#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3has s ARG 7 N 0.00 4.49 0.56 1.61 0.52 -1.26 -4.93 118.95 119.94 3has s ARG 7 Ca 0.00 1.93 0.25 0.00 -0.52 0.00 0.00 55.73 57.39 3has s ARG 7 Cb 0.00 -3.20 1.56 0.00 0.52 0.00 0.00 34.95 33.83 3has s ARG 7 CO 0.00 -0.06 2.15 -1.00 0.02 0.00 0.00 175.30 176.41 3has h PRO 8 N 4.75 0.00 0.00 3.54 0.13 -2.01 0.68 132.00 139.09 3has h PRO 8 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 3has h PRO 8 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 3has h PRO 8 CO 0.72 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.64 3has n GLU 9 N -4.11 0.21 -0.21 0.86 0.00 -1.26 -3.86 120.64 112.27 3has n GLU 9 Ca -0.00 0.14 0.09 0.00 0.00 0.00 0.00 57.16 57.38 3has n GLU 9 Cb 0.21 -1.50 0.37 0.00 0.00 0.00 0.00 31.44 30.52 3has n GLU 9 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.13 177.24 3has h TRP 10 N 0.00 0.77 -0.87 -1.84 5.08 -1.23 -1.83 115.95 116.03 3has h TRP 10 Ca 0.00 0.02 0.07 0.00 1.08 0.00 0.00 58.89 60.06 3has h TRP 10 Cb 0.18 -0.25 -0.06 0.00 -3.00 0.00 0.00 29.16 26.04 3has h TRP 10 CO 0.00 0.36 0.57 0.97 -1.28 0.00 0.00 178.44 179.06 3has h ILE 11 N 0.72 1.05 0.05 0.12 6.09 -1.81 0.21 117.51 123.95 3has h ILE 11 Ca 0.36 -0.33 -0.24 0.00 -1.37 0.00 0.00 64.86 63.28 3has h ILE 11 Cb 0.44 0.00 -0.02 0.00 0.47 0.00 0.00 36.82 37.72 3has h ILE 11 CO -0.14 0.18 -1.12 -0.50 -3.07 0.00 0.00 178.15 173.50 3has h TRP 12 N 0.96 0.21 -0.60 2.19 -0.00 -1.63 -1.53 115.95 115.54 3has h TRP 12 Ca 0.38 -0.15 -0.04 0.00 -0.00 0.00 0.00 58.89 59.08 3has h TRP 12 Cb 0.23 -0.01 -0.03 0.00 -0.00 0.00 0.00 29.16 29.35 3has h TRP 12 CO -0.00 1.12 0.22 -0.07 -0.00 0.00 0.00 178.44 179.71 3has h LEU 13 N 0.03 0.84 -0.39 -4.49 3.38 -1.07 0.63 115.31 114.25 3has h LEU 13 Ca -0.07 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.71 3has h LEU 13 Cb 1.86 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 42.37 3has h LEU 13 CO 0.16 0.80 0.20 0.00 0.09 0.00 0.00 178.44 179.69 3has h ALA 14 N 1.08 0.50 -0.33 1.53 0.00 -0.52 -0.40 119.26 121.11 3has h ALA 14 Ca 0.20 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 54.89 3has h ALA 14 Cb 0.23 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3has h ALA 14 CO -0.01 0.03 -0.31 -0.07 0.00 0.00 0.00 179.25 178.89 3has h LEU 15 N 0.49 0.73 -0.67 0.00 3.38 -1.18 -1.46 115.31 116.60 3has h LEU 15 Ca 0.13 -0.29 -0.03 0.00 0.09 0.00 0.00 57.88 57.78 3has h LEU 15 Cb 0.08 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 3has h LEU 15 CO -0.02 0.99 0.30 1.23 0.09 0.00 0.00 178.44 181.03 3has h GLY 16 N 0.97 1.05 0.97 0.83 0.00 -0.76 -0.83 103.07 105.31 3has h GLY 16 Ca 0.07 -0.54 0.00 0.00 0.00 0.00 0.00 47.33 46.86 3has h GLY 16 CO 0.07 0.51 -0.02 -0.84 0.00 0.00 0.00 176.54 176.26 3has h THR 17 N 0.94 0.95 -0.18 4.70 2.02 -0.81 -0.55 112.91 119.98 3has h THR 17 Ca 0.23 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.45 3has h THR 17 Cb 0.15 0.95 -0.04 0.00 -1.74 0.00 0.00 68.15 67.48 3has h THR 17 CO -0.02 0.00 -0.05 0.00 0.37 0.00 0.00 175.52 175.81 3has h ALA 18 N 0.93 0.11 -0.52 6.16 0.00 -1.09 -0.39 119.26 124.46 3has h ALA 18 Ca 0.00 0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 3has h ALA 18 Cb 0.05 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 3has h ALA 18 CO -0.01 -0.48 -0.00 -0.07 0.00 0.00 0.00 179.25 178.68 3has h LEU 19 N -0.01 0.90 -0.48 0.00 3.38 -1.00 -0.85 115.31 117.25 3has h LEU 19 Ca 0.09 -0.31 -0.14 0.00 0.09 0.00 0.00 57.88 57.62 3has h LEU 19 Cb 0.15 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 3has h LEU 19 CO -0.20 0.99 -0.24 0.24 0.09 0.00 0.00 178.44 179.33 3has h MET 20 N 0.79 1.00 0.07 1.13 2.86 -1.01 -0.91 114.93 118.87 3has h MET 20 Ca 0.15 -0.44 -0.00 0.00 -2.06 0.00 0.00 59.70 57.34 3has h MET 20 Cb 0.53 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.16 3has h MET 20 CO 0.03 1.12 -0.03 0.78 1.06 0.00 0.00 176.91 179.86 3has h GLY 21 N 0.86 -0.10 1.05 8.32 0.00 -0.88 -0.80 103.07 111.51 3has h GLY 21 Ca 0.11 0.04 -0.09 0.00 0.00 0.00 0.00 47.33 47.38 3has h GLY 21 CO 0.07 -0.04 -0.01 1.41 0.00 0.00 0.00 176.54 177.98 3has h LEU 22 N -0.13 0.95 -0.18 3.11 3.38 -1.13 -1.52 115.31 119.80 3has h LEU 22 Ca -0.01 -0.31 0.03 0.00 0.09 0.00 0.00 57.88 57.68 3has h LEU 22 Cb 0.10 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 3has h LEU 22 CO 0.02 1.03 0.01 1.23 0.09 0.00 0.00 178.44 180.82 3has h GLY 23 N 0.85 0.18 0.61 0.83 0.00 -1.09 -1.16 103.07 103.27 3has h GLY 23 Ca 0.15 0.01 0.04 0.00 0.00 0.00 0.00 47.33 47.54 3has h GLY 23 CO 0.03 -0.03 -0.02 -0.84 0.00 0.00 0.00 176.54 175.69 3has h THR 24 N 0.07 0.81 -0.39 4.70 2.02 -0.94 -1.27 112.91 117.92 3has h THR 24 Ca 0.08 -0.02 0.03 0.00 0.77 0.00 0.00 66.41 67.27 3has h THR 24 Cb 0.10 0.76 -0.03 0.00 -1.74 0.00 0.00 68.15 67.23 3has h THR 24 CO -0.13 0.01 0.20 0.25 0.37 0.00 0.00 175.52 176.21 3has h LEU 25 N 0.05 0.30 -0.44 2.58 6.46 -1.06 0.11 115.31 123.30 3has h LEU 25 Ca 0.11 0.02 -0.01 0.00 -0.12 0.00 0.00 57.88 57.88 3has h LEU 25 Cb 0.15 -0.04 -0.02 0.00 -0.73 0.00 0.00 40.66 40.02 3has h LEU 25 CO -0.20 0.22 0.23 0.22 -0.62 0.00 0.00 178.44 178.28 3has h TYR 26 N 0.41 0.62 -0.56 1.25 3.20 -1.00 -1.41 116.97 119.48 3has h TYR 26 Ca 0.16 -0.02 -0.09 0.00 3.14 0.00 0.00 58.73 61.92 3has h TYR 26 Cb 0.06 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.11 3has h TYR 26 CO -0.10 0.49 -0.01 0.74 -1.64 0.00 0.00 178.16 177.64 3has h PHE 27 N 0.58 1.06 -0.32 -3.82 0.04 -0.90 -1.49 116.94 112.10 3has h PHE 27 Ca 0.15 -0.18 -0.01 0.00 2.80 0.00 0.00 57.97 60.74 3has h PHE 27 Cb 0.08 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 37.94 3has h PHE 27 CO -0.02 0.95 0.17 1.25 -0.60 0.00 0.00 178.31 180.07 3has h LEU 28 N 0.89 0.40 -0.06 1.54 5.85 -0.74 0.17 115.31 123.37 3has h LEU 28 Ca 0.16 -0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.79 3has h LEU 28 Cb 0.54 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.47 3has h LEU 28 CO 0.03 0.38 0.04 0.58 -0.34 0.00 0.00 178.44 179.12 3has h VAL 29 N 0.39 1.04 -0.59 1.05 2.07 -1.05 0.17 116.25 119.33 3has h VAL 29 Ca 0.11 -0.11 -0.03 0.00 0.82 0.00 0.00 66.70 67.50 3has h VAL 29 Cb 0.07 1.01 -0.03 0.00 -1.52 0.00 0.00 31.29 30.82 3has h VAL 29 CO -0.02 0.04 0.27 0.11 0.02 0.00 0.00 177.57 177.98 3has h LYS 30 N 0.05 0.86 -0.57 1.57 1.79 -1.17 -3.00 116.57 116.11 3has h LYS 30 Ca 0.02 -0.14 -0.08 0.00 -2.18 0.00 0.00 60.65 58.27 3has h LYS 30 Cb 0.03 -0.15 -0.02 0.00 -1.58 0.00 0.00 32.23 30.51 3has h LYS 30 CO -0.00 0.72 0.04 0.78 -1.08 0.00 0.00 179.45 179.90 3has h GLY 31 N 0.81 1.05 2.00 3.86 0.00 -0.40 -2.51 103.07 107.88 3has h GLY 31 Ca 0.20 -0.74 0.00 0.00 0.00 0.00 0.00 47.33 46.79 3has h GLY 31 CO -0.02 0.68 0.00 -0.33 0.00 0.00 0.00 176.54 176.87 3has h MET 32 N 0.86 0.00 0.00 4.80 2.86 -0.94 -2.79 114.93 119.72 3has h MET 32 Ca 0.17 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.75 3has h MET 32 Cb 0.49 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.14 3has h MET 32 CO 0.02 0.00 -0.38 0.78 1.06 0.00 0.00 176.91 178.39 3has h GLY 33 N 2.21 0.00 -3.54 8.32 0.00 -1.30 -3.47 103.07 105.29 3has h GLY 33 Ca 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 46.84 3has h GLY 33 CO 0.00 0.00 0.31 0.54 0.00 0.00 0.00 176.54 177.39 3has s VAL 34 N -3.11 4.18 -0.07 4.60 0.11 -1.05 -5.00 120.40 120.06 3has s VAL 34 Ca 0.05 1.91 0.13 0.00 -2.93 0.00 0.00 61.98 61.14 3has s VAL 34 Cb 0.07 -4.17 -0.19 0.00 -1.53 0.00 0.00 36.38 30.55 3has s VAL 34 CO 0.72 0.37 0.18 -1.54 -3.33 0.00 0.00 175.10 171.49 3has n SER 35 N 1.14 1.77 -4.68 3.54 3.41 -1.26 -4.91 113.62 112.63 3has n SER 35 Ca -0.01 0.00 -0.48 0.00 -0.26 0.00 0.00 58.87 58.11 3has n SER 35 Cb 0.48 1.24 -0.05 0.00 -0.26 0.00 0.00 64.21 65.63 3has n SER 35 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3has n ASP 36 N -2.23 3.45 -0.33 4.04 2.03 -1.26 -4.89 116.55 117.35 3has n ASP 36 Ca -0.12 0.97 -0.03 0.00 0.52 0.00 0.00 54.79 56.13 3has n ASP 36 Cb 0.64 -1.37 0.09 0.00 -0.72 0.00 0.00 41.12 39.77 3has n ASP 36 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 3has h PRO 37 N 9.23 1.19 -0.15 -0.67 0.11 -1.97 -0.83 132.00 138.91 3has h PRO 37 Ca -0.49 -0.07 -0.00 0.00 0.11 0.00 0.00 66.00 65.55 3has h PRO 37 Cb 1.27 -0.27 -0.01 0.00 0.11 0.00 0.00 31.00 32.11 3has h PRO 37 CO 0.95 0.79 0.09 -0.44 -0.21 0.00 0.00 178.00 179.18 3has h ASP 38 N 1.22 0.18 -0.52 -2.05 5.19 -1.90 -2.39 116.42 116.15 3has h ASP 38 Ca 0.33 -0.05 -0.02 0.00 -0.62 0.00 0.00 57.03 56.67 3has h ASP 38 Cb -0.14 -0.04 -0.03 0.00 0.18 0.00 0.00 39.33 39.30 3has h ASP 38 CO -0.07 0.17 0.27 0.00 -3.12 0.00 0.00 179.24 176.50 3has h ALA 39 N 1.01 1.45 -0.38 3.45 0.00 -1.09 -1.86 119.26 121.84 3has h ALA 39 Ca 0.05 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 3has h ALA 39 Cb 0.03 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 3has h ALA 39 CO -0.01 0.44 0.08 0.87 0.00 0.00 0.00 179.25 180.63 3has h LYS 40 N 0.77 0.57 -0.46 0.00 1.57 -0.83 -0.44 116.57 117.75 3has h LYS 40 Ca 0.19 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 58.84 3has h LYS 40 Cb 0.06 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 3has h LYS 40 CO -0.03 0.54 0.17 -0.22 -0.57 0.00 0.00 179.45 179.34 3has h LYS 41 N 0.56 0.70 -0.53 3.15 3.64 -0.84 -0.38 116.57 122.87 3has h LYS 41 Ca 0.13 -0.13 -0.08 0.00 -1.27 0.00 0.00 60.65 59.29 3has h LYS 41 Cb 0.24 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.93 3has h LYS 41 CO -0.00 0.64 0.02 0.74 -2.27 0.00 0.00 179.45 178.58 3has h PHE 42 N 0.60 0.99 -0.93 1.91 0.04 -1.22 -2.14 116.94 116.20 3has h PHE 42 Ca 0.15 -0.16 0.02 0.00 2.80 0.00 0.00 57.97 60.78 3has h PHE 42 Cb 0.22 -0.26 -0.05 0.00 2.20 0.00 0.00 35.95 38.06 3has h PHE 42 CO 0.01 0.91 0.61 1.88 -0.60 0.00 0.00 178.31 181.12 3has h TYR 43 N 0.79 1.15 0.00 -0.55 0.05 -0.92 -1.04 116.97 116.45 3has h TYR 43 Ca 0.15 0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.96 3has h TYR 43 Cb 0.50 -0.39 0.00 0.00 1.01 0.00 0.00 36.73 37.85 3has h TYR 43 CO 0.04 0.70 -0.00 0.00 -1.05 0.00 0.00 178.16 177.85 3has h ALA 44 N 1.35 -0.00 -0.22 3.88 0.00 -0.76 -0.51 119.26 123.00 3has h ALA 44 Ca 0.35 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 3has h ALA 44 Cb -0.09 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 3has h ALA 44 CO -0.09 -0.39 0.13 0.82 0.00 0.00 0.00 179.25 179.72 3has h ILE 45 N -0.24 1.09 0.00 0.00 2.04 -1.34 -2.80 117.51 116.26 3has h ILE 45 Ca -0.00 -0.23 -0.11 0.00 1.00 0.00 0.00 64.86 65.52 3has h ILE 45 Cb 0.23 0.86 -0.02 0.00 -0.74 0.00 0.00 36.82 37.15 3has h ILE 45 CO 0.00 0.09 -0.53 0.74 0.00 0.00 0.00 178.15 178.45 3has h THR 46 N 0.26 1.08 -0.02 -0.27 2.02 -1.10 -2.91 112.91 111.97 3has h THR 46 Ca 0.08 -2.03 -0.23 0.00 0.77 0.00 0.00 66.41 65.00 3has h THR 46 Cb 0.03 2.20 0.01 0.00 -1.74 0.00 0.00 68.15 68.65 3has h THR 46 CO -0.01 0.52 -0.93 0.74 0.37 0.00 0.00 175.52 176.20 3has h THR 47 N 0.00 1.37 -0.81 3.16 2.02 -1.07 -3.21 112.91 114.37 3has h THR 47 Ca -0.01 -2.35 0.03 0.00 0.77 0.00 0.00 66.41 64.86 3has h THR 47 Cb 1.15 2.35 -0.04 0.00 -1.74 0.00 0.00 68.15 69.87 3has h THR 47 CO 0.07 0.71 0.53 -0.07 0.37 0.00 0.00 175.52 177.13 3has h LEU 48 N 0.29 0.88 0.53 2.58 3.38 -1.31 -2.83 115.31 118.83 3has h LEU 48 Ca -0.08 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 3has h LEU 48 Cb 1.57 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 42.09 3has h LEU 48 CO 0.17 0.62 -0.44 0.58 0.09 0.00 0.00 178.44 179.45 3has h VAL 49 N 1.03 0.00 0.00 1.22 2.07 -1.52 -0.91 116.25 118.14 3has h VAL 49 Ca 0.31 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.83 3has h VAL 49 Cb -0.01 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.76 3has h VAL 49 CO -0.09 0.00 0.00 1.55 0.02 0.00 0.00 177.57 179.05 3has h PRO 50 N -0.95 0.00 -0.34 1.57 0.13 -1.70 -2.36 132.00 128.35 3has h PRO 50 Ca -0.07 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.03 3has h PRO 50 Cb 0.80 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.92 3has h PRO 50 CO -0.00 0.00 0.10 0.00 -0.23 0.00 0.00 178.00 177.87 3has h ALA 51 N 2.07 0.45 -0.28 -0.56 0.00 -1.17 0.16 119.26 119.93 3has h ALA 51 Ca 0.00 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 3has h ALA 51 Cb 0.48 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3has h ALA 51 CO 0.00 0.10 0.10 0.82 0.00 0.00 0.00 179.25 180.26 3has h ILE 52 N 0.40 1.19 -0.66 0.00 2.04 -1.01 -2.47 117.51 117.00 3has h ILE 52 Ca 0.11 -0.60 0.00 0.00 1.00 0.00 0.00 64.86 65.37 3has h ILE 52 Cb 0.26 1.06 -0.03 0.00 -0.74 0.00 0.00 36.82 37.37 3has h ILE 52 CO -0.00 0.20 0.43 0.00 0.00 0.00 0.00 178.15 178.78 3has h ALA 53 N 0.93 0.84 -0.47 1.87 0.00 -1.33 -2.12 119.26 118.98 3has h ALA 53 Ca 0.09 -0.05 0.08 0.00 0.00 0.00 0.00 54.91 55.03 3has h ALA 53 Cb 0.22 -0.27 -0.07 0.00 0.00 0.00 0.00 17.79 17.67 3has h ALA 53 CO -0.00 0.28 0.08 0.35 0.00 0.00 0.00 179.25 179.96 3has h PHE 54 N 0.90 0.13 -0.81 0.00 3.57 -0.54 0.11 116.94 120.31 3has h PHE 54 Ca 0.24 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.76 3has h PHE 54 Cb -0.09 0.01 -0.04 0.00 2.79 0.00 0.00 35.95 38.63 3has h PHE 54 CO -0.02 -0.01 0.46 1.15 -2.23 0.00 0.00 178.31 177.65 3has h THR 55 N 0.21 1.23 0.10 4.41 2.02 -1.00 -0.34 112.91 119.56 3has h THR 55 Ca 0.24 -0.56 -0.29 0.00 0.77 0.00 0.00 66.41 66.57 3has h THR 55 Cb 0.31 0.12 0.03 0.00 -1.74 0.00 0.00 68.15 66.87 3has h THR 55 CO -0.32 0.26 -1.21 0.24 0.37 0.00 0.00 175.52 174.86 3has h MET 56 N 1.13 0.60 -0.74 6.66 2.86 -0.81 -1.27 114.93 123.36 3has h MET 56 Ca 0.29 -0.79 -0.04 0.00 -2.06 0.00 0.00 59.70 57.10 3has h MET 56 Cb 0.00 0.26 -0.03 0.00 0.06 0.00 0.00 31.60 31.88 3has h MET 56 CO -0.05 1.35 0.31 1.88 1.06 0.00 0.00 176.91 181.46 3has h TYR 57 N 0.28 1.12 -0.33 -0.22 0.05 -0.68 -1.10 116.97 116.10 3has h TYR 57 Ca -0.17 -0.08 -0.02 0.00 0.05 0.00 0.00 58.73 58.51 3has h TYR 57 Cb 1.88 -0.34 -0.01 0.00 1.01 0.00 0.00 36.73 39.27 3has h TYR 57 CO 0.11 0.85 0.13 1.25 -1.05 0.00 0.00 178.16 179.45 3has h LEU 58 N 1.06 0.47 -0.45 3.88 5.85 -1.04 0.14 115.31 125.22 3has h LEU 58 Ca 0.25 -0.18 0.06 0.00 0.84 0.00 0.00 57.88 58.86 3has h LEU 58 Cb 0.20 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.05 3has h LEU 58 CO -0.02 0.52 0.14 0.28 -0.34 0.00 0.00 178.44 179.01 3has h SER 59 N 0.39 0.11 -0.51 1.25 0.02 -1.05 -1.47 113.55 112.30 3has h SER 59 Ca 0.11 0.06 -0.09 0.00 -0.84 0.00 0.00 61.79 61.03 3has h SER 59 Cb 0.20 0.06 -0.02 0.00 0.14 0.00 0.00 62.40 62.78 3has h SER 59 CO -0.01 0.09 -0.04 0.24 -1.14 0.00 0.00 176.83 175.97 3has h MET 60 N 0.29 0.92 -0.74 3.45 2.86 -1.00 -0.29 114.93 120.42 3has h MET 60 Ca 0.22 -0.32 0.13 0.00 -2.06 0.00 0.00 59.70 57.67 3has h MET 60 Cb 0.24 -0.07 -0.09 0.00 0.06 0.00 0.00 31.60 31.74 3has h MET 60 CO -0.24 0.97 0.32 1.25 1.06 0.00 0.00 176.91 180.27 3has h LEU 61 N 0.78 0.35 -0.20 1.22 5.85 -0.39 -0.90 115.31 122.03 3has h LEU 61 Ca 0.14 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.95 3has h LEU 61 Cb 0.58 0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.66 3has h LEU 61 CO 0.03 0.16 0.00 0.18 -0.34 0.00 0.00 178.44 178.48 3has n LEU 62 N -4.95 0.29 0.00 2.25 4.77 -0.58 -4.88 117.00 113.90 3has n LEU 62 Ca 0.13 -0.13 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 3has n LEU 62 Cb 0.37 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 3has n LEU 62 CO 0.21 0.07 0.00 0.61 -1.33 0.00 0.00 177.39 176.94 3has n GLY 63 N 0.75 0.85 4.00 -0.72 0.00 -0.34 -5.06 105.19 104.67 3has n GLY 63 Ca 0.09 -0.04 -0.18 0.00 0.00 0.00 0.00 46.02 45.90 3has n GLY 63 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3has s TYR 64 N -2.00 2.84 -1.34 1.61 1.51 -0.15 -4.57 117.35 115.25 3has s TYR 64 Ca 0.00 -0.33 0.00 0.00 -1.01 0.00 0.00 57.07 55.73 3has s TYR 64 Cb 0.00 -2.42 0.00 0.00 -0.11 0.00 0.00 41.96 39.43 3has s TYR 64 CO 0.00 -0.47 0.00 0.41 -1.11 0.00 0.00 175.55 174.38 3has n GLY 65 N -1.92 0.74 3.17 0.71 0.00 -1.26 -3.78 105.19 102.85 3has n GLY 65 Ca 0.08 -0.35 -0.27 0.00 0.00 0.00 0.00 46.02 45.47 3has n GLY 65 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3has s LEU 66 N -3.48 1.97 0.07 0.99 2.96 -1.26 -0.61 118.68 119.31 3has s LEU 66 Ca 0.00 -0.38 -0.02 0.00 -0.22 0.00 0.00 54.13 53.51 3has s LEU 66 Cb 0.00 -1.05 -0.04 0.00 0.50 0.00 0.00 46.19 45.60 3has s LEU 66 CO 0.00 0.19 0.01 0.28 -1.32 0.00 0.00 176.35 175.50 3has s THR 67 N -0.09 0.19 -0.19 3.68 -1.32 -0.31 -4.96 115.64 112.64 3has s THR 67 Ca -0.02 -1.78 -0.09 0.00 -1.21 0.00 0.00 61.69 58.59 3has s THR 67 Cb -0.11 -1.61 -0.05 0.00 -1.51 0.00 0.00 72.50 69.22 3has s THR 67 CO 0.02 -0.86 0.11 -0.04 -2.21 0.00 0.00 174.62 171.64 3has s MET 68 N -3.94 4.06 -0.17 7.08 1.00 -1.26 -0.30 119.30 125.77 3has s MET 68 Ca 0.10 -0.24 0.01 0.00 0.00 0.00 0.00 55.69 55.56 3has s MET 68 Cb 0.08 -3.34 0.02 0.00 0.00 0.00 0.00 34.83 31.58 3has s MET 68 CO -0.08 0.34 -0.20 0.08 0.00 0.00 0.00 175.02 175.17 3has s VAL 69 N 0.23 2.00 -0.09 -6.03 1.01 0.60 -4.87 120.40 113.24 3has s VAL 69 Ca 0.07 -0.91 -0.30 0.00 0.00 0.00 0.00 61.98 60.85 3has s VAL 69 Cb -0.11 -1.80 -0.03 0.00 0.00 0.00 0.00 36.38 34.44 3has s VAL 69 CO -0.01 0.53 1.20 -2.16 0.00 0.00 0.00 175.10 174.66 3has s PRO 70 N 1.19 4.32 -0.05 2.72 0.04 -1.26 -1.22 135.00 140.75 3has s PRO 70 Ca 0.02 1.64 -0.30 0.00 0.04 0.00 0.00 61.00 62.40 3has s PRO 70 Cb -0.14 -3.61 0.08 0.00 0.04 0.00 0.00 34.50 30.87 3has s PRO 70 CO -0.10 -0.51 0.73 -0.59 0.04 0.00 0.00 177.00 176.57 3has s PHE 71 N 2.56 -0.59 -1.72 0.56 -0.12 -0.42 -4.48 117.98 113.77 3has s PHE 71 Ca 0.55 0.96 0.00 0.00 -0.05 0.00 0.00 56.93 58.38 3has s PHE 71 Cb -0.23 0.43 0.00 0.00 -0.63 0.00 0.00 43.02 42.59 3has s PHE 71 CO 0.19 -0.58 0.00 0.41 -0.05 0.00 0.00 175.22 175.19 3has n GLY 72 N 0.74 1.10 1.16 1.99 0.00 -1.26 -2.68 105.19 106.25 3has n GLY 72 Ca -0.17 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.66 3has n GLY 72 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3has n GLY 73 N -0.91 0.71 3.18 -0.02 0.00 -1.26 -5.04 105.19 101.85 3has n GLY 73 Ca -0.18 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.73 3has n GLY 73 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3has s GLU 74 N -0.42 0.96 -0.33 1.61 2.02 -1.09 -5.12 118.70 116.31 3has s GLU 74 Ca 0.00 -1.44 -0.19 0.00 0.02 0.00 0.00 54.97 53.35 3has s GLU 74 Cb 0.00 -0.01 -0.00 0.00 0.10 0.00 0.00 34.13 34.21 3has s GLU 74 CO 0.00 -0.17 0.59 -1.14 0.02 0.00 0.00 175.26 174.56 3has s GLN 75 N -3.96 3.75 -0.15 1.61 2.00 -1.26 -1.30 119.66 120.35 3has s GLN 75 Ca 0.21 0.07 -0.02 0.00 -2.00 0.00 0.00 55.36 53.62 3has s GLN 75 Cb 0.07 -3.78 -0.02 0.00 0.80 0.00 0.00 33.01 30.08 3has s GLN 75 CO 0.01 -0.64 -0.09 -0.80 -0.50 0.00 0.00 175.29 173.27 3has s ASN 76 N 1.73 4.27 0.09 6.67 -0.87 -0.36 -4.89 114.94 121.57 3has s ASN 76 Ca 0.23 -0.28 -0.30 0.00 -1.57 0.00 0.00 52.86 50.93 3has s ASN 76 Cb -0.15 -1.67 -0.06 0.00 -0.02 0.00 0.00 41.25 39.35 3has s ASN 76 CO 0.13 0.14 1.14 -2.16 -2.57 0.00 0.00 177.10 173.79 3has s PRO 77 N 0.49 4.49 -0.09 -0.60 0.04 -1.26 -0.29 135.00 137.78 3has s PRO 77 Ca -0.07 1.71 -0.00 0.00 0.04 0.00 0.00 61.00 62.68 3has s PRO 77 Cb -0.15 -3.34 0.02 0.00 0.04 0.00 0.00 34.50 31.07 3has s PRO 77 CO 0.04 -0.14 -0.05 0.42 0.04 0.00 0.00 177.00 177.30 3has s ILE 78 N 0.69 0.81 -0.72 0.56 -1.09 0.58 -4.85 121.20 117.19 3has s ILE 78 Ca 0.55 -0.17 -0.24 0.00 -2.23 0.00 0.00 60.65 58.57 3has s ILE 78 Cb -0.28 -0.86 0.06 0.00 -1.58 0.00 0.00 42.46 39.79 3has s ILE 78 CO 0.31 0.33 1.10 -0.31 -1.23 0.00 0.00 174.94 175.14 3has s TYR 79 N 1.67 2.57 -0.55 3.97 2.02 -1.26 -1.16 117.35 124.61 3has s TYR 79 Ca 0.03 -0.46 0.24 0.00 -0.37 0.00 0.00 57.07 56.51 3has s TYR 79 Cb -0.13 -4.42 0.50 0.00 -0.40 0.00 0.00 41.96 37.51 3has s TYR 79 CO -0.06 -1.79 1.64 0.11 -1.57 0.00 0.00 175.55 173.87 3has h TRP 80 N 9.68 0.00 0.00 2.71 5.08 -1.23 -3.29 115.95 128.90 3has h TRP 80 Ca -0.23 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 59.74 3has h TRP 80 Cb 1.06 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.22 3has h TRP 80 CO 1.05 0.00 -0.01 0.00 -1.28 0.00 0.00 178.44 178.20 3has h ALA 81 N 2.22 1.66 -0.82 0.11 0.00 -1.80 -1.09 119.26 119.54 3has h ALA 81 Ca 0.00 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 54.99 3has h ALA 81 Cb 0.89 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.62 3has h ALA 81 CO 0.00 0.02 0.53 0.00 0.00 0.00 0.00 179.25 179.80 3has h ARG 82 N 0.00 0.76 -0.00 0.00 3.08 -1.86 -2.24 114.38 114.12 3has h ARG 82 Ca -0.00 -0.05 -0.16 0.00 0.07 0.00 0.00 59.98 59.85 3has h ARG 82 Cb 0.03 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 29.89 3has h ARG 82 CO 0.00 0.50 -0.74 1.88 -1.07 0.00 0.00 179.97 180.54 3has h TYR 83 N 0.78 0.04 -0.72 3.04 0.05 -1.45 -0.87 116.97 117.85 3has h TYR 83 Ca 0.37 -0.02 -0.07 0.00 0.05 0.00 0.00 58.73 59.06 3has h TYR 83 Cb 0.41 -0.01 -0.03 0.00 1.01 0.00 0.00 36.73 38.11 3has h TYR 83 CO -0.00 0.76 0.19 0.00 -1.05 0.00 0.00 178.16 178.06 3has h ALA 84 N 1.24 0.96 0.70 3.88 0.00 -1.45 0.18 119.26 124.77 3has h ALA 84 Ca -0.01 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 3has h ALA 84 Cb 1.31 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 18.83 3has h ALA 84 CO 0.10 0.67 -0.34 0.22 0.00 0.00 0.00 179.25 179.90 3has h ASP 85 N 1.09 -0.80 0.10 0.00 1.82 -1.20 -3.29 116.42 114.14 3has h ASP 85 Ca 0.23 -0.00 -0.04 0.00 -0.39 0.00 0.00 57.03 56.83 3has h ASP 85 Cb 0.36 0.21 -0.01 0.00 0.68 0.00 0.00 39.33 40.56 3has h ASP 85 CO -0.00 -0.48 -0.15 -0.50 -1.61 0.00 0.00 179.24 176.51 3has h TRP 86 N -1.10 0.10 -0.97 0.28 6.55 -1.01 -1.10 115.95 118.70 3has h TRP 86 Ca -0.10 -0.01 0.11 0.00 0.95 0.00 0.00 58.89 59.84 3has h TRP 86 Cb 0.75 -0.03 -0.08 0.00 -0.86 0.00 0.00 29.16 28.94 3has h TRP 86 CO -0.00 0.25 0.62 1.25 -1.05 0.00 0.00 178.44 179.50 3has h LEU 87 N 0.10 0.89 0.05 -4.49 5.85 -0.72 -2.29 115.31 114.71 3has h LEU 87 Ca 0.02 0.03 -0.36 0.00 0.84 0.00 0.00 57.88 58.41 3has h LEU 87 Cb 0.32 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.16 3has h LEU 87 CO 0.02 0.50 -2.16 0.49 -0.34 0.00 0.00 178.44 176.96 3has n PHE 88 N -4.57 0.66 0.10 1.25 3.72 -0.88 -4.45 117.46 113.29 3has n PHE 88 Ca 0.17 0.16 -0.17 0.00 -0.05 0.00 0.00 57.45 57.57 3has n PHE 88 Cb 0.33 -1.10 -0.11 0.00 -0.94 0.00 0.00 39.48 37.66 3has n PHE 88 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 176.76 178.50 3has h THR 89 N 0.03 1.43 -0.40 4.37 1.35 -1.14 -3.08 112.91 115.47 3has h THR 89 Ca -0.47 -2.79 -0.01 0.00 -0.55 0.00 0.00 66.41 62.59 3has h THR 89 Cb 2.02 2.79 -0.02 0.00 -1.73 0.00 0.00 68.15 71.21 3has h THR 89 CO 0.02 0.83 0.20 0.71 -0.25 0.00 0.00 175.52 177.03 3has h THR 90 N 0.14 1.16 0.00 6.82 1.35 -1.65 -1.22 112.91 119.52 3has h THR 90 Ca -0.14 -0.44 -0.06 0.00 -0.55 0.00 0.00 66.41 65.23 3has h THR 90 Cb 1.88 0.73 -0.01 0.00 -1.73 0.00 0.00 68.15 69.02 3has h THR 90 CO 0.20 0.17 -0.28 1.55 -0.25 0.00 0.00 175.52 176.92 3has h PRO 91 N 0.50 0.00 -0.42 4.72 0.13 -1.78 -2.21 132.00 132.95 3has h PRO 91 Ca 0.14 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.22 3has h PRO 91 Cb 0.09 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.20 3has h PRO 91 CO -0.02 0.28 0.09 -0.07 -0.23 0.00 0.00 178.00 178.05 3has h LEU 92 N 0.00 0.65 -0.43 1.56 3.38 -1.38 0.45 115.31 119.54 3has h LEU 92 Ca -0.00 -0.24 0.01 0.00 0.09 0.00 0.00 57.88 57.73 3has h LEU 92 Cb 0.56 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 3has h LEU 92 CO 0.04 0.73 0.28 -0.07 0.09 0.00 0.00 178.44 179.50 3has h LEU 93 N 0.55 0.47 -1.02 1.67 3.38 -1.06 -1.71 115.31 117.60 3has h LEU 93 Ca 0.13 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 3has h LEU 93 Cb 0.34 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.93 3has h LEU 93 CO 0.00 0.34 0.57 -0.07 0.09 0.00 0.00 178.44 179.37 3has h LEU 94 N 0.56 1.09 -0.71 1.67 3.38 -1.24 -2.38 115.31 117.69 3has h LEU 94 Ca 0.16 -0.06 0.04 0.00 0.09 0.00 0.00 57.88 58.11 3has h LEU 94 Cb -0.05 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.38 3has h LEU 94 CO -0.04 0.83 0.44 0.25 0.09 0.00 0.00 178.44 180.00 3has h LEU 95 N 1.26 0.71 -0.50 1.67 5.85 -0.55 0.39 115.31 124.14 3has h LEU 95 Ca 0.33 0.00 0.09 0.00 0.84 0.00 0.00 57.88 59.15 3has h LEU 95 Cb -0.08 -0.15 -0.07 0.00 0.37 0.00 0.00 40.66 40.73 3has h LEU 95 CO -0.06 0.49 0.08 0.44 -0.34 0.00 0.00 178.44 179.04 3has h ASP 96 N 0.85 -0.05 -0.35 1.25 3.32 -0.84 0.96 116.42 121.57 3has h ASP 96 Ca 0.29 0.10 -0.04 0.00 0.02 0.00 0.00 57.03 57.40 3has h ASP 96 Cb 0.05 0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 3has h ASP 96 CO -0.12 0.00 0.06 -0.07 -1.72 0.00 0.00 179.24 177.40 3has h LEU 97 N 0.21 0.54 -1.20 1.55 3.38 -0.95 -2.28 115.31 116.56 3has h LEU 97 Ca 0.25 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3has h LEU 97 Cb 0.36 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 3has h LEU 97 CO -0.35 0.66 0.36 0.00 0.09 0.00 0.00 178.44 179.19 3has h ALA 98 N 0.91 1.39 -0.32 1.53 0.00 -0.47 -2.49 119.26 119.80 3has h ALA 98 Ca 0.11 -0.10 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 3has h ALA 98 Cb 0.34 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 3has h ALA 98 CO 0.01 0.50 -0.41 -0.07 0.00 0.00 0.00 179.25 179.27 3has h LEU 99 N 0.92 0.83 -1.28 0.00 3.38 -0.69 -0.50 115.31 117.98 3has h LEU 99 Ca 0.23 -0.39 0.04 0.00 0.09 0.00 0.00 57.88 57.86 3has h LEU 99 Cb 0.03 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.50 3has h LEU 99 CO -0.04 1.13 0.51 -0.07 0.09 0.00 0.00 178.44 180.07 3has h LEU 100 N 0.63 0.81 -2.60 1.67 3.38 -0.97 -3.01 115.31 115.23 3has h LEU 100 Ca 0.05 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3has h LEU 100 Cb 0.97 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.54 3has h LEU 100 CO 0.09 0.55 0.00 1.33 0.09 0.00 0.00 178.44 180.50 3has n VAL 101 N -4.46 0.81 -3.77 1.22 0.24 -1.05 -4.94 118.33 106.37 3has n VAL 101 Ca 0.10 -0.90 -0.23 0.00 -2.04 0.00 0.00 64.34 61.27 3has n VAL 101 Cb 0.13 0.67 0.02 0.00 -1.47 0.00 0.00 33.84 33.19 3has n VAL 101 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 3has n ASP 102 N 1.17 -1.18 -4.74 -1.34 2.03 -0.70 -4.50 116.55 107.29 3has n ASP 102 Ca 0.18 -0.89 -0.33 0.00 0.52 0.00 0.00 54.79 54.27 3has n ASP 102 Cb 0.53 -3.73 0.09 0.00 -0.72 0.00 0.00 41.12 37.29 3has n ASP 102 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3has s ALA 103 N -3.75 2.14 0.50 -1.67 0.00 -0.28 -4.98 121.76 113.72 3has s ALA 103 Ca 0.03 0.62 -0.21 0.00 0.00 0.00 0.00 51.96 52.40 3has s ALA 103 Cb -0.01 -3.38 -0.07 0.00 0.00 0.00 0.00 23.12 19.66 3has s ALA 103 CO 0.84 -1.82 1.13 -0.51 0.00 0.00 0.00 175.76 175.39 3has s ASP 104 N -2.56 6.01 0.25 0.00 1.01 -1.26 -4.91 116.67 115.22 3has s ASP 104 Ca 0.68 2.18 -0.04 0.00 0.71 0.00 0.00 52.55 56.09 3has s ASP 104 Cb -0.23 -2.59 0.38 0.00 1.01 0.00 0.00 42.92 41.49 3has s ASP 104 CO 0.48 -1.02 1.86 -0.61 0.21 0.00 0.00 175.17 176.09 3has h GLN 105 N 1.62 1.00 -0.13 8.23 4.15 -2.00 -1.66 115.11 126.32 3has h GLN 105 Ca -0.50 -0.06 -0.05 0.00 0.77 0.00 0.00 58.65 58.81 3has h GLN 105 Cb 1.25 -0.22 -0.01 0.00 0.21 0.00 0.00 27.48 28.70 3has h GLN 105 CO 0.59 0.66 -0.16 0.78 -1.93 0.00 0.00 178.83 178.76 3has h GLY 106 N 1.03 0.23 0.99 2.39 0.00 -1.99 -1.14 103.07 104.57 3has h GLY 106 Ca 0.41 -0.14 -0.09 0.00 0.00 0.00 0.00 47.33 47.50 3has h GLY 106 CO -0.19 0.13 -0.11 -0.84 0.00 0.00 0.00 176.54 175.54 3has h THR 107 N 0.20 1.28 -0.43 4.70 2.02 -1.70 -1.67 112.91 117.31 3has h THR 107 Ca 0.04 -1.21 -0.05 0.00 0.77 0.00 0.00 66.41 65.96 3has h THR 107 Cb 0.42 1.21 -0.02 0.00 -1.74 0.00 0.00 68.15 68.02 3has h THR 107 CO 0.03 0.41 0.09 0.40 0.37 0.00 0.00 175.52 176.81 3has h ILE 108 N 0.61 1.24 -0.60 3.11 2.04 -0.98 -0.82 117.51 122.12 3has h ILE 108 Ca 0.10 -0.84 0.00 0.00 1.00 0.00 0.00 64.86 65.12 3has h ILE 108 Cb 0.64 0.97 -0.03 0.00 -0.74 0.00 0.00 36.82 37.66 3has h ILE 108 CO 0.04 0.29 0.39 0.25 0.00 0.00 0.00 178.15 179.12 3has h LEU 109 N 0.56 0.69 -0.47 1.44 5.85 -1.16 -0.02 115.31 122.19 3has h LEU 109 Ca 0.13 -0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.80 3has h LEU 109 Cb 0.35 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 3has h LEU 109 CO 0.00 0.51 0.19 0.00 -0.34 0.00 0.00 178.44 178.81 3has h ALA 110 N 1.21 0.61 -0.67 1.25 0.00 -1.04 -0.63 119.26 119.99 3has h ALA 110 Ca 0.22 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 3has h ALA 110 Cb -0.08 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 3has h ALA 110 CO -0.05 0.22 0.21 -0.07 0.00 0.00 0.00 179.25 179.56 3has h LEU 111 N 0.62 0.98 -0.48 0.00 3.38 -0.87 -0.50 115.31 118.44 3has h LEU 111 Ca 0.16 -0.21 -0.12 0.00 0.09 0.00 0.00 57.88 57.80 3has h LEU 111 Cb 0.19 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 3has h LEU 111 CO -0.01 0.93 -0.15 0.58 0.09 0.00 0.00 178.44 179.87 3has h VAL 112 N 0.98 1.27 -0.26 1.22 2.07 -0.80 0.11 116.25 120.84 3has h VAL 112 Ca 0.22 -1.30 0.02 0.00 0.82 0.00 0.00 66.70 66.46 3has h VAL 112 Cb 0.30 1.11 -0.02 0.00 -1.52 0.00 0.00 31.29 31.16 3has h VAL 112 CO -0.01 0.45 0.11 1.23 0.02 0.00 0.00 177.57 179.38 3has h GLY 113 N 0.80 0.34 1.01 2.17 0.00 -0.98 -0.70 103.07 105.72 3has h GLY 113 Ca 0.12 -0.08 -0.00 0.00 0.00 0.00 0.00 47.33 47.37 3has h GLY 113 CO 0.05 0.06 0.54 0.00 0.00 0.00 0.00 176.54 177.19 3has h ALA 114 N 1.15 1.11 -0.38 3.60 0.00 -0.90 -1.57 119.26 122.27 3has h ALA 114 Ca 0.11 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 3has h ALA 114 Cb 0.05 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 3has h ALA 114 CO -0.09 0.55 0.20 0.22 0.00 0.00 0.00 179.25 180.13 3has h ASP 115 N 1.19 0.48 -0.74 0.00 1.82 -0.46 0.71 116.42 119.41 3has h ASP 115 Ca 0.31 -0.10 0.03 0.00 -0.39 0.00 0.00 57.03 56.89 3has h ASP 115 Cb -0.07 -0.12 -0.05 0.00 0.68 0.00 0.00 39.33 39.77 3has h ASP 115 CO -0.06 0.44 0.46 1.23 -1.61 0.00 0.00 179.24 179.70 3has h GLY 116 N 0.48 1.08 0.93 -0.78 0.00 -0.90 -0.63 103.07 103.24 3has h GLY 116 Ca 0.13 -0.35 0.02 0.00 0.00 0.00 0.00 47.33 47.13 3has h GLY 116 CO -0.02 0.29 0.35 -2.22 0.00 0.00 0.00 176.54 174.94 3has h ILE 117 N 0.90 1.09 0.02 2.60 2.04 -0.90 0.06 117.51 123.33 3has h ILE 117 Ca 0.30 -0.24 -0.00 0.00 1.00 0.00 0.00 64.86 65.92 3has h ILE 117 Cb 0.04 0.34 -0.00 0.00 -0.74 0.00 0.00 36.82 36.45 3has h ILE 117 CO -0.12 0.13 -0.02 -0.03 0.00 0.00 0.00 178.15 178.11 3has h MET 118 N 0.70 -0.04 -0.20 2.37 4.05 -0.24 -0.50 114.93 121.07 3has h MET 118 Ca 0.21 0.00 -0.07 0.00 -0.28 0.00 0.00 59.70 59.57 3has h MET 118 Cb -0.02 0.01 -0.00 0.00 -0.80 0.00 0.00 31.60 30.78 3has h MET 118 CO -0.07 -0.03 -0.13 0.82 0.23 0.00 0.00 176.91 177.73 3has h ILE 119 N -0.04 1.32 -0.25 1.77 1.08 -1.08 -1.83 117.51 118.49 3has h ILE 119 Ca -0.00 -1.24 -0.00 0.00 -0.39 0.00 0.00 64.86 63.23 3has h ILE 119 Cb 0.03 1.71 -0.01 0.00 -3.07 0.00 0.00 36.82 35.48 3has h ILE 119 CO 0.00 0.38 0.15 1.23 -0.69 0.00 0.00 178.15 179.22 3has h GLY 120 N 0.12 0.36 1.81 5.37 0.00 -0.93 -0.48 103.07 109.32 3has h GLY 120 Ca 0.04 -0.15 -0.13 0.00 0.00 0.00 0.00 47.33 47.09 3has h GLY 120 CO 0.04 0.14 -0.57 -0.91 0.00 0.00 0.00 176.54 175.24 3has h THR 121 N 0.32 1.38 -0.52 4.70 1.35 -1.16 -1.12 112.91 117.85 3has h THR 121 Ca 0.09 -1.90 0.02 0.00 -0.55 0.00 0.00 66.41 64.07 3has h THR 121 Cb 0.00 1.96 -0.03 0.00 -1.73 0.00 0.00 68.15 68.35 3has h THR 121 CO -0.02 0.56 0.32 1.23 -0.25 0.00 0.00 175.52 177.37 3has h GLY 122 N 1.48 0.74 0.99 5.82 0.00 -1.03 0.22 103.07 111.28 3has h GLY 122 Ca -0.00 -0.25 -0.08 0.00 0.00 0.00 0.00 47.33 47.00 3has h GLY 122 CO 0.09 0.22 -0.04 -2.00 0.00 0.00 0.00 176.54 174.81 3has h LEU 123 N 0.65 0.80 -0.30 3.11 5.85 -0.79 -0.07 115.31 124.56 3has h LEU 123 Ca 0.20 -0.33 0.00 0.00 0.84 0.00 0.00 57.88 58.60 3has h LEU 123 Cb -0.01 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.79 3has h LEU 123 CO -0.08 0.94 0.19 0.58 -0.34 0.00 0.00 178.44 179.73 3has h VAL 124 N 0.65 1.09 -0.46 1.05 2.07 -1.06 -1.55 116.25 118.05 3has h VAL 124 Ca 0.12 -0.20 0.09 0.00 0.82 0.00 0.00 66.70 67.53 3has h VAL 124 Cb 0.55 0.68 -0.10 0.00 -1.52 0.00 0.00 31.29 30.90 3has h VAL 124 CO 0.03 0.09 -0.30 1.23 0.02 0.00 0.00 177.57 178.65 3has h GLY 125 N 0.40 -0.11 2.00 2.17 0.00 -0.76 -1.84 103.07 104.93 3has h GLY 125 Ca 0.11 0.38 -0.00 0.00 0.00 0.00 0.00 47.33 47.82 3has h GLY 125 CO -0.02 -0.21 -0.01 0.00 0.00 0.00 0.00 176.54 176.29 3has h ALA 126 N 0.94 1.48 -0.02 3.60 0.00 -0.36 -2.58 119.26 122.31 3has h ALA 126 Ca 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.10 3has h ALA 126 Cb 0.52 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3has h ALA 126 CO -0.57 0.02 -0.10 1.28 0.00 0.00 0.00 179.25 179.88 3has n LEU 127 N -3.80 2.58 -4.74 0.00 4.77 -0.64 -4.97 117.00 110.20 3has n LEU 127 Ca -0.03 -0.94 -0.40 0.00 -0.03 0.00 0.00 56.01 54.60 3has n LEU 127 Cb 0.10 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.14 3has n LEU 127 CO 0.27 0.45 0.64 -0.89 -1.33 0.00 0.00 177.39 176.53 3has s THR 128 N -1.91 4.33 -0.76 -5.08 2.01 -0.77 -4.96 115.64 108.51 3has s THR 128 Ca 0.23 2.03 0.23 0.00 0.31 0.00 0.00 61.69 64.49 3has s THR 128 Cb 0.18 -4.30 -0.09 0.00 0.01 0.00 0.00 72.50 68.29 3has s THR 128 CO 0.33 0.41 1.12 0.29 -0.69 0.00 0.00 174.62 176.07 3has n LYS 129 N 2.19 0.18 -3.44 4.92 5.02 -1.26 -4.75 118.16 121.02 3has n LYS 129 Ca -0.00 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.89 3has n LYS 129 Cb 0.48 -1.56 -0.10 0.00 -0.02 0.00 0.00 35.03 33.83 3has n LYS 129 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3has s VAL 130 N -3.12 5.21 0.14 -0.18 1.01 -1.26 -4.42 120.40 117.77 3has s VAL 130 Ca 0.06 -0.03 -0.19 0.00 0.00 0.00 0.00 61.98 61.83 3has s VAL 130 Cb 0.15 -3.78 0.02 0.00 0.00 0.00 0.00 36.38 32.77 3has s VAL 130 CO 0.78 -0.06 1.69 0.22 0.00 0.00 0.00 175.10 177.73 3has h TYR 131 N 8.47 -0.13 -0.69 5.22 5.03 -1.93 -1.46 116.97 131.47 3has h TYR 131 Ca -0.30 0.03 -0.00 0.00 2.58 0.00 0.00 58.73 61.03 3has h TYR 131 Cb 1.15 0.10 -0.03 0.00 1.55 0.00 0.00 36.73 39.50 3has h TYR 131 CO 0.68 -0.11 0.42 0.77 -1.32 0.00 0.00 178.16 178.60 3has h SER 132 N 0.01 0.83 0.79 -2.11 0.02 -1.98 -2.43 113.55 108.68 3has h SER 132 Ca 0.14 -0.04 -0.06 0.00 -0.84 0.00 0.00 61.79 60.98 3has h SER 132 Cb 0.21 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 3has h SER 132 CO -0.29 0.64 -0.31 1.88 -1.14 0.00 0.00 176.83 177.61 3has h TYR 133 N 0.95 0.00 -0.91 3.45 0.05 -1.69 -2.25 116.97 116.57 3has h TYR 133 Ca 0.25 0.00 0.16 0.00 0.05 0.00 0.00 58.73 59.19 3has h TYR 133 Cb -0.04 0.00 -0.10 0.00 1.01 0.00 0.00 36.73 37.60 3has h TYR 133 CO 0.00 0.31 0.50 0.00 -1.05 0.00 0.00 178.16 177.92 3has h ARG 134 N 0.00 0.66 0.00 4.88 3.08 -1.04 -2.33 114.38 119.63 3has h ARG 134 Ca -0.00 -0.04 -0.08 0.00 0.07 0.00 0.00 59.98 59.93 3has h ARG 134 Cb 0.78 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.67 3has h ARG 134 CO 0.04 0.44 -0.38 0.74 -1.07 0.00 0.00 179.97 179.73 3has h PHE 135 N 0.68 0.00 -0.22 3.04 0.04 -1.49 -2.08 116.94 116.91 3has h PHE 135 Ca 0.51 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 61.27 3has h PHE 135 Cb 0.75 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.89 3has h PHE 135 CO -0.06 0.38 0.10 0.28 -0.60 0.00 0.00 178.31 178.41 3has h VAL 136 N 0.00 1.15 -0.53 -0.55 2.07 -1.42 -0.27 116.25 116.71 3has h VAL 136 Ca -0.00 -0.43 -0.09 0.00 0.82 0.00 0.00 66.70 67.00 3has h VAL 136 Cb 1.07 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 31.84 3has h VAL 136 CO 0.05 0.14 -0.05 -0.50 0.02 0.00 0.00 177.57 177.24 3has h TRP 137 N 0.22 1.02 -0.65 1.57 4.06 -1.39 -1.65 115.95 119.12 3has h TRP 137 Ca 0.08 -0.18 0.06 0.00 2.06 0.00 0.00 58.89 60.90 3has h TRP 137 Cb 0.13 -0.27 -0.05 0.00 -1.00 0.00 0.00 29.16 27.98 3has h TRP 137 CO -0.02 0.94 0.36 2.35 -3.56 0.00 0.00 178.44 178.51 3has h TRP 138 N 0.85 0.67 -0.56 0.49 7.01 -1.25 -0.26 115.95 122.91 3has h TRP 138 Ca 0.15 0.02 -0.07 0.00 2.11 0.00 0.00 58.89 61.11 3has h TRP 138 Cb 0.57 -0.21 -0.02 0.00 -2.10 0.00 0.00 29.16 27.40 3has h TRP 138 CO 0.03 0.33 0.09 0.00 -2.79 0.00 0.00 178.44 176.10 3has h ALA 139 N 1.34 0.75 -0.41 2.65 0.00 -0.51 0.26 119.26 123.34 3has h ALA 139 Ca 0.29 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3has h ALA 139 Cb 0.17 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3has h ALA 139 CO -0.17 0.49 0.12 0.82 0.00 0.00 0.00 179.25 180.51 3has h ILE 140 N 0.82 1.22 -0.69 0.00 2.04 -1.05 -0.54 117.51 119.31 3has h ILE 140 Ca 0.17 -0.73 -0.00 0.00 1.00 0.00 0.00 64.86 65.30 3has h ILE 140 Cb 0.42 0.93 -0.03 0.00 -0.74 0.00 0.00 36.82 37.39 3has h ILE 140 CO 0.01 0.26 0.42 -1.28 0.00 0.00 0.00 178.15 177.56 3has h SER 141 N 0.52 0.83 0.08 1.72 0.87 -0.75 -1.87 113.55 114.95 3has h SER 141 Ca 0.13 -0.06 -0.12 0.00 -1.23 0.00 0.00 61.79 60.51 3has h SER 141 Cb 0.27 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.01 3has h SER 141 CO -0.00 0.64 -0.40 0.00 -0.53 0.00 0.00 176.83 176.54 3has h THR 142 N 0.95 1.30 -0.74 2.23 1.03 -0.68 -0.49 112.91 116.50 3has h THR 142 Ca 0.25 -1.54 0.01 0.00 -0.01 0.00 0.00 66.41 65.12 3has h THR 142 Cb -0.04 1.60 -0.04 0.00 -1.07 0.00 0.00 68.15 68.61 3has h THR 142 CO -0.05 0.47 0.49 0.00 -0.01 0.00 0.00 175.52 176.43 3has h ALA 143 N 1.23 0.94 -0.41 0.00 0.00 -0.82 0.35 119.26 120.55 3has h ALA 143 Ca 0.03 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3has h ALA 143 Cb 0.85 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 3has h ALA 143 CO 0.07 0.36 0.20 0.00 0.00 0.00 0.00 179.25 179.88 3has h ALA 144 N 1.27 0.53 -0.49 0.00 0.00 -0.82 -1.77 119.26 117.97 3has h ALA 144 Ca 0.27 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 55.11 3has h ALA 144 Cb -0.12 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.47 3has h ALA 144 CO -0.06 0.09 0.25 1.98 0.00 0.00 0.00 179.25 181.52 3has h MET 145 N 0.53 0.49 -0.13 0.00 -1.53 -0.67 -1.96 114.93 111.65 3has h MET 145 Ca 0.14 -0.03 -0.06 0.00 -3.44 0.00 0.00 59.70 56.31 3has h MET 145 Cb 0.12 -0.11 -0.01 0.00 -0.55 0.00 0.00 31.60 31.04 3has h MET 145 CO -0.02 0.32 -0.19 -0.07 0.14 0.00 0.00 176.91 177.09 3has h LEU 146 N 0.50 0.20 -0.37 3.39 3.38 -0.55 -0.02 115.31 121.84 3has h LEU 146 Ca 0.21 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 3has h LEU 146 Cb 0.11 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 3has h LEU 146 CO -0.14 0.41 0.16 0.22 0.09 0.00 0.00 178.44 179.17 3has h TYR 147 N 0.19 0.55 -0.20 1.13 3.20 -0.76 -0.55 116.97 120.53 3has h TYR 147 Ca 0.04 -0.04 0.02 0.00 3.14 0.00 0.00 58.73 61.89 3has h TYR 147 Cb 0.45 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.54 3has h TYR 147 CO 0.01 0.49 0.08 0.82 -1.64 0.00 0.00 178.16 177.92 3has h ILE 148 N 0.45 0.97 -0.40 1.81 2.04 -0.57 -1.86 117.51 119.95 3has h ILE 148 Ca 0.12 -0.06 -0.08 0.00 1.00 0.00 0.00 64.86 65.84 3has h ILE 148 Cb 0.17 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 3has h ILE 148 CO -0.01 0.03 -0.07 -0.07 0.00 0.00 0.00 178.15 178.03 3has h LEU 149 N 0.19 0.65 -0.00 1.44 3.38 -0.89 0.40 115.31 120.48 3has h LEU 149 Ca 0.09 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 3has h LEU 149 Cb 0.04 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 3has h LEU 149 CO -0.08 0.77 0.00 0.22 0.09 0.00 0.00 178.44 179.44 3has h TYR 150 N 0.62 0.00 -0.43 1.13 3.20 -0.82 0.18 116.97 120.85 3has h TYR 150 Ca 0.12 -0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.93 3has h TYR 150 Cb 0.49 -0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.74 3has h TYR 150 CO 0.02 0.04 0.04 0.28 -1.64 0.00 0.00 178.16 176.91 3has h VAL 151 N -0.04 1.25 -0.12 1.81 2.07 -1.09 0.34 116.25 120.48 3has h VAL 151 Ca 0.00 -0.95 -0.06 0.00 0.82 0.00 0.00 66.70 66.51 3has h VAL 151 Cb 0.04 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 3has h VAL 151 CO -0.00 0.33 -0.21 0.00 0.02 0.00 0.00 177.57 177.71 3has h ALA 152 N 0.92 1.43 0.00 1.67 0.00 -0.79 0.42 119.26 122.91 3has h ALA 152 Ca 0.13 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 3has h ALA 152 Cb 0.43 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 3has h ALA 152 CO 0.01 0.40 -0.24 0.35 0.00 0.00 0.00 179.25 179.78 3has h PHE 153 N 0.19 0.00 0.00 0.00 3.04 -0.34 -3.32 116.94 116.51 3has h PHE 153 Ca 0.03 0.00 -0.03 0.00 3.98 0.00 0.00 57.97 61.95 3has h PHE 153 Cb 0.48 0.00 -0.01 0.00 2.56 0.00 0.00 35.95 38.99 3has h PHE 153 CO 0.01 0.55 -0.22 0.74 -2.02 0.00 0.00 178.31 177.37 3has h PHE 154 N -1.00 0.00 -0.02 0.41 0.04 -0.40 -3.26 116.94 112.71 3has h PHE 154 Ca -0.05 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.72 3has h PHE 154 Cb 0.60 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.75 3has h PHE 154 CO 0.08 0.77 0.00 0.78 -0.60 0.00 0.00 178.31 179.34 3has h GLY 155 N -1.00 0.04 1.37 -1.45 0.00 -1.08 -2.15 103.07 98.80 3has h GLY 155 Ca -0.05 -0.03 -0.15 0.00 0.00 0.00 0.00 47.33 47.10 3has h GLY 155 CO -0.03 0.03 -0.45 0.74 0.00 0.00 0.00 176.54 176.82 3has h PHE 156 N -0.25 0.83 -0.83 5.60 -1.00 -1.17 -2.14 116.94 117.97 3has h PHE 156 Ca 0.01 -0.26 -0.00 0.00 2.81 0.00 0.00 57.97 60.52 3has h PHE 156 Cb 0.31 -0.17 -0.04 0.00 3.61 0.00 0.00 35.95 39.66 3has h PHE 156 CO 0.03 1.01 0.50 1.15 -1.61 0.00 0.00 178.31 179.39 3has h THR 157 N 0.55 1.23 -0.46 -1.55 2.02 -1.60 0.15 112.91 113.26 3has h THR 157 Ca 0.03 -0.50 0.06 0.00 0.77 0.00 0.00 66.41 66.77 3has h THR 157 Cb 1.00 0.06 -0.05 0.00 -1.74 0.00 0.00 68.15 67.42 3has h THR 157 CO 0.09 0.24 0.16 0.28 0.37 0.00 0.00 175.52 176.67 3has h SER 158 N 1.14 0.17 -0.75 4.18 0.02 -1.05 -1.76 113.55 115.51 3has h SER 158 Ca 0.30 0.05 -0.03 0.00 -0.84 0.00 0.00 61.79 61.27 3has h SER 158 Cb -0.05 0.04 -0.03 0.00 0.14 0.00 0.00 62.40 62.49 3has h SER 158 CO -0.06 0.13 0.36 0.11 -1.14 0.00 0.00 176.83 176.24 3has h LYS 159 N 0.34 1.07 0.00 3.45 1.79 -0.97 -2.66 116.57 119.59 3has h LYS 159 Ca 0.22 -0.16 -0.00 0.00 -2.18 0.00 0.00 60.65 58.53 3has h LYS 159 Cb 0.21 -0.19 -0.00 0.00 -1.58 0.00 0.00 32.23 30.67 3has h LYS 159 CO -0.22 0.84 -0.01 0.00 -1.08 0.00 0.00 179.45 178.98 3has h ALA 160 N 1.18 1.67 0.00 3.86 0.00 0.02 -2.28 119.26 123.71 3has h ALA 160 Ca 0.26 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 3has h ALA 160 Cb 0.11 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 3has h ALA 160 CO -0.03 0.01 -0.00 0.93 0.00 0.00 0.00 179.25 180.15 3has h GLU 161 N 0.00 0.00 -0.01 0.00 5.08 -0.97 -1.08 114.58 117.60 3has h GLU 161 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3has h GLU 161 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 3has h GLU 161 CO 0.00 0.00 -0.22 -1.13 -1.00 0.00 0.00 179.01 176.67 3has n SER 162 N -3.13 1.67 -4.94 1.42 3.41 -0.86 -4.95 113.62 106.25 3has n SER 162 Ca -0.02 -1.35 -0.24 0.00 -0.26 0.00 0.00 58.87 57.00 3has n SER 162 Cb 0.12 0.17 0.02 0.00 -0.26 0.00 0.00 64.21 64.27 3has n SER 162 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 3has s MET 163 N -2.31 2.92 0.51 4.33 -1.94 -0.41 -5.06 119.30 117.34 3has s MET 163 Ca 0.26 -0.34 -0.22 0.00 -1.71 0.00 0.00 55.69 53.68 3has s MET 163 Cb 0.19 -2.43 -0.06 0.00 2.01 0.00 0.00 34.83 34.54 3has s MET 163 CO 0.46 -0.51 1.27 -0.98 -0.01 0.00 0.00 175.02 175.25 3has s ARG 164 N -4.76 3.37 0.42 2.03 1.70 -1.26 -4.71 118.95 115.74 3has s ARG 164 Ca 0.52 2.03 0.20 0.00 -0.47 0.00 0.00 55.73 58.00 3has s ARG 164 Cb -0.10 -2.30 1.14 0.00 -0.57 0.00 0.00 34.95 33.12 3has s ARG 164 CO 0.41 -0.94 1.81 -1.35 -1.08 0.00 0.00 175.30 174.14 3has h PRO 165 N 1.66 0.35 -0.62 3.89 0.11 -1.96 -0.35 132.00 135.07 3has h PRO 165 Ca -0.50 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.56 3has h PRO 165 Cb 1.28 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 32.28 3has h PRO 165 CO 0.58 0.23 0.27 1.49 -0.21 0.00 0.00 178.00 180.36 3has h GLU 166 N 0.36 0.91 -0.11 1.05 4.81 -1.99 0.21 114.58 119.82 3has h GLU 166 Ca 0.54 -0.15 -0.04 0.00 -0.13 0.00 0.00 59.36 59.58 3has h GLU 166 Cb 1.45 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 30.68 3has h GLU 166 CO -0.22 0.76 -0.10 0.28 -0.73 0.00 0.00 179.01 178.99 3has h VAL 167 N 0.86 1.35 -0.65 0.32 2.07 -1.48 -2.19 116.25 116.52 3has h VAL 167 Ca 0.21 -1.24 0.06 0.00 0.82 0.00 0.00 66.70 66.55 3has h VAL 167 Cb 0.17 1.92 -0.06 0.00 -1.52 0.00 0.00 31.29 31.80 3has h VAL 167 CO -0.02 0.36 0.36 0.00 0.02 0.00 0.00 177.57 178.28 3has h ALA 168 N 0.60 0.87 -0.60 1.67 0.00 -1.00 0.49 119.26 121.29 3has h ALA 168 Ca 0.02 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 3has h ALA 168 Cb 0.61 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 3has h ALA 168 CO 0.03 0.02 0.07 0.77 0.00 0.00 0.00 179.25 180.14 3has h SER 169 N 0.66 0.98 -0.46 0.00 0.02 -0.54 -0.41 113.55 113.79 3has h SER 169 Ca 0.30 -0.27 -0.08 0.00 -0.84 0.00 0.00 61.79 60.90 3has h SER 169 Cb 0.20 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.46 3has h SER 169 CO -0.19 1.01 -0.01 0.74 -1.14 0.00 0.00 176.83 177.24 3has h THR 170 N 0.92 1.26 -0.53 -2.27 2.02 -1.04 -2.40 112.91 110.88 3has h THR 170 Ca 0.18 -1.07 0.05 0.00 0.77 0.00 0.00 66.41 66.34 3has h THR 170 Cb 0.46 1.03 -0.05 0.00 -1.74 0.00 0.00 68.15 67.85 3has h THR 170 CO 0.02 0.37 0.26 0.15 0.37 0.00 0.00 175.52 176.68 3has h PHE 171 N 0.68 0.47 -0.68 3.16 3.57 -0.62 -2.10 116.94 121.42 3has h PHE 171 Ca 0.13 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.60 3has h PHE 171 Cb 0.52 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 39.09 3has h PHE 171 CO 0.04 0.21 0.22 0.87 -2.23 0.00 0.00 178.31 177.42 3has h LYS 172 N 0.49 1.03 -0.01 1.11 1.57 -0.72 0.44 116.57 120.49 3has h LYS 172 Ca 0.24 -0.20 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 3has h LYS 172 Cb 0.17 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.32 3has h LYS 172 CO -0.18 0.88 0.00 0.28 -0.57 0.00 0.00 179.45 179.86 3has h VAL 173 N 1.00 1.08 -0.85 0.50 2.07 -1.12 -0.86 116.25 118.07 3has h VAL 173 Ca 0.22 -0.22 -0.02 0.00 0.82 0.00 0.00 66.70 67.49 3has h VAL 173 Cb 0.27 1.21 -0.04 0.00 -1.52 0.00 0.00 31.29 31.22 3has h VAL 173 CO -0.01 0.06 0.44 -0.07 0.02 0.00 0.00 177.57 178.01 3has h LEU 174 N -0.08 1.08 -0.48 2.57 3.38 -0.95 -1.33 115.31 119.50 3has h LEU 174 Ca 0.00 -0.12 0.01 0.00 0.09 0.00 0.00 57.88 57.87 3has h LEU 174 Cb 0.09 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 3has h LEU 174 CO -0.00 0.89 0.30 -0.09 0.09 0.00 0.00 178.44 179.63 3has h ARG 175 N 1.19 0.59 -0.57 1.13 2.43 0.02 -1.19 114.38 117.98 3has h ARG 175 Ca 0.29 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.34 3has h ARG 175 Cb 0.07 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 3has h ARG 175 CO -0.04 0.39 -0.00 -0.91 -1.51 0.00 0.00 179.97 177.89 3has h ASN 176 N 0.61 0.98 -0.60 -3.80 4.21 -0.82 0.20 115.58 116.36 3has h ASN 176 Ca 0.18 -0.31 -0.01 0.00 1.21 0.00 0.00 56.30 57.37 3has h ASN 176 Cb -0.03 -0.26 -0.03 0.00 -1.12 0.00 0.00 38.32 36.88 3has h ASN 176 CO -0.06 1.05 0.33 0.58 -1.29 0.00 0.00 177.43 178.04 3has h VAL 177 N 0.89 1.20 -0.00 2.81 2.07 -1.13 -1.87 116.25 120.21 3has h VAL 177 Ca 0.16 -0.50 -0.00 0.00 0.82 0.00 0.00 66.70 67.18 3has h VAL 177 Cb 0.55 0.42 -0.00 0.00 -1.52 0.00 0.00 31.29 30.74 3has h VAL 177 CO 0.03 0.21 0.00 0.74 0.02 0.00 0.00 177.57 178.58 3has h THR 178 N 0.82 1.14 0.02 2.57 2.02 -0.87 -0.84 112.91 117.77 3has h THR 178 Ca 0.21 -0.40 0.01 0.00 0.77 0.00 0.00 66.41 67.00 3has h THR 178 Cb 0.05 1.40 -0.01 0.00 -1.74 0.00 0.00 68.15 67.85 3has h THR 178 CO -0.03 0.10 -0.04 0.58 0.37 0.00 0.00 175.52 176.50 3has h VAL 179 N -0.16 0.90 -0.06 3.16 2.07 -0.87 0.59 116.25 121.88 3has h VAL 179 Ca 0.00 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 3has h VAL 179 Cb 0.17 0.90 -0.00 0.00 -1.52 0.00 0.00 31.29 30.83 3has h VAL 179 CO -0.00 0.00 0.03 0.58 0.02 0.00 0.00 177.57 178.20 3has h VAL 180 N -0.08 1.08 -0.14 2.57 2.07 -1.31 -2.31 116.25 118.13 3has h VAL 180 Ca 0.01 -0.21 -0.06 0.00 0.82 0.00 0.00 66.70 67.26 3has h VAL 180 Cb 0.09 1.11 -0.00 0.00 -1.52 0.00 0.00 31.29 30.98 3has h VAL 180 CO -0.03 0.06 -0.15 -0.07 0.02 0.00 0.00 177.57 177.40 3has h LEU 181 N 0.01 0.37 -1.20 2.57 3.38 -1.07 -3.24 115.31 116.12 3has h LEU 181 Ca 0.02 -0.49 -0.06 0.00 0.09 0.00 0.00 57.88 57.44 3has h LEU 181 Cb 0.07 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 3has h LEU 181 CO -0.00 0.79 -0.04 -0.50 0.09 0.00 0.00 178.44 178.77 3has h TRP 182 N -0.05 0.52 0.00 1.13 4.06 -0.91 -2.28 115.95 118.43 3has h TRP 182 Ca 0.02 -0.06 0.00 0.00 2.06 0.00 0.00 58.89 60.91 3has h TRP 182 Cb 0.69 -0.15 0.00 0.00 -1.00 0.00 0.00 29.16 28.70 3has h TRP 182 CO 0.09 0.55 0.00 0.66 -3.56 0.00 0.00 178.44 176.17 3has h SER 183 N 0.48 0.00 0.68 -3.49 4.64 -1.46 -2.60 113.55 111.80 3has h SER 183 Ca 0.10 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.22 3has h SER 183 Cb 0.38 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.45 3has h SER 183 CO 0.02 0.00 -0.90 0.00 -0.87 0.00 0.00 176.83 175.08 3has h ALA 184 N 2.14 0.50 -0.37 5.18 0.00 -1.43 -3.37 119.26 121.92 3has h ALA 184 Ca 0.00 -0.76 0.06 0.00 0.00 0.00 0.00 54.91 54.22 3has h ALA 184 Cb 0.47 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.12 3has h ALA 184 CO 0.00 0.98 0.02 1.88 0.00 0.00 0.00 179.25 182.13 3has h TYR 185 N 0.07 0.02 -0.19 0.00 -1.99 -1.52 -1.25 116.97 112.12 3has h TYR 185 Ca -0.04 0.03 -0.01 0.00 2.00 0.00 0.00 58.73 60.71 3has h TYR 185 Cb 1.55 0.05 -0.01 0.00 2.00 0.00 0.00 36.73 40.31 3has h TYR 185 CO 0.02 -0.04 0.08 -1.00 -0.00 0.00 0.00 178.16 177.22 3has h PRO 186 N 0.13 0.26 -0.16 4.88 0.13 -1.74 -1.55 132.00 133.95 3has h PRO 186 Ca 0.18 -0.02 -0.11 0.00 -0.87 0.00 0.00 66.00 65.18 3has h PRO 186 Cb 0.24 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.32 3has h PRO 186 CO -0.28 0.22 -0.32 0.28 -0.23 0.00 0.00 178.00 177.67 3has h VAL 187 N 0.27 1.35 -0.88 1.56 2.07 -1.54 -1.06 116.25 118.02 3has h VAL 187 Ca 0.07 -1.57 0.03 0.00 0.82 0.00 0.00 66.70 66.04 3has h VAL 187 Cb 0.05 1.96 -0.05 0.00 -1.52 0.00 0.00 31.29 31.73 3has h VAL 187 CO -0.01 0.48 0.57 0.58 0.02 0.00 0.00 177.57 179.21 3has h VAL 188 N 0.14 1.17 -0.27 2.57 2.07 -0.96 -2.18 116.25 118.79 3has h VAL 188 Ca 0.01 -0.39 -0.01 0.00 0.82 0.00 0.00 66.70 67.13 3has h VAL 188 Cb 0.92 -0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 3has h VAL 188 CO 0.07 0.21 0.12 -0.25 0.02 0.00 0.00 177.57 177.74 3has h TRP 189 N 1.13 0.40 -0.93 1.57 7.01 -1.21 -0.60 115.95 123.32 3has h TRP 189 Ca 0.34 -0.02 0.04 0.00 2.11 0.00 0.00 58.89 61.36 3has h TRP 189 Cb -0.03 -0.12 -0.06 0.00 -2.10 0.00 0.00 29.16 26.85 3has h TRP 189 CO -0.02 0.38 0.60 1.25 -2.79 0.00 0.00 178.44 177.87 3has h LEU 190 N 0.30 0.99 0.00 0.65 5.85 -0.86 -2.60 115.31 119.63 3has h LEU 190 Ca 0.09 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.81 3has h LEU 190 Cb 0.14 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 40.96 3has h LEU 190 CO -0.01 0.67 -0.93 2.30 -0.34 0.00 0.00 178.44 180.13 3has n ILE 191 N -4.51 0.03 -1.51 4.05 -5.35 -0.85 0.08 119.36 111.30 3has n ILE 191 Ca 0.13 -0.07 0.00 0.00 -0.27 0.00 0.00 62.75 62.54 3has n ILE 191 Cb 0.12 0.62 0.00 0.00 -1.74 0.00 0.00 39.64 38.63 3has n ILE 191 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3has n GLY 192 N 1.46 1.52 0.30 3.28 0.00 -0.24 -1.26 105.19 110.26 3has n GLY 192 Ca 0.04 -1.95 0.11 0.00 0.00 0.00 0.00 46.02 44.22 3has n GLY 192 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3has h SER 193 N 0.00 0.08 1.78 1.61 0.02 -1.81 0.12 113.55 115.35 3has h SER 193 Ca 0.00 -0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 3has h SER 193 Cb 0.00 -0.02 -0.00 0.00 0.14 0.00 0.00 62.40 62.52 3has h SER 193 CO 0.00 0.06 -0.22 -0.33 -1.14 0.00 0.00 176.83 175.19 3has h GLU 194 N 0.10 0.00 0.00 3.45 3.07 -1.89 -3.43 114.58 115.88 3has h GLU 194 Ca 0.10 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.96 3has h GLU 194 Cb 0.29 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.20 3has h GLU 194 CO -0.01 0.07 0.00 0.41 -1.40 0.00 0.00 179.01 178.08 3has n GLY 195 N 1.13 1.29 0.22 -3.84 0.00 -0.38 -4.90 105.19 98.70 3has n GLY 195 Ca 0.03 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.20 3has n GLY 195 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3has h ALA 196 N 0.68 1.00 -1.12 4.61 0.00 -0.28 -3.47 119.26 120.67 3has h ALA 196 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.69 3has h ALA 196 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 3has h ALA 196 CO 0.00 0.00 -0.25 0.41 0.00 0.00 0.00 179.25 179.41 3has n GLY 197 N 0.28 0.46 0.07 0.00 0.00 0.26 -4.94 105.19 101.32 3has n GLY 197 Ca 0.02 -0.47 -0.14 0.00 0.00 0.00 0.00 46.02 45.42 3has n GLY 197 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3has h ILE 198 N 0.00 1.78 -3.43 -0.61 2.04 -1.40 -3.44 117.51 112.45 3has h ILE 198 Ca -0.24 -2.36 -0.60 0.00 1.00 0.00 0.00 64.86 62.66 3has h ILE 198 Cb 0.99 3.38 -0.10 0.00 -0.74 0.00 0.00 36.82 40.35 3has h ILE 198 CO 0.31 0.61 0.14 -0.69 0.00 0.00 0.00 178.15 178.53 3has s VAL 199 N -2.23 5.00 0.78 1.67 1.01 -0.39 -5.02 120.40 121.23 3has s VAL 199 Ca -0.19 1.18 -0.13 0.00 0.00 0.00 0.00 61.98 62.84 3has s VAL 199 Cb -0.03 -3.95 0.07 0.00 0.00 0.00 0.00 36.38 32.47 3has s VAL 199 CO 0.70 0.08 1.18 -2.16 0.00 0.00 0.00 175.10 174.89 3has s PRO 200 N 2.13 1.87 0.28 2.72 0.04 -1.26 -3.78 135.00 137.00 3has s PRO 200 Ca 0.28 1.64 -0.01 0.00 0.04 0.00 0.00 61.00 62.96 3has s PRO 200 Cb -0.16 -1.81 0.47 0.00 0.04 0.00 0.00 34.50 33.04 3has s PRO 200 CO 0.10 -2.01 1.87 1.25 0.04 0.00 0.00 177.00 178.25 3has h LEU 201 N -0.77 0.99 -0.53 -3.56 5.85 -1.97 -0.29 115.31 115.03 3has h LEU 201 Ca -0.46 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.31 3has h LEU 201 Cb 1.28 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 42.09 3has h LEU 201 CO 0.48 0.60 0.32 -0.55 -0.34 0.00 0.00 178.44 178.95 3has h ASN 202 N 1.10 0.51 -0.25 1.25 -1.07 -1.92 -0.13 115.58 115.07 3has h ASN 202 Ca 0.44 0.01 -0.20 0.00 0.07 0.00 0.00 56.30 56.62 3has h ASN 202 Cb 0.26 -0.10 0.00 0.00 -2.07 0.00 0.00 38.32 36.42 3has h ASN 202 CO -0.19 0.36 -0.61 0.40 0.07 0.00 0.00 177.43 177.45 3has h ILE 203 N 0.63 1.27 -0.89 6.14 1.08 -1.72 -2.32 117.51 121.70 3has h ILE 203 Ca 0.22 -1.80 0.06 0.00 -0.39 0.00 0.00 64.86 62.95 3has h ILE 203 Cb 0.03 1.74 -0.06 0.00 -3.07 0.00 0.00 36.82 35.46 3has h ILE 203 CO -0.10 0.58 0.56 -0.08 -0.69 0.00 0.00 178.15 178.42 3has h GLU 204 N 0.63 0.99 -0.51 2.37 4.81 -0.91 0.07 114.58 122.02 3has h GLU 204 Ca -0.01 -0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 59.12 3has h GLU 204 Cb 1.23 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 30.37 3has h GLU 204 CO 0.13 0.66 0.13 1.15 -0.73 0.00 0.00 179.01 180.35 3has h THR 205 N 1.02 1.24 -0.30 0.32 2.02 -0.89 -0.12 112.91 116.20 3has h THR 205 Ca 0.38 -0.83 0.07 0.00 0.77 0.00 0.00 66.41 66.80 3has h THR 205 Cb 0.16 0.81 -0.07 0.00 -1.74 0.00 0.00 68.15 67.31 3has h THR 205 CO -0.17 0.30 -0.15 0.25 0.37 0.00 0.00 175.52 176.12 3has h LEU 206 N 0.70 -0.51 0.04 2.58 5.85 -0.96 -0.17 115.31 122.84 3has h LEU 206 Ca 0.16 0.12 0.00 0.00 0.84 0.00 0.00 57.88 59.00 3has h LEU 206 Cb 0.32 0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 3has h LEU 206 CO -0.00 -0.19 -0.04 -0.07 -0.34 0.00 0.00 178.44 177.80 3has h LEU 207 N -0.11 -0.11 -1.50 2.25 3.38 -0.53 -1.31 115.31 117.39 3has h LEU 207 Ca 0.15 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 3has h LEU 207 Cb 0.35 0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 3has h LEU 207 CO -0.37 -0.07 0.14 -0.26 0.09 0.00 0.00 178.44 177.97 3has h PHE 208 N -0.09 0.46 -0.12 1.13 0.04 -0.96 -1.26 116.94 116.14 3has h PHE 208 Ca 0.01 -0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 3has h PHE 208 Cb 0.09 -0.15 -0.01 0.00 2.20 0.00 0.00 35.95 38.09 3has h PHE 208 CO -0.10 0.37 0.05 1.98 -0.60 0.00 0.00 178.31 180.00 3has h MET 209 N 0.47 0.18 -0.30 1.51 4.05 -0.57 0.24 114.93 120.51 3has h MET 209 Ca 0.12 -0.03 -0.01 0.00 -0.28 0.00 0.00 59.70 59.50 3has h MET 209 Cb 0.10 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 30.85 3has h MET 209 CO -0.01 0.29 0.16 0.28 0.23 0.00 0.00 176.91 177.86 3has h VAL 210 N 0.03 1.13 -0.05 -5.77 2.07 -0.99 -0.12 116.25 112.55 3has h VAL 210 Ca 0.04 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.23 3has h VAL 210 Cb 0.18 0.81 -0.00 0.00 -1.52 0.00 0.00 31.29 30.75 3has h VAL 210 CO -0.00 0.13 0.03 -0.07 0.02 0.00 0.00 177.57 177.67 3has h LEU 211 N 0.36 0.06 0.24 2.57 3.38 -1.13 -1.78 115.31 119.00 3has h LEU 211 Ca 0.10 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 3has h LEU 211 Cb 0.06 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.80 3has h LEU 211 CO -0.02 0.07 -0.11 0.44 0.09 0.00 0.00 178.44 178.91 3has h ASP 212 N 0.04 -0.27 -0.48 -0.43 3.32 -0.30 0.27 116.42 118.57 3has h ASP 212 Ca 0.02 -0.03 0.04 0.00 0.02 0.00 0.00 57.03 57.08 3has h ASP 212 Cb 0.02 0.07 -0.04 0.00 0.22 0.00 0.00 39.33 39.60 3has h ASP 212 CO -0.00 -0.15 0.23 0.58 -1.72 0.00 0.00 179.24 178.18 3has h VAL 213 N -0.37 0.94 -0.85 -1.35 2.07 -1.03 -1.43 116.25 114.23 3has h VAL 213 Ca -0.03 -0.16 -0.02 0.00 0.82 0.00 0.00 66.70 67.31 3has h VAL 213 Cb 0.29 0.45 -0.04 0.00 -1.52 0.00 0.00 31.29 30.46 3has h VAL 213 CO 0.05 0.08 0.43 0.28 0.02 0.00 0.00 177.57 178.44 3has h SER 214 N 0.46 1.08 1.76 0.57 0.02 -1.16 0.12 113.55 116.39 3has h SER 214 Ca 0.21 -0.11 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 3has h SER 214 Cb 0.13 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.40 3has h SER 214 CO -0.16 0.89 0.00 0.00 -1.14 0.00 0.00 176.83 176.42 3has h ALA 215 N 1.28 1.00 0.00 3.77 0.00 -0.49 -1.37 119.26 123.44 3has h ALA 215 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.20 3has h ALA 215 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3has h ALA 215 CO -0.04 0.00 -0.34 1.63 0.00 0.00 0.00 179.25 180.50 3has n LYS 216 N -3.04 0.18 0.02 0.00 5.02 -0.58 -4.38 118.16 115.38 3has n LYS 216 Ca 0.03 0.07 -0.19 0.00 -2.02 0.00 0.00 58.31 56.21 3has n LYS 216 Cb 0.47 -0.76 -0.10 0.00 -0.02 0.00 0.00 35.03 34.62 3has n LYS 216 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3has h VAL 217 N -0.34 1.33 0.18 -0.18 2.07 -0.99 -0.74 116.25 117.59 3has h VAL 217 Ca 0.00 -2.12 -0.01 0.00 0.82 0.00 0.00 66.70 65.39 3has h VAL 217 Cb 0.34 2.39 0.00 0.00 -1.52 0.00 0.00 31.29 32.50 3has h VAL 217 CO 0.00 0.65 -0.09 1.23 0.02 0.00 0.00 177.57 179.38 3has h GLY 218 N 0.23 -0.25 0.23 2.17 0.00 -0.95 0.00 103.07 104.50 3has h GLY 218 Ca -0.10 0.09 0.08 0.00 0.00 0.00 0.00 47.33 47.41 3has h GLY 218 CO 0.16 -0.09 -0.05 -2.75 0.00 0.00 0.00 176.54 173.81 3has h PHE 219 N -0.34 -0.13 -0.66 5.60 3.04 -1.35 -2.22 116.94 120.89 3has h PHE 219 Ca -0.02 0.03 -0.00 0.00 3.98 0.00 0.00 57.97 61.96 3has h PHE 219 Cb 0.26 0.12 -0.03 0.00 2.56 0.00 0.00 35.95 38.86 3has h PHE 219 CO -0.04 -0.14 0.41 0.78 -2.02 0.00 0.00 178.31 177.30 3has h GLY 220 N 0.05 0.95 0.83 2.40 0.00 -0.92 -1.23 103.07 105.15 3has h GLY 220 Ca 0.21 -0.39 0.03 0.00 0.00 0.00 0.00 47.33 47.18 3has h GLY 220 CO -0.39 0.38 0.24 1.41 0.00 0.00 0.00 176.54 178.17 3has h LEU 221 N 0.90 0.37 0.06 3.11 3.38 -0.70 0.20 115.31 122.62 3has h LEU 221 Ca 0.24 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.22 3has h LEU 221 Cb -0.04 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.65 3has h LEU 221 CO -0.05 0.26 -0.03 0.40 0.09 0.00 0.00 178.44 179.12 3has h ILE 222 N 0.48 0.94 -0.08 1.22 2.04 -1.12 -2.41 117.51 118.58 3has h ILE 222 Ca 0.19 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.03 3has h ILE 222 Cb 0.06 0.94 -0.00 0.00 -0.74 0.00 0.00 36.82 37.08 3has h ILE 222 CO -0.11 0.00 -0.01 0.25 0.00 0.00 0.00 178.15 178.28 3has h LEU 223 N -0.08 0.15 -0.08 1.44 5.85 -1.01 -3.23 115.31 118.36 3has h LEU 223 Ca -0.01 -0.35 0.00 0.00 0.84 0.00 0.00 57.88 58.36 3has h LEU 223 Cb 0.06 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.05 3has h LEU 223 CO 0.01 0.47 0.00 0.18 -0.34 0.00 0.00 178.44 178.77 3has n LEU 224 N -4.81 0.38 0.00 2.25 4.77 0.69 -1.92 117.00 118.37 3has n LEU 224 Ca -0.07 0.55 0.12 0.00 -0.03 0.00 0.00 56.01 56.59 3has n LEU 224 Cb 0.22 -0.44 0.32 0.00 -2.33 0.00 0.00 43.42 41.19 3has n LEU 224 CO 0.35 -0.16 0.55 0.54 -1.33 0.00 0.00 177.39 177.34 3has n ARG 225 N -1.87 0.01 -3.05 3.23 1.74 -0.91 -4.96 116.66 110.85 3has n ARG 225 Ca 0.06 0.00 -0.31 0.00 -0.77 0.00 0.00 57.85 56.83 3has n ARG 225 Cb 0.34 -1.51 -0.05 0.00 -1.02 0.00 0.00 32.46 30.23 3has n ARG 225 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 3has s SER 226 N -3.05 6.64 0.06 0.55 0.15 -0.81 -4.95 113.70 112.28 3has s SER 226 Ca 0.11 1.16 0.23 0.00 0.70 0.00 0.00 55.95 58.15 3has s SER 226 Cb 0.18 -2.33 0.92 0.00 -1.71 0.00 0.00 66.02 63.08 3has s SER 226 CO 0.67 -0.28 1.71 0.54 1.20 0.00 0.00 173.24 177.08 3has n ARG 227 N -0.78 0.06 0.28 5.44 1.74 -1.26 -3.79 116.66 118.35 3has n ARG 227 Ca 0.03 0.17 0.14 0.00 -0.77 0.00 0.00 57.85 57.42 3has n ARG 227 Cb 0.53 -1.58 0.85 0.00 -1.02 0.00 0.00 32.46 31.24 3has n ARG 227 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3has h ALA 228 N 2.66 1.38 0.00 7.54 0.00 -1.88 -2.48 119.26 126.48 3has h ALA 228 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3has h ALA 228 Cb 0.42 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3has h ALA 228 CO 0.00 0.07 -0.09 0.44 0.00 0.00 0.00 179.25 179.66 3has n ILE 229 N -3.70 0.06 -3.02 0.00 -5.35 -1.25 -4.88 119.36 101.21 3has n ILE 229 Ca -0.02 -0.03 -0.38 0.00 -0.27 0.00 0.00 62.75 62.05 3has n ILE 229 Cb 0.16 -0.38 -0.06 0.00 -1.74 0.00 0.00 39.64 37.62 3has n ILE 229 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 3has s PHE 230 N -3.01 3.80 -2.91 4.28 0.40 -0.93 -2.19 117.98 117.42 3has s PHE 230 Ca 0.13 1.55 0.25 0.00 -0.60 0.00 0.00 56.93 58.25 3has s PHE 230 Cb 0.18 -2.71 0.35 0.00 0.51 0.00 0.00 43.02 41.34 3has s PHE 230 CO 0.57 0.44 1.35 0.41 0.70 0.00 0.00 175.22 178.68