#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hct n TRP 46 N 0.00 0.00 -4.03 -0.14 2.14 -1.26 -4.89 117.44 109.26 2hct n TRP 46 Ca 0.00 0.00 -0.35 0.00 2.07 0.00 0.00 57.50 59.22 2hct n TRP 46 Cb 0.00 -0.21 -0.07 0.00 -0.81 0.00 0.00 31.31 30.22 2hct n TRP 46 CO 0.00 0.00 0.00 1.03 2.07 0.00 0.00 177.69 180.79 2hct s ARG 47 N -2.56 3.26 0.06 -2.67 0.52 -1.26 -5.11 118.95 111.20 2hct s ARG 47 Ca 0.26 -0.31 0.08 0.00 -0.52 0.00 0.00 55.73 55.25 2hct s ARG 47 Cb 0.20 -3.02 -0.03 0.00 0.52 0.00 0.00 34.95 32.62 2hct s ARG 47 CO 0.49 0.71 -0.21 -0.65 0.02 0.00 0.00 175.30 175.67 2hct s GLN 48 N -1.38 1.90 0.12 3.54 -0.21 -1.26 -5.04 119.66 117.33 2hct s GLN 48 Ca 0.19 -1.07 -0.11 0.00 0.02 0.00 0.00 55.36 54.39 2hct s GLN 48 Cb -0.12 -2.10 -0.12 0.00 1.00 0.00 0.00 33.01 31.67 2hct s GLN 48 CO 0.09 0.52 1.33 1.15 -2.12 0.00 0.00 175.29 176.26 2hct h THR 49 N 3.95 1.29 -2.48 -0.19 2.02 -1.96 -3.47 112.91 112.07 2hct h THR 49 Ca -0.48 -1.99 -0.53 0.00 0.77 0.00 0.00 66.41 64.18 2hct h THR 49 Cb 1.16 1.99 -0.14 0.00 -1.74 0.00 0.00 68.15 69.42 2hct h THR 49 CO 0.46 0.63 -0.70 0.26 0.37 0.00 0.00 175.52 176.53 2hct s TRP 50 N -3.74 2.05 -0.17 3.16 0.52 -1.26 -5.04 118.94 114.46 2hct s TRP 50 Ca -0.09 -0.58 0.17 0.00 0.02 0.00 0.00 56.10 55.61 2hct s TRP 50 Cb 0.09 -1.09 -0.02 0.00 -1.15 0.00 0.00 33.47 31.30 2hct s TRP 50 CO 0.90 0.42 1.14 0.77 0.02 0.00 0.00 176.95 180.19 2hct h SER 51 N 2.28 0.00 -3.32 2.95 0.02 -1.92 -3.43 113.55 110.13 2hct h SER 51 Ca -0.40 0.00 -0.48 0.00 -0.84 0.00 0.00 61.79 60.07 2hct h SER 51 Cb 1.24 0.00 0.04 0.00 0.14 0.00 0.00 62.40 63.82 2hct h SER 51 CO 0.66 0.45 0.05 -0.83 -1.14 0.00 0.00 176.83 176.02 2hct s GLY 52 N -4.58 1.53 0.64 -3.77 0.00 -0.32 -4.85 107.32 95.96 2hct s GLY 52 Ca 0.01 -0.74 -0.18 0.00 0.00 0.00 0.00 44.72 43.80 2hct s GLY 52 CO 0.78 -0.55 1.26 -1.05 0.00 0.00 0.00 173.10 173.54 2hct n PRO 53 N -2.27 1.13 -1.21 2.90 -0.02 -1.26 -1.90 135.00 132.38 2hct n PRO 53 Ca 0.01 0.44 -0.23 0.00 -2.02 0.00 0.00 63.50 61.71 2hct n PRO 53 Cb 0.57 -2.49 0.17 0.00 -0.02 0.00 0.00 33.50 31.73 2hct n PRO 53 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2hct n GLY 54 N 0.96 -1.90 3.71 -1.23 0.00 -1.23 -2.39 105.19 103.10 2hct n GLY 54 Ca 0.15 -1.62 -0.43 0.00 0.00 0.00 0.00 46.02 44.12 2hct n GLY 54 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2hct n THR 55 N -3.75 0.57 -1.62 2.61 -1.04 -0.61 -4.66 114.28 105.78 2hct n THR 55 Ca 0.12 -0.14 -0.45 0.00 -2.04 0.00 0.00 64.05 61.54 2hct n THR 55 Cb 0.45 -1.76 -0.02 0.00 -1.82 0.00 0.00 70.33 67.17 2hct n THR 55 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 2hct n THR 56 N 2.75 1.53 -1.84 12.58 -1.04 -0.43 -4.71 114.28 123.12 2hct n THR 56 Ca 0.13 -0.38 -0.40 0.00 -2.04 0.00 0.00 64.05 61.35 2hct n THR 56 Cb 0.33 -1.16 0.01 0.00 -1.82 0.00 0.00 70.33 67.69 2hct n THR 56 CO 0.00 0.00 0.00 -1.59 -0.64 0.00 0.00 175.07 172.84 2hct s LYS 57 N -1.10 3.80 -1.47 -2.82 -2.85 -1.26 -2.41 119.74 111.62 2hct s LYS 57 Ca 0.63 2.40 -0.00 0.00 -1.00 0.00 0.00 55.97 58.00 2hct s LYS 57 Cb -0.70 -2.72 0.00 0.00 -2.06 0.00 0.00 37.83 32.35 2hct s LYS 57 CO 0.56 -0.72 0.06 0.54 0.10 0.00 0.00 175.35 175.89 2hct n ARG 58 N -0.04 -1.73 -0.10 1.78 1.74 -1.26 -4.91 116.66 112.15 2hct n ARG 58 Ca 0.04 0.84 -0.06 0.00 -0.77 0.00 0.00 57.85 57.90 2hct n ARG 58 Cb 0.42 -5.32 0.01 0.00 -1.02 0.00 0.00 32.46 26.54 2hct n ARG 58 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 2hct h PHE 59 N -0.14 -0.30 0.05 -1.55 3.57 -1.84 0.19 116.94 116.91 2hct h PHE 59 Ca -0.42 0.04 0.01 0.00 3.53 0.00 0.00 57.97 61.13 2hct h PHE 59 Cb 1.31 0.19 -0.02 0.00 2.79 0.00 0.00 35.95 40.22 2hct h PHE 59 CO 0.46 -0.20 -0.11 -1.35 -2.23 0.00 0.00 178.31 174.88 2hct h PRO 60 N -0.06 -0.20 -0.58 6.41 0.11 -1.91 -0.29 132.00 135.49 2hct h PRO 60 Ca 0.18 0.01 0.01 0.00 0.11 0.00 0.00 66.00 66.30 2hct h PRO 60 Cb 0.32 0.04 -0.03 0.00 0.11 0.00 0.00 31.00 31.45 2hct h PRO 60 CO -0.40 -0.13 0.38 0.93 -0.21 0.00 0.00 178.00 178.58 2hct h GLU 61 N -0.20 0.77 -0.15 1.05 3.07 -1.86 -2.24 114.58 115.01 2hct h GLU 61 Ca 0.02 -0.05 -0.03 0.00 -0.50 0.00 0.00 59.36 58.81 2hct h GLU 61 Cb 0.23 -0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 27.96 2hct h GLU 61 CO -0.07 0.51 -0.01 1.15 -1.40 0.00 0.00 179.01 179.19 2hct h THR 62 N 0.79 1.26 -0.35 1.13 2.02 -0.06 -0.89 112.91 116.81 2hct h THR 62 Ca 0.21 -0.87 -0.02 0.00 0.77 0.00 0.00 66.41 66.51 2hct h THR 62 Cb -0.09 1.54 -0.02 0.00 -1.74 0.00 0.00 68.15 67.85 2hct h THR 62 CO -0.05 0.25 0.13 0.58 0.37 0.00 0.00 175.52 176.81 2hct h VAL 63 N -0.00 1.19 -0.53 3.16 2.07 -0.87 -0.99 116.25 120.28 2hct h VAL 63 Ca 0.04 -0.60 -0.02 0.00 0.82 0.00 0.00 66.70 66.95 2hct h VAL 63 Cb 0.39 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 31.07 2hct h VAL 63 CO 0.01 0.21 0.26 0.25 0.02 0.00 0.00 177.57 178.32 2hct h LEU 64 N 0.42 0.70 -1.45 2.57 5.85 -1.41 -1.19 115.31 120.78 2hct h LEU 64 Ca 0.12 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.68 2hct h LEU 64 Cb 0.20 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 2hct h LEU 64 CO -0.01 0.63 0.09 0.00 -0.34 0.00 0.00 178.44 178.81 2hct h ALA 65 N 1.10 1.57 -0.18 1.25 0.00 -0.94 -1.10 119.26 120.96 2hct h ALA 65 Ca 0.18 -0.12 -0.21 0.00 0.00 0.00 0.00 54.91 54.76 2hct h ALA 65 Cb 0.12 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 17.78 2hct h ALA 65 CO -0.02 0.33 -0.72 0.00 0.00 0.00 0.00 179.25 178.83 2hct h ARG 66 N 0.45 0.77 0.09 0.00 3.08 -0.82 -0.88 114.38 117.08 2hct h ARG 66 Ca 0.11 -0.59 -0.00 0.00 0.07 0.00 0.00 59.98 59.56 2hct h ARG 66 Cb 0.15 0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.32 2hct h ARG 66 CO -0.01 1.21 -0.04 0.00 -1.07 0.00 0.00 179.97 180.06 2hct h VAL 68 N -0.15 0.79 -0.38 0.00 2.07 -1.13 -2.07 116.25 115.37 2hct h VAL 68 Ca -0.01 -0.02 -0.04 0.00 0.82 0.00 0.00 66.70 67.45 2hct h VAL 68 Cb 0.12 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 30.58 2hct h VAL 68 CO 0.02 0.01 0.09 0.50 0.02 0.00 0.00 177.57 178.22 2hct h LYS 69 N 0.07 0.62 -0.51 1.57 3.64 -1.02 -2.16 116.57 118.78 2hct h LYS 69 Ca 0.13 -0.15 0.07 0.00 -1.27 0.00 0.00 60.65 59.43 2hct h LYS 69 Cb 0.18 -0.08 -0.06 0.00 -0.41 0.00 0.00 32.23 31.86 2hct h LYS 69 CO -0.23 0.65 0.19 -0.92 -2.27 0.00 0.00 179.45 176.86 2hct h TYR 70 N 0.48 0.33 -0.00 1.91 3.20 -0.60 0.87 116.97 123.15 2hct h TYR 70 Ca 0.12 0.02 -0.12 0.00 3.14 0.00 0.00 58.73 61.89 2hct h TYR 70 Cb 0.31 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.49 2hct h TYR 70 CO 0.02 0.11 -0.59 1.79 -1.64 0.00 0.00 178.16 177.86 2hct h THR 71 N 0.37 1.42 0.12 1.81 1.35 -1.32 0.55 112.91 117.21 2hct h THR 71 Ca 0.24 -2.01 -0.01 0.00 -0.55 0.00 0.00 66.41 64.09 2hct h THR 71 Cb 0.25 2.08 0.00 0.00 -1.73 0.00 0.00 68.15 68.75 2hct h THR 71 CO -0.24 0.57 -0.06 -0.33 -0.25 0.00 0.00 175.52 175.22 2hct h GLU 72 N 0.00 -0.15 -0.47 4.72 5.08 -0.77 -3.23 114.58 119.75 2hct h GLU 72 Ca -0.01 0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 58.26 2hct h GLU 72 Cb 1.04 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.31 2hct h GLU 72 CO 0.08 -0.00 -0.11 0.82 -1.00 0.00 0.00 179.01 178.79 2hct h ILE 73 N -0.27 1.26 -3.48 3.13 2.04 -0.54 -3.39 117.51 116.26 2hct h ILE 73 Ca -0.02 -1.21 -0.70 0.00 1.00 0.00 0.00 64.86 63.94 2hct h ILE 73 Cb 0.22 1.01 -0.34 0.00 -0.74 0.00 0.00 36.82 36.97 2hct h ILE 73 CO 0.03 0.42 -0.51 -1.00 0.00 0.00 0.00 178.15 177.09 2hct s HIS 74 N -4.81 3.55 0.53 1.37 3.76 0.19 -4.97 115.29 114.91 2hct s HIS 74 Ca -0.10 -2.45 0.19 0.00 -0.15 0.00 0.00 55.06 52.55 2hct s HIS 74 Cb 0.14 -3.24 1.34 0.00 1.11 0.00 0.00 32.58 31.93 2hct s HIS 74 CO 0.84 -0.95 2.13 -1.35 -0.85 0.00 0.00 174.74 174.56 2hct h PRO 75 N 7.89 0.00 0.00 8.40 0.11 -1.76 -2.39 132.00 144.24 2hct h PRO 75 Ca -0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.00 2hct h PRO 75 Cb 1.03 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.14 2hct h PRO 75 CO 0.71 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.65 2hct n GLU 76 N -4.45 0.16 -0.57 1.05 0.00 -1.26 -2.53 120.64 113.05 2hct n GLU 76 Ca -0.01 0.39 0.09 0.00 0.00 0.00 0.00 57.16 57.63 2hct n GLU 76 Cb 0.18 -1.80 0.33 0.00 0.00 0.00 0.00 31.44 30.15 2hct n GLU 76 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 2hct n MET 77 N -2.09 3.62 0.00 3.44 2.81 -0.90 -4.57 117.12 119.43 2hct n MET 77 Ca 0.02 -2.82 0.13 0.00 -1.81 0.00 0.00 57.70 53.23 2hct n MET 77 Cb 0.22 -1.84 0.69 0.00 -0.71 0.00 0.00 33.22 31.57 2hct n MET 77 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 2hct n ARG 78 N 0.86 0.46 0.00 0.03 1.74 -1.05 -2.34 116.66 116.36 2hct n ARG 78 Ca 0.24 0.03 0.11 0.00 -0.77 0.00 0.00 57.85 57.46 2hct n ARG 78 Cb 0.86 -1.50 0.63 0.00 -1.02 0.00 0.00 32.46 31.43 2hct n ARG 78 CO 0.00 0.00 0.00 -2.39 -1.52 0.00 0.00 177.63 173.72 2hct n HIS 79 N -1.24 0.00 -3.26 -1.55 1.44 -1.26 -4.80 115.22 104.55 2hct n HIS 79 Ca 0.14 0.00 -0.39 0.00 -2.01 0.00 0.00 57.72 55.46 2hct n HIS 79 Cb 0.19 -0.03 -0.06 0.00 0.12 0.00 0.00 29.99 30.21 2hct n HIS 79 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 2hct s VAL 80 N -2.07 4.87 -0.36 0.61 1.01 -0.99 -5.05 120.40 118.43 2hct s VAL 80 Ca 0.31 1.19 -0.16 0.00 0.00 0.00 0.00 61.98 63.32 2hct s VAL 80 Cb 0.15 -3.90 -0.00 0.00 0.00 0.00 0.00 36.38 32.63 2hct s VAL 80 CO 0.26 0.47 0.42 -0.62 0.00 0.00 0.00 175.10 175.63 2hct s ASP 81 N -0.54 6.22 0.30 3.32 2.15 -1.26 -4.97 116.67 121.90 2hct s ASP 81 Ca 0.29 -0.24 0.01 0.00 0.43 0.00 0.00 52.55 53.05 2hct s ASP 81 Cb -0.18 -2.22 0.49 0.00 -0.30 0.00 0.00 42.92 40.71 2hct s ASP 81 CO 0.17 -0.42 1.84 0.00 -0.17 0.00 0.00 175.17 176.60 2hct h GLN 83 N 0.64 0.91 -0.51 0.00 5.75 -1.95 -0.05 115.11 119.89 2hct h GLN 83 Ca 0.14 -0.08 -0.10 0.00 -0.15 0.00 0.00 58.65 58.46 2hct h GLN 83 Cb 0.34 -0.19 -0.02 0.00 1.07 0.00 0.00 27.48 28.68 2hct h GLN 83 CO 0.01 0.65 -0.06 0.77 -2.65 0.00 0.00 178.83 177.55 2hct h SER 84 N 0.92 0.94 -0.07 -0.69 0.02 -1.77 0.05 113.55 112.95 2hct h SER 84 Ca 0.24 -0.33 0.03 0.00 -0.84 0.00 0.00 61.79 60.89 2hct h SER 84 Cb -0.04 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.22 2hct h SER 84 CO -0.05 1.05 -0.11 0.58 -1.14 0.00 0.00 176.83 177.17 2hct h VAL 85 N 0.81 0.71 -0.94 2.27 2.07 -0.80 -0.37 116.25 120.00 2hct h VAL 85 Ca 0.14 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.68 2hct h VAL 85 Cb 0.60 0.71 -0.05 0.00 -1.52 0.00 0.00 31.29 31.03 2hct h VAL 85 CO 0.04 0.00 0.62 -0.25 0.02 0.00 0.00 177.57 177.99 2hct h TRP 86 N -0.15 1.17 -0.86 1.57 2.91 -0.58 -1.56 115.95 118.44 2hct h TRP 86 Ca 0.06 0.03 -0.02 0.00 1.13 0.00 0.00 58.89 60.09 2hct h TRP 86 Cb 0.24 -0.39 -0.04 0.00 -0.51 0.00 0.00 29.16 28.46 2hct h TRP 86 CO -0.20 0.71 0.46 -0.44 -1.03 0.00 0.00 178.44 177.94 2hct h ASP 87 N 1.24 1.08 -0.19 2.65 3.32 -0.66 -0.50 116.42 123.35 2hct h ASP 87 Ca 0.35 -0.10 -0.13 0.00 0.02 0.00 0.00 57.03 57.17 2hct h ASP 87 Cb -0.09 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.17 2hct h ASP 87 CO -0.09 0.87 -0.34 0.00 -1.72 0.00 0.00 179.24 177.96 2hct h ALA 88 N 1.30 0.81 0.23 3.45 0.00 -0.54 -1.82 119.26 122.69 2hct h ALA 88 Ca 0.30 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 2hct h ALA 88 Cb 0.04 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2hct h ALA 88 CO -0.05 0.65 -0.11 0.35 0.00 0.00 0.00 179.25 180.09 2hct h PHE 89 N 0.59 -0.29 -0.57 0.00 3.04 -0.78 -2.83 116.94 116.10 2hct h PHE 89 Ca 0.06 -0.01 0.07 0.00 3.98 0.00 0.00 57.97 62.07 2hct h PHE 89 Cb 0.86 0.10 -0.06 0.00 2.56 0.00 0.00 35.95 39.41 2hct h PHE 89 CO 0.04 -0.01 0.25 -0.22 -2.02 0.00 0.00 178.31 176.36 2hct h LYS 90 N -0.56 0.46 0.00 1.11 3.64 -1.14 -1.52 116.57 118.56 2hct h LYS 90 Ca -0.03 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 2hct h LYS 90 Cb 0.41 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 2hct h LYS 90 CO 0.05 0.30 0.00 0.78 -2.27 0.00 0.00 179.45 178.32 2hct h GLY 91 N 0.47 0.00 1.84 5.01 0.00 -1.29 0.30 103.07 109.41 2hct h GLY 91 Ca 0.27 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.49 2hct h GLY 91 CO -0.23 0.00 -0.47 0.00 0.00 0.00 0.00 176.54 175.84 2hct h ALA 92 N 2.00 1.09 0.00 3.60 0.00 -1.01 -3.40 119.26 121.53 2hct h ALA 92 Ca 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2hct h ALA 92 Cb 0.03 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2hct h ALA 92 CO 0.00 0.62 -0.52 1.97 0.00 0.00 0.00 179.25 181.32 2hct n PHE 93 N -3.98 0.00 -1.91 0.00 1.16 -0.93 -4.82 117.46 106.98 2hct n PHE 93 Ca -0.02 0.00 -0.41 0.00 -1.87 0.00 0.00 57.45 55.15 2hct n PHE 93 Cb 0.51 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.36 2hct n PHE 93 CO 0.00 0.00 0.00 0.42 -1.87 0.00 0.00 176.76 175.31 2hct s ILE 94 N -1.04 2.42 -0.79 1.97 -1.09 0.05 -2.09 121.20 120.63 2hct s ILE 94 Ca 0.00 0.34 0.00 0.00 -2.23 0.00 0.00 60.65 58.76 2hct s ILE 94 Cb 0.00 -3.22 0.00 0.00 -1.58 0.00 0.00 42.46 37.66 2hct s ILE 94 CO 0.00 0.05 0.00 -1.20 -1.23 0.00 0.00 174.94 172.56 2hct n SER 95 N 2.48 -4.85 -4.59 3.58 7.64 -1.08 -4.92 113.62 111.88 2hct n SER 95 Ca 0.08 0.18 -0.33 0.00 1.01 0.00 0.00 58.87 59.82 2hct n SER 95 Cb 0.39 -3.00 -0.11 0.00 -1.01 0.00 0.00 64.21 60.48 2hct n SER 95 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2hct s LYS 96 N -2.32 2.60 0.11 1.43 1.02 -0.89 -4.48 119.74 117.21 2hct s LYS 96 Ca 0.00 -0.68 -0.31 0.00 0.02 0.00 0.00 55.97 55.00 2hct s LYS 96 Cb 0.00 -2.52 -0.10 0.00 -0.52 0.00 0.00 37.83 34.70 2hct s LYS 96 CO 0.00 0.62 1.79 -1.58 -0.92 0.00 0.00 175.35 175.26 2hct s HIS 97 N -0.94 2.19 -2.00 3.18 5.65 -1.26 -3.12 115.29 118.99 2hct s HIS 97 Ca 0.16 0.05 0.04 0.00 0.25 0.00 0.00 55.06 55.56 2hct s HIS 97 Cb -0.11 -4.12 0.24 0.00 -1.18 0.00 0.00 32.58 27.41 2hct s HIS 97 CO 0.06 -4.62 0.91 -0.35 -0.65 0.00 0.00 174.74 170.08 2hct n PRO 98 N 5.71 0.73 -0.11 2.88 -0.04 -1.26 -1.33 135.00 141.58 2hct n PRO 98 Ca 0.17 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.74 2hct n PRO 98 Cb 0.39 -1.09 0.16 0.00 -0.04 0.00 0.00 33.50 32.92 2hct n PRO 98 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2hct n ASP 100 N 1.34 2.06 -4.76 0.00 8.00 -0.44 -4.43 116.55 118.31 2hct n ASP 100 Ca 0.16 -3.25 -0.39 0.00 0.71 0.00 0.00 54.79 52.02 2hct n ASP 100 Cb 0.57 -0.45 -0.05 0.00 -0.02 0.00 0.00 41.12 41.18 2hct n ASP 100 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2hct s ILE 101 N -2.81 3.72 0.25 0.53 -1.09 -0.73 -4.94 121.20 116.12 2hct s ILE 101 Ca 0.32 1.61 0.09 0.00 -2.23 0.00 0.00 60.65 60.44 2hct s ILE 101 Cb 0.29 -3.97 -0.05 0.00 -1.58 0.00 0.00 42.46 37.15 2hct s ILE 101 CO -0.00 0.29 -0.14 0.42 -1.23 0.00 0.00 174.94 174.28 2hct s THR 102 N -1.32 1.94 0.42 2.92 -4.23 -1.26 -4.76 115.64 109.35 2hct s THR 102 Ca 0.47 -2.25 0.09 0.00 -1.18 0.00 0.00 61.69 58.82 2hct s THR 102 Cb -0.27 -2.23 0.25 0.00 1.34 0.00 0.00 72.50 71.59 2hct s THR 102 CO 0.35 -0.46 2.06 -0.33 -0.54 0.00 0.00 174.62 175.69 2hct h GLU 103 N 2.40 0.42 -0.01 3.99 5.08 -1.97 -1.51 114.58 122.97 2hct h GLU 103 Ca -0.39 -0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 57.88 2hct h GLU 103 Cb 1.24 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.39 2hct h GLU 103 CO 0.63 0.31 -0.26 0.93 -1.00 0.00 0.00 179.01 179.62 2hct h GLU 104 N 0.43 0.02 -0.07 2.33 3.07 -1.99 -0.86 114.58 117.51 2hct h GLU 104 Ca 0.11 -0.01 0.02 0.00 -0.50 0.00 0.00 59.36 58.99 2hct h GLU 104 Cb 0.00 -0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 27.91 2hct h GLU 104 CO -0.02 0.28 0.07 -0.44 -1.40 0.00 0.00 179.01 177.50 2hct h ASP 105 N 0.02 0.00 0.00 1.42 3.32 -1.60 -2.60 116.42 116.98 2hct h ASP 105 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2hct h ASP 105 Cb 0.47 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.02 2hct h ASP 105 CO 0.03 0.00 -0.11 -1.22 -1.72 0.00 0.00 179.24 176.22 2hct n TYR 106 N -4.07 0.00 -0.10 4.55 4.02 -0.33 -4.21 117.16 117.02 2hct n TYR 106 Ca -0.01 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.79 2hct n TYR 106 Cb 0.17 -0.01 -0.01 0.00 -0.02 0.00 0.00 39.34 39.46 2hct n TYR 106 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 176.86 177.81 2hct h GLN 107 N 3.37 0.46 -0.77 -0.72 1.08 -1.46 0.39 115.11 117.47 2hct h GLN 107 Ca 0.00 -0.05 0.10 0.00 -1.45 0.00 0.00 58.65 57.25 2hct h GLN 107 Cb 0.78 -0.09 -0.07 0.00 -0.05 0.00 0.00 27.48 28.05 2hct h GLN 107 CO 0.00 0.38 0.40 -1.35 -0.95 0.00 0.00 178.83 177.31 2hct h PRO 108 N 0.42 0.65 -0.40 1.46 0.11 -1.80 0.42 132.00 132.86 2hct h PRO 108 Ca 0.12 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.18 2hct h PRO 108 Cb 0.05 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 30.99 2hct h PRO 108 CO -0.02 0.43 0.24 1.25 -0.21 0.00 0.00 178.00 179.69 2hct h LEU 109 N 0.67 0.48 -0.48 2.35 5.85 -1.67 -2.61 115.31 119.91 2hct h LEU 109 Ca 0.38 -0.06 0.06 0.00 0.84 0.00 0.00 57.88 59.10 2hct h LEU 109 Cb 0.40 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.26 2hct h LEU 109 CO -0.27 0.40 0.19 0.24 -0.34 0.00 0.00 178.44 178.65 2hct h MET 110 N 0.52 0.36 -0.29 1.25 2.86 -0.01 0.69 114.93 120.31 2hct h MET 110 Ca 0.14 -0.02 0.03 0.00 -2.06 0.00 0.00 59.70 57.79 2hct h MET 110 Cb 0.01 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.56 2hct h MET 110 CO -0.03 0.24 0.09 0.87 1.06 0.00 0.00 176.91 179.14 2hct h LYS 111 N 0.37 0.20 -0.05 1.72 1.57 -0.87 -1.71 116.57 117.80 2hct h LYS 111 Ca 0.22 -0.01 -0.10 0.00 -1.87 0.00 0.00 60.65 58.90 2hct h LYS 111 Cb 0.21 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 2hct h LYS 111 CO -0.21 0.13 -0.41 -0.07 -0.57 0.00 0.00 179.45 178.32 2hct h LEU 112 N 0.21 0.12 -1.61 2.94 3.38 -1.06 -2.83 115.31 116.46 2hct h LEU 112 Ca 0.13 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2hct h LEU 112 Cb 0.11 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2hct h LEU 112 CO -0.15 0.52 0.00 0.61 0.09 0.00 0.00 178.44 179.51 2hct n GLY 113 N -0.28 1.05 3.63 0.83 0.00 0.20 -4.95 105.19 105.66 2hct n GLY 113 Ca -0.02 -0.48 -0.48 0.00 0.00 0.00 0.00 46.02 45.05 2hct n GLY 113 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2hct n THR 114 N 0.78 0.40 -3.61 2.61 -1.04 -0.67 -4.71 114.28 108.04 2hct n THR 114 Ca 0.15 -0.10 -0.03 0.00 -2.04 0.00 0.00 64.05 62.03 2hct n THR 114 Cb 0.37 -1.19 -0.06 0.00 -1.82 0.00 0.00 70.33 67.63 2hct n THR 114 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 2hct s GLN 115 N 0.23 0.54 -0.14 -2.82 0.74 -1.26 -5.10 119.66 111.85 2hct s GLN 115 Ca 0.77 1.11 -0.06 0.00 0.05 0.00 0.00 55.36 57.23 2hct s GLN 115 Cb -0.78 0.38 -0.04 0.00 1.10 0.00 0.00 33.01 33.67 2hct s GLN 115 CO 0.46 -0.14 0.07 0.95 -0.55 0.00 0.00 175.29 176.07 2hct s THR 116 N 2.06 4.87 0.26 -0.34 -4.23 -1.26 -5.09 115.64 111.90 2hct s THR 116 Ca -0.08 -0.02 0.08 0.00 -1.18 0.00 0.00 61.69 60.49 2hct s THR 116 Cb -0.07 -3.13 -0.04 0.00 1.34 0.00 0.00 72.50 70.60 2hct s THR 116 CO -0.18 0.55 0.11 0.68 -0.54 0.00 0.00 174.62 175.23 2hct s VAL 117 N -0.39 4.01 0.10 2.29 -7.23 -1.26 -5.06 120.40 112.86 2hct s VAL 117 Ca 0.09 -1.62 -0.31 0.00 -1.81 0.00 0.00 61.98 58.34 2hct s VAL 117 Cb -0.12 -3.15 -0.09 0.00 0.56 0.00 0.00 36.38 33.58 2hct s VAL 117 CO 0.02 -0.35 1.68 -2.84 -0.31 0.00 0.00 175.10 173.30 2hct s PRO 118 N -3.74 4.18 0.44 4.82 0.02 -1.26 -4.84 135.00 134.63 2hct s PRO 118 Ca 0.32 2.40 0.29 0.00 0.02 0.00 0.00 61.00 64.04 2hct s PRO 118 Cb -0.07 -3.52 1.12 0.00 0.02 0.00 0.00 34.50 32.04 2hct s PRO 118 CO 0.23 -0.74 1.86 0.00 -0.33 0.00 0.00 177.00 178.01 2hct n ASN 120 N -2.83 2.33 -1.20 0.00 6.94 -1.24 -0.48 115.26 118.77 2hct n ASN 120 Ca 0.02 -2.05 -0.01 0.00 -0.02 0.00 0.00 54.58 52.51 2hct n ASN 120 Cb 0.32 -0.31 0.13 0.00 -2.36 0.00 0.00 39.78 37.56 2hct n ASN 120 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 2hct n LYS 121 N 0.65 1.78 -3.72 -3.83 4.76 -0.79 -4.75 118.16 112.26 2hct n LYS 121 Ca 0.14 -3.30 -0.35 0.00 -2.87 0.00 0.00 58.31 51.93 2hct n LYS 121 Cb 0.39 -1.50 -0.08 0.00 -1.84 0.00 0.00 35.03 32.00 2hct n LYS 121 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2hct s ILE 122 N -3.05 5.40 -0.24 -0.18 1.01 -1.26 -0.97 121.20 121.91 2hct s ILE 122 Ca 0.39 0.20 -0.04 0.00 0.00 0.00 0.00 60.65 61.21 2hct s ILE 122 Cb 0.38 -3.48 0.00 0.00 0.01 0.00 0.00 42.46 39.38 2hct s ILE 122 CO -0.06 0.43 -0.02 -0.22 0.00 0.00 0.00 174.94 175.07 2hct s LEU 123 N 0.42 3.16 0.27 2.97 2.96 0.51 -2.92 118.68 126.05 2hct s LEU 123 Ca 0.08 -0.59 -0.03 0.00 -0.22 0.00 0.00 54.13 53.38 2hct s LEU 123 Cb -0.11 -1.74 -0.05 0.00 0.50 0.00 0.00 46.19 44.79 2hct s LEU 123 CO -0.01 -0.08 0.49 -0.76 -1.32 0.00 0.00 176.35 174.67 2hct s LEU 124 N 1.44 4.11 0.15 -0.68 1.43 0.65 -4.03 118.68 121.75 2hct s LEU 124 Ca 0.04 0.56 -0.07 0.00 -1.03 0.00 0.00 54.13 53.63 2hct s LEU 124 Cb -0.15 -3.37 -0.02 0.00 0.03 0.00 0.00 46.19 42.68 2hct s LEU 124 CO -0.03 -0.15 0.21 -1.66 0.23 0.00 0.00 176.35 174.95 2hct s TRP 125 N -2.04 0.53 -0.18 0.29 1.48 -1.26 -0.89 118.94 116.87 2hct s TRP 125 Ca 0.41 -0.90 -0.04 0.00 -1.06 0.00 0.00 56.10 54.51 2hct s TRP 125 Cb -0.11 -0.18 0.09 0.00 -1.16 0.00 0.00 33.47 32.11 2hct s TRP 125 CO 0.30 -0.65 0.29 0.45 -4.06 0.00 0.00 176.95 173.28 2hct s SER 126 N -2.99 0.59 -1.18 -2.66 0.15 -0.60 -4.69 113.70 102.33 2hct s SER 126 Ca 0.19 0.30 -0.30 0.00 0.70 0.00 0.00 55.95 56.84 2hct s SER 126 Cb 0.05 0.74 0.03 0.00 -1.71 0.00 0.00 66.02 65.13 2hct s SER 126 CO 0.00 -0.28 0.72 0.54 1.20 0.00 0.00 173.24 175.42 2hct n ARG 127 N 5.35 -0.57 -2.68 5.44 1.74 -1.26 -3.62 116.66 121.06 2hct n ARG 127 Ca -0.06 0.22 -0.05 0.00 -0.77 0.00 0.00 57.85 57.19 2hct n ARG 127 Cb 0.50 -3.00 0.05 0.00 -1.02 0.00 0.00 32.46 28.99 2hct n ARG 127 CO 0.00 0.00 0.00 1.51 -1.52 0.00 0.00 177.63 177.62 2hct n ILE 128 N -4.71 0.00 0.15 0.55 0.13 -1.26 -4.31 119.36 109.91 2hct n ILE 128 Ca -0.11 -0.99 -0.14 0.00 -1.10 0.00 0.00 62.75 60.42 2hct n ILE 128 Cb 0.57 0.85 -0.07 0.00 -0.84 0.00 0.00 39.64 40.16 2hct n ILE 128 CO 0.00 0.00 0.00 0.50 2.80 0.00 0.00 176.55 179.85 2hct h LYS 129 N 1.70 -0.57 -0.48 9.51 3.64 -1.98 -3.21 116.57 125.18 2hct h LYS 129 Ca -0.42 0.04 0.01 0.00 -1.27 0.00 0.00 60.65 59.01 2hct h LYS 129 Cb 1.24 0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 33.17 2hct h LYS 129 CO -0.11 -0.38 0.31 -0.44 -2.27 0.00 0.00 179.45 176.56 2hct h ASP 130 N -0.59 0.54 -0.19 4.20 3.32 -2.00 -2.87 116.42 118.82 2hct h ASP 130 Ca 0.01 -0.01 -0.14 0.00 0.02 0.00 0.00 57.03 56.91 2hct h ASP 130 Cb 0.59 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.01 2hct h ASP 130 CO -0.14 0.39 -0.42 0.25 -1.72 0.00 0.00 179.24 177.60 2hct h LEU 131 N 0.64 0.69 -0.52 1.55 6.46 -1.99 -1.23 115.31 120.92 2hct h LEU 131 Ca 0.18 -0.56 0.10 0.00 -0.12 0.00 0.00 57.88 57.48 2hct h LEU 131 Cb -0.06 -0.20 -0.09 0.00 -0.73 0.00 0.00 40.66 39.58 2hct h LEU 131 CO -0.05 1.13 -0.09 0.00 -0.62 0.00 0.00 178.44 178.81 2hct h ALA 132 N 0.59 0.39 -0.02 1.25 0.00 -1.52 0.21 119.26 120.15 2hct h ALA 132 Ca 0.00 0.19 -0.24 0.00 0.00 0.00 0.00 54.91 54.86 2hct h ALA 132 Cb 1.02 0.35 0.01 0.00 0.00 0.00 0.00 17.79 19.17 2hct h ALA 132 CO 0.09 -0.43 -0.95 0.45 0.00 0.00 0.00 179.25 178.42 2hct h HIS 133 N 0.03 0.83 -0.97 0.00 3.86 -1.47 -2.17 115.15 115.26 2hct h HIS 133 Ca 0.25 -0.43 0.03 0.00 -1.16 0.00 0.00 60.37 59.06 2hct h HIS 133 Cb 0.39 -0.10 -0.05 0.00 1.06 0.00 0.00 27.41 28.71 2hct h HIS 133 CO -0.40 1.26 0.63 1.96 0.86 0.00 0.00 177.93 182.24 2hct h GLN 134 N 0.33 1.19 0.68 2.45 4.20 -0.85 -0.86 115.11 122.25 2hct h GLN 134 Ca -0.09 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.51 2hct h GLN 134 Cb 1.58 -0.27 0.01 0.00 0.30 0.00 0.00 27.48 29.10 2hct h GLN 134 CO 0.18 0.79 -0.33 0.35 -0.67 0.00 0.00 178.83 179.15 2hct h PHE 135 N 1.23 -0.85 0.00 2.96 3.04 -0.22 -2.68 116.94 120.42 2hct h PHE 135 Ca 0.38 -0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.31 2hct h PHE 135 Cb -0.01 0.28 0.00 0.00 2.56 0.00 0.00 35.95 38.78 2hct h PHE 135 CO -0.00 -0.49 0.00 0.25 -2.02 0.00 0.00 178.31 176.05 2hct n THR 136 N -5.42 1.15 -0.08 4.41 -2.24 -0.85 0.04 114.28 111.29 2hct n THR 136 Ca -0.13 0.29 -0.15 0.00 -2.27 0.00 0.00 64.05 61.79 2hct n THR 136 Cb 0.38 -1.10 -0.04 0.00 -2.10 0.00 0.00 70.33 67.47 2hct n THR 136 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 2hct h GLN 137 N 0.00 0.86 0.01 -0.78 1.08 -0.83 -3.33 115.11 112.12 2hct h GLN 137 Ca 0.00 -0.53 -0.02 0.00 -1.45 0.00 0.00 58.65 56.64 2hct h GLN 137 Cb 0.17 0.06 -0.00 0.00 -0.05 0.00 0.00 27.48 27.66 2hct h GLN 137 CO 0.00 1.17 -0.12 0.28 -0.95 0.00 0.00 178.83 179.21 2hct h VAL 138 N 0.64 1.74 -2.81 -0.54 2.07 -0.94 -3.39 116.25 113.02 2hct h VAL 138 Ca 0.02 -2.36 -0.77 0.00 0.82 0.00 0.00 66.70 64.41 2hct h VAL 138 Cb 1.11 3.33 -0.23 0.00 -1.52 0.00 0.00 31.29 33.98 2hct h VAL 138 CO 0.11 0.60 0.95 1.67 0.02 0.00 0.00 177.57 180.93 2hct n GLN 139 N -4.57 3.58 0.00 1.57 -0.06 0.11 -4.82 117.38 113.19 2hct n GLN 139 Ca -0.11 -4.17 0.06 0.00 -2.00 0.00 0.00 57.00 50.77 2hct n GLN 139 Cb 0.51 -2.76 0.33 0.00 -4.06 0.00 0.00 30.24 24.26 2hct n GLN 139 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 2hct n ARG 140 N 3.72 0.32 0.00 3.69 5.12 -1.25 -1.57 116.66 126.69 2hct n ARG 140 Ca 0.30 0.04 0.15 0.00 -1.93 0.00 0.00 57.85 56.41 2hct n ARG 140 Cb 0.40 -1.50 0.89 0.00 -1.16 0.00 0.00 32.46 31.08 2hct n ARG 140 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 2hct n ASP 141 N -1.06 0.00 -4.28 0.55 10.43 -1.26 -4.90 116.55 116.03 2hct n ASP 141 Ca 0.08 -0.87 -0.21 0.00 2.57 0.00 0.00 54.79 56.36 2hct n ASP 141 Cb 0.05 -0.03 -0.12 0.00 1.84 0.00 0.00 41.12 42.86 2hct n ASP 141 CO 0.00 0.00 0.00 -0.04 -1.07 0.00 0.00 177.20 176.09 2hct s MET 142 N -2.06 1.12 -0.08 -1.24 -1.94 -0.61 -4.77 119.30 109.72 2hct s MET 142 Ca 0.44 -1.24 -0.01 0.00 -1.71 0.00 0.00 55.69 53.17 2hct s MET 142 Cb 0.21 -1.19 0.03 0.00 2.01 0.00 0.00 34.83 35.88 2hct s MET 142 CO 0.36 0.25 -0.01 -0.06 -0.01 0.00 0.00 175.02 175.56 2hct s PHE 143 N -1.70 0.79 0.61 -0.03 0.08 -0.15 -4.80 117.98 112.78 2hct s PHE 143 Ca 0.09 -0.27 -0.01 0.00 0.12 0.00 0.00 56.93 56.86 2hct s PHE 143 Cb -0.07 -0.87 0.05 0.00 -0.57 0.00 0.00 43.02 41.56 2hct s PHE 143 CO 0.04 -0.37 0.86 0.95 -0.10 0.00 0.00 175.22 176.61 2hct s THR 144 N 1.93 2.50 0.32 0.64 -4.23 -1.26 -0.36 115.64 115.19 2hct s THR 144 Ca 0.05 -0.57 0.03 0.00 -1.18 0.00 0.00 61.69 60.02 2hct s THR 144 Cb -0.12 -2.93 0.29 0.00 1.34 0.00 0.00 72.50 71.07 2hct s THR 144 CO -0.06 0.00 1.91 0.25 -0.54 0.00 0.00 174.62 176.18 2hct h LEU 145 N -0.16 0.82 0.00 4.79 5.85 -1.97 -1.84 115.31 122.80 2hct h LEU 145 Ca -0.42 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.32 2hct h LEU 145 Cb 1.30 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.17 2hct h LEU 145 CO 0.52 0.51 0.00 -0.62 -0.34 0.00 0.00 178.44 178.51 2hct n GLU 146 N -4.50 0.08 0.00 1.25 4.71 -1.26 -1.89 120.64 119.03 2hct n GLU 146 Ca 0.14 0.19 0.12 0.00 -0.01 0.00 0.00 57.16 57.60 2hct n GLU 146 Cb 0.25 -1.50 0.28 0.00 -1.01 0.00 0.00 31.44 29.46 2hct n GLU 146 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 2hct n ASP 147 N -1.42 0.46 -4.86 1.62 10.43 -0.69 -3.16 116.55 118.92 2hct n ASP 147 Ca 0.05 -0.18 -0.31 0.00 2.57 0.00 0.00 54.79 56.93 2hct n ASP 147 Cb 0.17 0.18 -0.03 0.00 1.84 0.00 0.00 41.12 43.27 2hct n ASP 147 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 2hct s THR 148 N -3.00 4.68 0.20 -3.53 -4.23 -0.79 -4.93 115.64 104.04 2hct s THR 148 Ca 0.11 0.87 -0.12 0.00 -1.18 0.00 0.00 61.69 61.37 2hct s THR 148 Cb 0.18 -3.72 0.18 0.00 1.34 0.00 0.00 72.50 70.47 2hct s THR 148 CO 0.69 -0.58 1.67 0.25 -0.54 0.00 0.00 174.62 176.11 2hct h LEU 149 N 1.15 -0.27 -0.43 4.79 5.85 -1.88 -0.37 115.31 124.15 2hct h LEU 149 Ca -0.47 0.14 -0.17 0.00 0.84 0.00 0.00 57.88 58.23 2hct h LEU 149 Cb 1.19 0.26 -0.00 0.00 0.37 0.00 0.00 40.66 42.47 2hct h LEU 149 CO 0.63 -0.10 -0.48 -0.07 -0.34 0.00 0.00 178.44 178.08 2hct h LEU 150 N 0.11 0.86 -0.57 2.25 3.38 -1.86 -0.80 115.31 118.68 2hct h LEU 150 Ca 0.30 -0.43 -0.12 0.00 0.09 0.00 0.00 57.88 57.72 2hct h LEU 150 Cb 0.47 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 2hct h LEU 150 CO -0.50 1.19 -0.12 1.23 0.09 0.00 0.00 178.44 180.34 2hct h GLY 151 N 0.85 1.10 1.00 0.83 0.00 -1.55 -2.95 103.07 102.35 2hct h GLY 151 Ca 0.03 -0.89 0.00 0.00 0.00 0.00 0.00 47.33 46.47 2hct h GLY 151 CO 0.10 0.82 0.36 -1.82 0.00 0.00 0.00 176.54 176.00 2hct h TYR 152 N 0.90 0.71 -0.79 5.60 5.03 -0.87 0.89 116.97 128.45 2hct h TYR 152 Ca 0.14 0.01 0.10 0.00 2.58 0.00 0.00 58.73 61.56 2hct h TYR 152 Cb 0.69 -0.24 -0.07 0.00 1.55 0.00 0.00 36.73 38.65 2hct h TYR 152 CO 0.05 0.46 0.43 -0.07 -1.32 0.00 0.00 178.16 177.70 2hct h LEU 153 N 0.75 0.59 0.00 2.82 3.38 -1.10 -3.26 115.31 118.49 2hct h LEU 153 Ca 0.20 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.23 2hct h LEU 153 Cb -0.07 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.63 2hct h LEU 153 CO -0.04 0.33 -1.58 0.00 0.09 0.00 0.00 178.44 177.23 2hct n ALA 154 N -2.39 3.53 -1.64 1.53 0.00 -1.03 -4.79 120.51 115.72 2hct n ALA 154 Ca 0.13 -0.54 -0.62 0.00 0.00 0.00 0.00 53.44 52.41 2hct n ALA 154 Cb 0.29 -0.77 -0.09 0.00 0.00 0.00 0.00 19.45 18.88 2hct n ALA 154 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2hct n ASP 155 N -1.98 1.65 -0.60 0.00 4.64 0.28 -1.53 116.55 119.01 2hct n ASP 155 Ca -0.01 1.01 -0.08 0.00 -1.38 0.00 0.00 54.79 54.33 2hct n ASP 155 Cb 0.48 -1.01 -0.03 0.00 -1.04 0.00 0.00 41.12 39.52 2hct n ASP 155 CO 0.00 0.00 0.00 0.47 -0.82 0.00 0.00 177.20 176.85 2hct n ASP 156 N 5.51 -5.02 -4.92 1.67 8.00 -1.26 -5.00 116.55 115.53 2hct n ASP 156 Ca 0.34 0.19 -0.25 0.00 0.71 0.00 0.00 54.79 55.78 2hct n ASP 156 Cb 0.04 -3.20 -0.03 0.00 -0.02 0.00 0.00 41.12 37.90 2hct n ASP 156 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2hct s LEU 157 N -1.77 4.25 0.03 0.64 1.43 -0.58 -5.06 118.68 117.62 2hct s LEU 157 Ca 0.00 0.11 0.08 0.00 -1.03 0.00 0.00 54.13 53.29 2hct s LEU 157 Cb 0.00 -2.82 -0.03 0.00 0.03 0.00 0.00 46.19 43.37 2hct s LEU 157 CO 0.00 0.04 -0.24 -0.89 0.23 0.00 0.00 176.35 175.49 2hct s THR 158 N -1.78 2.35 -0.05 5.49 2.01 -1.26 -5.00 115.64 117.40 2hct s THR 158 Ca 0.34 -1.27 -0.21 0.00 0.31 0.00 0.00 61.69 60.86 2hct s THR 158 Cb -0.11 -1.92 0.04 0.00 0.01 0.00 0.00 72.50 70.52 2hct s THR 158 CO 0.28 0.40 0.46 -1.66 -0.69 0.00 0.00 174.62 173.40 2hct s TRP 159 N -0.81 -0.39 0.07 4.92 -2.14 -1.26 -1.31 118.94 118.03 2hct s TRP 159 Ca 0.12 0.69 -0.26 0.00 2.66 0.00 0.00 56.10 59.31 2hct s TRP 159 Cb -0.10 0.21 0.09 0.00 -3.10 0.00 0.00 33.47 30.57 2hct s TRP 159 CO 0.02 -0.45 0.76 0.00 -2.66 0.00 0.00 176.95 174.62 2hct n GLY 161 N -0.31 3.78 3.46 0.00 0.00 -1.26 -1.03 105.19 109.83 2hct n GLY 161 Ca -0.12 -1.74 -0.11 0.00 0.00 0.00 0.00 46.02 44.04 2hct n GLY 161 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2hct s GLU 162 N 4.05 0.60 0.26 1.61 2.02 -1.23 -4.51 118.70 121.49 2hct s GLU 162 Ca 0.00 0.90 -0.02 0.00 0.02 0.00 0.00 54.97 55.87 2hct s GLU 162 Cb 0.00 0.19 0.33 0.00 0.10 0.00 0.00 34.13 34.75 2hct s GLU 162 CO 0.00 -0.12 1.75 0.27 0.02 0.00 0.00 175.26 177.18 2hct h PHE 163 N 6.16 0.83 -1.64 1.61 -5.15 -1.77 -3.00 116.94 113.99 2hct h PHE 163 Ca -0.31 -0.12 0.47 0.00 -0.20 0.00 0.00 57.97 57.81 2hct h PHE 163 Cb 1.19 -0.23 -0.07 0.00 0.22 0.00 0.00 35.95 37.07 2hct h PHE 163 CO 0.27 0.78 1.24 -0.44 -2.00 0.00 0.00 178.31 178.17 2hct h ASP 164 N 0.72 0.00 -5.46 -0.68 3.32 -1.90 -3.42 116.42 109.01 2hct h ASP 164 Ca 0.14 0.00 0.22 0.00 0.02 0.00 0.00 57.03 57.41 2hct h ASP 164 Cb 0.48 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 39.94 2hct h ASP 164 CO 0.02 0.00 0.58 0.28 -1.72 0.00 0.00 179.24 178.41 2hct s THR 165 N -4.82 0.00 -2.12 0.35 -1.32 -1.14 -5.04 115.64 101.55 2hct s THR 165 Ca -0.05 -0.54 0.19 0.00 -1.21 0.00 0.00 61.69 60.08 2hct s THR 165 Cb 0.24 -2.04 0.49 0.00 -1.51 0.00 0.00 72.50 69.68 2hct s THR 165 CO 0.81 0.00 1.44 -1.54 -2.21 0.00 0.00 174.62 173.12 2hct n SER 166 N -0.51 2.99 -4.77 8.08 3.41 -1.26 -2.63 113.62 118.93 2hct n SER 166 Ca -0.07 -1.97 -0.38 0.00 -0.26 0.00 0.00 58.87 56.20 2hct n SER 166 Cb 0.61 -0.33 -0.06 0.00 -0.26 0.00 0.00 64.21 64.17 2hct n SER 166 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2hct s LYS 167 N -1.34 4.58 0.20 4.33 1.02 -1.26 -4.75 119.74 122.51 2hct s LYS 167 Ca 0.38 1.43 -0.30 0.00 0.02 0.00 0.00 55.97 57.50 2hct s LYS 167 Cb 0.20 -2.88 -0.08 0.00 -0.52 0.00 0.00 37.83 34.55 2hct s LYS 167 CO 0.27 0.26 1.03 0.42 -0.92 0.00 0.00 175.35 176.41 2hct s ILE 168 N -1.51 3.97 -0.48 2.17 1.01 -1.26 -3.78 121.20 121.34 2hct s ILE 168 Ca 0.49 1.80 -0.21 0.00 0.00 0.00 0.00 60.65 62.74 2hct s ILE 168 Cb -0.22 -4.15 0.04 0.00 0.01 0.00 0.00 42.46 38.14 2hct s ILE 168 CO 0.27 0.36 0.68 0.21 0.00 0.00 0.00 174.94 176.46 2hct s ASN 169 N -0.50 6.29 0.00 3.58 3.84 -0.20 -4.90 114.94 123.06 2hct s ASN 169 Ca 0.46 -0.53 0.26 0.00 0.21 0.00 0.00 52.86 53.27 2hct s ASN 169 Cb -0.28 -2.33 0.69 0.00 -0.55 0.00 0.00 41.25 38.79 2hct s ASN 169 CO 0.34 -0.88 1.54 -1.22 -2.79 0.00 0.00 177.10 174.09 2hct n TYR 170 N 6.40 0.00 -0.10 0.43 4.02 -1.26 -1.57 117.16 125.07 2hct n TYR 170 Ca -0.03 0.00 -0.21 0.00 -0.01 0.00 0.00 57.90 57.65 2hct n TYR 170 Cb 0.47 -0.02 -0.12 0.00 -0.02 0.00 0.00 39.34 39.65 2hct n TYR 170 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 2hct n GLN 171 N 0.33 0.65 -3.48 -0.72 6.02 -1.26 -4.14 117.38 114.79 2hct n GLN 171 Ca 0.16 0.22 -0.12 0.00 -0.01 0.00 0.00 57.00 57.25 2hct n GLN 171 Cb 0.43 -1.57 -0.03 0.00 1.02 0.00 0.00 30.24 30.10 2hct n GLN 171 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 2hct s SER 172 N -6.83 -0.49 0.03 1.08 1.04 -1.26 -3.58 113.70 103.68 2hct s SER 172 Ca -0.33 -0.08 -0.03 0.00 0.48 0.00 0.00 55.95 55.99 2hct s SER 172 Cb 0.09 0.58 -0.02 0.00 0.10 0.00 0.00 66.02 66.77 2hct s SER 172 CO 0.61 -0.95 0.04 0.00 0.98 0.00 0.00 173.24 173.91 2hct n PRO 174 N 1.06 2.15 -2.90 0.00 -0.02 -1.26 -1.18 135.00 132.85 2hct n PRO 174 Ca -0.21 0.77 -0.41 0.00 -2.02 0.00 0.00 63.50 61.63 2hct n PRO 174 Cb 0.57 -2.46 -0.04 0.00 -0.02 0.00 0.00 33.50 31.56 2hct n PRO 174 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2hct s ASP 175 N 0.39 7.08 0.34 2.55 -1.08 -1.26 -4.63 116.67 120.07 2hct s ASP 175 Ca 0.69 1.31 0.14 0.00 -0.52 0.00 0.00 52.55 54.17 2hct s ASP 175 Cb -0.63 -2.47 1.12 0.00 -1.46 0.00 0.00 42.92 39.48 2hct s ASP 175 CO 0.48 -0.26 1.59 -0.25 0.52 0.00 0.00 175.17 177.25 2hct h TRP 176 N 6.97 0.57 0.03 -5.34 2.91 -1.92 0.94 115.95 120.10 2hct h TRP 176 Ca -0.37 0.05 -0.39 0.00 1.13 0.00 0.00 58.89 59.31 2hct h TRP 176 Cb 1.18 -0.08 -0.06 0.00 -0.51 0.00 0.00 29.16 29.69 2hct h TRP 176 CO 0.68 -0.42 -2.32 -2.13 -1.03 0.00 0.00 178.44 173.22 2hct n ARG 177 N -5.30 0.66 0.09 2.65 0.63 -1.26 -3.61 116.66 110.52 2hct n ARG 177 Ca 0.32 0.22 0.01 0.00 -0.92 0.00 0.00 57.85 57.48 2hct n ARG 177 Cb 1.07 -1.57 -0.02 0.00 0.45 0.00 0.00 32.46 32.39 2hct n ARG 177 CO 0.00 0.00 0.00 0.87 -2.51 0.00 0.00 177.63 175.99 2hct h LYS 178 N -0.22 0.00 0.00 -0.14 1.57 -1.95 -3.43 116.57 112.40 2hct h LYS 178 Ca -0.56 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.22 2hct h LYS 178 Cb 1.84 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.15 2hct h LYS 178 CO -0.12 0.43 0.00 -0.25 -0.57 0.00 0.00 179.45 178.94 2hct n ASP 179 N -3.09 0.00 -3.56 0.86 8.00 0.30 -4.96 116.55 114.09 2hct n ASP 179 Ca -0.03 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.35 2hct n ASP 179 Cb 0.78 -0.17 -0.05 0.00 -0.02 0.00 0.00 41.12 41.66 2hct n ASP 179 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2hct h SER 181 N 2.63 0.00 -1.01 0.00 4.64 -1.85 -3.36 113.55 114.61 2hct h SER 181 Ca -0.20 -0.02 -0.60 0.00 -0.47 0.00 0.00 61.79 60.49 2hct h SER 181 Cb 1.16 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.11 2hct h SER 181 CO 0.33 0.01 1.43 0.59 -0.87 0.00 0.00 176.83 178.32 2hct n ASN 182 N -2.65 7.24 -4.96 4.97 3.02 -1.26 -4.54 115.26 117.07 2hct n ASN 182 Ca 0.01 -3.11 -0.20 0.00 -0.03 0.00 0.00 54.58 51.24 2hct n ASN 182 Cb 0.54 -1.32 -0.01 0.00 -0.61 0.00 0.00 39.78 38.38 2hct n ASN 182 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2hct s ASN 183 N 0.52 6.01 0.22 6.41 4.22 -1.24 -1.78 114.94 129.31 2hct s ASN 183 Ca 0.58 -0.13 -0.08 0.00 -2.14 0.00 0.00 52.86 51.09 2hct s ASN 183 Cb 0.28 -1.44 0.34 0.00 1.28 0.00 0.00 41.25 41.71 2hct s ASN 183 CO -0.15 -0.28 1.74 -0.65 -2.04 0.00 0.00 177.10 175.73 2hct h PRO 184 N 1.05 0.42 0.30 3.55 0.11 -1.80 -0.71 132.00 134.93 2hct h PRO 184 Ca -0.48 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 2hct h PRO 184 Cb 1.25 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2hct h PRO 184 CO 0.57 0.28 -0.14 0.28 -0.21 0.00 0.00 178.00 178.77 2hct h VAL 185 N 0.44 0.69 -0.59 3.15 2.07 -1.96 -2.11 116.25 117.93 2hct h VAL 185 Ca 0.35 -0.63 0.07 0.00 0.82 0.00 0.00 66.70 67.31 2hct h VAL 185 Cb 0.46 1.00 -0.06 0.00 -1.52 0.00 0.00 31.29 31.17 2hct h VAL 185 CO -0.34 0.12 0.27 0.28 0.02 0.00 0.00 177.57 177.92 2hct h SER 186 N -0.77 0.34 0.07 0.57 0.02 -1.80 -2.28 113.55 109.69 2hct h SER 186 Ca -0.04 0.05 -0.15 0.00 -0.84 0.00 0.00 61.79 60.81 2hct h SER 186 Cb 0.51 -0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.04 2hct h SER 186 CO 0.07 0.22 -0.52 0.58 -1.14 0.00 0.00 176.83 176.03 2hct h VAL 187 N 0.50 1.32 0.15 2.27 2.07 -1.18 -0.86 116.25 120.51 2hct h VAL 187 Ca 0.28 -1.77 0.00 0.00 0.82 0.00 0.00 66.70 66.04 2hct h VAL 187 Cb 0.27 1.76 -0.01 0.00 -1.52 0.00 0.00 31.29 31.79 2hct h VAL 187 CO -0.24 0.55 -0.15 0.15 0.02 0.00 0.00 177.57 177.90 2hct h PHE 188 N 0.39 -0.39 -0.46 1.57 3.57 -0.89 -1.32 116.94 119.41 2hct h PHE 188 Ca 0.01 0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.42 2hct h PHE 188 Cb 1.05 0.16 -0.02 0.00 2.79 0.00 0.00 35.95 39.92 2hct h PHE 188 CO 0.04 -0.23 -0.11 -1.49 -2.23 0.00 0.00 178.31 174.28 2hct h TRP 189 N -0.33 0.93 -0.27 0.41 4.06 -1.21 -1.25 115.95 118.29 2hct h TRP 189 Ca 0.01 -0.18 0.04 0.00 2.06 0.00 0.00 58.89 60.82 2hct h TRP 189 Cb 0.32 -0.24 -0.04 0.00 -1.00 0.00 0.00 29.16 28.20 2hct h TRP 189 CO -0.14 0.91 0.01 -0.22 -3.56 0.00 0.00 178.44 175.44 2hct h LYS 190 N 0.76 0.09 0.33 0.49 3.64 -1.07 -0.43 116.57 120.37 2hct h LYS 190 Ca 0.12 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.48 2hct h LYS 190 Cb 0.62 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 2hct h LYS 190 CO 0.04 0.06 -0.16 1.15 -2.27 0.00 0.00 179.45 178.27 2hct h THR 191 N 0.09 0.70 -0.56 1.00 2.02 -0.87 -1.97 112.91 113.31 2hct h THR 191 Ca 0.13 -0.35 -0.11 0.00 0.77 0.00 0.00 66.41 66.85 2hct h THR 191 Cb 0.16 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 67.43 2hct h THR 191 CO -0.21 0.07 -0.07 -0.37 0.37 0.00 0.00 175.52 175.31 2hct h VAL 192 N -0.63 1.27 -0.92 3.16 -1.51 -1.24 -2.60 116.25 113.78 2hct h VAL 192 Ca -0.04 -1.22 0.02 0.00 -1.23 0.00 0.00 66.70 64.22 2hct h VAL 192 Cb 0.45 0.90 -0.05 0.00 -2.13 0.00 0.00 31.29 30.47 2hct h VAL 192 CO 0.07 0.44 0.60 0.28 -1.23 0.00 0.00 177.57 177.73 2hct h SER 193 N 0.93 1.03 0.33 4.19 0.02 -1.11 0.10 113.55 119.04 2hct h SER 193 Ca 0.15 -0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 2hct h SER 193 Cb 0.63 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 62.92 2hct h SER 193 CO 0.04 0.74 -0.19 -0.09 -1.14 0.00 0.00 176.83 176.19 2hct h ARG 194 N 1.21 -0.47 -0.61 3.45 2.43 -1.15 0.70 114.38 119.94 2hct h ARG 194 Ca 0.35 0.03 0.04 0.00 -0.81 0.00 0.00 59.98 59.59 2hct h ARG 194 Cb -0.10 0.11 -0.05 0.00 -0.42 0.00 0.00 29.97 29.52 2hct h ARG 194 CO -0.09 -0.32 0.35 0.00 -1.51 0.00 0.00 179.97 178.41 2hct h ARG 195 N -0.49 0.65 -0.31 0.20 3.08 -1.16 -1.42 114.38 114.93 2hct h ARG 195 Ca -0.04 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 2hct h ARG 195 Cb 0.40 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 2hct h ARG 195 CO 0.04 0.43 0.16 0.35 -1.07 0.00 0.00 179.97 179.89 2hct h PHE 196 N 0.67 0.44 -0.86 3.04 3.57 -0.35 -2.43 116.94 121.01 2hct h PHE 196 Ca 0.26 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.73 2hct h PHE 196 Cb 0.10 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 38.66 2hct h PHE 196 CO -0.07 0.37 0.48 0.00 -2.23 0.00 0.00 178.31 176.85 2hct h ALA 197 N 1.03 1.10 0.00 2.41 0.00 -0.66 -3.02 119.26 120.12 2hct h ALA 197 Ca 0.11 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 2hct h ALA 197 Cb 0.08 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 2hct h ALA 197 CO -0.02 0.61 -0.17 0.93 0.00 0.00 0.00 179.25 180.60 2hct h GLU 198 N 1.20 0.00 0.00 0.00 5.08 -0.84 -2.61 114.58 117.41 2hct h GLU 198 Ca 0.30 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.66 2hct h GLU 198 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 2hct h GLU 198 CO -0.05 0.17 -0.69 0.00 -1.00 0.00 0.00 179.01 177.44 2hct h ALA 199 N 1.83 0.57 -2.93 3.43 0.00 -1.32 -3.45 119.26 117.39 2hct h ALA 199 Ca -0.00 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.37 2hct h ALA 199 Cb 0.37 0.00 0.10 0.00 0.00 0.00 0.00 17.79 18.26 2hct h ALA 199 CO 0.02 0.00 0.75 0.00 0.00 0.00 0.00 179.25 180.02 2hct s ALA 200 N -3.21 3.54 0.08 0.00 0.00 -0.98 -4.68 121.76 116.50 2hct s ALA 200 Ca 0.05 1.51 -0.01 0.00 0.00 0.00 0.00 51.96 53.50 2hct s ALA 200 Cb 0.12 -3.58 -0.04 0.00 0.00 0.00 0.00 23.12 19.62 2hct s ALA 200 CO 0.74 -0.98 -0.01 0.00 0.00 0.00 0.00 175.76 175.51 2hct n ASP 202 N 0.04 0.00 -4.64 0.00 8.00 0.39 -3.71 116.55 116.64 2hct n ASP 202 Ca -0.12 0.00 -0.38 0.00 0.71 0.00 0.00 54.79 55.01 2hct n ASP 202 Cb 0.62 0.00 -0.09 0.00 -0.02 0.00 0.00 41.12 41.63 2hct n ASP 202 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2hct s VAL 203 N 0.00 5.26 -0.14 2.53 1.01 -1.26 -0.50 120.40 127.30 2hct s VAL 203 Ca 0.00 0.42 -0.03 0.00 0.00 0.00 0.00 61.98 62.37 2hct s VAL 203 Cb 0.00 -3.62 -0.03 0.00 0.00 0.00 0.00 36.38 32.73 2hct s VAL 203 CO 0.00 0.25 -0.04 -0.69 0.00 0.00 0.00 175.10 174.63 2hct s VAL 204 N 1.52 3.90 -0.01 2.92 1.01 1.00 -4.67 120.40 126.06 2hct s VAL 204 Ca 0.12 -0.37 0.00 0.00 0.00 0.00 0.00 61.98 61.74 2hct s VAL 204 Cb -0.15 -2.69 -0.04 0.00 0.00 0.00 0.00 36.38 33.51 2hct s VAL 204 CO 0.08 0.52 0.03 -1.00 0.00 0.00 0.00 175.10 174.73 2hct s HIS 205 N 0.07 3.15 -0.06 5.22 3.76 -1.15 0.63 115.29 126.91 2hct s HIS 205 Ca -0.00 0.14 0.00 0.00 -0.15 0.00 0.00 55.06 55.05 2hct s HIS 205 Cb -0.13 -1.71 0.02 0.00 1.11 0.00 0.00 32.58 31.87 2hct s HIS 205 CO 0.03 0.49 -0.05 0.54 -0.85 0.00 0.00 174.74 174.90 2hct s VAL 206 N -1.10 0.64 -0.17 -0.90 0.11 0.04 -0.25 120.40 118.78 2hct s VAL 206 Ca 0.20 -0.12 -0.28 0.00 -2.93 0.00 0.00 61.98 58.84 2hct s VAL 206 Cb -0.12 -0.69 -0.00 0.00 -1.53 0.00 0.00 36.38 34.04 2hct s VAL 206 CO 0.10 0.27 0.98 -0.04 -3.33 0.00 0.00 175.10 173.08 2hct s MET 207 N 1.29 4.33 0.07 1.54 -1.94 -0.06 -0.14 119.30 124.39 2hct s MET 207 Ca -0.05 1.29 0.07 0.00 -1.71 0.00 0.00 55.69 55.29 2hct s MET 207 Cb -0.14 -3.59 -0.04 0.00 2.01 0.00 0.00 34.83 33.08 2hct s MET 207 CO -0.02 -0.43 -0.14 -0.51 -0.01 0.00 0.00 175.02 173.91 2hct s LEU 208 N 2.47 2.83 -0.60 -0.03 1.43 -0.19 -1.56 118.68 123.03 2hct s LEU 208 Ca 0.44 -0.40 -0.25 0.00 -1.03 0.00 0.00 54.13 52.89 2hct s LEU 208 Cb -0.17 -1.66 0.04 0.00 0.03 0.00 0.00 46.19 44.44 2hct s LEU 208 CO 0.12 0.22 1.05 -0.62 0.23 0.00 0.00 176.35 177.35 2hct s ASP 209 N -1.81 6.31 0.00 2.29 2.15 -1.24 -1.82 116.67 122.55 2hct s ASP 209 Ca 0.18 -0.37 0.07 0.00 0.43 0.00 0.00 52.55 52.85 2hct s ASP 209 Cb -0.11 -2.48 0.34 0.00 -0.30 0.00 0.00 42.92 40.37 2hct s ASP 209 CO 0.09 -1.41 1.23 0.61 -0.17 0.00 0.00 175.17 175.52 2hct n GLY 210 N 5.18 -0.73 3.04 2.66 0.00 -0.13 -4.27 105.19 110.94 2hct n GLY 210 Ca 0.02 -0.10 -0.34 0.00 0.00 0.00 0.00 46.02 45.61 2hct n GLY 210 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2hct s SER 211 N -1.16 5.21 0.00 1.61 0.01 -1.24 -4.80 113.70 113.33 2hct s SER 211 Ca 0.11 -3.28 0.00 0.00 1.31 0.00 0.00 55.95 54.09 2hct s SER 211 Cb 0.05 -1.80 0.00 0.00 0.21 0.00 0.00 66.02 64.49 2hct s SER 211 CO 0.08 -0.25 0.00 -1.14 0.41 0.00 0.00 173.24 172.34 2hct n ARG 212 N 2.86 0.00 -0.01 12.44 3.00 -1.26 -5.00 116.66 128.69 2hct n ARG 212 Ca 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.98 2hct n ARG 212 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.82 2hct n ARG 212 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 2hct n SER 213 N 0.00 1.47 -2.73 6.15 3.41 -1.26 -2.65 113.62 118.00 2hct n SER 213 Ca 0.00 -0.98 -0.17 0.00 -0.26 0.00 0.00 58.87 57.46 2hct n SER 213 Cb 0.00 -0.25 0.00 0.00 -0.26 0.00 0.00 64.21 63.71 2hct n SER 213 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2hct n LYS 214 N 0.80 1.94 0.22 4.33 4.01 -1.26 -5.02 118.16 123.18 2hct n LYS 214 Ca 0.00 -3.78 -0.17 0.00 -0.51 0.00 0.00 58.31 53.85 2hct n LYS 214 Cb 0.24 -1.70 -0.09 0.00 -0.51 0.00 0.00 35.03 32.97 2hct n LYS 214 CO 0.00 0.00 0.00 0.82 -1.11 0.00 0.00 177.40 177.11 2hct h ILE 215 N 2.53 0.08 -3.72 -0.18 2.04 -1.76 -3.35 117.51 113.15 2hct h ILE 215 Ca 0.07 0.00 -0.67 0.00 1.00 0.00 0.00 64.86 65.25 2hct h ILE 215 Cb 1.00 0.08 -0.19 0.00 -0.74 0.00 0.00 36.82 36.97 2hct h ILE 215 CO 0.63 0.00 -0.47 0.12 0.00 0.00 0.00 178.15 178.43 2hct s PHE 216 N -5.88 3.23 -0.36 1.37 5.36 -1.26 -4.60 117.98 115.84 2hct s PHE 216 Ca -0.17 -0.18 -0.11 0.00 -0.96 0.00 0.00 56.93 55.51 2hct s PHE 216 Cb 0.06 -2.49 0.02 0.00 -0.34 0.00 0.00 43.02 40.26 2hct s PHE 216 CO 0.62 -0.36 0.20 0.34 -1.46 0.00 0.00 175.22 174.55 2hct s ASP 217 N 1.72 5.70 0.64 6.13 2.15 -1.26 -4.88 116.67 126.88 2hct s ASP 217 Ca 0.07 -0.83 0.41 0.00 0.43 0.00 0.00 52.55 52.62 2hct s ASP 217 Cb -0.17 -2.03 2.23 0.00 -0.30 0.00 0.00 42.92 42.65 2hct s ASP 217 CO 0.11 -0.33 2.26 0.50 -0.17 0.00 0.00 175.17 177.54 2hct h LYS 218 N 8.42 0.00 0.00 4.34 3.64 -1.96 -1.49 116.57 129.52 2hct h LYS 218 Ca -0.28 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.08 2hct h LYS 218 Cb 1.12 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.94 2hct h LYS 218 CO 0.65 0.00 -0.09 -0.44 -2.27 0.00 0.00 179.45 177.30 2hct h ASP 219 N 0.00 0.00 -3.73 4.20 3.32 -1.92 -3.24 116.42 115.05 2hct h ASP 219 Ca 0.00 0.00 -0.44 0.00 0.02 0.00 0.00 57.03 56.61 2hct h ASP 219 Cb 0.09 0.00 0.17 0.00 0.22 0.00 0.00 39.33 39.81 2hct h ASP 219 CO 0.00 0.09 0.16 -0.94 -1.72 0.00 0.00 179.24 176.84 2hct s SER 220 N -6.23 2.02 0.22 6.45 1.04 -0.56 -4.68 113.70 111.96 2hct s SER 220 Ca 0.06 1.05 -0.08 0.00 0.48 0.00 0.00 55.95 57.46 2hct s SER 220 Cb 0.06 -1.62 0.19 0.00 0.10 0.00 0.00 66.02 64.75 2hct s SER 220 CO 0.68 -3.49 1.85 0.74 0.98 0.00 0.00 173.24 174.00 2hct h THR 221 N -2.14 1.25 -0.15 2.02 2.02 -1.92 -0.17 112.91 113.81 2hct h THR 221 Ca -0.53 -0.58 -0.03 0.00 0.77 0.00 0.00 66.41 66.04 2hct h THR 221 Cb 1.33 0.08 -0.01 0.00 -1.74 0.00 0.00 68.15 67.81 2hct h THR 221 CO 0.52 0.27 -0.00 0.15 0.37 0.00 0.00 175.52 176.82 2hct h PHE 222 N 1.19 0.30 -0.09 3.16 3.57 -1.89 -0.48 116.94 122.69 2hct h PHE 222 Ca 0.30 -0.05 -0.06 0.00 3.53 0.00 0.00 57.97 61.69 2hct h PHE 222 Cb 0.00 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.65 2hct h PHE 222 CO 0.00 0.50 -0.23 0.78 -2.23 0.00 0.00 178.31 177.13 2hct h GLY 223 N 0.01 0.16 0.00 2.40 0.00 -1.62 0.10 103.07 104.12 2hct h GLY 223 Ca 0.04 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.26 2hct h GLY 223 CO 0.01 0.10 -0.76 -1.14 0.00 0.00 0.00 176.54 174.76 2hct n SER 224 N -4.21 1.46 0.01 0.19 3.41 -0.09 -4.60 113.62 109.80 2hct n SER 224 Ca -0.01 -0.42 0.00 0.00 -0.26 0.00 0.00 58.87 58.18 2hct n SER 224 Cb 0.32 1.14 0.00 0.00 -0.26 0.00 0.00 64.21 65.42 2hct n SER 224 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2hct n VAL 225 N -1.41 0.25 0.22 -3.33 0.31 -0.31 -4.81 118.33 109.25 2hct n VAL 225 Ca 0.00 0.08 -0.12 0.00 -0.01 0.00 0.00 64.34 64.30 2hct n VAL 225 Cb 0.15 -1.47 -0.06 0.00 -0.91 0.00 0.00 33.84 31.55 2hct n VAL 225 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 2hct h GLY 226 N 0.00 -1.01 1.07 2.92 0.00 -0.86 -2.70 103.07 102.48 2hct h GLY 226 Ca 0.00 0.45 0.11 0.00 0.00 0.00 0.00 47.33 47.88 2hct h GLY 226 CO 0.00 -0.33 0.36 -0.39 0.00 0.00 0.00 176.54 176.18 2hct h VAL 227 N -0.68 0.48 0.00 4.60 -1.51 -1.06 -2.09 116.25 116.00 2hct h VAL 227 Ca -0.05 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.42 2hct h VAL 227 Cb 0.57 0.72 0.00 0.00 -2.13 0.00 0.00 31.29 30.45 2hct h VAL 227 CO 0.00 0.00 -0.67 1.41 -1.23 0.00 0.00 177.57 177.08 2hct n HIS 228 N -3.88 0.07 -0.38 5.19 8.25 -1.09 -3.80 115.22 119.58 2hct n HIS 228 Ca 0.06 0.02 0.05 0.00 -0.26 0.00 0.00 57.72 57.59 2hct n HIS 228 Cb 0.53 -0.25 0.13 0.00 1.12 0.00 0.00 29.99 31.53 2hct n HIS 228 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2hct n ASN 229 N -1.60 2.82 -4.63 0.41 3.02 -0.79 -4.91 115.26 109.58 2hct n ASN 229 Ca 0.05 -2.30 -0.43 0.00 -0.03 0.00 0.00 54.58 51.86 2hct n ASN 229 Cb 0.35 -0.25 -0.02 0.00 -0.61 0.00 0.00 39.78 39.25 2hct n ASN 229 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2hct s LEU 230 N -1.54 3.86 -0.33 3.41 1.43 -1.19 -2.88 118.68 121.44 2hct s LEU 230 Ca 0.22 1.01 -0.21 0.00 -1.03 0.00 0.00 54.13 54.12 2hct s LEU 230 Cb 0.15 -3.54 -0.00 0.00 0.03 0.00 0.00 46.19 42.82 2hct s LEU 230 CO 0.09 -1.03 0.67 -1.10 0.23 0.00 0.00 176.35 175.22 2hct s GLN 231 N 4.00 3.80 0.00 1.70 -1.52 -1.26 -4.95 119.66 121.43 2hct s GLN 231 Ca 0.50 0.24 0.06 0.00 -1.95 0.00 0.00 55.36 54.21 2hct s GLN 231 Cb -0.13 -3.77 0.29 0.00 -0.22 0.00 0.00 33.01 29.17 2hct s GLN 231 CO 0.21 -0.69 1.07 -0.35 -0.25 0.00 0.00 175.29 175.29 2hct n PRO 232 N 6.07 0.06 0.03 2.91 -0.04 -1.26 0.06 135.00 142.82 2hct n PRO 232 Ca 0.00 0.27 0.13 0.00 -0.04 0.00 0.00 63.50 63.86 2hct n PRO 232 Cb 0.49 -1.50 0.42 0.00 -0.04 0.00 0.00 33.50 32.87 2hct n PRO 232 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2hct n GLU 233 N -1.34 0.08 -0.00 0.54 4.71 -1.26 -4.05 120.64 119.32 2hct n GLU 233 Ca 0.02 0.05 -0.00 0.00 -0.01 0.00 0.00 57.16 57.22 2hct n GLU 233 Cb 0.05 -1.57 -0.00 0.00 -1.01 0.00 0.00 31.44 28.91 2hct n GLU 233 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 2hct n LYS 234 N -1.71 2.17 -3.88 3.49 5.02 0.46 -5.03 118.16 118.68 2hct n LYS 234 Ca 0.06 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 55.99 2hct n LYS 234 Cb 0.37 -1.00 -0.13 0.00 -0.02 0.00 0.00 35.03 34.25 2hct n LYS 234 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2hct s VAL 235 N -2.00 4.04 -0.12 -0.18 1.01 0.11 0.15 120.40 123.41 2hct s VAL 235 Ca -0.00 -0.27 -0.00 0.00 0.00 0.00 0.00 61.98 61.71 2hct s VAL 235 Cb 0.00 -2.86 -0.25 0.00 0.00 0.00 0.00 36.38 33.28 2hct s VAL 235 CO 0.00 0.38 0.38 0.00 0.00 0.00 0.00 175.10 175.86 2hct n GLN 236 N 4.66 0.72 -3.83 2.72 10.64 0.35 -4.39 117.38 128.24 2hct n GLN 236 Ca -0.17 0.25 -0.13 0.00 -1.83 0.00 0.00 57.00 55.12 2hct n GLN 236 Cb 0.51 -1.71 -0.15 0.00 -0.86 0.00 0.00 30.24 28.04 2hct n GLN 236 CO 0.00 0.00 0.00 0.99 -1.83 0.00 0.00 177.06 176.22 2hct s THR 237 N -2.56 -0.02 -0.39 -0.39 2.01 -1.04 -0.73 115.64 112.51 2hct s THR 237 Ca -0.19 0.08 -0.10 0.00 0.31 0.00 0.00 61.69 61.79 2hct s THR 237 Cb 0.07 -0.04 0.05 0.00 0.01 0.00 0.00 72.50 72.59 2hct s THR 237 CO 0.77 0.03 0.23 -0.22 -0.69 0.00 0.00 174.62 174.74 2hct s LEU 238 N 0.38 4.90 -0.28 4.42 2.96 -0.30 -0.00 118.68 130.76 2hct s LEU 238 Ca -0.03 -1.19 -0.15 0.00 -0.22 0.00 0.00 54.13 52.53 2hct s LEU 238 Cb -0.05 -2.01 -0.03 0.00 0.50 0.00 0.00 46.19 44.60 2hct s LEU 238 CO -0.01 -0.45 0.40 -0.70 -1.32 0.00 0.00 176.35 174.27 2hct s GLU 239 N 1.51 3.95 -0.03 1.98 2.12 0.20 -1.79 118.70 126.64 2hct s GLU 239 Ca 0.02 0.01 -0.14 0.00 0.36 0.00 0.00 54.97 55.22 2hct s GLU 239 Cb -0.21 -3.68 -0.05 0.00 0.26 0.00 0.00 34.13 30.45 2hct s GLU 239 CO 0.05 -0.34 0.37 0.00 -0.54 0.00 0.00 175.26 174.80 2hct s ALA 240 N 2.12 3.70 -0.22 6.30 0.00 0.31 -0.78 121.76 133.18 2hct s ALA 240 Ca 0.16 -0.29 -0.04 0.00 0.00 0.00 0.00 51.96 51.79 2hct s ALA 240 Cb -0.16 -2.35 -0.01 0.00 0.00 0.00 0.00 23.12 20.60 2hct s ALA 240 CO 0.10 0.44 -0.04 -1.58 0.00 0.00 0.00 175.76 174.68 2hct s TRP 241 N -0.84 2.97 -0.26 0.00 0.51 0.80 -0.34 118.94 121.78 2hct s TRP 241 Ca 0.22 -0.95 -0.09 0.00 -2.12 0.00 0.00 56.10 53.15 2hct s TRP 241 Cb -0.16 -2.11 -0.04 0.00 -0.81 0.00 0.00 33.47 30.35 2hct s TRP 241 CO 0.11 -0.55 0.14 0.08 -0.51 0.00 0.00 176.95 176.22 2hct s VAL 242 N 1.48 4.96 -0.34 4.03 1.01 -0.22 -1.02 120.40 130.29 2hct s VAL 242 Ca 0.06 0.05 -0.18 0.00 0.00 0.00 0.00 61.98 61.90 2hct s VAL 242 Cb -0.14 -3.33 -0.00 0.00 0.00 0.00 0.00 36.38 32.90 2hct s VAL 242 CO -0.03 0.31 0.53 -0.63 0.00 0.00 0.00 175.10 175.28 2hct s ILE 243 N 1.52 5.00 0.52 2.22 -1.09 -0.76 -1.98 121.20 126.63 2hct s ILE 243 Ca 0.07 0.41 -0.09 0.00 -2.23 0.00 0.00 60.65 58.81 2hct s ILE 243 Cb -0.15 -3.97 0.13 0.00 -1.58 0.00 0.00 42.46 36.89 2hct s ILE 243 CO 0.07 -0.21 0.35 1.41 -1.23 0.00 0.00 174.94 175.32 2hct n HIS 244 N 5.78 -2.87 -3.71 3.97 8.25 -0.65 -0.95 115.22 125.03 2hct n HIS 244 Ca -0.04 -0.32 -0.34 0.00 -0.26 0.00 0.00 57.72 56.76 2hct n HIS 244 Cb 0.49 -0.45 -0.08 0.00 1.12 0.00 0.00 29.99 31.07 2hct n HIS 244 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2hct s GLY 245 N -2.66 3.03 0.00 -1.41 0.00 -1.26 -4.73 107.32 100.30 2hct s GLY 245 Ca 0.25 -3.83 0.00 0.00 0.00 0.00 0.00 44.72 41.14 2hct s GLY 245 CO 0.20 1.16 0.00 0.61 0.00 0.00 0.00 173.10 175.08 2hct n GLY 246 N 2.25 2.59 3.06 0.20 0.00 -1.26 -4.68 105.19 107.34 2hct n GLY 246 Ca 0.21 0.03 -0.16 0.00 0.00 0.00 0.00 46.02 46.10 2hct n GLY 246 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2hct n ARG 247 N 7.03 0.58 -1.30 1.61 0.63 -1.26 -4.32 116.66 119.62 2hct n ARG 247 Ca 0.00 -2.40 0.00 0.00 -0.92 0.00 0.00 57.85 54.53 2hct n ARG 247 Cb 0.00 -0.25 0.00 0.00 0.45 0.00 0.00 32.46 32.66 2hct n ARG 247 CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21 2hct n GLU 248 N -2.07 0.00 -2.25 -0.14 2.13 -1.26 -4.90 120.64 112.15 2hct n GLU 248 Ca 0.13 0.43 -0.33 0.00 0.66 0.00 0.00 57.16 58.05 2hct n GLU 248 Cb 0.47 -0.87 -0.04 0.00 0.27 0.00 0.00 31.44 31.27 2hct n GLU 248 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 2hct s ASP 249 N 0.00 5.66 -1.23 4.31 3.68 -1.26 -4.81 116.67 123.02 2hct s ASP 249 Ca 0.00 -1.84 -0.11 0.00 2.13 0.00 0.00 52.55 52.73 2hct s ASP 249 Cb 0.00 -2.58 0.19 0.00 -1.45 0.00 0.00 42.92 39.07 2hct s ASP 249 CO 0.00 -2.40 1.60 -1.54 0.13 0.00 0.00 175.17 172.95 2hct n SER 250 N 12.28 5.27 -1.74 -0.34 3.41 -1.26 -4.95 113.62 126.29 2hct n SER 250 Ca 0.45 -3.06 0.00 0.00 -0.26 0.00 0.00 58.87 56.00 2hct n SER 250 Cb 0.47 -1.50 0.00 0.00 -0.26 0.00 0.00 64.21 62.91 2hct n SER 250 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 2hct n ARG 251 N 4.47 -4.26 -0.95 4.33 -4.01 -1.26 -4.67 116.66 110.30 2hct n ARG 251 Ca 0.37 3.12 -0.17 0.00 -1.04 0.00 0.00 57.85 60.12 2hct n ARG 251 Cb 0.39 -3.57 -0.13 0.00 -3.04 0.00 0.00 32.46 26.11 2hct n ARG 251 CO 0.00 0.00 0.00 -3.47 -3.04 0.00 0.00 177.63 171.12 2hct n ASP 252 N -0.17 -0.62 0.00 2.89 -0.08 -1.26 -4.74 116.55 112.57 2hct n ASP 252 Ca 0.00 -0.22 0.10 0.00 -1.51 0.00 0.00 54.79 53.17 2hct n ASP 252 Cb 0.00 -0.41 0.52 0.00 2.34 0.00 0.00 41.12 43.57 2hct n ASP 252 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 2hct n LEU 253 N 4.39 0.00 0.12 -2.67 4.77 -1.26 -2.92 117.00 119.44 2hct n LEU 253 Ca 0.43 0.34 0.12 0.00 -0.03 0.00 0.00 56.01 56.87 2hct n LEU 253 Cb 0.07 -0.34 0.46 0.00 -2.33 0.00 0.00 43.42 41.28 2hct n LEU 253 CO 0.67 -0.10 0.87 0.00 -1.33 0.00 0.00 177.39 177.50 2hct n GLN 255 N -2.28 3.33 -2.29 0.00 1.13 -1.15 -4.62 117.38 111.51 2hct n GLN 255 Ca 0.03 -2.13 -0.41 0.00 -1.94 0.00 0.00 57.00 52.56 2hct n GLN 255 Cb 0.31 -1.87 -0.03 0.00 0.11 0.00 0.00 30.24 28.76 2hct n GLN 255 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 2hct s ASP 256 N -0.67 7.01 0.20 1.08 -1.08 -1.15 -4.90 116.67 117.16 2hct s ASP 256 Ca 0.37 2.47 -0.17 0.00 -0.52 0.00 0.00 52.55 54.71 2hct s ASP 256 Cb 0.26 -2.64 0.20 0.00 -1.46 0.00 0.00 42.92 39.28 2hct s ASP 256 CO 0.15 -0.35 1.60 1.55 0.52 0.00 0.00 175.17 178.64 2hct h PRO 257 N 3.77 -0.08 -0.26 4.34 0.13 -1.92 -0.09 132.00 137.89 2hct h PRO 257 Ca -0.48 0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 64.65 2hct h PRO 257 Cb 1.22 0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.35 2hct h PRO 257 CO 0.67 -0.05 0.12 1.79 -0.23 0.00 0.00 178.00 180.30 2hct h THR 258 N -0.08 1.10 -0.13 1.56 1.35 -1.93 0.31 112.91 115.08 2hct h THR 258 Ca 0.28 -0.28 -0.03 0.00 -0.55 0.00 0.00 66.41 65.83 2hct h THR 258 Cb 0.53 0.77 -0.00 0.00 -1.73 0.00 0.00 68.15 67.72 2hct h THR 258 CO -0.69 0.11 -0.04 0.40 -0.25 0.00 0.00 175.52 175.05 2hct h ILE 259 N 0.36 1.30 -0.11 6.82 1.08 -1.73 -1.06 117.51 124.16 2hct h ILE 259 Ca 0.09 -1.02 0.03 0.00 -0.39 0.00 0.00 64.86 63.58 2hct h ILE 259 Cb 0.05 1.71 -0.00 0.00 -3.07 0.00 0.00 36.82 35.50 2hct h ILE 259 CO -0.01 0.29 0.09 0.11 -0.69 0.00 0.00 178.15 177.94 2hct h LYS 260 N -0.06 0.00 0.30 2.37 1.79 0.30 0.41 116.57 121.67 2hct h LYS 260 Ca 0.03 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.49 2hct h LYS 260 Cb 0.48 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.13 2hct h LYS 260 CO 0.02 0.00 -0.15 1.49 -1.08 0.00 0.00 179.45 179.73 2hct h GLU 261 N 0.00 -0.39 -0.81 3.15 4.81 -0.34 -2.52 114.58 118.47 2hct h GLU 261 Ca 0.05 0.03 0.20 0.00 -0.13 0.00 0.00 59.36 59.51 2hct h GLU 261 Cb 0.24 0.09 -0.13 0.00 0.63 0.00 0.00 28.75 29.58 2hct h GLU 261 CO -0.00 -0.23 0.18 1.25 -0.73 0.00 0.00 179.01 179.48 2hct h LEU 262 N -1.10 -0.04 -0.18 1.64 5.85 -0.94 -1.34 115.31 119.20 2hct h LEU 262 Ca -0.04 0.18 0.04 0.00 0.84 0.00 0.00 57.88 58.90 2hct h LEU 262 Cb 0.34 0.25 -0.07 0.00 0.37 0.00 0.00 40.66 41.55 2hct h LEU 262 CO 0.07 -0.11 -0.46 -0.08 -0.34 0.00 0.00 178.44 177.51 2hct h GLU 263 N 0.22 -0.48 0.00 1.25 4.81 -0.25 -1.94 114.58 118.20 2hct h GLU 263 Ca 0.48 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.75 2hct h GLU 263 Cb 0.91 0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.40 2hct h GLU 263 CO -0.61 -0.32 0.00 1.03 -0.73 0.00 0.00 179.01 178.39 2hct h SER 264 N -0.49 0.00 0.13 1.04 0.87 -0.81 -1.45 113.55 112.84 2hct h SER 264 Ca 0.07 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.63 2hct h SER 264 Cb 0.64 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.60 2hct h SER 264 CO -0.44 0.00 -0.06 0.40 -0.53 0.00 0.00 176.83 176.20 2hct h ILE 265 N 0.00 0.00 0.00 2.23 2.04 -0.61 -2.77 117.51 118.40 2hct h ILE 265 Ca 0.00 -0.73 -0.02 0.00 1.00 0.00 0.00 64.86 65.11 2hct h ILE 265 Cb 0.27 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.35 2hct h ILE 265 CO 0.00 0.00 -0.11 0.16 0.00 0.00 0.00 178.15 178.20 2hct h ILE 266 N -0.90 0.72 -0.77 -0.67 -0.00 -1.36 -0.23 117.51 114.30 2hct h ILE 266 Ca -0.02 -0.45 -0.04 0.00 -0.00 0.00 0.00 64.86 64.36 2hct h ILE 266 Cb 0.13 1.27 -0.03 0.00 -0.00 0.00 0.00 36.82 38.19 2hct h ILE 266 CO 0.03 0.11 0.32 0.28 -0.00 0.00 0.00 178.15 178.89 2hct h SER 267 N 0.00 1.05 0.39 2.16 0.02 -1.28 0.81 113.55 116.71 2hct h SER 267 Ca -0.00 -0.15 -0.09 0.00 -0.84 0.00 0.00 61.79 60.71 2hct h SER 267 Cb 0.26 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.52 2hct h SER 267 CO 0.01 0.92 -0.41 0.11 -1.14 0.00 0.00 176.83 176.32 2hct h LYS 268 N 1.12 0.03 -0.00 3.45 6.56 -0.75 -1.73 116.57 125.23 2hct h LYS 268 Ca 0.26 -0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.84 2hct h LYS 268 Cb 0.19 -0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.85 2hct h LYS 268 CO -0.02 0.43 0.00 0.54 -2.06 0.00 0.00 179.45 178.34 2hct n ARG 269 N -4.05 1.01 -3.38 3.15 1.74 -0.87 -4.91 116.66 109.35 2hct n ARG 269 Ca -0.02 -0.01 -0.17 0.00 -0.77 0.00 0.00 57.85 56.88 2hct n ARG 269 Cb 0.44 -1.21 0.08 0.00 -1.02 0.00 0.00 32.46 30.76 2hct n ARG 269 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2hct n ASN 270 N -0.69 -3.70 -4.01 0.55 4.05 -0.65 -4.55 115.26 106.25 2hct n ASN 270 Ca 0.10 -0.66 -0.24 0.00 0.45 0.00 0.00 54.58 54.23 2hct n ASN 270 Cb 0.05 -5.10 -0.16 0.00 1.23 0.00 0.00 39.78 35.79 2hct n ASN 270 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 2hct s ILE 271 N -3.38 1.05 0.45 -1.44 1.01 0.25 -4.82 121.20 114.32 2hct s ILE 271 Ca 0.17 -0.44 -0.25 0.00 0.00 0.00 0.00 60.65 60.13 2hct s ILE 271 Cb -0.02 -0.97 -0.09 0.00 0.01 0.00 0.00 42.46 41.39 2hct s ILE 271 CO 0.74 0.34 1.37 0.00 0.00 0.00 0.00 174.94 177.39 2hct n GLN 272 N 3.81 2.12 -4.10 2.79 6.02 0.09 -3.40 117.38 124.71 2hct n GLN 272 Ca -0.23 0.76 -0.34 0.00 -0.01 0.00 0.00 57.00 57.17 2hct n GLN 272 Cb 0.52 -2.54 -0.15 0.00 1.02 0.00 0.00 30.24 29.09 2hct n GLN 272 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.06 176.17 2hct s PHE 273 N -1.20 2.88 0.12 1.08 5.36 -1.26 -1.15 117.98 123.81 2hct s PHE 273 Ca 0.61 -1.11 0.09 0.00 -0.96 0.00 0.00 56.93 55.56 2hct s PHE 273 Cb -0.47 -2.01 -0.04 0.00 -0.34 0.00 0.00 43.02 40.16 2hct s PHE 273 CO 0.57 -0.58 -0.17 0.45 -1.46 0.00 0.00 175.22 174.04 2hct s SER 274 N 1.26 3.96 -0.01 6.13 0.15 -0.74 -4.99 113.70 119.47 2hct s SER 274 Ca 0.03 -0.54 0.00 0.00 0.70 0.00 0.00 55.95 56.15 2hct s SER 274 Cb -0.14 -0.59 0.00 0.00 -1.71 0.00 0.00 66.02 63.59 2hct s SER 274 CO -0.05 0.18 -0.01 0.00 1.20 0.00 0.00 173.24 174.56 2hct s LYS 276 N 0.14 0.76 -0.36 0.00 -0.14 0.54 -4.94 119.74 115.74 2hct s LYS 276 Ca -0.01 -1.00 -0.10 0.00 -1.36 0.00 0.00 55.97 53.50 2hct s LYS 276 Cb -0.03 -0.56 0.02 0.00 -1.68 0.00 0.00 37.83 35.59 2hct s LYS 276 CO -0.00 0.10 0.19 -0.80 -0.76 0.00 0.00 175.35 174.08 2hct s ASN 277 N -2.02 5.67 -0.62 2.83 0.01 -1.26 -1.06 114.94 118.49 2hct s ASN 277 Ca -0.01 -0.94 -0.25 0.00 -0.71 0.00 0.00 52.86 50.95 2hct s ASN 277 Cb -0.07 -2.01 0.05 0.00 0.41 0.00 0.00 41.25 39.63 2hct s ASN 277 CO 0.01 -0.35 1.05 -0.63 -1.51 0.00 0.00 177.10 175.66 2hct s ILE 278 N 1.55 4.18 0.00 0.60 1.09 -0.84 -4.95 121.20 122.84 2hct s ILE 278 Ca 0.02 0.21 0.00 0.00 -1.10 0.00 0.00 60.65 59.78 2hct s ILE 278 Cb -0.19 -4.68 0.00 0.00 -1.06 0.00 0.00 42.46 36.53 2hct s ILE 278 CO 0.06 -1.39 0.15 -1.22 -0.10 0.00 0.00 174.94 172.44 2hct n TYR 279 N 8.05 0.00 -2.73 3.97 4.01 -1.26 -1.64 117.16 127.56 2hct n TYR 279 Ca 0.01 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.33 2hct n TYR 279 Cb 0.47 -0.39 -0.03 0.00 -0.31 0.00 0.00 39.34 39.08 2hct n TYR 279 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2hct s ARG 280 N -1.07 3.15 0.44 -0.72 1.81 -1.26 -4.44 118.95 116.85 2hct s ARG 280 Ca 0.00 -0.61 0.11 0.00 -1.72 0.00 0.00 55.73 53.52 2hct s ARG 280 Cb 0.00 -4.23 0.99 0.00 -0.45 0.00 0.00 34.95 31.26 2hct s ARG 280 CO 0.00 -1.96 2.04 -1.35 -0.68 0.00 0.00 175.30 173.35 2hct h PRO 281 N 9.75 0.41 0.64 3.54 0.11 -1.81 0.26 132.00 144.90 2hct h PRO 281 Ca -0.27 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.78 2hct h PRO 281 Cb 1.06 -0.09 0.01 0.00 0.11 0.00 0.00 31.00 32.08 2hct h PRO 281 CO 1.22 0.27 -0.31 -0.44 -0.21 0.00 0.00 178.00 178.54 2hct h ASP 282 N 0.42 -0.72 -0.52 -2.05 5.19 -1.90 -2.38 116.42 114.46 2hct h ASP 282 Ca 0.18 0.01 -0.07 0.00 -0.62 0.00 0.00 57.03 56.53 2hct h ASP 282 Cb 0.21 0.19 -0.02 0.00 0.18 0.00 0.00 39.33 39.88 2hct h ASP 282 CO -0.04 -0.49 0.06 0.11 -3.12 0.00 0.00 179.24 175.75 2hct h LYS 283 N -0.89 0.93 -0.23 3.56 6.56 -1.91 -2.28 116.57 122.31 2hct h LYS 283 Ca -0.09 -0.25 0.05 0.00 -1.06 0.00 0.00 60.65 59.30 2hct h LYS 283 Cb 0.67 -0.11 -0.07 0.00 -0.57 0.00 0.00 32.23 32.14 2hct h LYS 283 CO 0.14 0.89 -0.49 0.35 -2.06 0.00 0.00 179.45 178.28 2hct h PHE 284 N 0.87 -1.45 -0.97 -1.35 3.57 -0.46 -0.43 116.94 116.71 2hct h PHE 284 Ca 0.17 0.06 0.11 0.00 3.53 0.00 0.00 57.97 61.85 2hct h PHE 284 Cb 0.44 0.67 -0.08 0.00 2.79 0.00 0.00 35.95 39.77 2hct h PHE 284 CO 0.03 -0.50 0.62 -0.07 -2.23 0.00 0.00 178.31 176.15 2hct h LEU 285 N -0.48 0.89 0.07 0.59 3.38 -1.29 -1.89 115.31 116.58 2hct h LEU 285 Ca 0.07 0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.10 2hct h LEU 285 Cb 0.64 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.21 2hct h LEU 285 CO -0.48 0.49 -0.25 1.56 0.09 0.00 0.00 178.44 179.85 2hct h GLN 286 N 0.96 -0.41 -0.72 1.13 7.50 -0.72 -1.38 115.11 121.47 2hct h GLN 286 Ca 0.47 0.03 -0.05 0.00 0.50 0.00 0.00 58.65 59.60 2hct h GLN 286 Cb 0.46 0.09 -0.03 0.00 0.05 0.00 0.00 27.48 28.05 2hct h GLN 286 CO -0.23 -0.28 0.26 0.00 -1.50 0.00 0.00 178.83 177.08 2hct h VAL 288 N 1.05 1.17 -0.04 0.00 2.07 -1.34 -3.09 116.25 116.07 2hct h VAL 288 Ca 0.24 -0.39 -0.01 0.00 0.82 0.00 0.00 66.70 67.36 2hct h VAL 288 Cb 0.26 0.40 -0.00 0.00 -1.52 0.00 0.00 31.29 30.42 2hct h VAL 288 CO -0.01 0.18 -0.00 0.50 0.02 0.00 0.00 177.57 178.25 2hct h LYS 289 N 0.77 0.08 -4.69 1.57 3.64 -0.69 -3.41 116.57 113.85 2hct h LYS 289 Ca 0.20 -0.03 -0.66 0.00 -1.27 0.00 0.00 60.65 58.90 2hct h LYS 289 Cb -0.01 -0.01 -0.39 0.00 -0.41 0.00 0.00 32.23 31.41 2hct h LYS 289 CO -0.04 0.37 -0.75 -0.80 -2.27 0.00 0.00 179.45 175.96 2hct s ASN 290 N -5.60 4.57 0.46 4.20 -0.87 0.96 -5.09 114.94 113.57 2hct s ASN 290 Ca -0.15 -1.82 -0.25 0.00 -1.57 0.00 0.00 52.86 49.08 2hct s ASN 290 Cb 0.04 -1.54 -0.08 0.00 -0.02 0.00 0.00 41.25 39.65 2hct s ASN 290 CO 0.68 -0.31 1.37 -2.16 -2.57 0.00 0.00 177.10 174.11 2hct s PRO 291 N 1.03 3.64 -0.57 -0.60 0.05 -1.17 -3.80 135.00 133.58 2hct s PRO 291 Ca 0.03 2.28 -0.17 0.00 0.05 0.00 0.00 61.00 63.19 2hct s PRO 291 Cb -0.19 -2.58 0.02 0.00 0.05 0.00 0.00 34.50 31.80 2hct s PRO 291 CO -0.08 -0.80 0.64 -0.85 0.05 0.00 0.00 177.00 175.96 2hct n GLU 292 N -0.31 -1.90 0.00 4.56 -0.00 -1.26 -5.01 120.64 116.73 2hct n GLU 292 Ca 0.06 1.56 0.00 0.00 -0.00 0.00 0.00 57.16 58.78 2hct n GLU 292 Cb 0.43 -4.03 0.00 0.00 -0.00 0.00 0.00 31.44 27.84 2hct n GLU 292 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.13 176.73 2hct n ASP 293 N -0.97 0.00 0.00 -1.84 5.75 -1.25 -5.16 116.55 113.08 2hct n ASP 293 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.74 2hct n ASP 293 Cb 0.58 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.67 2hct n ASP 293 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 2hct n SER 294 N 0.00 0.00 0.04 -1.12 2.88 -1.26 -4.60 113.62 109.55 2hct n SER 294 Ca 0.00 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.65 2hct n SER 294 Cb 0.00 0.00 0.07 0.00 -0.75 0.00 0.00 64.21 63.53 2hct n SER 294 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2hct n SER 295 N 0.00 0.64 0.00 -3.46 7.64 -1.26 -5.18 113.62 112.00 2hct n SER 295 Ca 0.00 -0.10 0.10 0.00 1.01 0.00 0.00 58.87 59.87 2hct n SER 295 Cb 0.00 0.59 0.58 0.00 -1.01 0.00 0.00 64.21 64.36 2hct n SER 295 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03