#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ntm n HIS 2 N 0.00 0.00 0.52 0.66 1.44 -1.26 -2.99 115.22 113.59 1ntm n HIS 2 Ca 0.00 0.00 0.10 0.00 -2.01 0.00 0.00 57.72 55.81 1ntm n HIS 2 Cb 0.00 -0.44 0.43 0.00 0.12 0.00 0.00 29.99 30.10 1ntm n HIS 2 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 1ntm n THR 3 N -1.48 0.78 1.67 0.61 -2.24 -1.26 -2.09 114.28 110.27 1ntm n THR 3 Ca 0.07 0.15 0.15 0.00 -2.27 0.00 0.00 64.05 62.16 1ntm n THR 3 Cb 0.33 -0.97 0.82 0.00 -2.10 0.00 0.00 70.33 68.41 1ntm n THR 3 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1ntm n ASP 4 N -1.90 0.10 -4.53 3.42 10.43 -1.16 -4.78 116.55 118.13 1ntm n ASP 4 Ca 0.03 -0.60 -0.43 0.00 2.57 0.00 0.00 54.79 56.37 1ntm n ASP 4 Cb 0.24 -0.13 -0.04 0.00 1.84 0.00 0.00 41.12 43.03 1ntm n ASP 4 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 1ntm s ILE 5 N -2.30 4.37 -0.00 0.53 1.01 -0.89 -5.00 121.20 118.92 1ntm s ILE 5 Ca 0.37 0.34 0.04 0.00 0.00 0.00 0.00 60.65 61.40 1ntm s ILE 5 Cb 0.21 -4.54 -0.03 0.00 0.01 0.00 0.00 42.46 38.10 1ntm s ILE 5 CO 0.42 -1.11 -0.09 -0.75 0.00 0.00 0.00 174.94 173.41 1ntm s LYS 6 N 3.99 2.48 0.07 2.79 2.20 -1.26 -5.10 119.74 124.91 1ntm s LYS 6 Ca 0.31 -0.75 -0.31 0.00 -0.36 0.00 0.00 55.97 54.87 1ntm s LYS 6 Cb -0.12 -2.45 -0.06 0.00 -1.51 0.00 0.00 37.83 33.69 1ntm s LYS 6 CO 0.20 0.60 1.24 0.08 -0.36 0.00 0.00 175.35 177.10 1ntm s VAL 7 N -0.95 3.90 0.58 4.02 1.01 -1.26 -4.99 120.40 122.70 1ntm s VAL 7 Ca 0.16 1.36 -0.19 0.00 0.00 0.00 0.00 61.98 63.30 1ntm s VAL 7 Cb -0.11 -3.87 -0.06 0.00 0.00 0.00 0.00 36.38 32.34 1ntm s VAL 7 CO 0.06 0.11 0.99 -2.65 0.00 0.00 0.00 175.10 173.61 1ntm n PRO 8 N 3.94 1.00 -2.01 2.72 -0.02 -1.26 -4.88 135.00 134.48 1ntm n PRO 8 Ca 0.09 0.38 -0.42 0.00 -2.02 0.00 0.00 63.50 61.54 1ntm n PRO 8 Cb 0.46 -2.17 -0.03 0.00 -0.02 0.00 0.00 33.50 31.73 1ntm n PRO 8 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1ntm s ASP 9 N -1.16 6.66 0.00 2.55 -1.08 -1.26 -4.91 116.67 117.48 1ntm s ASP 9 Ca 0.74 2.58 0.10 0.00 -0.52 0.00 0.00 52.55 55.45 1ntm s ASP 9 Cb -0.43 -2.60 0.08 0.00 -1.46 0.00 0.00 42.92 38.51 1ntm s ASP 9 CO 0.49 -0.74 0.83 0.49 0.52 0.00 0.00 175.17 176.76 1ntm n PHE 10 N 3.31 0.00 -0.41 -5.34 3.01 -1.26 -4.68 117.46 112.09 1ntm n PHE 10 Ca 0.11 -0.00 0.34 0.00 1.01 0.00 0.00 57.45 58.91 1ntm n PHE 10 Cb 0.40 -0.00 0.62 0.00 -0.01 0.00 0.00 39.48 40.49 1ntm n PHE 10 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 1ntm h SER 11 N 2.04 0.29 -0.13 4.37 0.02 -1.95 0.53 113.55 118.72 1ntm h SER 11 Ca 0.00 0.15 0.04 0.00 -0.84 0.00 0.00 61.79 61.14 1ntm h SER 11 Cb 0.43 0.14 -0.01 0.00 0.14 0.00 0.00 62.40 63.11 1ntm h SER 11 CO 0.00 -0.19 0.13 -0.78 -1.14 0.00 0.00 176.83 174.85 1ntm h ASP 12 N 0.12 0.00 0.00 3.07 3.58 -2.02 -3.06 116.42 118.11 1ntm h ASP 12 Ca 0.80 0.00 0.00 0.00 0.42 0.00 0.00 57.03 58.25 1ntm h ASP 12 Cb 2.38 0.00 0.00 0.00 1.72 0.00 0.00 39.33 43.43 1ntm h ASP 12 CO -0.47 0.00 -1.24 -1.22 -2.88 0.00 0.00 179.24 173.43 1ntm n TYR 13 N -3.90 0.00 -2.00 0.28 4.01 0.18 -5.05 117.16 110.68 1ntm n TYR 13 Ca 0.00 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.35 1ntm n TYR 13 Cb 0.24 -0.16 0.01 0.00 -0.31 0.00 0.00 39.34 39.12 1ntm n TYR 13 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1ntm s ARG 14 N -2.46 3.69 0.80 -0.72 0.52 -0.97 -5.01 118.95 114.80 1ntm s ARG 14 Ca -0.02 2.13 -0.13 0.00 -0.52 0.00 0.00 55.73 57.19 1ntm s ARG 14 Cb 0.05 -2.55 0.08 0.00 0.52 0.00 0.00 34.95 33.05 1ntm s ARG 14 CO 0.34 -0.72 1.19 1.03 0.02 0.00 0.00 175.30 177.16 1ntm s ARG 15 N -2.52 1.71 0.44 3.54 0.52 -1.26 -4.91 118.95 116.46 1ntm s ARG 15 Ca 0.62 1.67 0.18 0.00 -0.52 0.00 0.00 55.73 57.69 1ntm s ARG 15 Cb -0.37 -1.79 1.02 0.00 0.52 0.00 0.00 34.95 34.33 1ntm s ARG 15 CO 0.47 -2.14 1.95 -1.35 0.02 0.00 0.00 175.30 174.24 1ntm h PRO 16 N -0.93 0.00 0.00 3.54 0.11 -1.98 -2.03 132.00 130.72 1ntm h PRO 16 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1ntm h PRO 16 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1ntm h PRO 16 CO 0.47 0.24 0.00 0.93 -0.21 0.00 0.00 178.00 179.42 1ntm h GLU 17 N 0.00 0.00 -1.20 1.05 3.07 -1.99 -3.15 114.58 112.35 1ntm h GLU 17 Ca -0.00 0.00 -0.56 0.00 -0.50 0.00 0.00 59.36 58.30 1ntm h GLU 17 Cb 0.47 0.00 -0.42 0.00 -0.84 0.00 0.00 28.75 27.96 1ntm h GLU 17 CO 0.03 0.00 -0.79 0.28 -1.40 0.00 0.00 179.01 177.13 1ntm n VAL 18 N -2.60 2.33 -0.02 3.13 0.31 -0.76 -4.73 118.33 116.00 1ntm n VAL 18 Ca 0.01 -4.55 0.09 0.00 -0.01 0.00 0.00 64.34 59.87 1ntm n VAL 18 Cb 0.23 -1.07 -0.15 0.00 -0.91 0.00 0.00 33.84 31.94 1ntm n VAL 18 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1ntm n LEU 19 N -0.54 0.00 -4.61 7.52 4.77 -1.19 -4.75 117.00 118.20 1ntm n LEU 19 Ca 0.38 0.00 -0.39 0.00 -0.03 0.00 0.00 56.01 55.98 1ntm n LEU 19 Cb 0.78 0.03 -0.09 0.00 -2.33 0.00 0.00 43.42 41.81 1ntm n LEU 19 CO 0.34 0.03 0.02 -0.62 -1.33 0.00 0.00 177.39 175.84 1ntm s ASP 20 N -4.37 6.23 0.40 -1.43 3.68 -1.26 -4.94 116.67 114.98 1ntm s ASP 20 Ca -0.07 0.26 0.16 0.00 2.13 0.00 0.00 52.55 55.02 1ntm s ASP 20 Cb 0.12 -2.19 0.84 0.00 -1.45 0.00 0.00 42.92 40.24 1ntm s ASP 20 CO 0.83 -0.14 1.86 0.28 0.13 0.00 0.00 175.17 178.13 1ntm h SER 21 N 8.07 0.00 -0.98 -0.34 0.02 -2.01 -2.71 113.55 115.61 1ntm h SER 21 Ca -0.33 0.00 0.06 0.00 -0.84 0.00 0.00 61.79 60.68 1ntm h SER 21 Cb 1.17 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.64 1ntm h SER 21 CO 0.64 0.32 0.63 0.74 -1.14 0.00 0.00 176.83 178.02 1ntm h THR 22 N 0.00 1.09 -4.18 -2.27 2.02 -2.03 -3.45 112.91 104.10 1ntm h THR 22 Ca -0.00 -0.40 -0.69 0.00 0.77 0.00 0.00 66.41 66.09 1ntm h THR 22 Cb 0.62 -0.16 -0.25 0.00 -1.74 0.00 0.00 68.15 66.62 1ntm h THR 22 CO 0.04 0.21 -0.82 -0.75 0.37 0.00 0.00 175.52 174.57 1ntm s LYS 23 N -6.05 2.21 0.32 6.66 2.20 -1.02 -5.11 119.74 118.95 1ntm s LYS 23 Ca -0.13 -0.88 -0.24 0.00 -0.36 0.00 0.00 55.97 54.36 1ntm s LYS 23 Cb 0.20 -2.20 -0.16 0.00 -1.51 0.00 0.00 37.83 34.16 1ntm s LYS 23 CO 0.81 0.57 0.38 0.43 -0.36 0.00 0.00 175.35 177.18 1ntm n SER 24 N 2.05 -1.71 -0.11 1.43 7.64 -1.26 -4.82 113.62 116.84 1ntm n SER 24 Ca -0.16 0.97 0.12 0.00 1.01 0.00 0.00 58.87 60.80 1ntm n SER 24 Cb 0.52 -0.97 0.17 0.00 -1.01 0.00 0.00 64.21 62.92 1ntm n SER 24 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1ntm n SER 25 N 1.98 0.91 -0.17 6.43 7.64 -1.26 -4.15 113.62 124.99 1ntm n SER 25 Ca 0.14 -0.71 -0.08 0.00 1.01 0.00 0.00 58.87 59.23 1ntm n SER 25 Cb 0.34 0.42 0.01 0.00 -1.01 0.00 0.00 64.21 63.97 1ntm n SER 25 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 1ntm h LYS 26 N 0.55 0.68 -0.93 1.43 1.79 -1.99 -2.15 116.57 115.96 1ntm h LYS 26 Ca 0.00 -0.07 0.13 0.00 -2.18 0.00 0.00 60.65 58.52 1ntm h LYS 26 Cb 0.53 -0.14 -0.07 0.00 -1.58 0.00 0.00 32.23 30.97 1ntm h LYS 26 CO 0.00 0.52 0.59 0.93 -1.08 0.00 0.00 179.45 180.41 1ntm h GLU 27 N 0.65 0.81 -0.14 3.15 5.08 -1.98 -2.57 114.58 119.59 1ntm h GLU 27 Ca 0.17 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1ntm h GLU 27 Cb 0.03 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.09 1ntm h GLU 27 CO -0.03 0.54 0.00 -1.13 -1.00 0.00 0.00 179.01 177.39 1ntm n SER 28 N -4.57 2.72 -0.14 1.42 3.41 -1.15 -4.53 113.62 110.78 1ntm n SER 28 Ca 0.17 -1.81 -0.06 0.00 -0.26 0.00 0.00 58.87 56.92 1ntm n SER 28 Cb 0.39 -0.08 0.03 0.00 -0.26 0.00 0.00 64.21 64.30 1ntm n SER 28 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1ntm h SER 29 N 3.51 0.31 0.48 4.04 4.64 -0.96 0.19 113.55 125.77 1ntm h SER 29 Ca 0.00 0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.33 1ntm h SER 29 Cb 0.78 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 62.82 1ntm h SER 29 CO 0.00 0.22 -0.45 -0.33 -0.87 0.00 0.00 176.83 175.40 1ntm h GLU 30 N 0.44 -0.91 -0.92 4.77 5.08 -1.80 0.24 114.58 121.49 1ntm h GLU 30 Ca 0.19 0.06 0.10 0.00 -1.00 0.00 0.00 59.36 58.71 1ntm h GLU 30 Cb 0.10 0.21 -0.08 0.00 0.50 0.00 0.00 28.75 29.48 1ntm h GLU 30 CO -0.14 -0.60 0.56 0.00 -1.00 0.00 0.00 179.01 177.83 1ntm h ALA 31 N -0.69 1.33 -0.43 3.43 0.00 -1.80 2.53 119.26 123.63 1ntm h ALA 31 Ca -0.05 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 1ntm h ALA 31 Cb 0.82 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1ntm h ALA 31 CO -0.05 0.20 -0.11 0.00 0.00 0.00 0.00 179.25 179.30 1ntm h ARG 32 N 0.93 0.82 -0.22 0.00 3.08 -0.10 0.98 114.38 119.87 1ntm h ARG 32 Ca 0.44 -0.32 -0.13 0.00 0.07 0.00 0.00 59.98 60.05 1ntm h ARG 32 Cb 0.37 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.38 1ntm h ARG 32 CO -0.24 0.94 -0.35 0.87 -1.07 0.00 0.00 179.97 180.12 1ntm h LYS 33 N 0.65 0.62 -0.36 0.04 1.57 0.42 -2.86 116.57 116.65 1ntm h LYS 33 Ca 0.11 -0.38 0.06 0.00 -1.87 0.00 0.00 60.65 58.57 1ntm h LYS 33 Cb 0.64 0.04 -0.09 0.00 0.08 0.00 0.00 32.23 32.90 1ntm h LYS 33 CO 0.04 0.99 -0.43 0.78 -0.57 0.00 0.00 179.45 180.27 1ntm h GLY 34 N 0.31 -0.59 0.08 3.86 0.00 0.45 0.54 103.07 107.73 1ntm h GLY 34 Ca 0.02 0.54 0.04 0.00 0.00 0.00 0.00 47.33 47.93 1ntm h GLY 34 CO 0.08 -0.19 -0.43 -2.75 0.00 0.00 0.00 176.54 173.26 1ntm h PHE 35 N -0.35 -1.22 0.00 5.60 3.04 -0.77 0.19 116.94 123.43 1ntm h PHE 35 Ca 0.13 0.04 -0.06 0.00 3.98 0.00 0.00 57.97 62.06 1ntm h PHE 35 Cb 0.59 0.54 -0.01 0.00 2.56 0.00 0.00 35.95 39.63 1ntm h PHE 35 CO -0.60 -0.49 -0.26 0.77 -2.02 0.00 0.00 178.31 175.71 1ntm h SER 36 N -0.54 0.00 0.72 0.41 0.02 -1.21 -2.61 113.55 110.33 1ntm h SER 36 Ca 0.06 0.00 -0.26 0.00 -0.84 0.00 0.00 61.79 60.75 1ntm h SER 36 Cb 0.64 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.17 1ntm h SER 36 CO -0.36 0.26 -1.22 1.88 -1.14 0.00 0.00 176.83 176.26 1ntm h TYR 37 N 0.00 0.32 -0.71 3.45 0.05 -0.41 -2.99 116.97 116.68 1ntm h TYR 37 Ca -0.00 -0.23 -0.01 0.00 0.05 0.00 0.00 58.73 58.54 1ntm h TYR 37 Cb 0.52 -0.01 -0.03 0.00 1.01 0.00 0.00 36.73 38.22 1ntm h TYR 37 CO 0.00 1.20 0.42 1.25 -1.05 0.00 0.00 178.16 179.98 1ntm h LEU 38 N 0.05 0.86 0.00 3.88 5.85 -0.62 0.37 115.31 125.69 1ntm h LEU 38 Ca -0.11 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.56 1ntm h LEU 38 Cb 1.92 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 42.73 1ntm h LEU 38 CO 0.17 0.67 -0.02 0.58 -0.34 0.00 0.00 178.44 179.50 1ntm h VAL 39 N 0.98 0.95 -0.35 1.05 2.07 -1.43 -0.83 116.25 118.70 1ntm h VAL 39 Ca 0.26 0.00 -0.16 0.00 0.82 0.00 0.00 66.70 67.62 1ntm h VAL 39 Cb -0.02 0.95 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 1ntm h VAL 39 CO -0.05 0.00 -0.39 0.71 0.02 0.00 0.00 177.57 177.86 1ntm h THR 40 N -0.03 1.28 -0.13 2.57 1.35 -1.28 -2.16 112.91 114.50 1ntm h THR 40 Ca 0.01 -1.57 0.05 0.00 -0.55 0.00 0.00 66.41 64.34 1ntm h THR 40 Cb 0.04 1.42 -0.05 0.00 -1.73 0.00 0.00 68.15 67.83 1ntm h THR 40 CO -0.02 0.52 -0.21 0.00 -0.25 0.00 0.00 175.52 175.56 1ntm h ALA 41 N 0.85 -0.16 -0.58 6.62 0.00 0.00 -0.79 119.26 125.19 1ntm h ALA 41 Ca 0.06 0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.05 1ntm h ALA 41 Cb 0.97 0.41 -0.04 0.00 0.00 0.00 0.00 17.79 19.13 1ntm h ALA 41 CO 0.09 -0.66 0.34 1.15 0.00 0.00 0.00 179.25 180.17 1ntm h THR 42 N -0.26 1.03 -0.07 0.00 2.02 -1.13 -1.22 112.91 113.28 1ntm h THR 42 Ca 0.10 -0.23 0.04 0.00 0.77 0.00 0.00 66.41 67.09 1ntm h THR 42 Cb 0.41 0.31 -0.05 0.00 -1.74 0.00 0.00 68.15 67.08 1ntm h THR 42 CO -0.29 0.12 -0.21 0.74 0.37 0.00 0.00 175.52 176.26 1ntm h THR 43 N 0.66 0.49 -0.66 3.16 2.02 -0.82 0.10 112.91 117.86 1ntm h THR 43 Ca 0.25 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.46 1ntm h THR 43 Cb 0.08 0.49 -0.04 0.00 -1.74 0.00 0.00 68.15 66.93 1ntm h THR 43 CO -0.13 0.00 0.40 0.74 0.37 0.00 0.00 175.52 176.90 1ntm h THR 44 N -0.30 1.06 -0.83 3.16 2.02 -0.66 0.28 112.91 117.64 1ntm h THR 44 Ca 0.08 -0.27 0.06 0.00 0.77 0.00 0.00 66.41 67.05 1ntm h THR 44 Cb 0.41 0.22 -0.06 0.00 -1.74 0.00 0.00 68.15 66.98 1ntm h THR 44 CO -0.24 0.14 0.51 0.58 0.37 0.00 0.00 175.52 176.88 1ntm h VAL 45 N 0.78 1.04 0.80 3.16 2.07 -0.78 0.72 116.25 124.05 1ntm h VAL 45 Ca 0.27 -0.32 -0.04 0.00 0.82 0.00 0.00 66.70 67.43 1ntm h VAL 45 Cb 0.05 0.02 0.01 0.00 -1.52 0.00 0.00 31.29 29.85 1ntm h VAL 45 CO -0.12 0.17 -0.39 1.23 0.02 0.00 0.00 177.57 178.49 1ntm h GLY 46 N 0.94 -1.13 0.20 2.17 0.00 0.99 -0.82 103.07 105.43 1ntm h GLY 46 Ca 0.36 0.42 0.19 0.00 0.00 0.00 0.00 47.33 48.30 1ntm h GLY 46 CO -0.17 -0.41 0.61 -2.08 0.00 0.00 0.00 176.54 174.50 1ntm h VAL 47 N -1.28 0.70 0.76 4.60 2.07 -0.26 -1.21 116.25 121.64 1ntm h VAL 47 Ca -0.11 -0.22 -0.04 0.00 0.82 0.00 0.00 66.70 67.15 1ntm h VAL 47 Cb 0.83 0.00 0.01 0.00 -1.52 0.00 0.00 31.29 30.61 1ntm h VAL 47 CO 0.18 0.12 -0.37 0.00 0.02 0.00 0.00 177.57 177.52 1ntm h ALA 48 N 1.62 -1.02 -0.79 1.67 0.00 0.69 0.56 119.26 121.99 1ntm h ALA 48 Ca 0.54 -0.22 0.19 0.00 0.00 0.00 0.00 54.91 55.41 1ntm h ALA 48 Cb 0.99 0.40 -0.13 0.00 0.00 0.00 0.00 17.79 19.04 1ntm h ALA 48 CO -0.30 -1.08 0.07 -0.92 0.00 0.00 0.00 179.25 177.02 1ntm h TYR 49 N -1.02 0.06 -0.02 0.00 3.20 -0.00 0.27 116.97 119.45 1ntm h TYR 49 Ca -0.10 0.05 -0.15 0.00 3.14 0.00 0.00 58.73 61.67 1ntm h TYR 49 Cb 0.79 0.10 -0.02 0.00 1.54 0.00 0.00 36.73 39.14 1ntm h TYR 49 CO -0.02 -0.23 -0.69 0.00 -1.64 0.00 0.00 178.16 175.58 1ntm h ALA 50 N 1.73 0.81 -0.15 1.82 0.00 -0.92 -3.24 119.26 119.31 1ntm h ALA 50 Ca 0.45 -0.61 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 1ntm h ALA 50 Cb 0.82 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1ntm h ALA 50 CO -0.66 0.82 -0.01 0.00 0.00 0.00 0.00 179.25 179.40 1ntm h ALA 51 N 1.22 0.20 0.15 0.00 0.00 0.38 -3.01 119.26 118.20 1ntm h ALA 51 Ca -0.01 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1ntm h ALA 51 Cb 1.22 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 1ntm h ALA 51 CO 0.10 -0.09 -0.08 1.57 0.00 0.00 0.00 179.25 180.75 1ntm h LYS 52 N -0.00 -0.21 -0.65 0.00 2.10 -1.50 -1.46 116.57 114.84 1ntm h LYS 52 Ca 0.04 0.01 0.06 0.00 -2.00 0.00 0.00 60.65 58.77 1ntm h LYS 52 Cb 0.39 0.05 -0.09 0.00 -0.90 0.00 0.00 32.23 31.68 1ntm h LYS 52 CO 0.01 -0.14 -0.50 -0.91 -2.00 0.00 0.00 179.45 175.91 1ntm h ASN 53 N -0.22 -1.78 -0.47 7.07 -0.26 -1.58 1.52 115.58 119.86 1ntm h ASN 53 Ca -0.02 0.26 0.02 0.00 -0.56 0.00 0.00 56.30 56.00 1ntm h ASN 53 Cb 0.18 0.76 -0.03 0.00 -1.06 0.00 0.00 38.32 38.17 1ntm h ASN 53 CO 0.03 -0.26 0.28 0.58 -1.06 0.00 0.00 177.43 177.00 1ntm h VAL 54 N -0.15 1.06 -0.46 2.81 2.07 -1.40 0.22 116.25 120.40 1ntm h VAL 54 Ca 0.11 -0.20 -0.01 0.00 0.82 0.00 0.00 66.70 67.42 1ntm h VAL 54 Cb 0.42 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.61 1ntm h VAL 54 CO -0.69 0.10 0.26 0.58 0.02 0.00 0.00 177.57 177.84 1ntm h VAL 55 N 0.57 1.16 0.40 2.57 2.07 0.17 0.09 116.25 123.28 1ntm h VAL 55 Ca 0.19 -0.41 -0.02 0.00 0.82 0.00 0.00 66.70 67.28 1ntm h VAL 55 Cb 0.00 0.59 0.00 0.00 -1.52 0.00 0.00 31.29 30.37 1ntm h VAL 55 CO -0.08 0.17 -0.19 0.28 0.02 0.00 0.00 177.57 177.77 1ntm h SER 56 N 0.61 -0.45 -0.95 0.57 0.02 0.27 0.26 113.55 113.88 1ntm h SER 56 Ca 0.16 -0.05 0.22 0.00 -0.84 0.00 0.00 61.79 61.28 1ntm h SER 56 Cb 0.04 0.12 -0.12 0.00 0.14 0.00 0.00 62.40 62.58 1ntm h SER 56 CO -0.03 -0.23 0.50 1.56 -1.14 0.00 0.00 176.83 177.50 1ntm h GLN 57 N -0.65 0.52 -0.02 3.45 4.20 -0.46 1.22 115.11 123.37 1ntm h GLN 57 Ca -0.05 -0.03 -0.13 0.00 0.06 0.00 0.00 58.65 58.50 1ntm h GLN 57 Cb 0.48 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.12 1ntm h GLN 57 CO 0.09 0.35 -0.58 0.74 -0.67 0.00 0.00 178.83 178.75 1ntm h PHE 58 N 0.54 0.08 -0.07 2.96 -1.00 -0.40 -2.22 116.94 116.83 1ntm h PHE 58 Ca 0.59 -0.03 -0.03 0.00 2.81 0.00 0.00 57.97 61.30 1ntm h PHE 58 Cb 1.07 -0.01 -0.00 0.00 3.61 0.00 0.00 35.95 40.61 1ntm h PHE 58 CO -0.06 0.63 -0.08 0.28 -1.61 0.00 0.00 178.31 177.46 1ntm h VAL 59 N 0.05 1.38 -0.88 -0.55 2.07 0.35 -3.16 116.25 115.52 1ntm h VAL 59 Ca -0.01 -1.28 0.11 0.00 0.82 0.00 0.00 66.70 66.34 1ntm h VAL 59 Cb 1.04 2.07 -0.06 0.00 -1.52 0.00 0.00 31.29 32.82 1ntm h VAL 59 CO 0.08 0.36 0.57 0.28 0.02 0.00 0.00 177.57 178.87 1ntm h SER 60 N -0.27 0.75 0.00 0.57 0.02 0.13 -2.62 113.55 112.13 1ntm h SER 60 Ca 0.01 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1ntm h SER 60 Cb 0.61 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.02 1ntm h SER 60 CO 0.02 0.43 0.04 -1.54 -1.14 0.00 0.00 176.83 174.64 1ntm n SER 61 N -4.53 0.00 -0.53 3.07 3.41 -0.85 -1.43 113.62 112.76 1ntm n SER 61 Ca 0.15 0.06 0.06 0.00 -0.26 0.00 0.00 58.87 58.88 1ntm n SER 61 Cb 0.35 -0.06 0.19 0.00 -0.26 0.00 0.00 64.21 64.42 1ntm n SER 61 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1ntm n MET 62 N -0.90 1.63 0.00 4.33 2.81 -0.99 -4.97 117.12 119.03 1ntm n MET 62 Ca 0.00 -3.01 0.00 0.00 -1.81 0.00 0.00 57.70 52.88 1ntm n MET 62 Cb 0.04 -1.63 0.00 0.00 -0.71 0.00 0.00 33.22 30.92 1ntm n MET 62 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1ntm n SER 63 N -1.18 0.00 -4.00 7.83 7.64 -0.51 -5.13 113.62 118.27 1ntm n SER 63 Ca 0.20 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.08 1ntm n SER 63 Cb 0.74 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.94 1ntm n SER 63 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ntm n ALA 64 N -2.87 0.00 0.00 -0.43 0.00 -1.26 -4.96 120.51 110.99 1ntm n ALA 64 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1ntm n ALA 64 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1ntm n ALA 64 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1ntm n SER 65 N 0.00 0.00 -1.45 0.00 7.64 -1.26 -4.67 113.62 113.88 1ntm n SER 65 Ca 0.00 0.00 -0.00 0.00 1.01 0.00 0.00 58.87 59.88 1ntm n SER 65 Cb 0.00 0.00 0.22 0.00 -1.01 0.00 0.00 64.21 63.42 1ntm n SER 65 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ntm n ALA 66 N -0.63 3.60 -2.51 -0.43 0.00 -1.26 -4.62 120.51 114.66 1ntm n ALA 66 Ca 0.00 -1.32 -0.33 0.00 0.00 0.00 0.00 53.44 51.79 1ntm n ALA 66 Cb 0.00 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.33 1ntm n ALA 66 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1ntm n ASP 67 N 0.18 5.95 -2.59 0.00 10.43 -1.26 -4.31 116.55 124.95 1ntm n ASP 67 Ca 0.22 -3.73 -0.14 0.00 2.57 0.00 0.00 54.79 53.71 1ntm n ASP 67 Cb 0.93 -0.80 0.02 0.00 1.84 0.00 0.00 41.12 43.11 1ntm n ASP 67 CO 0.00 0.00 0.00 0.52 -1.07 0.00 0.00 177.20 176.65 1ntm n VAL 68 N -0.33 1.53 0.22 2.53 0.31 -1.26 -4.74 118.33 116.59 1ntm n VAL 68 Ca 0.42 -3.62 -0.13 0.00 -0.01 0.00 0.00 64.34 61.00 1ntm n VAL 68 Cb 0.39 0.11 -0.07 0.00 -0.91 0.00 0.00 33.84 33.36 1ntm n VAL 68 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1ntm h LEU 69 N 2.76 -0.51 0.00 7.52 3.38 -1.98 -3.48 115.31 123.00 1ntm h LEU 69 Ca 0.04 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1ntm h LEU 69 Cb 1.16 0.13 0.00 0.00 0.09 0.00 0.00 40.66 42.04 1ntm h LEU 69 CO 0.56 -0.12 0.00 0.00 0.09 0.00 0.00 178.44 178.97 1ntm n ALA 70 N -2.59 -0.52 -3.51 1.53 0.00 -1.26 -4.80 120.51 109.36 1ntm n ALA 70 Ca -0.10 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.18 1ntm n ALA 70 Cb 0.30 -0.12 -0.05 0.00 0.00 0.00 0.00 19.45 19.57 1ntm n ALA 70 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1ntm s MET 71 N -0.25 1.05 0.00 0.00 -1.94 -1.26 -4.82 119.30 112.09 1ntm s MET 71 Ca 0.00 0.13 0.00 0.00 -1.71 0.00 0.00 55.69 54.11 1ntm s MET 71 Cb 0.00 0.50 0.00 0.00 2.01 0.00 0.00 34.83 37.34 1ntm s MET 71 CO 0.00 -0.36 0.00 0.43 -0.01 0.00 0.00 175.02 175.08 1ntm n SER 72 N 0.67 0.00 -3.15 3.03 7.64 -1.26 -4.90 113.62 115.65 1ntm n SER 72 Ca -0.18 0.00 0.04 0.00 1.01 0.00 0.00 58.87 59.74 1ntm n SER 72 Cb 0.58 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.78 1ntm n SER 72 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1ntm s LYS 73 N 0.00 0.53 0.15 1.43 1.02 -1.24 -4.63 119.74 117.00 1ntm s LYS 73 Ca 0.00 0.69 -0.17 0.00 0.02 0.00 0.00 55.97 56.51 1ntm s LYS 73 Cb 0.00 0.35 -0.07 0.00 -0.52 0.00 0.00 37.83 37.59 1ntm s LYS 73 CO 0.00 -0.83 0.60 -1.50 -0.92 0.00 0.00 175.35 172.70 1ntm s ILE 74 N 2.85 4.74 -0.30 2.17 2.07 0.27 -4.83 121.20 128.18 1ntm s ILE 74 Ca 0.14 1.07 -0.02 0.00 -1.41 0.00 0.00 60.65 60.43 1ntm s ILE 74 Cb -0.11 -3.82 0.05 0.00 0.13 0.00 0.00 42.46 38.70 1ntm s ILE 74 CO -0.24 0.33 0.00 -1.61 -1.91 0.00 0.00 174.94 171.51 1ntm s GLU 75 N -1.71 2.48 -0.15 3.50 2.02 -1.26 -1.07 118.70 122.50 1ntm s GLU 75 Ca 0.37 -1.24 -0.01 0.00 0.02 0.00 0.00 54.97 54.11 1ntm s GLU 75 Cb -0.17 -3.19 -0.01 0.00 0.10 0.00 0.00 34.13 30.86 1ntm s GLU 75 CO 0.20 -0.61 -0.11 0.42 0.02 0.00 0.00 175.26 175.18 1ntm s ILE 76 N 1.27 3.17 -0.36 -1.63 1.01 -0.85 -5.00 121.20 118.80 1ntm s ILE 76 Ca -0.05 -0.61 -0.29 0.00 0.00 0.00 0.00 60.65 59.71 1ntm s ILE 76 Cb -0.20 -2.36 0.01 0.00 0.01 0.00 0.00 42.46 39.93 1ntm s ILE 76 CO -0.01 0.50 1.22 -0.75 0.00 0.00 0.00 174.94 175.91 1ntm s LYS 77 N 0.57 3.86 0.34 2.79 2.20 -1.26 -2.49 119.74 125.76 1ntm s LYS 77 Ca -0.07 1.01 0.05 0.00 -0.36 0.00 0.00 55.97 56.60 1ntm s LYS 77 Cb -0.15 -3.87 0.61 0.00 -1.51 0.00 0.00 37.83 32.91 1ntm s LYS 77 CO 0.03 -1.18 1.88 -0.07 -0.36 0.00 0.00 175.35 175.64 1ntm h LEU 78 N 10.93 0.48 0.00 5.43 3.38 -0.18 -2.91 115.31 132.44 1ntm h LEU 78 Ca -0.24 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.64 1ntm h LEU 78 Cb 1.08 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.71 1ntm h LEU 78 CO 1.06 0.55 0.00 -1.54 0.09 0.00 0.00 178.44 178.61 1ntm n SER 79 N -4.28 0.00 0.00 -0.43 3.41 -1.26 -2.00 113.62 109.07 1ntm n SER 79 Ca 0.01 -0.40 0.11 0.00 -0.26 0.00 0.00 58.87 58.33 1ntm n SER 79 Cb 0.25 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.15 1ntm n SER 79 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1ntm n ASP 80 N -0.95 0.73 -4.17 4.04 8.00 -1.10 -4.73 116.55 118.36 1ntm n ASP 80 Ca 0.08 -0.61 -0.38 0.00 0.71 0.00 0.00 54.79 54.59 1ntm n ASP 80 Cb 0.04 0.97 -0.11 0.00 -0.02 0.00 0.00 41.12 42.00 1ntm n ASP 80 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1ntm s ILE 81 N -3.10 3.63 0.94 0.53 1.01 -0.85 -5.10 121.20 118.26 1ntm s ILE 81 Ca 0.06 -1.80 -0.12 0.00 0.00 0.00 0.00 60.65 58.78 1ntm s ILE 81 Cb 0.16 -3.37 0.15 0.00 0.01 0.00 0.00 42.46 39.41 1ntm s ILE 81 CO 0.84 -0.61 1.10 -2.16 0.00 0.00 0.00 174.94 174.11 1ntm s PRO 82 N 1.25 0.90 0.14 2.79 0.04 -1.26 -4.78 135.00 134.07 1ntm s PRO 82 Ca 0.05 0.53 -0.32 0.00 0.04 0.00 0.00 61.00 61.30 1ntm s PRO 82 Cb -0.23 -1.79 -0.12 0.00 0.04 0.00 0.00 34.50 32.40 1ntm s PRO 82 CO -0.02 -2.41 1.77 0.39 0.04 0.00 0.00 177.00 176.77 1ntm n GLU 83 N -3.96 2.65 -0.11 4.56 1.02 -1.26 -2.96 120.64 120.58 1ntm n GLU 83 Ca 0.06 0.96 0.00 0.00 -0.02 0.00 0.00 57.16 58.16 1ntm n GLU 83 Cb 0.57 -2.82 0.00 0.00 -0.02 0.00 0.00 31.44 29.17 1ntm n GLU 83 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ntm n GLY 84 N 4.05 0.62 3.81 0.62 0.00 -0.05 -4.96 105.19 109.28 1ntm n GLY 84 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 1ntm n GLY 84 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ntm s LYS 85 N -0.79 3.28 -0.43 1.61 2.20 -1.15 -4.95 119.74 119.51 1ntm s LYS 85 Ca 0.00 -0.24 -0.14 0.00 -0.36 0.00 0.00 55.97 55.23 1ntm s LYS 85 Cb 0.00 -3.05 0.05 0.00 -1.51 0.00 0.00 37.83 33.32 1ntm s LYS 85 CO 0.00 0.75 0.31 1.21 -0.36 0.00 0.00 175.35 177.26 1ntm s ASN 86 N -1.05 6.01 -0.27 1.43 2.47 -1.26 -2.94 114.94 119.33 1ntm s ASN 86 Ca 0.15 -1.13 -0.12 0.00 0.42 0.00 0.00 52.86 52.19 1ntm s ASN 86 Cb -0.12 -2.13 -0.05 0.00 -1.45 0.00 0.00 41.25 37.51 1ntm s ASN 86 CO 0.04 -0.52 0.22 -0.32 -3.72 0.00 0.00 177.10 172.81 1ntm s MET 87 N 1.62 3.99 -0.13 0.43 -2.45 -0.91 -4.97 119.30 116.88 1ntm s MET 87 Ca 0.04 -0.23 -0.07 0.00 -1.25 0.00 0.00 55.69 54.18 1ntm s MET 87 Cb -0.21 -3.63 -0.04 0.00 1.25 0.00 0.00 34.83 32.20 1ntm s MET 87 CO 0.07 -0.14 0.13 0.00 1.05 0.00 0.00 175.02 176.13 1ntm s ALA 88 N 1.66 3.80 0.37 4.11 0.00 -1.26 -1.40 121.76 129.05 1ntm s ALA 88 Ca 0.09 -0.66 0.04 0.00 0.00 0.00 0.00 51.96 51.43 1ntm s ALA 88 Cb -0.15 -1.96 -0.06 0.00 0.00 0.00 0.00 23.12 20.95 1ntm s ALA 88 CO 0.09 0.55 0.05 -0.06 0.00 0.00 0.00 175.76 176.39 1ntm s PHE 89 N -0.80 2.04 -0.25 0.00 0.40 0.05 -4.94 117.98 114.48 1ntm s PHE 89 Ca 0.14 -0.95 -0.10 0.00 -0.60 0.00 0.00 56.93 55.42 1ntm s PHE 89 Cb -0.12 -1.40 -0.04 0.00 0.51 0.00 0.00 43.02 41.97 1ntm s PHE 89 CO 0.03 0.07 0.14 0.21 0.70 0.00 0.00 175.22 176.38 1ntm s LYS 90 N -3.82 3.93 -0.13 0.44 2.20 -1.26 -0.78 119.74 120.31 1ntm s LYS 90 Ca 0.31 -0.34 -0.05 0.00 -0.36 0.00 0.00 55.97 55.53 1ntm s LYS 90 Cb 0.07 -3.51 0.06 0.00 -1.51 0.00 0.00 37.83 32.95 1ntm s LYS 90 CO 0.15 -0.06 0.28 -0.46 -0.36 0.00 0.00 175.35 174.90 1ntm s TRP 91 N 1.36 -0.45 -1.49 4.03 -0.00 0.38 -4.86 118.94 117.92 1ntm s TRP 91 Ca 0.07 1.00 -0.03 0.00 -0.00 0.00 0.00 56.10 57.14 1ntm s TRP 91 Cb -0.15 0.04 0.00 0.00 -0.00 0.00 0.00 33.47 33.36 1ntm s TRP 91 CO 0.06 -0.33 0.35 0.54 -0.00 0.00 0.00 176.95 177.57 1ntm n ARG 92 N 4.99 -3.35 -0.85 5.86 1.74 -1.26 -1.55 116.66 122.24 1ntm n ARG 92 Ca -0.12 0.86 0.00 0.00 -0.77 0.00 0.00 57.85 57.81 1ntm n ARG 92 Cb 0.51 -5.49 0.00 0.00 -1.02 0.00 0.00 32.46 26.46 1ntm n ARG 92 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ntm n GLY 93 N -1.29 0.50 3.43 -0.13 0.00 -1.26 -4.94 105.19 101.50 1ntm n GLY 93 Ca -0.15 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.60 1ntm n GLY 93 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ntm s LYS 94 N -0.53 1.54 0.20 1.61 -0.14 -0.60 -5.12 119.74 116.71 1ntm s LYS 94 Ca 0.00 -1.51 -0.30 0.00 -1.36 0.00 0.00 55.97 52.80 1ntm s LYS 94 Cb 0.00 -1.86 -0.09 0.00 -1.68 0.00 0.00 37.83 34.20 1ntm s LYS 94 CO 0.00 0.40 1.34 -2.14 -0.76 0.00 0.00 175.35 174.19 1ntm s PRO 95 N -2.66 4.36 -0.15 -1.68 0.02 -1.26 -0.47 135.00 133.16 1ntm s PRO 95 Ca 0.21 2.10 0.01 0.00 0.02 0.00 0.00 61.00 63.34 1ntm s PRO 95 Cb -0.08 -3.18 0.01 0.00 0.02 0.00 0.00 34.50 31.27 1ntm s PRO 95 CO 0.10 -0.29 -0.19 -1.17 -0.33 0.00 0.00 177.00 175.11 1ntm s LEU 96 N -0.08 2.24 -0.16 -5.54 2.96 0.04 0.13 118.68 118.27 1ntm s LEU 96 Ca 0.58 -0.57 -0.11 0.00 -0.22 0.00 0.00 54.13 53.80 1ntm s LEU 96 Cb -0.37 -1.49 -0.05 0.00 0.50 0.00 0.00 46.19 44.77 1ntm s LEU 96 CO 0.39 0.06 0.21 -0.36 -1.32 0.00 0.00 176.35 175.33 1ntm s PHE 97 N 0.93 3.47 -0.18 5.38 0.08 0.13 -0.77 117.98 127.02 1ntm s PHE 97 Ca -0.04 0.50 -0.00 0.00 0.12 0.00 0.00 56.93 57.51 1ntm s PHE 97 Cb -0.15 -2.21 0.04 0.00 -0.57 0.00 0.00 43.02 40.14 1ntm s PHE 97 CO -0.04 0.35 -0.05 0.08 -0.10 0.00 0.00 175.22 175.46 1ntm s VAL 98 N 0.13 1.18 -0.08 -0.44 1.01 -0.49 -1.69 120.40 120.01 1ntm s VAL 98 Ca 0.13 -0.73 0.03 0.00 0.00 0.00 0.00 61.98 61.42 1ntm s VAL 98 Cb -0.12 -1.37 0.00 0.00 0.00 0.00 0.00 36.38 34.89 1ntm s VAL 98 CO 0.02 0.09 -0.19 -0.60 0.00 0.00 0.00 175.10 174.42 1ntm s ARG 99 N 1.59 2.45 -0.41 2.72 3.52 -0.41 -2.15 118.95 126.26 1ntm s ARG 99 Ca -0.00 -0.68 -0.24 0.00 -0.13 0.00 0.00 55.73 54.68 1ntm s ARG 99 Cb -0.16 -1.91 0.02 0.00 -1.56 0.00 0.00 34.95 31.34 1ntm s ARG 99 CO -0.08 0.13 0.81 -1.58 -0.81 0.00 0.00 175.30 173.77 1ntm s HIS 100 N 0.44 3.03 0.04 5.12 5.65 -1.15 -1.91 115.29 126.51 1ntm s HIS 100 Ca -0.16 0.37 -0.15 0.00 0.25 0.00 0.00 55.06 55.37 1ntm s HIS 100 Cb -0.17 -3.60 -0.06 0.00 -1.18 0.00 0.00 32.58 27.57 1ntm s HIS 100 CO 0.06 -0.89 0.46 1.03 -0.65 0.00 0.00 174.74 174.75 1ntm s ARG 101 N 3.28 3.98 0.72 2.88 0.52 0.76 -0.87 118.95 130.22 1ntm s ARG 101 Ca 0.32 0.48 -0.10 0.00 -0.52 0.00 0.00 55.73 55.90 1ntm s ARG 101 Cb -0.12 -3.18 0.04 0.00 0.52 0.00 0.00 34.95 32.21 1ntm s ARG 101 CO 0.21 0.65 1.08 0.95 0.02 0.00 0.00 175.30 178.21 1ntm s THR 102 N -1.15 2.79 0.36 0.02 -4.23 -1.26 -4.71 115.64 107.46 1ntm s THR 102 Ca 0.27 0.11 0.11 0.00 -1.18 0.00 0.00 61.69 61.00 1ntm s THR 102 Cb -0.17 -3.22 0.34 0.00 1.34 0.00 0.00 72.50 70.79 1ntm s THR 102 CO 0.16 -0.28 1.83 0.50 -0.54 0.00 0.00 174.62 176.29 1ntm h LYS 103 N -0.71 0.59 -0.23 3.99 3.64 -1.98 -2.61 116.57 119.27 1ntm h LYS 103 Ca -0.45 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 58.88 1ntm h LYS 103 Cb 1.29 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.97 1ntm h LYS 103 CO 0.63 0.39 0.09 -0.22 -2.27 0.00 0.00 179.45 178.08 1ntm h LYS 104 N 0.61 0.34 -0.47 1.90 3.64 -2.00 -2.90 116.57 117.68 1ntm h LYS 104 Ca 0.50 -0.06 -0.08 0.00 -1.27 0.00 0.00 60.65 59.74 1ntm h LYS 104 Cb 0.96 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.71 1ntm h LYS 104 CO -0.25 0.39 -0.03 0.93 -2.27 0.00 0.00 179.45 178.22 1ntm h GLU 105 N 0.22 0.81 -0.26 1.90 5.08 -1.84 -2.63 114.58 117.86 1ntm h GLU 105 Ca 0.08 -0.23 0.01 0.00 -1.00 0.00 0.00 59.36 58.21 1ntm h GLU 105 Cb 0.17 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 1ntm h GLU 105 CO -0.01 0.83 0.16 0.82 -1.00 0.00 0.00 179.01 179.81 1ntm h ILE 106 N 0.75 1.04 -0.25 3.13 2.04 -1.45 -2.47 117.51 120.30 1ntm h ILE 106 Ca 0.14 -0.11 -0.05 0.00 1.00 0.00 0.00 64.86 65.84 1ntm h ILE 106 Cb 0.50 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 37.25 1ntm h ILE 106 CO 0.03 0.06 -0.07 0.44 0.00 0.00 0.00 178.15 178.60 1ntm h ASP 107 N 0.32 0.37 -0.35 1.72 3.32 -1.45 -2.78 116.42 117.57 1ntm h ASP 107 Ca 0.10 -0.07 -0.14 0.00 0.02 0.00 0.00 57.03 56.93 1ntm h ASP 107 Cb -0.01 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.43 1ntm h ASP 107 CO -0.04 0.48 -0.32 -0.61 -1.72 0.00 0.00 179.24 177.04 1ntm h GLN 108 N 0.37 0.88 0.00 3.56 4.15 -1.17 -2.46 115.11 120.44 1ntm h GLN 108 Ca 0.08 -0.42 -0.11 0.00 0.77 0.00 0.00 58.65 58.97 1ntm h GLN 108 Cb 0.36 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.03 1ntm h GLN 108 CO 0.02 1.07 -0.51 0.93 -1.93 0.00 0.00 178.83 178.40 1ntm h GLU 109 N 0.74 0.00 0.00 1.69 4.39 -1.36 -2.95 114.58 117.09 1ntm h GLU 109 Ca 0.08 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.70 1ntm h GLU 109 Cb 0.89 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.52 1ntm h GLU 109 CO 0.08 0.51 -0.38 0.00 -1.16 0.00 0.00 179.01 178.06 1ntm h ALA 110 N 1.49 0.90 -0.01 3.43 0.00 -1.40 -3.13 119.26 120.55 1ntm h ALA 110 Ca -0.01 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1ntm h ALA 110 Cb 1.15 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1ntm h ALA 110 CO 0.07 0.47 -0.20 0.00 0.00 0.00 0.00 179.25 179.59 1ntm n ALA 111 N -2.26 2.95 -1.93 0.00 0.00 -0.94 -4.93 120.51 113.40 1ntm n ALA 111 Ca 0.00 -0.33 -0.42 0.00 0.00 0.00 0.00 53.44 52.70 1ntm n ALA 111 Cb 0.56 -1.23 -0.03 0.00 0.00 0.00 0.00 19.45 18.75 1ntm n ALA 111 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1ntm s VAL 112 N -2.55 2.66 -0.82 0.00 1.01 -1.18 -4.91 120.40 114.61 1ntm s VAL 112 Ca 0.25 0.45 -0.25 0.00 0.00 0.00 0.00 61.98 62.43 1ntm s VAL 112 Cb 0.19 -3.29 -0.04 0.00 0.00 0.00 0.00 36.38 33.25 1ntm s VAL 112 CO 0.51 0.03 1.92 -0.70 0.00 0.00 0.00 175.10 176.87 1ntm s GLU 113 N 1.28 2.58 0.24 2.72 -6.30 -1.26 -4.87 118.70 113.08 1ntm s GLU 113 Ca 0.70 -0.04 -0.05 0.00 -2.50 0.00 0.00 54.97 53.08 1ntm s GLU 113 Cb -0.43 -4.88 0.35 0.00 0.00 0.00 0.00 34.13 29.17 1ntm s GLU 113 CO 0.31 -3.20 1.83 0.28 0.02 0.00 0.00 175.26 174.51 1ntm h VAL 114 N 7.16 0.99 0.00 3.70 2.07 -1.93 -2.75 116.25 125.48 1ntm h VAL 114 Ca -0.00 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.22 1ntm h VAL 114 Cb 1.05 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.85 1ntm h VAL 114 CO 1.21 0.16 0.00 -1.54 0.02 0.00 0.00 177.57 177.42 1ntm n SER 115 N -4.68 0.00 0.03 0.57 3.41 -1.26 -1.96 113.62 109.73 1ntm n SER 115 Ca 0.12 0.40 0.12 0.00 -0.26 0.00 0.00 58.87 59.25 1ntm n SER 115 Cb 0.21 -0.44 0.13 0.00 -0.26 0.00 0.00 64.21 63.85 1ntm n SER 115 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ntm n GLN 116 N -1.44 0.20 -2.10 4.33 1.13 -1.03 -4.97 117.38 113.50 1ntm n GLN 116 Ca 0.04 0.03 -0.37 0.00 -1.94 0.00 0.00 57.00 54.76 1ntm n GLN 116 Cb 0.13 -1.60 0.01 0.00 0.11 0.00 0.00 30.24 28.90 1ntm n GLN 116 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1ntm s LEU 117 N -3.75 3.88 0.15 1.08 1.43 -0.83 -4.97 118.68 115.67 1ntm s LEU 117 Ca 0.07 2.42 -0.13 0.00 -1.03 0.00 0.00 54.13 55.45 1ntm s LEU 117 Cb 0.15 -4.35 0.02 0.00 0.03 0.00 0.00 46.19 42.03 1ntm s LEU 117 CO 0.75 -1.23 1.61 -0.09 0.23 0.00 0.00 176.35 177.62 1ntm h ARG 118 N 1.60 0.82 -3.68 1.70 2.43 -1.90 -3.35 114.38 112.00 1ntm h ARG 118 Ca -0.50 -0.24 -0.64 0.00 -0.81 0.00 0.00 59.98 57.79 1ntm h ARG 118 Cb 1.27 -0.09 -0.41 0.00 -0.42 0.00 0.00 29.97 30.33 1ntm h ARG 118 CO 0.58 0.84 -0.67 0.34 -1.51 0.00 0.00 179.97 179.56 1ntm s ASP 119 N -6.26 4.35 -0.13 -3.80 2.15 -1.26 -5.03 116.67 106.69 1ntm s ASP 119 Ca -0.13 -2.71 -0.31 0.00 0.43 0.00 0.00 52.55 49.83 1ntm s ASP 119 Cb 0.11 -1.55 -0.09 0.00 -0.30 0.00 0.00 42.92 41.10 1ntm s ASP 119 CO 0.81 -0.28 2.07 -0.81 -0.17 0.00 0.00 175.17 176.78 1ntm n PRO 120 N 3.50 2.16 -3.65 4.34 -0.04 -1.26 -4.87 135.00 135.19 1ntm n PRO 120 Ca 0.05 0.72 -0.09 0.00 -0.04 0.00 0.00 63.50 64.13 1ntm n PRO 120 Cb 0.35 -2.93 -0.08 0.00 -0.04 0.00 0.00 33.50 30.81 1ntm n PRO 120 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1ntm s GLN 121 N 5.24 0.69 0.46 0.54 -0.21 -1.26 -5.13 119.66 119.99 1ntm s GLN 121 Ca 0.97 1.10 -0.20 0.00 0.02 0.00 0.00 55.36 57.24 1ntm s GLN 121 Cb -0.52 0.18 -0.10 0.00 1.00 0.00 0.00 33.01 33.58 1ntm s GLN 121 CO 0.43 -0.14 0.98 -1.58 -2.12 0.00 0.00 175.29 172.87 1ntm s HIS 122 N 1.28 3.21 0.37 0.91 5.65 -1.26 -4.96 115.29 120.49 1ntm s HIS 122 Ca -0.07 1.59 0.05 0.00 0.25 0.00 0.00 55.06 56.87 1ntm s HIS 122 Cb -0.05 -2.92 0.72 0.00 -1.18 0.00 0.00 32.58 29.15 1ntm s HIS 122 CO -0.14 -0.39 2.00 0.22 -0.65 0.00 0.00 174.74 175.78 1ntm h ASP 123 N 1.67 0.65 0.08 9.88 3.58 -1.96 -2.68 116.42 127.65 1ntm h ASP 123 Ca -0.49 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 56.95 1ntm h ASP 123 Cb 1.19 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 42.09 1ntm h ASP 123 CO 0.60 0.46 0.00 0.18 -2.88 0.00 0.00 179.24 177.60 1ntm n LEU 124 N -4.46 0.00 -0.66 2.28 4.77 -1.26 -1.84 117.00 115.83 1ntm n LEU 124 Ca 0.07 0.06 0.06 0.00 -0.03 0.00 0.00 56.01 56.17 1ntm n LEU 124 Cb 0.11 -0.06 0.15 0.00 -2.33 0.00 0.00 43.42 41.30 1ntm n LEU 124 CO 0.35 -0.01 0.61 -1.84 -1.33 0.00 0.00 177.39 175.17 1ntm n GLU 125 N -1.06 2.56 0.00 3.23 0.28 -1.01 -4.33 120.64 120.32 1ntm n GLU 125 Ca 0.17 -1.97 0.02 0.00 -0.16 0.00 0.00 57.16 55.21 1ntm n GLU 125 Cb 0.10 -1.28 -0.01 0.00 1.43 0.00 0.00 31.44 31.69 1ntm n GLU 125 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1ntm n ARG 126 N 0.60 3.46 -4.12 3.44 1.74 -0.77 -5.00 116.66 116.01 1ntm n ARG 126 Ca 0.12 -0.28 -0.09 0.00 -0.77 0.00 0.00 57.85 56.83 1ntm n ARG 126 Cb 0.42 -0.82 -0.10 0.00 -1.02 0.00 0.00 32.46 30.94 1ntm n ARG 126 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1ntm s VAL 127 N -0.95 0.47 -0.27 1.55 -7.23 -1.17 -4.75 120.40 108.05 1ntm s VAL 127 Ca 0.03 -1.80 -0.09 0.00 -1.81 0.00 0.00 61.98 58.30 1ntm s VAL 127 Cb 0.03 -1.51 -0.14 0.00 0.56 0.00 0.00 36.38 35.32 1ntm s VAL 127 CO 0.11 -0.89 -0.31 0.29 -0.31 0.00 0.00 175.10 174.00 1ntm n LYS 128 N 0.16 0.61 -3.88 4.82 5.02 -1.26 -4.85 118.16 118.77 1ntm n LYS 128 Ca -0.14 0.23 -0.36 0.00 -2.02 0.00 0.00 58.31 56.03 1ntm n LYS 128 Cb 0.60 -1.51 -0.13 0.00 -0.02 0.00 0.00 35.03 33.98 1ntm n LYS 128 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1ntm s LYS 129 N -2.51 3.54 0.55 1.97 1.02 -1.26 -5.01 119.74 118.03 1ntm s LYS 129 Ca -0.38 -0.54 0.31 0.00 0.02 0.00 0.00 55.97 55.38 1ntm s LYS 129 Cb 0.13 -3.15 1.47 0.00 -0.52 0.00 0.00 37.83 35.76 1ntm s LYS 129 CO 0.53 -0.15 1.88 -1.35 -0.92 0.00 0.00 175.35 175.34 1ntm h PRO 130 N 8.03 0.00 -0.00 -1.68 0.11 -1.98 -0.65 132.00 135.83 1ntm h PRO 130 Ca -0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1ntm h PRO 130 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1ntm h PRO 130 CO 0.59 0.00 -0.00 -0.85 -0.21 0.00 0.00 178.00 177.53 1ntm n GLU 131 N -4.11 0.73 -4.23 1.05 0.00 -1.26 -4.78 120.64 108.04 1ntm n GLU 131 Ca 0.16 -0.02 -0.24 0.00 0.00 0.00 0.00 57.16 57.06 1ntm n GLU 131 Cb 0.89 -1.50 -0.17 0.00 0.00 0.00 0.00 31.44 30.66 1ntm n GLU 131 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.13 175.55 1ntm s TRP 132 N -2.28 1.23 -0.14 -1.84 0.52 -0.25 -0.17 118.94 116.01 1ntm s TRP 132 Ca 0.38 -0.49 0.02 0.00 0.02 0.00 0.00 56.10 56.04 1ntm s TRP 132 Cb 0.21 -1.00 0.01 0.00 -1.15 0.00 0.00 33.47 31.54 1ntm s TRP 132 CO 0.42 -0.33 -0.21 0.54 0.02 0.00 0.00 176.95 177.39 1ntm s VAL 133 N 1.12 2.13 -0.18 4.03 0.11 -0.80 -4.54 120.40 122.27 1ntm s VAL 133 Ca -0.07 -0.96 -0.00 0.00 -2.93 0.00 0.00 61.98 58.03 1ntm s VAL 133 Cb -0.14 -1.86 0.01 0.00 -1.53 0.00 0.00 36.38 32.86 1ntm s VAL 133 CO -0.01 0.55 -0.15 -0.63 -3.33 0.00 0.00 175.10 171.52 1ntm s ILE 134 N 0.84 2.52 0.07 7.04 1.01 -1.26 -1.29 121.20 130.13 1ntm s ILE 134 Ca -0.06 -0.80 0.00 0.00 0.00 0.00 0.00 60.65 59.79 1ntm s ILE 134 Cb -0.15 -2.08 -0.04 0.00 0.01 0.00 0.00 42.46 40.20 1ntm s ILE 134 CO -0.02 0.51 -0.04 -0.76 0.00 0.00 0.00 174.94 174.62 1ntm s LEU 135 N 1.14 2.48 -0.10 2.97 1.43 -0.68 -4.20 118.68 121.73 1ntm s LEU 135 Ca 0.01 -1.01 -0.24 0.00 -1.03 0.00 0.00 54.13 51.86 1ntm s LEU 135 Cb -0.14 0.08 -0.03 0.00 0.03 0.00 0.00 46.19 46.13 1ntm s LEU 135 CO -0.06 -0.54 0.76 -0.63 0.23 0.00 0.00 176.35 176.11 1ntm s ILE 136 N -3.79 4.98 0.00 -0.59 -1.09 -0.67 0.17 121.20 120.22 1ntm s ILE 136 Ca 0.10 1.53 -0.02 0.00 -2.23 0.00 0.00 60.65 60.03 1ntm s ILE 136 Cb 0.07 -4.09 -0.11 0.00 -1.58 0.00 0.00 42.46 36.75 1ntm s ILE 136 CO -0.07 0.17 1.87 0.61 -1.23 0.00 0.00 174.94 176.28 1ntm n GLY 137 N 3.24 1.91 2.93 6.18 0.00 0.35 -4.55 105.19 115.25 1ntm n GLY 137 Ca 0.01 -0.48 -0.30 0.00 0.00 0.00 0.00 46.02 45.25 1ntm n GLY 137 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ntm s VAL 138 N 1.76 1.37 0.13 1.61 1.01 -1.26 -4.25 120.40 120.77 1ntm s VAL 138 Ca 0.27 -0.94 -0.31 0.00 0.00 0.00 0.00 61.98 61.00 1ntm s VAL 138 Cb 0.13 -1.57 -0.09 0.00 0.00 0.00 0.00 36.38 34.86 1ntm s VAL 138 CO 0.00 0.04 1.44 0.00 0.00 0.00 0.00 175.10 176.57 1ntm n THR 140 N 3.89 1.25 0.00 0.00 -2.24 -1.26 -1.25 114.28 114.68 1ntm n THR 140 Ca 0.12 0.39 0.00 0.00 -2.27 0.00 0.00 64.05 62.29 1ntm n THR 140 Cb 0.41 -1.29 0.00 0.00 -2.10 0.00 0.00 70.33 67.35 1ntm n THR 140 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 1ntm n HIS 141 N -1.78 0.00 -1.88 4.78 -0.00 -1.26 -4.49 115.22 110.60 1ntm n HIS 141 Ca 0.01 0.00 0.05 0.00 -0.00 0.00 0.00 57.72 57.79 1ntm n HIS 141 Cb 0.11 -0.17 0.11 0.00 -0.00 0.00 0.00 29.99 30.04 1ntm n HIS 141 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 1ntm n LEU 142 N -1.01 1.75 0.00 0.27 4.77 -1.24 -4.98 117.00 116.56 1ntm n LEU 142 Ca 0.00 -2.79 0.00 0.00 -0.03 0.00 0.00 56.01 53.19 1ntm n LEU 142 Cb 0.00 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 40.82 1ntm n LEU 142 CO 0.00 0.86 0.00 0.61 -1.33 0.00 0.00 177.39 177.53 1ntm n GLY 143 N -0.48 0.67 3.68 -0.72 0.00 -0.38 -5.01 105.19 102.95 1ntm n GLY 143 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 1ntm n GLY 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ntm s VAL 145 N -3.10 4.46 0.27 0.00 1.01 -1.26 -0.24 120.40 121.53 1ntm s VAL 145 Ca 0.68 -0.12 -0.30 0.00 0.00 0.00 0.00 61.98 62.24 1ntm s VAL 145 Cb -0.13 -3.08 -0.10 0.00 0.00 0.00 0.00 36.38 33.07 1ntm s VAL 145 CO 0.56 0.34 1.37 -2.84 0.00 0.00 0.00 175.10 174.53 1ntm s PRO 146 N 1.52 4.32 -0.10 2.72 0.02 -1.26 -4.73 135.00 137.48 1ntm s PRO 146 Ca 0.06 2.23 -0.25 0.00 0.02 0.00 0.00 61.00 63.07 1ntm s PRO 146 Cb -0.15 -3.11 -0.03 0.00 0.02 0.00 0.00 34.50 31.23 1ntm s PRO 146 CO 0.04 -0.31 0.77 0.42 -0.33 0.00 0.00 177.00 177.59 1ntm s ILE 147 N -0.39 4.97 0.33 2.83 1.01 0.40 -4.80 121.20 125.54 1ntm s ILE 147 Ca 0.55 1.56 -0.29 0.00 0.00 0.00 0.00 60.65 62.47 1ntm s ILE 147 Cb -0.40 -4.10 -0.12 0.00 0.01 0.00 0.00 42.46 37.85 1ntm s ILE 147 CO 0.46 0.16 1.46 0.00 0.00 0.00 0.00 174.94 177.02 1ntm n ALA 148 N 4.36 1.99 -3.80 9.38 0.00 -1.26 -2.43 120.51 128.74 1ntm n ALA 148 Ca 0.01 0.36 -0.26 0.00 0.00 0.00 0.00 53.44 53.56 1ntm n ALA 148 Cb 0.50 -2.37 0.03 0.00 0.00 0.00 0.00 19.45 17.61 1ntm n ALA 148 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1ntm n ASN 149 N 1.26 -3.04 -4.23 0.00 3.02 0.51 -4.95 115.26 107.82 1ntm n ASN 149 Ca 0.06 -0.79 -0.13 0.00 -0.03 0.00 0.00 54.58 53.68 1ntm n ASN 149 Cb 0.36 -4.01 -0.10 0.00 -0.61 0.00 0.00 39.78 35.43 1ntm n ASN 149 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ntm s ALA 150 N -3.49 1.33 0.00 5.41 0.00 -1.23 -4.88 121.76 118.89 1ntm s ALA 150 Ca 0.33 -1.50 0.00 0.00 0.00 0.00 0.00 51.96 50.79 1ntm s ALA 150 Cb -0.16 0.24 0.00 0.00 0.00 0.00 0.00 23.12 23.19 1ntm s ALA 150 CO 0.82 -0.20 0.00 0.41 0.00 0.00 0.00 175.76 176.79 1ntm n GLY 151 N -0.18 0.46 0.00 0.00 0.00 -1.26 -3.20 105.19 101.00 1ntm n GLY 151 Ca -0.09 -2.03 0.12 0.00 0.00 0.00 0.00 46.02 44.01 1ntm n GLY 151 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ntm n ASP 152 N -0.14 0.00 -0.14 1.61 8.00 -1.26 -3.75 116.55 120.86 1ntm n ASP 152 Ca 0.00 0.21 0.06 0.00 0.71 0.00 0.00 54.79 55.77 1ntm n ASP 152 Cb 0.00 -0.39 0.10 0.00 -0.02 0.00 0.00 41.12 40.81 1ntm n ASP 152 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1ntm n PHE 153 N -1.39 0.10 -2.84 1.24 3.01 -1.26 -4.99 117.46 111.32 1ntm n PHE 153 Ca 0.09 -0.78 -0.20 0.00 1.01 0.00 0.00 57.45 57.57 1ntm n PHE 153 Cb 0.24 -0.12 0.01 0.00 -0.01 0.00 0.00 39.48 39.59 1ntm n PHE 153 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ntm n GLY 154 N -0.91 -0.50 0.00 1.37 0.00 -1.25 -4.13 105.19 99.77 1ntm n GLY 154 Ca 0.10 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1ntm n GLY 154 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ntm n GLY 155 N -1.15 0.37 3.06 -0.02 0.00 -1.23 -4.44 105.19 101.77 1ntm n GLY 155 Ca -0.12 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.82 1ntm n GLY 155 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ntm s TYR 156 N 0.00 0.46 -0.06 1.61 1.51 -0.71 -0.37 117.35 119.79 1ntm s TYR 156 Ca 0.00 -0.86 -0.03 0.00 -1.01 0.00 0.00 57.07 55.17 1ntm s TYR 156 Cb 0.00 -0.33 0.04 0.00 -0.11 0.00 0.00 41.96 41.56 1ntm s TYR 156 CO 0.00 -0.29 0.12 -0.47 -1.11 0.00 0.00 175.55 173.80 1ntm s TYR 157 N -3.00 -0.10 -0.33 2.71 5.04 -1.02 0.20 117.35 120.86 1ntm s TYR 157 Ca -0.01 0.45 -0.15 0.00 -2.44 0.00 0.00 57.07 54.93 1ntm s TYR 157 Cb 0.01 -0.28 -0.02 0.00 0.35 0.00 0.00 41.96 42.03 1ntm s TYR 157 CO -0.06 -0.21 0.34 0.00 -1.34 0.00 0.00 175.55 174.27 1ntm h PRO 159 N 8.44 0.00 -0.60 0.00 0.13 -1.87 -1.86 132.00 136.24 1ntm h PRO 159 Ca -0.30 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.85 1ntm h PRO 159 Cb 1.15 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.24 1ntm h PRO 159 CO 0.68 0.00 0.38 0.00 -0.23 0.00 0.00 178.00 178.82 1ntm n HIS 161 N -4.72 0.00 -1.82 0.00 8.25 -1.26 -5.05 115.22 110.63 1ntm n HIS 161 Ca 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.51 1ntm n HIS 161 Cb 0.06 0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.18 1ntm n HIS 161 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ntm n GLY 162 N 0.00 0.71 3.64 -1.41 0.00 -1.04 -4.46 105.19 102.62 1ntm n GLY 162 Ca 0.00 -0.47 -0.42 0.00 0.00 0.00 0.00 46.02 45.13 1ntm n GLY 162 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ntm s SER 163 N -2.71 6.80 -0.23 1.61 0.01 -0.73 -3.67 113.70 114.79 1ntm s SER 163 Ca 0.00 0.98 -0.08 0.00 1.31 0.00 0.00 55.95 58.16 1ntm s SER 163 Cb 0.00 -2.43 -0.04 0.00 0.21 0.00 0.00 66.02 63.76 1ntm s SER 163 CO 0.00 -0.52 0.09 -1.00 0.41 0.00 0.00 173.24 172.22 1ntm s HIS 164 N 2.84 3.18 0.25 2.43 0.09 0.28 0.21 115.29 124.57 1ntm s HIS 164 Ca 0.34 -0.11 0.11 0.00 -0.00 0.00 0.00 55.06 55.40 1ntm s HIS 164 Cb -0.15 -2.19 -0.05 0.00 -0.00 0.00 0.00 32.58 30.19 1ntm s HIS 164 CO 0.08 -0.10 -0.13 0.71 -0.00 0.00 0.00 174.74 175.29 1ntm s TYR 165 N 1.10 2.46 0.20 1.40 1.51 0.13 -1.80 117.35 122.36 1ntm s TYR 165 Ca 0.05 -0.29 0.01 0.00 -1.01 0.00 0.00 57.07 55.83 1ntm s TYR 165 Cb -0.14 -1.11 0.04 0.00 -0.11 0.00 0.00 41.96 40.64 1ntm s TYR 165 CO 0.04 0.64 0.28 -0.40 -1.11 0.00 0.00 175.55 174.99 1ntm n ASP 166 N -0.51 0.47 0.00 2.29 5.68 -0.82 -1.74 116.55 121.93 1ntm n ASP 166 Ca -0.07 -1.38 0.11 0.00 -0.50 0.00 0.00 54.79 52.95 1ntm n ASP 166 Cb 0.59 -0.17 0.57 0.00 -1.14 0.00 0.00 41.12 40.96 1ntm n ASP 166 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1ntm n ALA 167 N -2.92 2.16 0.97 2.12 0.00 -1.26 -1.87 120.51 119.71 1ntm n ALA 167 Ca -0.05 -0.11 0.10 0.00 0.00 0.00 0.00 53.44 53.38 1ntm n ALA 167 Cb 0.18 -1.35 -0.10 0.00 0.00 0.00 0.00 19.45 18.18 1ntm n ALA 167 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1ntm n SER 168 N -1.21 1.12 0.00 0.00 2.88 -1.26 -4.90 113.62 110.25 1ntm n SER 168 Ca 0.12 -1.06 0.00 0.00 -1.33 0.00 0.00 58.87 56.60 1ntm n SER 168 Cb 0.14 0.93 0.00 0.00 -0.75 0.00 0.00 64.21 64.53 1ntm n SER 168 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ntm n GLY 169 N 1.47 0.81 3.78 0.46 0.00 -0.78 -4.96 105.19 105.98 1ntm n GLY 169 Ca 0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 1ntm n GLY 169 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ntm s ARG 170 N -0.70 4.55 0.03 1.61 0.52 -1.26 -1.53 118.95 122.17 1ntm s ARG 170 Ca 0.00 1.23 -0.30 0.00 -0.52 0.00 0.00 55.73 56.13 1ntm s ARG 170 Cb 0.00 -2.97 -0.05 0.00 0.52 0.00 0.00 34.95 32.45 1ntm s ARG 170 CO 0.00 0.39 1.17 -1.50 0.02 0.00 0.00 175.30 175.39 1ntm s ILE 171 N -1.45 4.18 0.00 1.52 1.10 -1.26 -1.94 121.20 123.35 1ntm s ILE 171 Ca 0.45 1.56 0.00 0.00 -0.51 0.00 0.00 60.65 62.14 1ntm s ILE 171 Cb -0.20 -4.00 0.00 0.00 0.15 0.00 0.00 42.46 38.41 1ntm s ILE 171 CO 0.25 0.09 0.00 0.54 -2.11 0.00 0.00 174.94 173.71 1ntm n ARG 172 N 4.23 2.53 -3.68 3.50 5.12 -0.74 -4.37 116.66 123.26 1ntm n ARG 172 Ca 0.09 0.00 -0.14 0.00 -1.93 0.00 0.00 57.85 55.87 1ntm n ARG 172 Cb 0.47 -0.86 -0.07 0.00 -1.16 0.00 0.00 32.46 30.84 1ntm n ARG 172 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 1ntm s LYS 173 N -1.64 0.86 0.02 5.56 2.20 -1.12 -5.00 119.74 120.61 1ntm s LYS 173 Ca 0.00 -0.23 0.00 0.00 -0.36 0.00 0.00 55.97 55.38 1ntm s LYS 173 Cb 0.00 0.39 0.00 0.00 -1.51 0.00 0.00 37.83 36.71 1ntm s LYS 173 CO 0.00 -0.28 0.00 0.41 -0.36 0.00 0.00 175.35 175.12 1ntm n GLY 174 N 0.79 -2.98 0.07 5.54 0.00 -1.24 -0.56 105.19 106.82 1ntm n GLY 174 Ca -0.19 -2.07 0.12 0.00 0.00 0.00 0.00 46.02 43.88 1ntm n GLY 174 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ntm n PRO 175 N -0.02 0.24 -1.66 1.61 -0.02 -1.26 -4.94 135.00 128.95 1ntm n PRO 175 Ca 0.00 0.12 -0.47 0.00 -2.02 0.00 0.00 63.50 61.13 1ntm n PRO 175 Cb 0.00 -1.71 -0.04 0.00 -0.02 0.00 0.00 33.50 31.73 1ntm n PRO 175 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ntm n ALA 176 N -1.77 1.07 0.05 3.55 0.00 -1.26 -4.91 120.51 117.24 1ntm n ALA 176 Ca 0.04 0.43 -0.14 0.00 0.00 0.00 0.00 53.44 53.77 1ntm n ALA 176 Cb 0.42 -2.35 -0.04 0.00 0.00 0.00 0.00 19.45 17.48 1ntm n ALA 176 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1ntm h PRO 177 N 6.31 0.49 -5.15 0.00 0.13 -1.93 -3.48 132.00 128.38 1ntm h PRO 177 Ca -0.46 -0.49 -0.47 0.00 -0.87 0.00 0.00 66.00 63.71 1ntm h PRO 177 Cb 1.26 0.13 -0.14 0.00 0.13 0.00 0.00 31.00 32.39 1ntm h PRO 177 CO 0.89 1.13 -0.59 -0.51 -0.23 0.00 0.00 178.00 178.68 1ntm s LEU 178 N -7.89 2.07 0.50 1.56 1.43 -1.26 -4.62 118.68 110.47 1ntm s LEU 178 Ca -0.07 -1.43 -0.20 0.00 -1.03 0.00 0.00 54.13 51.40 1ntm s LEU 178 Cb 0.09 -0.28 -0.08 0.00 0.03 0.00 0.00 46.19 45.95 1ntm s LEU 178 CO 0.87 -0.68 1.07 0.20 0.23 0.00 0.00 176.35 178.05 1ntm s ASN 179 N -3.48 6.17 0.40 2.29 0.01 -1.26 -4.50 114.94 114.57 1ntm s ASN 179 Ca 0.35 2.02 -0.26 0.00 -0.71 0.00 0.00 52.86 54.26 1ntm s ASN 179 Cb 0.08 -2.57 -0.11 0.00 0.41 0.00 0.00 41.25 39.06 1ntm s ASN 179 CO 0.15 -0.90 1.18 0.18 -1.51 0.00 0.00 177.10 176.20 1ntm n LEU 180 N -1.00 3.44 -4.72 0.60 4.77 -0.58 -4.88 117.00 114.63 1ntm n LEU 180 Ca 0.10 1.10 -0.42 0.00 -0.03 0.00 0.00 56.01 56.76 1ntm n LEU 180 Cb 0.52 -1.44 -0.03 0.00 -2.33 0.00 0.00 43.42 40.13 1ntm n LEU 180 CO 0.41 -0.91 0.96 -0.70 -1.33 0.00 0.00 177.39 175.83 1ntm s GLU 181 N -2.07 4.39 -0.35 3.23 2.12 -1.26 -4.87 118.70 119.89 1ntm s GLU 181 Ca 0.61 1.93 -0.23 0.00 0.36 0.00 0.00 54.97 57.64 1ntm s GLU 181 Cb -0.54 -3.28 0.01 0.00 0.26 0.00 0.00 34.13 30.58 1ntm s GLU 181 CO 0.58 -0.30 0.77 0.08 -0.54 0.00 0.00 175.26 175.85 1ntm s VAL 182 N 0.83 4.76 0.77 3.70 1.01 -1.26 -1.66 120.40 128.54 1ntm s VAL 182 Ca 0.60 0.96 -0.11 0.00 0.00 0.00 0.00 61.98 63.43 1ntm s VAL 182 Cb -0.33 -4.18 0.05 0.00 0.00 0.00 0.00 36.38 31.92 1ntm s VAL 182 CO 0.32 -0.37 1.09 -2.16 0.00 0.00 0.00 175.10 173.97 1ntm s PRO 183 N 3.03 2.29 -0.09 2.72 0.04 -1.26 -4.97 135.00 136.76 1ntm s PRO 183 Ca 0.31 1.09 -0.30 0.00 0.04 0.00 0.00 61.00 62.15 1ntm s PRO 183 Cb -0.14 -1.91 -0.03 0.00 0.04 0.00 0.00 34.50 32.47 1ntm s PRO 183 CO 0.15 -1.60 1.23 0.45 0.04 0.00 0.00 177.00 177.28 1ntm s SER 184 N -3.48 7.01 0.20 6.66 0.15 -1.26 -4.97 113.70 118.01 1ntm s SER 184 Ca 0.61 1.79 -0.12 0.00 0.70 0.00 0.00 55.95 58.93 1ntm s SER 184 Cb -0.17 -2.55 -0.00 0.00 -1.71 0.00 0.00 66.02 61.59 1ntm s SER 184 CO 0.56 -0.65 0.40 -0.72 1.20 0.00 0.00 173.24 174.03 1ntm s TYR 185 N 2.63 0.31 0.03 3.44 -0.85 -1.26 -1.22 117.35 120.44 1ntm s TYR 185 Ca 0.56 -0.67 -0.21 0.00 -0.52 0.00 0.00 57.07 56.23 1ntm s TYR 185 Cb -0.24 0.10 0.05 0.00 0.38 0.00 0.00 41.96 42.25 1ntm s TYR 185 CO 0.20 -0.86 0.49 -1.83 -1.52 0.00 0.00 175.55 172.03 1ntm s GLU 186 N -3.98 0.98 -0.26 -3.49 -1.05 -1.06 -5.03 118.70 104.81 1ntm s GLU 186 Ca 0.18 -0.22 -0.13 0.00 -0.15 0.00 0.00 54.97 54.65 1ntm s GLU 186 Cb 0.01 0.44 -0.04 0.00 -0.44 0.00 0.00 34.13 34.10 1ntm s GLU 186 CO 0.03 -0.34 0.27 -0.06 0.95 0.00 0.00 175.26 176.12 1ntm s PHE 187 N -2.26 3.26 -0.92 4.83 0.08 -1.26 -1.38 117.98 120.33 1ntm s PHE 187 Ca -0.06 0.29 0.26 0.00 0.12 0.00 0.00 56.93 57.54 1ntm s PHE 187 Cb -0.01 -2.45 0.75 0.00 -0.57 0.00 0.00 43.02 40.74 1ntm s PHE 187 CO -0.00 -0.14 1.60 0.25 -0.10 0.00 0.00 175.22 176.83 1ntm n THR 188 N 4.90 0.11 -3.75 0.64 -2.24 -1.05 -4.98 114.28 107.90 1ntm n THR 188 Ca -0.12 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 1ntm n THR 188 Cb 0.51 -0.13 0.00 0.00 -2.10 0.00 0.00 70.33 68.62 1ntm n THR 188 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1ntm n SER 189 N -1.66 -0.39 0.24 3.42 3.41 -1.23 -4.96 113.62 112.45 1ntm n SER 189 Ca 0.06 -1.14 0.12 0.00 -0.26 0.00 0.00 58.87 57.64 1ntm n SER 189 Cb 0.36 0.62 0.58 0.00 -0.26 0.00 0.00 64.21 65.51 1ntm n SER 189 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 1ntm h ASP 190 N 0.55 0.00 0.00 4.04 2.03 -2.04 -3.25 116.42 117.74 1ntm h ASP 190 Ca -0.07 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.23 1ntm h ASP 190 Cb 0.33 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.83 1ntm h ASP 190 CO 0.09 0.15 -1.45 -0.90 -1.03 0.00 0.00 179.24 176.11 1ntm n ASP 191 N -3.37 2.09 -4.58 4.15 5.75 -1.26 -4.88 116.55 114.46 1ntm n ASP 191 Ca -0.00 -0.08 -0.34 0.00 -0.01 0.00 0.00 54.79 54.37 1ntm n ASP 191 Cb 0.36 1.49 -0.11 0.00 -1.03 0.00 0.00 41.12 41.83 1ntm n ASP 191 CO 0.00 0.00 0.00 -0.04 -0.11 0.00 0.00 177.20 177.05 1ntm s MET 192 N -2.76 2.71 -0.07 0.11 -1.94 -1.23 0.61 119.30 116.72 1ntm s MET 192 Ca -0.04 -0.58 0.02 0.00 -1.71 0.00 0.00 55.69 53.38 1ntm s MET 192 Cb 0.08 -2.57 0.01 0.00 2.01 0.00 0.00 34.83 34.36 1ntm s MET 192 CO 0.50 0.65 -0.13 0.54 -0.01 0.00 0.00 175.02 176.57 1ntm s VAL 193 N -0.84 1.21 -0.33 -6.03 0.11 -1.04 -2.53 120.40 110.94 1ntm s VAL 193 Ca 0.13 -0.51 -0.06 0.00 -2.93 0.00 0.00 61.98 58.61 1ntm s VAL 193 Cb -0.11 -1.11 0.04 0.00 -1.53 0.00 0.00 36.38 33.67 1ntm s VAL 193 CO 0.03 0.37 0.09 -0.63 -3.33 0.00 0.00 175.10 171.63 1ntm s ILE 194 N 0.74 3.75 -0.24 7.04 1.01 -0.48 -2.02 121.20 131.01 1ntm s ILE 194 Ca -0.13 -1.10 -0.09 0.00 0.00 0.00 0.00 60.65 59.33 1ntm s ILE 194 Cb -0.16 -3.10 -0.04 0.00 0.01 0.00 0.00 42.46 39.17 1ntm s ILE 194 CO 0.03 -0.14 0.13 -0.69 0.00 0.00 0.00 174.94 174.26 1ntm s VAL 195 N 1.40 5.03 0.00 2.92 1.01 -0.23 -2.55 120.40 127.99 1ntm s VAL 195 Ca -0.01 0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.03 1ntm s VAL 195 Cb -0.19 -3.34 0.00 0.00 0.00 0.00 0.00 36.38 32.84 1ntm s VAL 195 CO 0.02 0.35 0.00 0.61 0.00 0.00 0.00 175.10 176.08