4.99 120.40 111.73 3i4n s VAL 87 Ca 0.26 -0.33 0.04 0.00 -1.81 0.00 0.00 61.98 60.14 3i4n s VAL 87 Cb -0.16 -0.58 -0.00 0.00 0.56 0.00 0.00 36.38 36.20 3i4n s VAL 87 CO 0.11 -0.18 -0.23 1.51 -0.31 0.00 0.00 175.10 176.00 3i4n s ASP 88 N -0.88 3.19 0.00 4.85 3.84 -1.26 -0.48 116.67 125.92 3i4n s ASP 88 Ca -0.10 -0.52 0.00 0.00 -0.00 0.00 0.00 52.55 51.93 3i4n s ASP 88 Cb -0.04 -1.28 0.00 0.00 -1.38 0.00 0.00 42.92 40.22 3i4n s ASP 88 CO 0.03 0.18 0.00 0.61 -0.00 0.00 0.00 175.17 176.00 3i4n n GLY 89 N 3.36 4.56 3.83 2.12 0.00 -0.77 -4.93 105.19 113.37 3i4n n GLY 89 Ca -0.18 -1.58 -0.38 0.00 0.00 0.00 0.00 46.02 43.87 3i4n n GLY 89 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3i4n s THR 90 N -1.52 5.06 0.49 2.61 2.01 -0.52 -1.35 115.64 122.42 3i4n s THR 90 Ca 0.00 0.81 -0.22 0.00 0.31 0.00 0.00 61.69 62.60 3i4n s THR 90 Cb 0.00 -3.70 -0.07 0.00 0.01 0.00 0.00 72.50 68.74 3i4n s THR 90 CO 0.00 0.56 1.15 -0.69 -0.69 0.00 0.00 174.62 174.95 3i4n s VAL 91 N -0.94 3.15 0.00 3.82 1.01 -1.22 0.57 120.40 126.79 3i4n s VAL 91 Ca 0.23 0.81 0.00 0.00 0.00 0.00 0.00 61.98 63.03 3i4n s VAL 91 Cb -0.16 -3.39 0.00 0.00 0.00 0.00 0.00 36.38 32.83 3i4n s VAL 91 CO 0.13 -0.06 0.00 0.52 0.00 0.00 0.00 175.10 175.68 3i4n n VAL 92 N -0.74 0.00 -2.51 2.92 0.31 0.13 -4.38 118.33 114.05 3i4n n VAL 92 Ca 0.09 0.00 -0.25 0.00 -0.01 0.00 0.00 64.34 64.16 3i4n n VAL 92 Cb 0.49 -0.02 0.03 0.00 -0.91 0.00 0.00 33.84 33.44 3i4n n VAL 92 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 3i4n s SER 93 N 0.64 5.53 -0.30 4.52 1.04 -1.21 -4.51 113.70 119.42 3i4n s SER 93 Ca 0.00 0.54 -0.06 0.00 0.48 0.00 0.00 55.95 56.91 3i4n s SER 93 Cb 0.00 -1.54 0.16 0.00 0.10 0.00 0.00 66.02 64.74 3i4n s SER 93 CO 0.00 -1.05 0.64 0.00 0.98 0.00 0.00 173.24 173.81 3i4n n SER 95 N 5.43 2.54 0.18 0.00 3.41 0.21 -4.81 113.62 120.59 3i4n n SER 95 Ca -0.07 -2.54 0.18 0.00 -0.26 0.00 0.00 58.87 56.18 3i4n n SER 95 Cb 0.50 0.36 0.80 0.00 -0.26 0.00 0.00 64.21 65.61 3i4n n SER 95 CO 0.00 0.00 0.00 0.06 -0.16 0.00 0.00 175.04 174.94 3i4n h GLN 96 N 0.00 0.00 0.00 4.33 3.07 -1.97 -0.21 115.11 120.33 3i4n h GLN 96 Ca -0.28 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.46 3i4n h GLN 96 Cb 0.88 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.44 3i4n h GLN 96 CO 0.46 0.00 -1.01 0.72 0.09 0.00 0.00 178.83 179.08 3i4n n HIS 97 N -3.54 0.17 -0.40 0.06 8.25 -1.26 -4.83 115.22 113.66 3i4n n HIS 97 Ca 0.03 0.05 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 3i4n n HIS 97 Cb 0.47 -0.33 0.00 0.00 1.12 0.00 0.00 29.99 31.25 3i4n n HIS 97 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3i4n n GLY 98 N 1.40 -1.07 3.30 -1.41 0.00 -0.09 -0.43 105.19 106.89 3i4n n GLY 98 Ca 0.02 -1.59 -0.32 0.00 0.00 0.00 0.00 46.02 44.14 3i4n n GLY 98 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3i4n s PHE 99 N -1.74 2.46 -0.37 1.61 -0.12 -1.04 0.65 117.98 119.43 3i4n s PHE 99 Ca 0.00 -0.63 -0.16 0.00 -0.05 0.00 0.00 56.93 56.08 3i4n s PHE 99 Cb 0.00 -1.60 0.00 0.00 -0.63 0.00 0.00 43.02 40.79 3i4n s PHE 99 CO 0.00 -0.16 0.41 -2.00 -0.05 0.00 0.00 175.22 173.43 3i4n s GLU 100 N -0.26 3.41 -0.02 1.99 2.12 -0.11 -1.88 118.70 123.95 3i4n s GLU 100 Ca -0.01 -0.49 -0.14 0.00 0.36 0.00 0.00 54.97 54.69 3i4n s GLU 100 Cb -0.13 -3.86 -0.05 0.00 0.26 0.00 0.00 34.13 30.34 3i4n s GLU 100 CO 0.03 -0.66 0.38 0.08 -0.54 0.00 0.00 175.26 174.55 3i4n s VAL 101 N 2.13 5.10 -0.21 3.70 1.01 0.13 -0.69 120.40 131.56 3i4n s VAL 101 Ca 0.13 0.77 -0.07 0.00 0.00 0.00 0.00 61.98 62.81 3i4n s VAL 101 Cb -0.16 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 32.50 3i4n s VAL 101 CO 0.13 0.56 0.07 -1.58 0.00 0.00 0.00 175.10 174.28 3i4n s GLN 102 N -0.92 3.83 -0.34 2.72 0.74 0.19 -0.08 119.66 125.80 3i4n s GLN 102 Ca 0.23 -0.40 0.03 0.00 0.05 0.00 0.00 55.36 55.26 3i4n s GLN 102 Cb -0.16 -3.26 0.10 0.00 1.10 0.00 0.00 33.01 30.79 3i4n s GLN 102 CO 0.12 0.07 0.07 0.08 -0.55 0.00 0.00 175.29 175.08 3i4n s VAL 103 N 0.92 1.94 0.00 1.34 1.01 -0.76 -1.43 120.40 123.42 3i4n s VAL 103 Ca 0.04 -2.16 0.00 0.00 0.00 0.00 0.00 61.98 59.86 3i4n s VAL 103 Cb -0.14 -2.43 0.00 0.00 0.00 0.00 0.00 36.38 33.81 3i4n s VAL 103 CO 0.03 -0.63 0.00 0.61 0.00 0.00 0.00 175.10 175.10 3i4n n GLY 104 N 4.34 -0.36 0.00 4.51 0.00 -1.26 -2.99 105.19 109.43 3i4n n GLY 104 Ca 0.03 -1.07 0.04 0.00 0.00 0.00 0.00 46.02 45.02 3i4n n GLY 104 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3i4n n PRO 105 N 0.00 0.14 -3.83 1.61 -0.04 -1.26 -4.71 135.00 126.90 3i4n n PRO 105 Ca 0.00 0.19 -0.21 0.00 -0.04 0.00 0.00 63.50 63.44 3i4n n PRO 105 Cb 0.00 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 31.93 3i4n n PRO 105 CO 0.00 0.00 0.00 1.41 -0.04 0.00 0.00 175.50 176.87 3i4n s MET 106 N -2.55 2.81 -0.16 0.54 0.00 -1.16 -4.99 119.30 113.80 3i4n s MET 106 Ca 0.09 -1.22 -0.00 0.00 0.00 0.00 0.00 55.69 54.56 3i4n s MET 106 Cb 0.06 -2.53 0.03 0.00 0.00 0.00 0.00 34.83 32.39 3i4n s MET 106 CO 0.14 0.15 -0.09 0.15 0.00 0.00 0.00 175.02 175.37 3i4n s LYS 107 N -3.99 1.76 -0.12 4.11 1.02 -1.26 -1.82 119.74 119.44 3i4n s LYS 107 Ca 0.40 -0.55 -0.04 0.00 0.02 0.00 0.00 55.97 55.81 3i4n s LYS 107 Cb -0.07 -2.04 -0.03 0.00 -0.52 0.00 0.00 37.83 35.17 3i4n s LYS 107 CO 0.27 -0.36 0.02 0.08 -0.92 0.00 0.00 175.35 174.44 3i4n s VAL 108 N 1.56 4.44 -0.06 3.17 1.01 0.88 -3.47 120.40 127.93 3i4n s VAL 108 Ca 0.02 -0.19 0.02 0.00 0.00 0.00 0.00 61.98 61.83 3i4n s VAL 108 Cb -0.14 -2.91 -0.03 0.00 0.00 0.00 0.00 36.38 33.30 3i4n s VAL 108 CO -0.09 0.57 -0.11 0.12 0.00 0.00 0.00 175.10 175.59 3i4n s PHE 109 N -0.49 2.81 -0.15 5.22 5.36 -0.43 0.21 117.98 130.51 3i4n s PHE 109 Ca 0.09 -0.09 0.00 0.00 -0.96 0.00 0.00 56.93 55.97 3i4n s PHE 109 Cb -0.12 -1.68 -0.00 0.00 -0.34 0.00 0.00 43.02 40.88 3i4n s PHE 109 CO 0.02 0.24 -0.16 0.08 -1.46 0.00 0.00 175.22 173.94 3i4n s VAL 110 N -0.72 2.61 0.35 3.12 1.01 -0.79 -0.44 120.40 125.54 3i4n s VAL 110 Ca 0.11 -0.79 -0.20 0.00 0.00 0.00 0.00 61.98 61.11 3i4n s VAL 110 Cb -0.11 -2.10 -0.10 0.00 0.00 0.00 0.00 36.38 34.08 3i4n s VAL 110 CO 0.01 0.52 0.85 -0.89 0.00 0.00 0.00 175.10 175.59 3i4n s THR 111 N 0.80 4.48 0.23 3.92 2.01 -1.26 -2.50 115.64 123.32 3i4n s THR 111 Ca -0.06 1.34 -0.15 0.00 0.31 0.00 0.00 61.69 63.13 3i4n s THR 111 Cb -0.15 -3.70 0.27 0.00 0.01 0.00 0.00 72.50 68.93 3i4n s THR 111 CO -0.00 -0.14 1.58 0.11 -0.69 0.00 0.00 174.62 175.49 3i4n h LYS 112 N 2.41 -0.04 -3.43 4.92 1.57 -1.07 -1.19 116.57 119.75 3i4n h LYS 112 Ca -0.48 0.00 -0.75 0.00 -1.87 0.00 0.00 60.65 57.55 3i4n h LYS 112 Cb 1.18 0.01 -0.15 0.00 0.08 0.00 0.00 32.23 33.35 3i4n h LYS 112 CO 0.64 -0.03 2.09 0.72 -0.57 0.00 0.00 179.45 182.30 3i4n n HIS 113 N -5.50 2.90 -0.79 -1.35 8.25 -1.26 -3.21 115.22 114.25 3i4n n HIS 113 Ca 0.09 -2.79 0.00 0.00 -0.26 0.00 0.00 57.72 54.76 3i4n n HIS 113 Cb 0.40 -1.95 0.00 0.00 1.12 0.00 0.00 29.99 29.56 3i4n n HIS 113 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 3i4n n LEU 114 N 3.72 0.00 -4.46 2.41 7.94 -0.45 -5.13 117.00 121.03 3i4n n LEU 114 Ca 0.42 -0.19 -0.25 0.00 -1.11 0.00 0.00 56.01 54.88 3i4n n LEU 114 Cb 0.35 0.00 -0.08 0.00 0.53 0.00 0.00 43.42 44.23 3i4n n LEU 114 CO 0.81 0.34 -0.15 0.00 -1.11 0.00 0.00 177.39 177.28 3i4n s MET 115 N 0.00 1.94 0.94 1.96 0.23 -1.20 -2.48 119.30 120.69 3i4n s MET 115 Ca 0.00 -2.18 -0.11 0.00 -1.03 0.00 0.00 55.69 52.37 3i4n s MET 115 Cb 0.00 -0.30 0.16 0.00 -1.53 0.00 0.00 34.83 33.16 3i4n s MET 115 CO 0.00 -0.58 1.10 -1.25 -2.03 0.00 0.00 175.02 172.26 3i4n s PRO 116 N -3.58 0.87 -0.05 3.16 0.04 -1.26 -4.74 135.00 129.43 3i4n s PRO 116 Ca 0.27 1.16 -0.13 0.00 0.04 0.00 0.00 61.00 62.34 3i4n s PRO 116 Cb 0.01 -1.74 -0.08 0.00 0.04 0.00 0.00 34.50 32.74 3i4n s PRO 116 CO 0.19 -2.61 0.54 1.96 0.04 0.00 0.00 177.00 177.12 3i4n h GLN 117 N -1.83 -0.35 -0.00 4.56 7.50 -2.00 -3.23 115.11 119.76 3i4n h GLN 117 Ca -0.49 0.02 0.00 0.00 0.50 0.00 0.00 58.65 58.69 3i4n h GLN 117 Cb 1.28 0.08 -0.00 0.00 0.05 0.00 0.00 27.48 28.89 3i4n h GLN 117 CO 0.48 -0.15 0.77 0.38 -1.50 0.00 0.00 178.83 178.81 3i4n h ASP 118 N -1.06 0.00 -1.92 1.46 2.03 -1.94 -3.33 116.42 111.66 3i4n h ASP 118 Ca -0.04 0.00 -0.56 0.00 -0.73 0.00 0.00 57.03 55.70 3i4n h ASP 118 Cb 0.36 0.00 -0.09 0.00 -0.83 0.00 0.00 39.33 38.77 3i4n h ASP 118 CO 0.06 0.00 1.21 -0.22 -1.03 0.00 0.00 179.24 179.26 3i4n s LEU 119 N -5.26 3.28 0.00 0.15 2.96 -1.22 -4.27 118.68 114.32 3i4n s LEU 119 Ca -0.01 -0.78 0.00 0.00 -0.22 0.00 0.00 54.13 53.11 3i4n s LEU 119 Cb 0.03 -2.56 0.00 0.00 0.50 0.00 0.00 46.19 44.16 3i4n s LEU 119 CO 0.10 -1.74 0.00 0.35 -1.32 0.00 0.00 176.35 173.74 3i4n n THR 120 N 6.57 0.00 -3.15 3.68 -2.24 0.17 -4.83 114.28 114.47 3i4n n THR 120 Ca 0.14 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.97 3i4n n THR 120 Cb 0.50 0.00 -0.00 0.00 -2.10 0.00 0.00 70.33 68.73 3i4n n THR 120 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 3i4n s PHE 121 N 0.00 -0.99 -0.11 4.78 5.36 -1.26 -4.24 117.98 121.53 3i4n s PHE 121 Ca 0.00 0.59 -0.30 0.00 -0.96 0.00 0.00 56.93 56.27 3i4n s PHE 121 Cb 0.00 0.18 -0.03 0.00 -0.34 0.00 0.00 43.02 42.83 3i4n s PHE 121 CO 0.00 -0.57 1.35 1.21 -1.46 0.00 0.00 175.22 175.74 3i4n s ASN 122 N 2.91 6.89 -0.12 6.13 2.47 -0.38 -4.93 114.94 127.91 3i4n s ASN 122 Ca 0.21 1.86 -0.11 0.00 0.42 0.00 0.00 52.86 55.24 3i4n s ASN 122 Cb -0.05 -2.54 -0.09 0.00 -1.45 0.00 0.00 41.25 37.11 3i4n s ASN 122 CO -0.24 -0.77 0.25 0.00 -3.72 0.00 0.00 177.10 172.62 3i4n h ALA 123 N 8.32 0.01 0.00 1.71 0.00 -2.00 -3.25 119.26 124.04 3i4n h ALA 123 Ca -0.31 -0.24 -0.14 0.00 0.00 0.00 0.00 54.91 54.21 3i4n h ALA 123 Cb 1.13 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.93 3i4n h ALA 123 CO 0.95 0.06 -0.24 0.41 0.00 0.00 0.00 179.25 180.43 3i4n n GLY 124 N 1.70 2.66 3.38 0.00 0.00 -1.26 -4.83 105.19 106.85 3i4n n GLY 124 Ca -0.05 -0.92 -0.33 0.00 0.00 0.00 0.00 46.02 44.72 3i4n n GLY 124 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3i4n s SER 125 N 2.12 4.22 -0.32 1.61 1.04 -1.26 -5.07 113.70 116.05 3i4n s SER 125 Ca 0.51 -0.30 0.02 0.00 0.48 0.00 0.00 55.95 56.65 3i4n s SER 125 Cb 0.24 -1.67 0.10 0.00 0.10 0.00 0.00 66.02 64.79 3i4n s SER 125 CO 0.00 0.13 0.06 0.20 0.98 0.00 0.00 173.24 174.62 3i4n s ASN 126 N 0.56 4.36 0.72 7.02 0.02 -1.26 -1.07 114.94 125.30 3i4n s ASN 126 Ca -0.06 -1.85 -0.11 0.00 -1.02 0.00 0.00 52.86 49.82 3i4n s ASN 126 Cb -0.15 -1.25 0.02 0.00 0.02 0.00 0.00 41.25 39.90 3i4n s ASN 126 CO 0.03 -0.39 1.07 -2.16 0.02 0.00 0.00 177.10 175.68 3i4n s PRO 127 N 1.27 2.70 0.38 -0.60 0.04 -1.26 -5.12 135.00 132.41 3i4n s PRO 127 Ca 0.09 1.05 -0.25 0.00 0.04 0.00 0.00 61.00 61.93 3i4n s PRO 127 Cb -0.18 -1.96 -0.12 0.00 0.04 0.00 0.00 34.50 32.28 3i4n s PRO 127 CO -0.16 -1.29 0.94 -2.30 0.04 0.00 0.00 177.00 174.23 3i4n n PRO 128 N -3.23 1.23 -3.21 0.56 -0.02 -0.23 -4.93 135.00 125.17 3i4n n PRO 128 Ca 0.08 0.44 -0.10 0.00 -2.02 0.00 0.00 63.50 61.90 3i4n n PRO 128 Cb 0.53 -1.91 -0.03 0.00 -0.02 0.00 0.00 33.50 32.07 3i4n n PRO 128 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3i4n n SER 129 N 0.81 -0.68 -3.67 2.55 3.41 -1.23 -4.42 113.62 110.39 3i4n n SER 129 Ca 0.10 -2.26 -0.19 0.00 -0.26 0.00 0.00 58.87 56.25 3i4n n SER 129 Cb 0.37 1.36 -0.17 0.00 -0.26 0.00 0.00 64.21 65.51 3i4n n SER 129 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 3i4n s TYR 130 N -3.33 0.01 0.44 7.33 1.51 -0.39 -1.25 117.35 121.67 3i4n s TYR 130 Ca 0.21 0.33 0.05 0.00 -1.01 0.00 0.00 57.07 56.65 3i4n s TYR 130 Cb 0.00 -0.43 0.05 0.00 -0.11 0.00 0.00 41.96 41.47 3i4n s TYR 130 CO 0.15 -0.20 0.38 1.04 -1.11 0.00 0.00 175.55 175.81 3i4n n GLN 131 N 5.28 0.82 -2.84 -0.62 6.02 -1.26 -0.69 117.38 124.09 3i4n n GLN 131 Ca -0.04 -2.66 0.00 0.00 -0.01 0.00 0.00 57.00 54.29 3i4n n GLN 131 Cb 0.50 0.20 0.01 0.00 1.02 0.00 0.00 30.24 31.96 3i4n n GLN 131 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 3i4n n SER 132 N -1.99 -0.70 -0.06 1.08 2.88 -0.27 0.41 113.62 114.98 3i4n n SER 132 Ca 0.01 -1.24 -0.03 0.00 -1.33 0.00 0.00 58.87 56.28 3i4n n SER 132 Cb 0.49 1.11 -0.02 0.00 -0.75 0.00 0.00 64.21 65.03 3i4n n SER 132 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 3i4n h SER 133 N 1.00 -0.49 -0.02 -3.46 0.02 -2.01 -3.26 113.55 105.33 3i4n h SER 133 Ca -0.12 0.07 -0.05 0.00 -0.84 0.00 0.00 61.79 60.85 3i4n h SER 133 Cb 0.60 0.21 -0.10 0.00 0.14 0.00 0.00 62.40 63.24 3i4n h SER 133 CO 0.17 -0.09 -0.63 -1.84 -1.14 0.00 0.00 176.83 173.30 3i4n n GLU 134 N -3.43 1.31 -4.63 3.45 0.28 -1.26 -5.05 120.64 111.31 3i4n n GLU 134 Ca -0.00 -3.06 -0.23 0.00 -0.16 0.00 0.00 57.16 53.71 3i4n n GLU 134 Cb 0.08 -1.29 -0.15 0.00 1.43 0.00 0.00 31.44 31.50 3i4n n GLU 134 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 3i4n s ASP 135 N -2.99 1.68 -0.17 -1.84 1.01 -1.23 -5.12 116.67 108.01 3i4n s ASP 135 Ca 0.37 -0.26 -0.02 0.00 0.71 0.00 0.00 52.55 53.35 3i4n s ASP 135 Cb 0.37 -0.33 0.05 0.00 1.01 0.00 0.00 42.92 44.02 3i4n s ASP 135 CO -0.09 0.14 0.01 -0.69 0.21 0.00 0.00 175.17 174.75 3i4n s VAL 136 N -0.09 0.65 -0.08 -1.27 1.01 -1.26 -1.11 120.40 118.25 3i4n s VAL 136 Ca 0.01 -0.51 0.02 0.00 0.00 0.00 0.00 61.98 61.49 3i4n s VAL 136 Cb -0.08 -1.05 -0.02 0.00 0.00 0.00 0.00 36.38 35.23 3i4n s VAL 136 CO 0.00 -0.09 -0.13 -0.63 0.00 0.00 0.00 175.10 174.26 3i4n s ILE 137 N 1.81 3.17 0.00 2.22 1.01 0.13 -4.97 121.20 124.58 3i4n s ILE 137 Ca -0.00 -0.66 0.00 0.00 0.00 0.00 0.00 60.65 59.99 3i4n s ILE 137 Cb -0.16 -2.28 0.00 0.00 0.01 0.00 0.00 42.46 40.03 3i4n s ILE 137 CO -0.07 0.57 0.00 0.41 0.00 0.00 0.00 174.94 175.85 3i4n n THR 138 N 2.67 0.00 0.00 2.92 -1.04 -1.26 -1.26 114.28 116.31 3i4n n THR 138 Ca -0.18 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.83 3i4n n THR 138 Cb 0.52 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.03 3i4n n THR 138 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 3i4n n ILE 139 N 0.00 0.00 0.19 12.58 5.41 -1.26 -3.56 119.36 132.72 3i4n n ILE 139 Ca 0.00 0.34 -0.12 0.00 1.00 0.00 0.00 62.75 63.97 3i4n n ILE 139 Cb 0.00 -0.56 -0.07 0.00 -0.71 0.00 0.00 39.64 38.30 3i4n n ILE 139 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 3i4n h LYS 140 N 0.00 -0.51 0.00 0.38 1.79 -1.88 -3.31 116.57 113.04 3i4n h LYS 140 Ca 0.00 0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 3i4n h LYS 140 Cb 0.00 0.12 0.00 0.00 -1.58 0.00 0.00 32.23 30.77 3i4n h LYS 140 CO 0.00 -0.20 0.00 -1.13 -1.08 0.00 0.00 179.45 177.04 3i4n n SER 141 N -5.16 0.00 -4.77 0.86 3.41 -1.23 -3.54 113.62 103.19 3i4n n SER 141 Ca -0.09 0.00 -0.39 0.00 -0.26 0.00 0.00 58.87 58.13 3i4n n SER 141 Cb 0.28 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.21 3i4n n SER 141 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3i4n s ARG 142 N 0.00 4.09 0.29 4.33 0.52 -1.26 -3.46 118.95 123.46 3i4n s ARG 142 Ca 0.00 1.95 0.02 0.00 -0.52 0.00 0.00 55.73 57.18 3i4n s ARG 142 Cb 0.00 -2.76 -0.05 0.00 0.52 0.00 0.00 34.95 32.66 3i4n s ARG 142 CO 0.00 -0.32 0.09 0.42 0.02 0.00 0.00 175.30 175.50 3i4n s ILE 143 N -1.34 0.81 -0.13 1.52 1.01 -0.46 -3.51 121.20 119.11 3i4n s ILE 143 Ca 0.56 -2.00 -0.03 0.00 0.00 0.00 0.00 60.65 59.18 3i4n s ILE 143 Cb -0.33 -2.68 0.05 0.00 0.01 0.00 0.00 42.46 39.50 3i4n s ILE 143 CO 0.42 0.00 0.05 -0.60 0.00 0.00 0.00 174.94 174.81 3i4n s ARG 144 N -3.95 0.31 0.29 2.79 3.52 0.85 -1.84 118.95 120.92 3i4n s ARG 144 Ca 0.37 -0.05 0.11 0.00 -0.13 0.00 0.00 55.73 56.03 3i4n s ARG 144 Cb 0.08 -1.47 -0.05 0.00 -1.56 0.00 0.00 34.95 31.95 3i4n s ARG 144 CO 0.15 -0.52 -0.11 0.08 -0.81 0.00 0.00 175.30 174.09 3i4n s VAL 145 N 2.03 2.73 -0.35 7.11 1.01 0.36 -2.11 120.40 131.18 3i4n s VAL 145 Ca 0.02 -2.21 -0.08 0.00 0.00 0.00 0.00 61.98 59.71 3i4n s VAL 145 Cb -0.15 -2.54 0.03 0.00 0.00 0.00 0.00 36.38 33.73 3i4n s VAL 145 CO -0.07 -0.35 0.15 -0.75 0.00 0.00 0.00 175.10 174.08 3i4n s LYS 146 N -3.59 2.73 -0.53 2.72 2.20 -1.08 -0.38 119.74 121.81 3i4n s LYS 146 Ca 0.31 -1.12 -0.26 0.00 -0.36 0.00 0.00 55.97 54.53 3i4n s LYS 146 Cb -0.04 -3.58 -0.05 0.00 -1.51 0.00 0.00 37.83 32.65 3i4n s LYS 146 CO 0.17 -0.67 2.17 0.42 -0.36 0.00 0.00 175.35 177.08 3i4n s ILE 147 N 1.47 3.16 0.03 5.43 1.01 -0.81 -2.15 121.20 129.35 3i4n s ILE 147 Ca 0.00 0.10 -0.19 0.00 0.00 0.00 0.00 60.65 60.56 3i4n s ILE 147 Cb -0.19 -3.40 -0.18 0.00 0.01 0.00 0.00 42.46 38.70 3i4n s ILE 147 CO 0.05 -0.38 1.23 -0.33 0.00 0.00 0.00 174.94 175.50 3i4n h GLU 148 N 17.43 0.45 -2.62 2.79 4.39 -0.12 2.56 114.58 139.45 3i4n h GLU 148 Ca -0.26 -0.34 -0.11 0.00 0.34 0.00 0.00 59.36 58.99 3i4n h GLU 148 Cb 1.22 0.07 -0.24 0.00 -0.10 0.00 0.00 28.75 29.70 3i4n h GLU 148 CO 1.17 0.97 -0.18 0.20 -1.16 0.00 0.00 179.01 180.02 3i4n s GLY 149 N -3.81 -0.35 -0.12 -3.84 0.00 -0.67 -4.47 107.32 94.06 3i4n s GLY 149 Ca -0.13 1.31 -0.04 0.00 0.00 0.00 0.00 44.72 45.86 3i4n s GLY 149 CO 0.80 1.14 0.01 0.00 0.00 0.00 0.00 173.10 175.06 3i4n s ILE 151 N -0.36 1.34 0.21 0.00 1.01 -0.24 -4.97 121.20 118.19 3i4n s ILE 151 Ca 0.07 -1.52 -0.30 0.00 0.00 0.00 0.00 60.65 58.91 3i4n s ILE 151 Cb -0.12 -1.89 -0.08 0.00 0.01 0.00 0.00 42.46 40.37 3i4n s ILE 151 CO 0.02 -0.49 1.01 -0.94 0.00 0.00 0.00 174.94 174.54 3i4n s SER 152 N 1.41 7.46 0.13 3.58 1.04 -1.26 -1.79 113.70 124.27 3i4n s SER 152 Ca 0.06 2.02 -0.05 0.00 0.48 0.00 0.00 55.95 58.46 3i4n s SER 152 Cb -0.18 -2.61 -0.02 0.00 0.10 0.00 0.00 66.02 63.31 3i4n s SER 152 CO -0.15 -0.02 0.16 -1.58 0.98 0.00 0.00 173.24 172.62 3i4n s GLN 153 N -0.87 0.99 0.00 4.02 0.74 -0.86 -4.94 119.66 118.74 3i4n s GLN 153 Ca 0.45 -1.25 0.00 0.00 0.05 0.00 0.00 55.36 54.60 3i4n s GLN 153 Cb -0.28 0.31 0.00 0.00 1.10 0.00 0.00 33.01 34.14 3i4n s GLN 153 CO 0.34 -0.32 0.00 0.28 -0.55 0.00 0.00 175.29 175.04 3i4n n VAL 154 N -0.13 0.00 -3.05 1.34 0.31 -1.26 -0.82 118.33 114.72 3i4n n VAL 154 Ca -0.08 0.00 -0.26 0.00 -0.01 0.00 0.00 64.34 63.99 3i4n n VAL 154 Cb 0.63 0.00 -0.05 0.00 -0.91 0.00 0.00 33.84 33.51 3i4n n VAL 154 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 3i4n n SER 155 N 0.00 3.89 -3.15 4.52 3.41 -1.26 -4.72 113.62 116.32 3i4n n SER 155 Ca 0.00 -3.56 0.05 0.00 -0.26 0.00 0.00 58.87 55.10 3i4n n SER 155 Cb 0.00 -0.59 -0.01 0.00 -0.26 0.00 0.00 64.21 63.35 3i4n n SER 155 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3i4n s SER 156 N -3.16 -0.95 -0.75 4.04 1.04 -0.00 -4.75 113.70 109.16 3i4n s SER 156 Ca 0.46 0.60 -0.18 0.00 0.48 0.00 0.00 55.95 57.31 3i4n s SER 156 Cb 0.27 1.80 0.14 0.00 0.10 0.00 0.00 66.02 68.32 3i4n s SER 156 CO -0.11 -0.18 0.85 -0.63 0.98 0.00 0.00 173.24 174.15 3i4n s ILE 157 N 2.90 4.96 1.04 -1.02 1.01 -1.26 -2.03 121.20 126.81 3i4n s ILE 157 Ca 0.11 -1.48 -0.17 0.00 0.00 0.00 0.00 60.65 59.11 3i4n s ILE 157 Cb -0.13 -4.58 0.22 0.00 0.01 0.00 0.00 42.46 37.99 3i4n s ILE 157 CO -0.16 -1.23 1.22 -1.00 0.00 0.00 0.00 174.94 173.77 3i4n s HIS 158 N 2.15 1.29 -0.02 3.97 3.76 -0.74 -4.67 115.29 121.03 3i4n s HIS 158 Ca 0.19 0.44 -0.30 0.00 -0.15 0.00 0.00 55.06 55.24 3i4n s HIS 158 Cb -0.15 -3.79 0.11 0.00 1.11 0.00 0.00 32.58 29.86 3i4n s HIS 158 CO -0.02 -3.07 1.21 0.00 -0.85 0.00 0.00 174.74 172.01 3i4n s ALA 159 N -3.50 -2.10 -0.00 -1.40 0.00 -1.23 -1.07 121.76 112.45 3i4n s ALA 159 Ca 0.72 0.76 0.06 0.00 0.00 0.00 0.00 51.96 53.50 3i4n s ALA 159 Cb -0.07 0.33 -0.02 0.00 0.00 0.00 0.00 23.12 23.36 3i4n s ALA 159 CO 0.54 -0.97 -0.20 0.42 0.00 0.00 0.00 175.76 175.55 3i4n s ILE 160 N -2.59 1.58 0.21 0.00 1.01 0.05 -1.31 121.20 120.15 3i4n s ILE 160 Ca 0.13 -0.91 0.00 0.00 0.00 0.00 0.00 60.65 59.88 3i4n s ILE 160 Cb 0.03 -1.32 -0.05 0.00 0.01 0.00 0.00 42.46 41.13 3i4n s ILE 160 CO -0.03 0.40 0.09 -0.83 0.00 0.00 0.00 174.94 174.56 3i4n s GLY 161 N -0.59 1.49 0.08 6.18 0.00 0.42 0.62 107.32 115.52 3i4n s GLY 161 Ca 0.08 -1.73 0.05 0.00 0.00 0.00 0.00 44.72 43.11 3i4n s GLY 161 CO -0.00 -1.51 -0.12 -1.35 0.00 0.00 0.00 173.10 170.12 3i4n s SER 162 N -3.22 1.59 -0.05 1.64 1.04 -0.91 -4.20 113.70 109.59 3i4n s SER 162 Ca 0.34 -0.69 0.07 0.00 0.48 0.00 0.00 55.95 56.16 3i4n s SER 162 Cb 0.07 -0.03 0.11 0.00 0.10 0.00 0.00 66.02 66.27 3i4n s SER 162 CO 0.10 -0.15 0.99 2.30 0.98 0.00 0.00 173.24 177.47 3i4n n ILE 163 N 1.01 1.03 0.75 -1.02 -5.35 -1.03 -2.65 119.36 112.10 3i4n n ILE 163 Ca -0.19 -1.18 0.05 0.00 -0.27 0.00 0.00 62.75 61.15 3i4n n ILE 163 Cb 0.55 0.28 0.15 0.00 -1.74 0.00 0.00 39.64 38.89 3i4n n ILE 163 CO 0.00 0.00 0.00 1.17 -1.76 0.00 0.00 176.55 175.96 3i4n n LYS 164 N -0.71 2.01 -2.28 6.28 4.81 -1.20 -4.36 118.16 122.71 3i4n n LYS 164 Ca 0.06 -1.21 -0.11 0.00 -0.87 0.00 0.00 58.31 56.18 3i4n n LYS 164 Cb 0.51 -1.42 0.02 0.00 0.02 0.00 0.00 35.03 34.17 3i4n n LYS 164 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 3i4n n GLU 165 N 0.39 0.90 -2.68 1.64 -0.58 -1.26 -4.86 120.64 114.19 3i4n n GLU 165 Ca 0.11 -1.67 -0.31 0.00 -0.42 0.00 0.00 57.16 54.87 3i4n n GLU 165 Cb 0.38 -0.00 -0.03 0.00 -0.57 0.00 0.00 31.44 31.21 3i4n n GLU 165 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 3i4n s ASP 166 N -2.78 6.56 -1.64 1.62 1.01 -1.26 -3.83 116.67 116.35 3i4n s ASP 166 Ca 0.26 1.30 0.00 0.00 0.71 0.00 0.00 52.55 54.82 3i4n s ASP 166 Cb -0.02 -2.40 0.00 0.00 1.01 0.00 0.00 42.92 41.51 3i4n s ASP 166 CO 0.16 -0.47 0.00 -1.22 0.21 0.00 0.00 175.17 173.85 3i4n n TYR 167 N -1.39 -0.07 -4.32 4.23 4.02 -1.26 -4.95 117.16 113.42 3i4n n TYR 167 Ca 0.04 0.00 -0.24 0.00 -0.01 0.00 0.00 57.90 57.69 3i4n n TYR 167 Cb 0.54 -3.01 -0.08 0.00 -0.02 0.00 0.00 39.34 36.77 3i4n n TYR 167 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 3i4n s LEU 168 N -3.66 3.01 0.00 7.72 1.43 -1.25 -5.03 118.68 120.91 3i4n s LEU 168 Ca 0.00 -0.92 0.00 0.00 -1.03 0.00 0.00 54.13 52.18 3i4n s LEU 168 Cb 0.00 -1.43 0.00 0.00 0.03 0.00 0.00 46.19 44.79 3i4n s LEU 168 CO 0.00 -0.18 0.00 0.61 0.23 0.00 0.00 176.35 177.01 3i4n n GLY 169 N -0.94 0.19 3.90 -3.19 0.00 -0.90 -4.91 105.19 99.34 3i4n n GLY 169 Ca -0.04 -1.52 -0.29 0.00 0.00 0.00 0.00 46.02 44.16 3i4n n GLY 169 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i4n s ALA 170 N -2.00 2.71 0.00 4.61 0.00 -1.26 -0.11 121.76 125.71 3i4n s ALA 170 Ca 0.00 -0.59 0.00 0.00 0.00 0.00 0.00 51.96 51.37 3i4n s ALA 170 Cb 0.00 -2.97 0.00 0.00 0.00 0.00 0.00 23.12 20.15 3i4n s ALA 170 CO 0.00 -1.56 0.00 0.44 0.00 0.00 0.00 175.76 174.64