#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g2q s PRO 9 N 0.00 1.10 -0.09 1.61 0.02 -1.26 -4.96 135.00 131.43 3g2q s PRO 9 Ca 0.00 1.09 -0.29 0.00 0.02 0.00 0.00 61.00 61.82 3g2q s PRO 9 Cb 0.00 -1.77 -0.06 0.00 0.02 0.00 0.00 34.50 32.69 3g2q s PRO 9 CO 0.00 -2.43 1.79 0.08 -0.33 0.00 0.00 177.00 176.12 3g2q s VAL 10 N -2.78 3.39 -1.07 3.83 1.01 -1.26 -4.94 120.40 118.58 3g2q s VAL 10 Ca 0.64 0.46 -0.16 0.00 0.00 0.00 0.00 61.98 62.93 3g2q s VAL 10 Cb -0.20 -3.35 0.15 0.00 0.00 0.00 0.00 36.38 32.99 3g2q s VAL 10 CO 0.58 -0.09 1.28 -0.60 0.00 0.00 0.00 175.10 176.26 3g2q s ARG 11 N 4.56 3.85 0.73 2.72 3.52 -1.26 -4.73 118.95 128.34 3g2q s ARG 11 Ca 0.80 -2.18 -0.11 0.00 -0.13 0.00 0.00 55.73 54.11 3g2q s ARG 11 Cb -0.34 -4.99 0.03 0.00 -1.56 0.00 0.00 34.95 28.10 3g2q s ARG 11 CO 0.33 -1.77 1.09 0.95 -0.81 0.00 0.00 175.30 175.09 3g2q s THR 12 N 2.11 3.49 0.25 4.11 -4.23 -1.26 -4.77 115.64 115.35 3g2q s THR 12 Ca 0.38 0.52 -0.04 0.00 -1.18 0.00 0.00 61.69 61.37 3g2q s THR 12 Cb -0.04 -3.07 0.25 0.00 1.34 0.00 0.00 72.50 70.98 3g2q s THR 12 CO -0.05 -0.60 1.87 -0.65 -0.54 0.00 0.00 174.62 174.66 3g2q h PRO 13 N -0.79 1.06 -0.21 3.99 0.11 -2.00 0.72 132.00 134.87 3g2q h PRO 13 Ca -0.44 -0.06 -0.16 0.00 0.11 0.00 0.00 66.00 65.45 3g2q h PRO 13 Cb 1.23 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 32.09 3g2q h PRO 13 CO 0.53 0.70 -0.52 1.25 -0.21 0.00 0.00 178.00 179.75 3g2q h HIS 14 N 1.09 0.73 -0.50 0.65 2.76 -2.00 -3.03 115.15 114.85 3g2q h HIS 14 Ca 0.41 -0.25 -0.01 0.00 -2.20 0.00 0.00 60.37 58.32 3g2q h HIS 14 Cb 0.17 -0.14 -0.02 0.00 1.55 0.00 0.00 27.41 28.96 3g2q h HIS 14 CO -0.01 0.98 0.29 0.00 -1.30 0.00 0.00 177.93 177.88 3g2q h ALA 15 N 0.97 0.64 -0.36 5.26 0.00 -1.70 -2.00 119.26 122.07 3g2q h ALA 15 Ca 0.02 -0.08 0.08 0.00 0.00 0.00 0.00 54.91 54.92 3g2q h ALA 15 Cb 1.06 -0.20 -0.07 0.00 0.00 0.00 0.00 17.79 18.58 3g2q h ALA 15 CO 0.10 0.15 -0.12 -0.44 0.00 0.00 0.00 179.25 178.94 3g2q h ASP 16 N 0.67 -0.43 0.34 0.00 3.32 -0.81 -0.84 116.42 118.66 3g2q h ASP 16 Ca 0.18 0.12 -0.19 0.00 0.02 0.00 0.00 57.03 57.16 3g2q h ASP 16 Cb 0.03 0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 3g2q h ASP 16 CO -0.03 -0.16 -0.78 0.58 -1.72 0.00 0.00 179.24 177.13 3g2q h VAL 17 N -0.04 1.40 -0.38 -1.35 2.07 -1.46 -2.82 116.25 113.66 3g2q h VAL 17 Ca 0.18 -2.26 -0.01 0.00 0.82 0.00 0.00 66.70 65.42 3g2q h VAL 17 Cb 0.32 2.22 -0.02 0.00 -1.52 0.00 0.00 31.29 32.29 3g2q h VAL 17 CO -0.40 0.67 0.18 -0.07 0.02 0.00 0.00 177.57 177.98 3g2q h LEU 18 N 0.23 0.49 -1.04 2.57 3.38 -1.08 -2.22 115.31 117.64 3g2q h LEU 18 Ca -0.04 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 57.73 3g2q h LEU 18 Cb 1.37 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.98 3g2q h LEU 18 CO 0.13 0.48 -0.19 -0.07 0.09 0.00 0.00 178.44 178.88 3g2q h LEU 19 N 0.47 0.46 -0.27 1.67 3.38 -1.11 -1.42 115.31 118.49 3g2q h LEU 19 Ca 0.13 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 3g2q h LEU 19 Cb 0.11 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 3g2q h LEU 19 CO -0.02 0.66 -0.01 0.00 0.09 0.00 0.00 178.44 179.17 3g2q h ALA 20 N 1.38 0.37 0.00 1.53 0.00 -1.51 -2.76 119.26 118.27 3g2q h ALA 20 Ca 0.07 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3g2q h ALA 20 Cb 0.57 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.26 3g2q h ALA 20 CO 0.04 0.12 0.00 0.45 0.00 0.00 0.00 179.25 179.86 3g2q n SER 21 N -4.59 0.00 -0.00 0.00 2.88 -0.84 -3.31 113.62 107.76 3g2q n SER 21 Ca -0.03 0.38 0.02 0.00 -1.33 0.00 0.00 58.87 57.91 3g2q n SER 21 Cb 0.26 -0.44 -0.04 0.00 -0.75 0.00 0.00 64.21 63.24 3g2q n SER 21 CO 0.00 0.00 0.00 0.55 -1.23 0.00 0.00 175.04 174.36 3g2q n VAL 22 N -1.44 0.00 0.00 2.46 3.14 -0.58 -5.05 118.33 116.86 3g2q n VAL 22 Ca 0.05 -0.15 0.00 0.00 -2.96 0.00 0.00 64.34 61.28 3g2q n VAL 22 Cb 0.16 0.46 0.00 0.00 -1.06 0.00 0.00 33.84 33.40 3g2q n VAL 22 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3g2q n GLY 23 N 2.09 1.97 0.00 7.55 0.00 -1.04 -3.45 105.19 112.30 3g2q n GLY 23 Ca -0.01 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.05 3g2q n GLY 23 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3g2q n GLU 24 N 0.00 2.91 0.25 1.61 0.00 -1.26 -4.74 120.64 119.40 3g2q n GLU 24 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 57.16 57.33 3g2q n GLU 24 Cb 0.00 -0.57 0.86 0.00 0.00 0.00 0.00 31.44 31.72 3g2q n GLU 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3g2q h ARG 25 N 0.00 0.00 -6.04 3.44 3.08 -1.93 -3.45 114.38 109.47 3g2q h ARG 25 Ca 0.00 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.49 3g2q h ARG 25 Cb 0.07 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.07 3g2q h ARG 25 CO 0.00 0.00 0.07 0.20 -1.07 0.00 0.00 179.97 179.17 3g2q s GLY 26 N -3.87 2.62 -0.06 0.04 0.00 -1.26 0.23 107.32 105.02 3g2q s GLY 26 Ca -0.02 0.12 0.03 0.00 0.00 0.00 0.00 44.72 44.84 3g2q s GLY 26 CO 0.35 1.11 -0.14 0.14 0.00 0.00 0.00 173.10 174.56 3g2q s VAL 27 N 0.63 1.26 -0.28 1.40 1.01 0.10 -4.92 120.40 119.60 3g2q s VAL 27 Ca 0.36 -0.58 -0.16 0.00 0.00 0.00 0.00 61.98 61.60 3g2q s VAL 27 Cb -0.18 -1.12 -0.03 0.00 0.00 0.00 0.00 36.38 35.06 3g2q s VAL 27 CO 0.18 0.38 0.44 -0.22 0.00 0.00 0.00 175.10 175.88 3g2q s LEU 28 N 0.40 4.10 0.19 3.92 2.96 -1.26 -0.44 118.68 128.55 3g2q s LEU 28 Ca -0.11 0.31 0.08 0.00 -0.22 0.00 0.00 54.13 54.20 3g2q s LEU 28 Cb -0.14 -2.53 -0.04 0.00 0.50 0.00 0.00 46.19 43.97 3g2q s LEU 28 CO 0.03 -0.27 -0.16 0.00 -1.32 0.00 0.00 176.35 174.64 3g2q s ASP 30 N -3.06 7.23 0.48 0.00 2.15 -1.26 -0.69 116.67 121.52 3g2q s ASP 30 Ca 0.20 1.57 0.15 0.00 0.43 0.00 0.00 52.55 54.90 3g2q s ASP 30 Cb -0.03 -2.48 1.15 0.00 -0.30 0.00 0.00 42.92 41.26 3g2q s ASP 30 CO 0.07 0.08 2.08 0.15 -0.17 0.00 0.00 175.17 177.38 3g2q h PHE 31 N 3.72 0.20 -1.06 -5.34 3.57 -1.04 -2.83 116.94 114.16 3g2q h PHE 31 Ca -0.47 0.00 -0.58 0.00 3.53 0.00 0.00 57.97 60.45 3g2q h PHE 31 Cb 1.20 -0.07 -0.23 0.00 2.79 0.00 0.00 35.95 39.64 3g2q h PHE 31 CO 0.63 0.11 0.72 0.66 -2.23 0.00 0.00 178.31 178.21 3g2q n TYR 32 N -4.49 2.51 0.00 0.41 4.01 -1.26 -4.79 117.16 113.55 3g2q n TYR 32 Ca 0.03 -2.47 0.00 0.00 -0.16 0.00 0.00 57.90 55.30 3g2q n TYR 32 Cb 0.21 -1.27 0.00 0.00 -0.31 0.00 0.00 39.34 37.97 3g2q n TYR 32 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 3g2q n ASP 33 N -0.26 0.00 -4.52 7.72 5.68 -1.07 -5.05 116.55 119.04 3g2q n ASP 33 Ca 0.51 0.00 -0.29 0.00 -0.50 0.00 0.00 54.79 54.51 3g2q n ASP 33 Cb 0.54 0.00 -0.13 0.00 -1.14 0.00 0.00 41.12 40.40 3g2q n ASP 33 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3g2q n GLU 34 N 0.00 0.37 -3.65 0.11 1.02 -1.26 -4.83 120.64 112.39 3g2q n GLU 34 Ca 0.00 -0.19 -0.28 0.00 -0.02 0.00 0.00 57.16 56.68 3g2q n GLU 34 Cb 0.00 -2.31 -0.11 0.00 -0.02 0.00 0.00 31.44 29.00 3g2q n GLU 34 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 3g2q s GLY 35 N 7.86 2.09 0.00 0.62 0.00 -1.26 -4.85 107.32 111.78 3g2q s GLY 35 Ca 1.17 -3.17 0.00 0.00 0.00 0.00 0.00 44.72 42.72 3g2q s GLY 35 CO 0.37 1.59 0.95 0.00 0.00 0.00 0.00 173.10 176.01 3g2q n ALA 36 N 2.40 1.01 -3.86 3.20 0.00 -1.26 -5.18 120.51 116.82 3g2q n ALA 36 Ca 0.24 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.35 3g2q n ALA 36 Cb 0.41 -0.97 -0.15 0.00 0.00 0.00 0.00 19.45 18.74 3g2q n ALA 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3g2q s ALA 37 N -2.91 2.57 -0.30 0.00 0.00 -1.26 -5.30 121.76 114.56 3g2q s ALA 37 Ca 0.00 -1.34 -0.10 0.00 0.00 0.00 0.00 51.96 50.52 3g2q s ALA 37 Cb 0.00 -1.49 0.17 0.00 0.00 0.00 0.00 23.12 21.80 3g2q s ALA 37 CO 0.00 -0.60 0.83 0.00 0.00 0.00 0.00 175.76 175.99 3g2q s ALA 47 N 1.32 -2.64 -0.05 0.00 0.00 -1.26 -5.07 121.76 114.07 3g2q s ALA 47 Ca 0.02 1.90 -0.02 0.00 0.00 0.00 0.00 51.96 53.86 3g2q s ALA 47 Cb -0.15 -2.15 0.03 0.00 0.00 0.00 0.00 23.12 20.86 3g2q s ALA 47 CO -0.08 -1.18 0.08 0.34 0.00 0.00 0.00 175.76 174.92 3g2q s ASP 48 N 2.77 0.79 -0.28 0.00 2.15 -1.26 -4.97 116.67 115.87 3g2q s ASP 48 Ca 0.04 0.14 0.18 0.00 0.43 0.00 0.00 52.55 53.34 3g2q s ASP 48 Cb -0.11 -0.03 0.49 0.00 -0.30 0.00 0.00 42.92 42.98 3g2q s ASP 48 CO -0.17 -0.22 1.10 0.61 -0.17 0.00 0.00 175.17 176.32 3g2q n GLY 49 N 5.04 2.84 0.29 2.66 0.00 -1.25 -4.84 105.19 109.93 3g2q n GLY 49 Ca -0.09 -1.49 0.19 0.00 0.00 0.00 0.00 46.02 44.63 3g2q n GLY 49 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3g2q h THR 50 N 4.42 0.00 0.13 2.61 1.35 -1.96 -0.44 112.91 119.02 3g2q h THR 50 Ca -0.01 -0.28 -0.36 0.00 -0.55 0.00 0.00 66.41 65.21 3g2q h THR 50 Cb 1.29 1.25 -0.01 0.00 -1.73 0.00 0.00 68.15 68.95 3g2q h THR 50 CO 0.37 0.00 -1.91 0.77 -0.25 0.00 0.00 175.52 174.50 3g2q h SER 51 N 0.00 0.44 -0.26 5.36 4.64 -1.89 -2.58 113.55 119.26 3g2q h SER 51 Ca 0.00 -0.94 -0.01 0.00 -0.47 0.00 0.00 61.79 60.38 3g2q h SER 51 Cb 0.28 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.22 3g2q h SER 51 CO 0.00 1.83 0.13 -0.08 -0.87 0.00 0.00 176.83 177.84 3g2q h GLU 52 N 0.03 0.37 -0.86 4.77 4.81 -1.79 -2.07 114.58 119.84 3g2q h GLU 52 Ca -0.40 -0.05 0.13 0.00 -0.13 0.00 0.00 59.36 58.91 3g2q h GLU 52 Cb 2.01 -0.07 -0.07 0.00 0.63 0.00 0.00 28.75 31.26 3g2q h GLU 52 CO 0.09 0.36 0.56 0.00 -0.73 0.00 0.00 179.01 179.29 3g2q h ALA 53 N 0.99 1.83 -0.21 2.92 0.00 -1.21 -1.55 119.26 122.04 3g2q h ALA 53 Ca 0.09 0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.87 3g2q h ALA 53 Cb 0.11 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3g2q h ALA 53 CO -0.01 -0.05 -0.46 -0.09 0.00 0.00 0.00 179.25 178.63 3g2q h ARG 54 N 0.69 0.54 -0.54 0.00 2.43 -1.23 -1.23 114.38 115.04 3g2q h ARG 54 Ca 0.43 -0.30 0.02 0.00 -0.81 0.00 0.00 59.98 59.32 3g2q h ARG 54 Cb 0.66 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.20 3g2q h ARG 54 CO -0.19 0.89 0.33 0.93 -1.51 0.00 0.00 179.97 180.43 3g2q h GLU 55 N 0.43 0.64 0.43 0.20 4.39 -0.58 0.16 114.58 120.25 3g2q h GLU 55 Ca 0.03 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.67 3g2q h GLU 55 Cb 0.98 -0.15 0.00 0.00 -0.10 0.00 0.00 28.75 29.49 3g2q h GLU 55 CO 0.09 0.43 -0.21 0.74 -1.16 0.00 0.00 179.01 178.89 3g2q h PHE 56 N 0.66 -0.55 -0.57 4.33 0.04 -1.22 -2.71 116.94 116.92 3g2q h PHE 56 Ca 0.21 -0.01 0.10 0.00 2.80 0.00 0.00 57.97 61.07 3g2q h PHE 56 Cb 0.00 0.18 -0.08 0.00 2.20 0.00 0.00 35.95 38.26 3g2q h PHE 56 CO -0.06 -0.34 0.14 0.00 -0.60 0.00 0.00 178.31 177.45 3g2q h ALA 57 N -0.01 0.68 -0.02 2.45 0.00 -1.07 -0.60 119.26 120.68 3g2q h ALA 57 Ca -0.06 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3g2q h ALA 57 Cb 0.45 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 3g2q h ALA 57 CO 0.09 -0.29 0.03 1.15 0.00 0.00 0.00 179.25 180.24 3g2q h THR 58 N 0.28 0.32 -0.19 0.00 2.02 -0.63 -1.83 112.91 112.87 3g2q h THR 58 Ca 0.29 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.47 3g2q h THR 58 Cb 0.41 0.97 0.00 0.00 -1.74 0.00 0.00 68.15 67.80 3g2q h THR 58 CO -0.36 0.00 0.00 0.54 0.37 0.00 0.00 175.52 176.07 3g2q n ARG 59 N -3.54 1.73 0.00 6.66 1.74 -0.31 -4.64 116.66 118.30 3g2q n ARG 59 Ca -0.03 -1.66 0.00 0.00 -0.77 0.00 0.00 57.85 55.40 3g2q n ARG 59 Cb 0.11 -1.27 0.00 0.00 -1.02 0.00 0.00 32.46 30.28 3g2q n ARG 59 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3g2q n THR 60 N 0.68 0.00 -2.59 0.55 -2.24 -0.75 -5.07 114.28 104.86 3g2q n THR 60 Ca 0.10 0.33 -0.06 0.00 -2.27 0.00 0.00 64.05 62.15 3g2q n THR 60 Cb 0.38 -1.32 0.01 0.00 -2.10 0.00 0.00 70.33 67.30 3g2q n THR 60 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3g2q n GLY 61 N 2.11 -1.19 3.35 3.38 0.00 -0.74 -5.05 105.19 107.04 3g2q n GLY 61 Ca 0.00 0.98 -0.30 0.00 0.00 0.00 0.00 46.02 46.70 3g2q n GLY 61 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g2q s VAL 63 N -2.31 2.14 -0.06 1.61 1.01 -1.26 -5.09 120.40 116.44 3g2q s VAL 63 Ca 0.19 -1.42 -0.18 0.00 0.00 0.00 0.00 61.98 60.58 3g2q s VAL 63 Cb -0.05 -1.84 -0.13 0.00 0.00 0.00 0.00 36.38 34.36 3g2q s VAL 63 CO 0.62 0.34 0.72 -1.28 0.00 0.00 0.00 175.10 175.49 3g2q h SER 64 N 4.71 -0.21 0.00 3.32 0.87 -1.99 -3.50 113.55 116.75 3g2q h SER 64 Ca -0.47 -0.27 0.00 0.00 -1.23 0.00 0.00 61.79 59.82 3g2q h SER 64 Cb 1.14 0.06 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 3g2q h SER 64 CO 0.43 0.33 0.00 0.61 -0.53 0.00 0.00 176.83 177.67 3g2q n GLY 65 N 0.74 4.61 3.55 5.77 0.00 -1.26 -5.11 105.19 113.49 3g2q n GLY 65 Ca -0.07 -0.85 -0.45 0.00 0.00 0.00 0.00 46.02 44.64 3g2q n GLY 65 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3g2q n PRO 66 N 0.00 1.09 -4.86 1.61 -0.02 -1.26 -4.62 135.00 126.94 3g2q n PRO 66 Ca 0.00 0.38 -0.33 0.00 -2.02 0.00 0.00 63.50 61.53 3g2q n PRO 66 Cb 0.00 -1.69 -0.15 0.00 -0.02 0.00 0.00 33.50 31.64 3g2q n PRO 66 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3g2q s VAL 67 N -0.98 2.88 -0.27 -1.45 1.01 0.35 -3.43 120.40 118.50 3g2q s VAL 67 Ca 0.61 -0.73 -0.19 0.00 0.00 0.00 0.00 61.98 61.68 3g2q s VAL 67 Cb -0.76 -2.19 -0.02 0.00 0.00 0.00 0.00 36.38 33.41 3g2q s VAL 67 CO 0.59 0.53 0.55 -0.22 0.00 0.00 0.00 175.10 176.55 3g2q s LEU 68 N 0.31 4.09 -0.22 3.92 2.96 0.36 -0.80 118.68 129.30 3g2q s LEU 68 Ca -0.12 0.49 -0.06 0.00 -0.22 0.00 0.00 54.13 54.22 3g2q s LEU 68 Cb -0.16 -2.71 -0.03 0.00 0.50 0.00 0.00 46.19 43.79 3g2q s LEU 68 CO 0.06 -0.35 0.03 -0.70 -1.32 0.00 0.00 176.35 174.08 3g2q s GLU 69 N 2.40 3.66 -0.06 1.98 2.12 0.94 -0.47 118.70 129.26 3g2q s GLU 69 Ca 0.22 -0.49 -0.10 0.00 0.36 0.00 0.00 54.97 54.97 3g2q s GLU 69 Cb -0.15 -3.19 -0.05 0.00 0.26 0.00 0.00 34.13 30.99 3g2q s GLU 69 CO 0.10 -0.06 0.25 -0.51 -0.54 0.00 0.00 175.26 174.50 3g2q s LEU 70 N 1.22 4.42 -1.23 2.70 1.43 -0.40 -0.67 118.68 126.15 3g2q s LEU 70 Ca 0.04 0.66 -0.11 0.00 -1.03 0.00 0.00 54.13 53.70 3g2q s LEU 70 Cb -0.15 -2.33 -0.01 0.00 0.03 0.00 0.00 46.19 43.74 3g2q s LEU 70 CO 0.02 0.36 0.70 0.00 0.23 0.00 0.00 176.35 177.66 3g2q n ALA 71 N 1.82 -2.31 0.34 4.21 0.00 0.29 -4.52 120.51 120.33 3g2q n ALA 71 Ca -0.17 -0.20 0.13 0.00 0.00 0.00 0.00 53.44 53.20 3g2q n ALA 71 Cb 0.54 -3.18 0.57 0.00 0.00 0.00 0.00 19.45 17.37 3g2q n ALA 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3g2q h ALA 72 N 0.77 1.00 -0.80 0.00 0.00 -1.26 -3.48 119.26 115.50 3g2q h ALA 72 Ca -0.64 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.27 3g2q h ALA 72 Cb 1.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.15 3g2q h ALA 72 CO 0.53 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.19 3g2q n GLY 73 N -0.24 2.78 1.73 0.00 0.00 -1.26 -1.89 105.19 106.31 3g2q n GLY 73 Ca 0.01 -0.32 0.09 0.00 0.00 0.00 0.00 46.02 45.80 3g2q n GLY 73 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3g2q n MET 74 N 13.61 4.18 -0.34 1.61 2.81 -1.26 -4.68 117.12 133.04 3g2q n MET 74 Ca 0.00 -3.01 0.00 0.00 -1.81 0.00 0.00 57.70 52.88 3g2q n MET 74 Cb 0.00 -2.04 0.00 0.00 -0.71 0.00 0.00 33.22 30.47 3g2q n MET 74 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3g2q n GLY 75 N 0.99 0.79 0.41 3.03 0.00 -0.79 -4.71 105.19 104.91 3g2q n GLY 75 Ca 0.27 -0.36 0.22 0.00 0.00 0.00 0.00 46.02 46.15 3g2q n GLY 75 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3g2q h ARG 76 N 0.17 0.39 0.00 1.61 2.43 -1.92 -0.88 114.38 116.17 3g2q h ARG 76 Ca 0.00 -0.02 -0.35 0.00 -0.81 0.00 0.00 59.98 58.79 3g2q h ARG 76 Cb 0.00 -0.09 -0.07 0.00 -0.42 0.00 0.00 29.97 29.40 3g2q h ARG 76 CO 0.00 0.26 -2.32 1.28 -1.51 0.00 0.00 179.97 177.67 3g2q n LEU 77 N -4.60 0.10 -0.06 3.80 4.77 -1.26 -3.97 117.00 115.79 3g2q n LEU 77 Ca 0.24 -0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 56.11 3g2q n LEU 77 Cb 0.85 0.43 -0.04 0.00 -2.33 0.00 0.00 43.42 42.33 3g2q n LEU 77 CO 0.26 0.49 0.90 0.74 -1.33 0.00 0.00 177.39 178.46 3g2q h THR 78 N 0.00 1.12 0.02 -5.08 2.02 -1.72 -1.21 112.91 108.05 3g2q h THR 78 Ca -0.52 -0.34 -0.00 0.00 0.77 0.00 0.00 66.41 66.32 3g2q h THR 78 Cb 2.18 0.96 0.00 0.00 -1.74 0.00 0.00 68.15 69.55 3g2q h THR 78 CO 0.02 0.12 -0.01 -0.26 0.37 0.00 0.00 175.52 175.77 3g2q h PHE 79 N 0.22 -0.02 -0.84 3.16 0.04 -1.44 0.27 116.94 118.33 3g2q h PHE 79 Ca 0.07 -0.00 0.20 0.00 2.80 0.00 0.00 57.97 61.04 3g2q h PHE 79 Cb 0.09 0.01 -0.12 0.00 2.20 0.00 0.00 35.95 38.13 3g2q h PHE 79 CO -0.03 0.04 0.31 -1.35 -0.60 0.00 0.00 178.31 176.68 3g2q h PRO 80 N -0.08 0.34 -0.53 1.51 0.11 -1.76 -0.62 132.00 130.97 3g2q h PRO 80 Ca -0.00 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.07 3g2q h PRO 80 Cb 0.07 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.08 3g2q h PRO 80 CO 0.00 0.23 0.25 0.74 -0.21 0.00 0.00 178.00 179.01 3g2q h PHE 81 N 0.35 0.78 -0.67 0.65 0.04 -0.43 -2.85 116.94 114.81 3g2q h PHE 81 Ca 0.51 -0.04 0.03 0.00 2.80 0.00 0.00 57.97 61.27 3g2q h PHE 81 Cb 0.93 -0.24 -0.04 0.00 2.20 0.00 0.00 35.95 38.80 3g2q h PHE 81 CO -0.19 0.61 0.44 -0.07 -0.60 0.00 0.00 178.31 178.50 3g2q h LEU 82 N 0.71 0.68 0.00 1.54 3.38 0.42 -1.95 115.31 120.10 3g2q h LEU 82 Ca 0.18 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.14 3g2q h LEU 82 Cb 0.14 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.73 3g2q h LEU 82 CO -0.02 0.47 0.00 0.47 0.09 0.00 0.00 178.44 179.45 3g2q n ASP 83 N -4.46 0.00 -1.08 -0.43 8.00 -0.33 -2.25 116.55 116.00 3g2q n ASP 83 Ca 0.08 0.42 0.12 0.00 0.71 0.00 0.00 54.79 56.12 3g2q n ASP 83 Cb 0.13 -0.46 0.19 0.00 -0.02 0.00 0.00 41.12 40.97 3g2q n ASP 83 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3g2q n LEU 84 N -1.46 3.26 0.00 0.64 4.77 -0.74 -4.94 117.00 118.53 3g2q n LEU 84 Ca 0.04 -1.32 0.00 0.00 -0.03 0.00 0.00 56.01 54.70 3g2q n LEU 84 Cb 0.14 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 3g2q n LEU 84 CO 0.12 0.66 0.00 0.61 -1.33 0.00 0.00 177.39 177.45 3g2q n GLY 85 N 1.45 1.10 3.68 -0.72 0.00 -0.96 -5.05 105.19 104.70 3g2q n GLY 85 Ca 0.18 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.76 3g2q n GLY 85 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3g2q n TRP 86 N -2.00 2.30 -2.76 1.61 7.02 -1.20 -4.98 117.44 117.43 3g2q n TRP 86 Ca 0.00 0.38 -0.43 0.00 -1.02 0.00 0.00 57.50 56.44 3g2q n TRP 86 Cb 0.00 -2.49 -0.03 0.00 -2.42 0.00 0.00 31.31 26.36 3g2q n TRP 86 CO 0.00 0.00 0.00 -1.21 -2.02 0.00 0.00 177.69 174.46 3g2q s GLU 87 N -0.31 4.06 -0.15 -0.99 2.02 -1.26 -4.54 118.70 117.53 3g2q s GLU 87 Ca 0.68 0.93 0.00 0.00 0.02 0.00 0.00 54.97 56.61 3g2q s GLU 87 Cb -0.62 -3.72 -0.00 0.00 0.10 0.00 0.00 34.13 29.89 3g2q s GLU 87 CO 0.48 -0.76 -0.15 0.08 0.02 0.00 0.00 175.26 174.93 3g2q s VAL 88 N 3.30 2.76 -0.27 2.63 1.01 0.23 -0.50 120.40 129.56 3g2q s VAL 88 Ca 0.40 -0.74 -0.19 0.00 0.00 0.00 0.00 61.98 61.45 3g2q s VAL 88 Cb -0.13 -2.16 -0.02 0.00 0.00 0.00 0.00 36.38 34.06 3g2q s VAL 88 CO 0.13 0.51 0.57 -0.89 0.00 0.00 0.00 175.10 175.42 3g2q s THR 89 N 0.73 5.02 -0.27 3.92 2.01 0.02 -0.56 115.64 126.50 3g2q s THR 89 Ca -0.06 0.93 -0.07 0.00 0.31 0.00 0.00 61.69 62.80 3g2q s THR 89 Cb -0.15 -3.89 -0.01 0.00 0.01 0.00 0.00 72.50 68.45 3g2q s THR 89 CO 0.01 0.02 0.07 0.00 -0.69 0.00 0.00 174.62 174.03 3g2q s ALA 90 N 2.42 3.10 -0.15 7.40 0.00 0.12 -0.04 121.76 134.62 3g2q s ALA 90 Ca 0.23 -1.27 -0.05 0.00 0.00 0.00 0.00 51.96 50.87 3g2q s ALA 90 Cb -0.15 -2.09 -0.04 0.00 0.00 0.00 0.00 23.12 20.84 3g2q s ALA 90 CO 0.10 -0.67 0.03 -1.17 0.00 0.00 0.00 175.76 174.05 3g2q s LEU 91 N 1.56 3.70 -0.03 0.00 0.20 0.16 -1.10 118.68 123.16 3g2q s LEU 91 Ca 0.05 0.09 -0.13 0.00 0.69 0.00 0.00 54.13 54.83 3g2q s LEU 91 Cb -0.16 -1.90 0.02 0.00 -0.43 0.00 0.00 46.19 43.72 3g2q s LEU 91 CO 0.03 0.24 0.29 -0.70 -0.29 0.00 0.00 176.35 175.91 3g2q s GLU 92 N -0.05 0.58 -0.11 1.98 2.56 -0.65 -0.55 118.70 122.47 3g2q s GLU 92 Ca 0.05 -0.10 -0.14 0.00 0.00 0.00 0.00 54.97 54.78 3g2q s GLU 92 Cb -0.12 0.26 -0.27 0.00 2.00 0.00 0.00 34.13 36.00 3g2q s GLU 92 CO 0.01 -0.15 0.51 1.25 -0.56 0.00 0.00 175.26 176.33 3g2q h LEU 93 N 4.27 0.40 -9.39 2.70 5.85 -1.83 -0.72 115.31 116.59 3g2q h LEU 93 Ca -0.29 -0.86 -0.54 0.00 0.84 0.00 0.00 57.88 57.02 3g2q h LEU 93 Cb 1.18 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 42.06 3g2q h LEU 93 CO 0.38 1.69 0.44 -0.55 -0.34 0.00 0.00 178.44 180.07 3g2q s SER 94 N -7.06 7.30 0.19 1.25 0.15 -1.26 -4.72 113.70 109.54 3g2q s SER 94 Ca -0.20 1.69 -0.07 0.00 0.70 0.00 0.00 55.95 58.06 3g2q s SER 94 Cb 0.05 -2.57 0.10 0.00 -1.71 0.00 0.00 66.02 61.89 3g2q s SER 94 CO 0.77 -0.34 1.58 0.71 1.20 0.00 0.00 173.24 177.17 3g2q h THR 95 N 4.83 1.27 -0.53 6.45 1.35 -1.99 -1.67 112.91 122.63 3g2q h THR 95 Ca -0.39 -1.38 -0.10 0.00 -0.55 0.00 0.00 66.41 63.99 3g2q h THR 95 Cb 1.20 1.20 -0.02 0.00 -1.73 0.00 0.00 68.15 68.80 3g2q h THR 95 CO 0.78 0.47 -0.08 0.77 -0.25 0.00 0.00 175.52 177.22 3g2q h SER 96 N 0.75 0.95 -0.59 5.36 4.64 -1.99 0.06 113.55 122.74 3g2q h SER 96 Ca 0.10 -0.29 -0.04 0.00 -0.47 0.00 0.00 61.79 61.08 3g2q h SER 96 Cb 0.78 -0.26 -0.03 0.00 -0.31 0.00 0.00 62.40 62.59 3g2q h SER 96 CO 0.06 1.05 0.20 0.58 -0.87 0.00 0.00 176.83 177.85 3g2q h VAL 97 N 0.86 1.24 -0.67 0.95 2.07 -1.92 -2.04 116.25 116.74 3g2q h VAL 97 Ca 0.14 -0.79 -0.02 0.00 0.82 0.00 0.00 66.70 66.86 3g2q h VAL 97 Cb 0.61 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 30.99 3g2q h VAL 97 CO 0.04 0.30 0.33 -0.07 0.02 0.00 0.00 177.57 178.19 3g2q h LEU 98 N 0.82 0.85 -0.03 2.57 3.38 -1.05 -0.61 115.31 121.25 3g2q h LEU 98 Ca 0.19 -0.08 0.01 0.00 0.09 0.00 0.00 57.88 58.08 3g2q h LEU 98 Cb 0.26 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3g2q h LEU 98 CO -0.01 0.72 -0.01 0.00 0.09 0.00 0.00 178.44 179.23 3g2q h ALA 99 N 1.42 0.01 -0.48 1.53 0.00 -0.75 -0.23 119.26 120.76 3g2q h ALA 99 Ca 0.23 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.12 3g2q h ALA 99 Cb 0.08 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 3g2q h ALA 99 CO -0.03 -0.50 0.14 0.00 0.00 0.00 0.00 179.25 178.86 3g2q h ALA 100 N 1.02 1.35 -0.12 0.00 0.00 -1.10 -1.43 119.26 118.99 3g2q h ALA 100 Ca 0.01 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 3g2q h ALA 100 Cb 0.03 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3g2q h ALA 100 CO -0.03 0.47 0.05 0.35 0.00 0.00 0.00 179.25 180.09 3g2q h PHE 101 N 0.69 0.17 -0.94 0.00 -0.00 -0.98 -2.77 116.94 113.11 3g2q h PHE 101 Ca 0.16 -0.01 0.05 0.00 -0.00 0.00 0.00 57.97 58.17 3g2q h PHE 101 Cb 0.22 -0.05 -0.06 0.00 -0.00 0.00 0.00 35.95 36.06 3g2q h PHE 101 CO 0.01 0.26 0.61 -0.09 -0.00 0.00 0.00 178.31 179.11 3g2q h ARG 102 N 0.04 1.10 0.57 1.11 2.43 -0.50 0.09 114.38 119.22 3g2q h ARG 102 Ca 0.04 -0.07 -0.03 0.00 -0.81 0.00 0.00 59.98 59.12 3g2q h ARG 102 Cb 0.16 -0.25 0.00 0.00 -0.42 0.00 0.00 29.97 29.46 3g2q h ARG 102 CO -0.00 0.73 -0.28 0.87 -1.51 0.00 0.00 179.97 179.77 3g2q h LYS 103 N 1.13 -0.75 -0.78 0.20 1.57 -1.22 -1.23 116.57 115.49 3g2q h LYS 103 Ca 0.39 0.05 0.10 0.00 -1.87 0.00 0.00 60.65 59.32 3g2q h LYS 103 Cb 0.10 0.17 -0.08 0.00 0.08 0.00 0.00 32.23 32.51 3g2q h LYS 103 CO -0.14 -0.50 0.41 0.00 -0.57 0.00 0.00 179.45 178.66 3g2q h ARG 104 N -0.78 0.66 0.00 3.15 3.08 -1.18 -1.08 114.38 118.23 3g2q h ARG 104 Ca -0.08 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 59.90 3g2q h ARG 104 Cb 0.60 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.50 3g2q h ARG 104 CO 0.12 0.44 -0.15 1.25 -1.07 0.00 0.00 179.97 180.55 3g2q h LEU 105 N 0.68 0.00 -0.35 3.04 5.85 -0.83 -2.71 115.31 121.00 3g2q h LEU 105 Ca 0.39 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.98 3g2q h LEU 105 Cb 0.41 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.43 3g2q h LEU 105 CO -0.28 0.15 -0.59 0.00 -0.34 0.00 0.00 178.44 177.39 3g2q h ALA 106 N 1.85 0.72 -0.30 1.25 0.00 0.05 -3.17 119.26 119.66 3g2q h ALA 106 Ca -0.00 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.37 3g2q h ALA 106 Cb 0.44 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3g2q h ALA 106 CO 0.02 0.74 0.00 0.39 0.00 0.00 0.00 179.25 180.40 3g2q n GLU 107 N -3.40 2.52 -4.22 0.00 1.02 -1.02 -4.92 120.64 110.62 3g2q n GLU 107 Ca 0.01 -1.43 -0.30 0.00 -0.02 0.00 0.00 57.16 55.42 3g2q n GLU 107 Cb 0.70 -1.67 -0.09 0.00 -0.02 0.00 0.00 31.44 30.36 3g2q n GLU 107 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3g2q s ALA 108 N -1.74 3.09 0.34 0.62 0.00 -1.20 -5.09 121.76 117.78 3g2q s ALA 108 Ca 0.25 -1.17 -0.27 0.00 0.00 0.00 0.00 51.96 50.77 3g2q s ALA 108 Cb 0.17 -1.04 -0.13 0.00 0.00 0.00 0.00 23.12 22.13 3g2q s ALA 108 CO 0.10 0.66 1.15 -2.30 0.00 0.00 0.00 175.76 175.38 3g2q n PRO 109 N 0.76 1.74 0.00 0.00 -0.02 -1.26 -4.57 135.00 131.65 3g2q n PRO 109 Ca -0.13 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 3g2q n PRO 109 Cb 0.52 -2.12 0.02 0.00 -0.02 0.00 0.00 33.50 31.91 3g2q n PRO 109 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3g2q n ALA 110 N 0.17 1.13 0.05 3.55 0.00 -1.26 -0.48 120.51 123.68 3g2q n ALA 110 Ca 0.07 -0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.33 3g2q n ALA 110 Cb 0.35 -1.01 -0.14 0.00 0.00 0.00 0.00 19.45 18.64 3g2q n ALA 110 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 3g2q h ASP 111 N 0.00 0.38 0.11 0.00 2.03 -1.99 -3.12 116.42 113.84 3g2q h ASP 111 Ca 0.00 -0.58 -0.01 0.00 -0.73 0.00 0.00 57.03 55.71 3g2q h ASP 111 Cb 0.01 -0.13 0.00 0.00 -0.83 0.00 0.00 39.33 38.39 3g2q h ASP 111 CO 0.00 1.49 -0.05 0.58 -1.03 0.00 0.00 179.24 180.23 3g2q h VAL 112 N 0.07 1.08 -0.12 4.15 2.07 -1.12 -3.23 116.25 119.15 3g2q h VAL 112 Ca -0.28 -1.11 0.03 0.00 0.82 0.00 0.00 66.70 66.17 3g2q h VAL 112 Cb 2.03 1.75 -0.00 0.00 -1.52 0.00 0.00 31.29 33.54 3g2q h VAL 112 CO 0.15 0.25 0.20 -0.09 0.02 0.00 0.00 177.57 178.10 3g2q h ARG 113 N -0.70 0.00 0.00 1.57 2.43 -1.26 -2.50 114.38 113.91 3g2q h ARG 113 Ca -0.02 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 3g2q h ARG 113 Cb 0.53 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.08 3g2q h ARG 113 CO 0.03 0.00 -1.01 -0.25 -1.51 0.00 0.00 179.97 177.22 3g2q n ASP 114 N -3.49 0.86 -0.65 -3.80 8.00 -1.18 -4.00 116.55 112.29 3g2q n ASP 114 Ca 0.00 -0.85 0.11 0.00 0.71 0.00 0.00 54.79 54.76 3g2q n ASP 114 Cb 0.29 1.10 0.35 0.00 -0.02 0.00 0.00 41.12 42.84 3g2q n ASP 114 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3g2q n ARG 115 N -1.53 1.86 -3.96 -1.24 1.74 -0.95 -4.86 116.66 107.73 3g2q n ARG 115 Ca 0.03 -1.29 -0.35 0.00 -0.77 0.00 0.00 57.85 55.47 3g2q n ARG 115 Cb 0.32 -1.42 -0.14 0.00 -1.02 0.00 0.00 32.46 30.21 3g2q n ARG 115 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3g2q s THR 117 N 1.37 4.03 -0.19 0.00 2.01 0.27 -5.00 115.64 118.13 3g2q s THR 117 Ca 0.04 -0.31 -0.06 0.00 0.31 0.00 0.00 61.69 61.68 3g2q s THR 117 Cb -0.14 -2.78 -0.03 0.00 0.01 0.00 0.00 72.50 69.56 3g2q s THR 117 CO -0.01 0.48 0.02 -0.22 -0.69 0.00 0.00 174.62 174.20 3g2q s LEU 118 N 0.40 3.46 -0.03 4.42 2.96 -1.26 0.14 118.68 128.77 3g2q s LEU 118 Ca -0.03 -0.09 0.02 0.00 -0.22 0.00 0.00 54.13 53.82 3g2q s LEU 118 Cb -0.14 -1.87 0.00 0.00 0.50 0.00 0.00 46.19 44.68 3g2q s LEU 118 CO 0.02 0.12 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.39 3g2q s VAL 119 N 0.68 0.81 -0.05 1.68 1.01 -0.26 -4.96 120.40 119.31 3g2q s VAL 119 Ca 0.01 -0.37 -0.26 0.00 0.00 0.00 0.00 61.98 61.36 3g2q s VAL 119 Cb -0.14 -0.73 -0.03 0.00 0.00 0.00 0.00 36.38 35.48 3g2q s VAL 119 CO 0.02 0.26 0.80 -1.58 0.00 0.00 0.00 175.10 174.59 3g2q s GLN 120 N 0.23 4.47 -0.10 2.72 0.74 -1.26 -1.63 119.66 124.82 3g2q s GLN 120 Ca -0.04 1.06 -0.33 0.00 0.05 0.00 0.00 55.36 56.10 3g2q s GLN 120 Cb -0.09 -3.46 0.13 0.00 1.10 0.00 0.00 33.01 30.69 3g2q s GLN 120 CO 0.01 0.00 1.21 0.20 -0.55 0.00 0.00 175.29 176.16 3g2q s GLY 121 N 0.89 -0.34 -0.35 2.59 0.00 -0.28 -4.89 107.32 104.93 3g2q s GLY 121 Ca 0.42 1.18 -0.17 0.00 0.00 0.00 0.00 44.72 46.15 3g2q s GLY 121 CO 0.21 0.35 0.44 -0.35 0.00 0.00 0.00 173.10 173.75 3g2q s ASP 122 N -2.52 6.25 0.05 1.64 -1.08 -1.26 -2.84 116.67 116.91 3g2q s ASP 122 Ca 0.11 -0.16 0.13 0.00 -0.52 0.00 0.00 52.55 52.11 3g2q s ASP 122 Cb 0.01 -2.23 0.55 0.00 -1.46 0.00 0.00 42.92 39.79 3g2q s ASP 122 CO -0.04 -0.43 1.40 1.15 0.52 0.00 0.00 175.17 177.77 3g2q n MET 123 N 5.58 0.03 0.15 4.34 0.00 -1.26 -1.53 117.12 124.43 3g2q n MET 123 Ca -0.07 0.35 0.12 0.00 0.00 0.00 0.00 57.70 58.11 3g2q n MET 123 Cb 0.49 -1.58 0.12 0.00 0.00 0.00 0.00 33.22 32.26 3g2q n MET 123 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 3g2q h SER 124 N 0.00 0.00 -0.78 3.17 4.64 -1.87 -3.36 113.55 115.35 3g2q h SER 124 Ca 0.00 -0.02 -0.22 0.00 -0.47 0.00 0.00 61.79 61.07 3g2q h SER 124 Cb 0.19 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 62.10 3g2q h SER 124 CO 0.00 0.01 -0.55 0.00 -0.87 0.00 0.00 176.83 175.42 3g2q n ALA 125 N -2.08 -1.20 -2.45 5.18 0.00 -0.58 -2.84 120.51 116.54 3g2q n ALA 125 Ca 0.03 -1.41 -0.23 0.00 0.00 0.00 0.00 53.44 51.82 3g2q n ALA 125 Cb 0.52 -1.36 -0.10 0.00 0.00 0.00 0.00 19.45 18.51 3g2q n ALA 125 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 3g2q s PHE 126 N 0.66 2.19 -0.23 0.00 -0.12 -1.08 -4.54 117.98 114.85 3g2q s PHE 126 Ca 0.31 -0.41 -0.08 0.00 -0.05 0.00 0.00 56.93 56.71 3g2q s PHE 126 Cb 0.09 -1.01 0.11 0.00 -0.63 0.00 0.00 43.02 41.58 3g2q s PHE 126 CO -0.13 0.62 0.50 0.00 -0.05 0.00 0.00 175.22 176.15 3g2q s ALA 127 N -2.62 -1.46 0.26 1.99 0.00 -1.26 -4.91 121.76 113.75 3g2q s ALA 127 Ca 0.29 1.78 0.10 0.00 0.00 0.00 0.00 51.96 54.13 3g2q s ALA 127 Cb -0.03 -1.49 -0.05 0.00 0.00 0.00 0.00 23.12 21.55 3g2q s ALA 127 CO 0.14 -0.83 -0.08 -0.51 0.00 0.00 0.00 175.76 174.47 3g2q s LEU 128 N 2.71 2.95 -0.87 0.00 1.43 -1.26 -5.03 118.68 118.62 3g2q s LEU 128 Ca -0.03 -0.76 -0.05 0.00 -1.03 0.00 0.00 54.13 52.26 3g2q s LEU 128 Cb -0.12 -1.50 0.08 0.00 0.03 0.00 0.00 46.19 44.68 3g2q s LEU 128 CO -0.15 0.03 2.62 -0.67 0.23 0.00 0.00 176.35 178.41 3g2q n ASP 129 N -0.66 7.22 -3.62 2.29 2.03 -1.26 -4.83 116.55 117.73 3g2q n ASP 129 Ca -0.07 -3.14 -0.10 0.00 0.52 0.00 0.00 54.79 52.00 3g2q n ASP 129 Cb 0.59 -1.30 -0.06 0.00 -0.72 0.00 0.00 41.12 39.62 3g2q n ASP 129 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 3g2q s LYS 130 N -1.31 0.57 0.30 -0.67 2.20 -1.26 -5.18 119.74 114.39 3g2q s LYS 130 Ca 0.57 0.47 0.10 0.00 -0.36 0.00 0.00 55.97 56.75 3g2q s LYS 130 Cb 0.28 0.27 -0.05 0.00 -1.51 0.00 0.00 37.83 36.83 3g2q s LYS 130 CO -0.15 -0.11 -0.03 1.03 -0.36 0.00 0.00 175.35 175.73 3g2q s ARG 131 N -0.20 2.11 0.03 4.03 0.52 -1.26 -4.84 118.95 119.33 3g2q s ARG 131 Ca 0.01 -1.61 0.02 0.00 -0.52 0.00 0.00 55.73 53.63 3g2q s ARG 131 Cb -0.04 -2.00 -0.02 0.00 0.52 0.00 0.00 34.95 33.41 3g2q s ARG 131 CO -0.03 0.26 -0.07 -0.06 0.02 0.00 0.00 175.30 175.42 3g2q s PHE 132 N -2.44 0.62 0.16 -0.53 0.08 0.12 -4.87 117.98 111.12 3g2q s PHE 132 Ca 0.33 -0.37 0.15 0.00 0.12 0.00 0.00 56.93 57.16 3g2q s PHE 132 Cb -0.04 -0.38 0.44 0.00 -0.57 0.00 0.00 43.02 42.48 3g2q s PHE 132 CO 0.19 -0.06 1.63 0.78 -0.10 0.00 0.00 175.22 177.66 3g2q h GLY 133 N 4.99 0.00 -6.00 4.36 0.00 -1.85 0.17 103.07 104.74 3g2q h GLY 133 Ca -0.33 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 46.73 3g2q h GLY 133 CO 0.44 0.00 -0.73 -1.59 0.00 0.00 0.00 176.54 174.66 3g2q s THR 134 N -3.46 0.00 -0.07 4.70 2.01 -1.25 -0.80 115.64 116.78 3g2q s THR 134 Ca 0.00 0.09 0.03 0.00 0.31 0.00 0.00 61.69 62.12 3g2q s THR 134 Cb 0.11 -0.07 0.01 0.00 0.01 0.00 0.00 72.50 72.56 3g2q s THR 134 CO 0.73 0.05 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.87 3g2q s VAL 135 N 0.51 1.37 0.01 3.82 1.01 -0.00 -0.49 120.40 126.63 3g2q s VAL 135 Ca -0.04 -0.62 0.06 0.00 0.00 0.00 0.00 61.98 61.38 3g2q s VAL 135 Cb -0.06 -1.22 -0.02 0.00 0.00 0.00 0.00 36.38 35.08 3g2q s VAL 135 CO -0.01 0.41 -0.19 0.68 0.00 0.00 0.00 175.10 175.99 3g2q s VAL 136 N 0.52 1.48 -0.03 2.92 -7.23 0.38 -0.20 120.40 118.23 3g2q s VAL 136 Ca -0.14 -0.97 -0.04 0.00 -1.81 0.00 0.00 61.98 59.02 3g2q s VAL 136 Cb -0.16 -1.27 0.01 0.00 0.56 0.00 0.00 36.38 35.52 3g2q s VAL 136 CO 0.05 0.28 0.10 -0.51 -0.31 0.00 0.00 175.10 174.71 3g2q s ILE 137 N -0.62 0.02 0.29 -0.62 2.07 -0.47 -1.28 121.20 120.59 3g2q s ILE 137 Ca 0.06 -0.19 0.03 0.00 -1.41 0.00 0.00 60.65 59.15 3g2q s ILE 137 Cb -0.08 -0.22 -0.03 0.00 0.13 0.00 0.00 42.46 42.27 3g2q s ILE 137 CO 0.00 -0.10 0.44 -0.94 -1.91 0.00 0.00 174.94 172.43 3g2q s SER 138 N -0.30 6.31 0.19 4.50 1.04 -1.26 -2.20 113.70 121.97 3g2q s SER 138 Ca -0.04 0.23 -0.19 0.00 0.48 0.00 0.00 55.95 56.44 3g2q s SER 138 Cb -0.03 -1.93 0.14 0.00 0.10 0.00 0.00 66.02 64.30 3g2q s SER 138 CO 0.00 -0.17 1.61 -1.28 0.98 0.00 0.00 173.24 174.38 3g2q h SER 139 N 0.99 -0.86 -1.39 7.02 0.87 -1.14 0.25 113.55 119.29 3g2q h SER 139 Ca -0.51 0.19 0.41 0.00 -1.23 0.00 0.00 61.79 60.65 3g2q h SER 139 Cb 1.23 0.46 -0.08 0.00 -0.44 0.00 0.00 62.40 63.56 3g2q h SER 139 CO 0.61 -0.26 0.96 1.23 -0.53 0.00 0.00 176.83 178.84 3g2q h GLY 140 N -0.13 0.55 0.00 5.77 0.00 -1.95 -2.69 103.07 104.62 3g2q h GLY 140 Ca 0.23 -0.06 -0.21 0.00 0.00 0.00 0.00 47.33 47.29 3g2q h GLY 140 CO -0.59 -0.13 -1.21 1.44 0.00 0.00 0.00 176.54 176.05 3g2q n SER 141 N -4.33 1.86 0.25 0.19 7.64 0.83 -3.67 113.62 116.38 3g2q n SER 141 Ca 0.33 0.45 0.09 0.00 1.01 0.00 0.00 58.87 60.75 3g2q n SER 141 Cb 1.43 -0.94 0.63 0.00 -1.01 0.00 0.00 64.21 64.31 3g2q n SER 141 CO 0.00 0.00 0.00 -0.29 -3.01 0.00 0.00 175.04 171.74 3g2q h ILE 142 N -1.00 0.87 0.00 0.44 2.10 -1.11 0.23 117.51 119.05 3g2q h ILE 142 Ca -0.31 -0.51 0.00 0.00 1.08 0.00 0.00 64.86 65.12 3g2q h ILE 142 Cb 1.20 1.29 0.00 0.00 -1.09 0.00 0.00 36.82 38.22 3g2q h ILE 142 CO -0.19 0.13 0.00 0.59 -1.08 0.00 0.00 178.15 177.61 3g2q n ASN 143 N -4.05 0.04 0.28 2.19 3.02 -1.04 -2.08 115.26 113.63 3g2q n ASN 143 Ca -0.02 0.51 0.16 0.00 -0.03 0.00 0.00 54.58 55.19 3g2q n ASN 143 Cb 0.22 -0.52 0.82 0.00 -0.61 0.00 0.00 39.78 39.69 3g2q n ASN 143 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 3g2q h GLU 144 N 0.00 0.00 -5.60 3.52 4.39 -1.01 -3.41 114.58 112.46 3g2q h GLU 144 Ca 0.00 0.00 -0.65 0.00 0.34 0.00 0.00 59.36 59.05 3g2q h GLU 144 Cb 0.35 0.00 -0.15 0.00 -0.10 0.00 0.00 28.75 28.86 3g2q h GLU 144 CO 0.00 0.07 -0.58 -0.51 -1.16 0.00 0.00 179.01 176.83 3g2q s LEU 145 N -6.83 3.77 0.00 1.33 1.43 -0.88 -5.11 118.68 112.38 3g2q s LEU 145 Ca -0.02 0.15 -0.14 0.00 -1.03 0.00 0.00 54.13 53.08 3g2q s LEU 145 Cb 0.12 -1.91 0.21 0.00 0.03 0.00 0.00 46.19 44.64 3g2q s LEU 145 CO 0.54 0.29 0.75 -0.90 0.23 0.00 0.00 176.35 177.27 3g2q n ASP 146 N 2.75 -1.75 -0.13 2.29 5.68 -1.26 -4.71 116.55 119.42 3g2q n ASP 146 Ca -0.18 -0.96 -0.11 0.00 -0.50 0.00 0.00 54.79 53.03 3g2q n ASP 146 Cb 0.53 -0.69 -0.02 0.00 -1.14 0.00 0.00 41.12 39.80 3g2q n ASP 146 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 3g2q h GLU 147 N 0.00 0.78 -0.49 0.11 4.81 -1.99 -1.38 114.58 116.42 3g2q h GLU 147 Ca -0.28 -0.32 -0.02 0.00 -0.13 0.00 0.00 59.36 58.61 3g2q h GLU 147 Cb 0.87 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.19 3g2q h GLU 147 CO 0.19 0.93 0.21 0.00 -0.73 0.00 0.00 179.01 179.61 3g2q h ALA 148 N 0.82 0.64 -0.47 2.92 0.00 -2.00 -2.62 119.26 118.55 3g2q h ALA 148 Ca 0.09 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 3g2q h ALA 148 Cb 0.67 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 3g2q h ALA 148 CO 0.05 0.22 -0.07 -0.44 0.00 0.00 0.00 179.25 179.01 3g2q h ASP 149 N 0.65 0.80 -0.85 0.00 3.32 -1.88 -2.17 116.42 116.29 3g2q h ASP 149 Ca 0.17 -0.23 0.00 0.00 0.02 0.00 0.00 57.03 56.99 3g2q h ASP 149 Cb 0.16 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 39.45 3g2q h ASP 149 CO -0.02 0.91 0.54 0.03 -1.72 0.00 0.00 179.24 178.98 3g2q h ARG 150 N 0.75 1.14 -0.49 3.56 3.08 -1.13 0.17 114.38 121.46 3g2q h ARG 150 Ca 0.13 -0.09 0.02 0.00 0.07 0.00 0.00 59.98 60.11 3g2q h ARG 150 Cb 0.55 -0.25 -0.03 0.00 0.08 0.00 0.00 29.97 30.33 3g2q h ARG 150 CO 0.03 0.79 0.30 0.00 -1.07 0.00 0.00 179.97 180.02 3g2q h ARG 151 N 1.17 0.58 -0.51 0.04 3.08 -1.07 -0.77 114.38 116.91 3g2q h ARG 151 Ca 0.31 -0.04 0.07 0.00 0.07 0.00 0.00 59.98 60.39 3g2q h ARG 151 Cb -0.08 -0.13 -0.06 0.00 0.08 0.00 0.00 29.97 29.78 3g2q h ARG 151 CO -0.06 0.39 0.19 0.78 -1.07 0.00 0.00 179.97 180.19 3g2q h GLY 152 N 0.60 0.69 0.20 0.04 0.00 -0.93 -1.92 103.07 101.75 3g2q h GLY 152 Ca 0.19 -0.11 0.07 0.00 0.00 0.00 0.00 47.33 47.49 3g2q h GLY 152 CO -0.08 0.02 -0.16 -2.00 0.00 0.00 0.00 176.54 174.32 3g2q h LEU 153 N 0.37 -0.53 -0.58 3.11 5.85 -0.22 -1.33 115.31 121.98 3g2q h LEU 153 Ca 0.24 0.12 -0.06 0.00 0.84 0.00 0.00 57.88 59.03 3g2q h LEU 153 Cb 0.25 0.29 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 3g2q h LEU 153 CO -0.24 -0.19 0.13 1.88 -0.34 0.00 0.00 178.44 179.68 3g2q h TYR 154 N -0.11 0.99 -0.20 1.25 0.05 -0.92 0.04 116.97 118.07 3g2q h TYR 154 Ca 0.16 -0.12 -0.01 0.00 0.05 0.00 0.00 58.73 58.81 3g2q h TYR 154 Cb 0.36 -0.28 -0.01 0.00 1.01 0.00 0.00 36.73 37.81 3g2q h TYR 154 CO -0.36 0.85 0.07 0.00 -1.05 0.00 0.00 178.16 177.67 3g2q h ALA 155 N 1.02 0.26 -0.95 3.88 0.00 -1.30 -2.34 119.26 119.84 3g2q h ALA 155 Ca 0.18 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3g2q h ALA 155 Cb 0.36 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.03 3g2q h ALA 155 CO 0.00 -0.13 0.61 0.77 0.00 0.00 0.00 179.25 180.50 3g2q h SER 156 N 0.16 1.11 -0.15 0.00 0.02 -0.99 -2.77 113.55 110.93 3g2q h SER 156 Ca 0.07 -0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 60.95 3g2q h SER 156 Cb 0.20 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.46 3g2q h SER 156 CO -0.00 0.82 0.01 0.58 -1.14 0.00 0.00 176.83 177.10 3g2q h VAL 157 N 1.30 1.24 -0.89 2.27 2.07 -0.91 -2.74 116.25 118.59 3g2q h VAL 157 Ca 0.35 -0.79 0.24 0.00 0.82 0.00 0.00 66.70 67.31 3g2q h VAL 157 Cb -0.11 1.47 -0.14 0.00 -1.52 0.00 0.00 31.29 30.99 3g2q h VAL 157 CO -0.07 0.24 0.32 -0.09 0.02 0.00 0.00 177.57 177.99 3g2q h ARG 158 N 0.02 0.28 0.00 1.57 2.43 -1.18 0.68 114.38 118.19 3g2q h ARG 158 Ca 0.04 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 3g2q h ARG 158 Cb 0.35 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 3g2q h ARG 158 CO 0.01 0.18 0.00 0.39 -1.51 0.00 0.00 179.97 179.04 3g2q n GLU 159 N -5.14 0.18 -0.08 0.20 -0.58 -1.05 -2.89 120.64 111.27 3g2q n GLU 159 Ca 0.23 0.39 0.05 0.00 -0.42 0.00 0.00 57.16 57.41 3g2q n GLU 159 Cb 0.70 -1.82 0.09 0.00 -0.57 0.00 0.00 31.44 29.84 3g2q n GLU 159 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 3g2q n HIS 160 N -2.15 0.22 -3.56 -0.32 8.25 0.20 -4.91 115.22 112.94 3g2q n HIS 160 Ca 0.03 -0.24 -0.38 0.00 -0.26 0.00 0.00 57.72 56.87 3g2q n HIS 160 Cb 0.24 -0.01 -0.06 0.00 1.12 0.00 0.00 29.99 31.27 3g2q n HIS 160 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3g2q s LEU 161 N -0.94 4.41 0.62 2.41 1.43 -1.00 0.14 118.68 125.74 3g2q s LEU 161 Ca 0.17 0.80 -0.11 0.00 -1.03 0.00 0.00 54.13 53.96 3g2q s LEU 161 Cb 0.10 -2.47 -0.04 0.00 0.03 0.00 0.00 46.19 43.81 3g2q s LEU 161 CO 0.14 0.28 1.03 -1.61 0.23 0.00 0.00 176.35 176.43 3g2q s GLU 162 N -0.71 3.56 -0.34 1.70 2.02 0.05 -4.74 118.70 120.23 3g2q s GLU 162 Ca 0.21 0.77 -0.44 0.00 0.02 0.00 0.00 54.97 55.54 3g2q s GLU 162 Cb -0.15 -2.08 -0.19 0.00 0.10 0.00 0.00 34.13 31.81 3g2q s GLU 162 CO 0.10 -0.60 1.53 -2.30 0.02 0.00 0.00 175.26 174.01 3g2q n PRO 163 N -2.74 0.31 -1.00 0.39 -0.02 -1.26 -0.39 135.00 130.29 3g2q n PRO 163 Ca 0.06 0.11 0.00 0.00 -2.02 0.00 0.00 63.50 61.65 3g2q n PRO 163 Cb 0.54 -1.66 0.00 0.00 -0.02 0.00 0.00 33.50 32.36 3g2q n PRO 163 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3g2q n GLY 164 N 3.55 0.41 3.80 -1.23 0.00 -1.26 -5.03 105.19 105.44 3g2q n GLY 164 Ca 0.28 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.97 3g2q n GLY 164 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3g2q s GLY 165 N -2.00 2.11 0.02 -0.02 0.00 0.48 -5.02 107.32 102.89 3g2q s GLY 165 Ca 0.00 0.38 0.04 0.00 0.00 0.00 0.00 44.72 45.14 3g2q s GLY 165 CO 0.00 0.70 -0.07 -1.59 0.00 0.00 0.00 173.10 172.14 3g2q s LYS 166 N -4.10 2.48 -0.27 2.90 0.00 0.02 -4.45 119.74 116.32 3g2q s LYS 166 Ca 0.63 -0.77 -0.05 0.00 0.00 0.00 0.00 55.97 55.78 3g2q s LYS 166 Cb -0.16 -2.47 0.01 0.00 0.00 0.00 0.00 37.83 35.21 3g2q s LYS 166 CO 0.37 0.59 0.03 0.12 0.00 0.00 0.00 175.35 176.46 3g2q s PHE 167 N -1.03 3.10 -0.12 1.78 5.36 0.09 -0.82 117.98 126.34 3g2q s PHE 167 Ca 0.18 -1.04 0.00 0.00 -0.96 0.00 0.00 56.93 55.11 3g2q s PHE 167 Cb -0.11 -2.19 -0.02 0.00 -0.34 0.00 0.00 43.02 40.36 3g2q s PHE 167 CO 0.09 -0.58 -0.13 -0.51 -1.46 0.00 0.00 175.22 172.62 3g2q s LEU 168 N 1.47 2.71 0.01 6.12 1.02 0.72 -0.60 118.68 130.13 3g2q s LEU 168 Ca 0.03 -0.32 0.04 0.00 0.02 0.00 0.00 54.13 53.90 3g2q s LEU 168 Cb -0.16 -1.60 -0.01 0.00 0.02 0.00 0.00 46.19 44.43 3g2q s LEU 168 CO 0.00 0.18 -0.13 -0.76 0.02 0.00 0.00 176.35 175.67 3g2q s LEU 169 N 0.26 2.07 -0.04 1.79 1.02 -0.54 -1.36 118.68 121.88 3g2q s LEU 169 Ca -0.09 -0.29 0.01 0.00 0.02 0.00 0.00 54.13 53.77 3g2q s LEU 169 Cb -0.16 -0.61 -0.03 0.00 0.02 0.00 0.00 46.19 45.41 3g2q s LEU 169 CO 0.05 0.11 -0.02 -0.94 0.02 0.00 0.00 176.35 175.57 3g2q s SER 170 N -0.56 4.99 -0.03 2.29 1.04 -0.93 -0.35 113.70 120.15 3g2q s SER 170 Ca 0.03 0.02 -0.01 0.00 0.48 0.00 0.00 55.95 56.47 3g2q s SER 170 Cb -0.06 -1.31 0.03 0.00 0.10 0.00 0.00 66.02 64.78 3g2q s SER 170 CO 0.00 0.33 0.05 -0.76 0.98 0.00 0.00 173.24 173.84 3g2q s LEU 171 N -1.17 0.54 0.31 2.42 1.43 -0.23 -0.45 118.68 121.54 3g2q s LEU 171 Ca 0.16 0.07 -0.29 0.00 -1.03 0.00 0.00 54.13 53.04 3g2q s LEU 171 Cb -0.11 -0.10 -0.10 0.00 0.03 0.00 0.00 46.19 45.91 3g2q s LEU 171 CO 0.05 -0.20 1.32 0.00 0.23 0.00 0.00 176.35 177.76 3g2q s ALA 172 N 1.69 3.52 -0.27 4.21 0.00 -1.26 -0.35 121.76 129.30 3g2q s ALA 172 Ca -0.01 1.25 0.02 0.00 0.00 0.00 0.00 51.96 53.22 3g2q s ALA 172 Cb -0.12 -3.49 0.05 0.00 0.00 0.00 0.00 23.12 19.56 3g2q s ALA 172 CO -0.03 -0.64 -0.08 1.41 0.00 0.00 0.00 175.76 176.41 3g2q s MET 173 N -1.45 2.34 0.92 0.00 1.75 -0.44 -4.53 119.30 117.88 3g2q s MET 173 Ca 0.51 -1.30 -0.12 0.00 -1.25 0.00 0.00 55.69 53.54 3g2q s MET 173 Cb -0.40 -2.96 0.14 0.00 2.84 0.00 0.00 34.83 34.46 3g2q s MET 173 CO 0.50 -0.56 1.10 -1.54 -0.65 0.00 0.00 175.02 173.86 3g2q s SER 174 N 1.15 3.34 0.16 1.11 1.04 -1.26 -4.62 113.70 114.63 3g2q s SER 174 Ca -0.07 1.36 -0.17 0.00 0.48 0.00 0.00 55.95 57.55 3g2q s SER 174 Cb -0.20 -2.04 0.08 0.00 0.10 0.00 0.00 66.02 63.97 3g2q s SER 174 CO -0.04 -2.70 1.69 -0.33 0.98 0.00 0.00 173.24 172.83 3g2q h GLU 175 N -1.60 0.05 -0.94 4.02 5.08 -1.99 0.98 114.58 120.19 3g2q h GLU 175 Ca -0.51 -0.00 0.01 0.00 -1.00 0.00 0.00 59.36 57.86 3g2q h GLU 175 Cb 1.30 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 30.49 3g2q h GLU 175 CO 0.56 0.03 0.61 0.00 -1.00 0.00 0.00 179.01 179.22 3g2q h ALA 176 N 1.34 1.32 0.00 3.43 0.00 -1.94 -1.66 119.26 121.75 3g2q h ALA 176 Ca 0.18 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 3g2q h ALA 176 Cb 0.26 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3g2q h ALA 176 CO -0.34 0.63 -0.42 0.00 0.00 0.00 0.00 179.25 179.12 3g2q h ALA 177 N 1.40 1.13 -0.01 0.00 0.00 -1.73 -3.24 119.26 116.81 3g2q h ALA 177 Ca 0.34 -0.38 -0.25 0.00 0.00 0.00 0.00 54.91 54.62 3g2q h ALA 177 Cb -0.14 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 17.60 3g2q h ALA 177 CO -0.07 0.52 -0.99 1.49 0.00 0.00 0.00 179.25 180.20 3g2q h GLU 178 N 0.00 0.60 -7.07 0.00 4.81 0.05 -3.46 114.58 109.50 3g2q h GLU 178 Ca -0.00 -0.63 -0.55 0.00 -0.13 0.00 0.00 59.36 58.05 3g2q h GLU 178 Cb 0.83 0.17 0.14 0.00 0.63 0.00 0.00 28.75 30.52 3g2q h GLU 178 CO 0.05 1.24 0.56 -1.12 -0.73 0.00 0.00 179.01 179.01 3g2q s SER 179 N -7.20 5.11 -0.06 1.04 0.01 -0.73 -4.97 113.70 106.90 3g2q s SER 179 Ca -0.08 2.66 -0.30 0.00 1.31 0.00 0.00 55.95 59.54 3g2q s SER 179 Cb 0.08 -2.63 -0.05 0.00 0.21 0.00 0.00 66.02 63.63 3g2q s SER 179 CO 0.90 -1.67 1.55 -1.61 0.41 0.00 0.00 173.24 172.82 3g2q s GLU 180 N -3.08 4.20 0.18 12.44 0.41 -1.26 -4.95 118.70 126.64 3g2q s GLU 180 Ca 0.75 2.07 -0.33 0.00 -0.41 0.00 0.00 54.97 57.06 3g2q s GLU 180 Cb -0.38 -3.87 -0.15 0.00 -1.78 0.00 0.00 34.13 27.95 3g2q s GLU 180 CO 0.43 -0.78 1.29 -2.30 -0.49 0.00 0.00 175.26 173.41 3g2q n PRO 181 N 6.71 1.49 -2.31 0.39 -0.02 -1.26 -4.89 135.00 135.11 3g2q n PRO 181 Ca 0.16 0.53 -0.42 0.00 -2.02 0.00 0.00 63.50 61.76 3g2q n PRO 181 Cb 0.43 -2.12 -0.03 0.00 -0.02 0.00 0.00 33.50 31.76 3g2q n PRO 181 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3g2q s LEU 182 N 0.49 4.39 0.23 2.45 1.43 -1.26 -4.94 118.68 121.47 3g2q s LEU 182 Ca 0.73 2.19 -0.07 0.00 -1.03 0.00 0.00 54.13 55.96 3g2q s LEU 182 Cb -0.79 -3.59 -0.06 0.00 0.03 0.00 0.00 46.19 41.78 3g2q s LEU 182 CO 0.50 -0.51 0.51 -1.61 0.23 0.00 0.00 176.35 175.47 3g2q s GLU 183 N 0.70 3.69 -0.38 1.70 2.02 -1.26 -4.25 118.70 120.92 3g2q s GLU 183 Ca 0.59 0.08 0.02 0.00 0.02 0.00 0.00 54.97 55.69 3g2q s GLU 183 Cb -0.33 -2.69 0.11 0.00 0.10 0.00 0.00 34.13 31.32 3g2q s GLU 183 CO 0.32 0.31 0.13 -0.98 0.02 0.00 0.00 175.26 175.06 3g2q s ARG 184 N -3.08 1.29 0.35 1.61 1.70 -0.88 -5.01 118.95 114.94 3g2q s ARG 184 Ca 0.45 -1.79 -0.27 0.00 -0.47 0.00 0.00 55.73 53.65 3g2q s ARG 184 Cb -0.11 -2.70 -0.09 0.00 -0.57 0.00 0.00 34.95 31.48 3g2q s ARG 184 CO 0.25 -1.02 1.18 0.15 -1.08 0.00 0.00 175.30 174.78 3g2q s LYS 185 N 0.82 4.28 0.00 3.89 1.02 -1.26 -3.52 119.74 124.96 3g2q s LYS 185 Ca 0.13 1.92 0.00 0.00 0.02 0.00 0.00 55.97 58.04 3g2q s LYS 185 Cb -0.21 -2.90 0.00 0.00 -0.52 0.00 0.00 37.83 34.20 3g2q s LYS 185 CO -0.10 -0.15 0.00 0.94 -0.92 0.00 0.00 175.35 175.12 3g2q n GLN 186 N 0.53 0.00 -4.58 1.68 7.27 -1.26 -4.95 117.38 116.07 3g2q n GLN 186 Ca 0.02 0.00 -0.33 0.00 0.07 0.00 0.00 57.00 56.75 3g2q n GLN 186 Cb 0.45 -0.26 -0.13 0.00 2.41 0.00 0.00 30.24 32.71 3g2q n GLN 186 CO 0.00 0.00 0.00 0.08 0.07 0.00 0.00 177.06 177.21 3g2q s VAL 197 N -1.95 3.57 -0.25 1.69 1.01 -1.26 -4.94 120.40 118.27 3g2q s VAL 197 Ca 0.00 -0.49 -0.02 0.00 0.00 0.00 0.00 61.98 61.48 3g2q s VAL 197 Cb 0.00 -2.52 0.03 0.00 0.00 0.00 0.00 36.38 33.89 3g2q s VAL 197 CO 0.00 0.53 -0.06 -0.22 0.00 0.00 0.00 175.10 175.35 3g2q s LEU 198 N 0.07 3.18 -0.37 3.92 2.96 -1.26 -5.09 118.68 122.09 3g2q s LEU 198 Ca -0.02 -0.87 -0.18 0.00 -0.22 0.00 0.00 54.13 52.84 3g2q s LEU 198 Cb -0.14 -1.66 0.00 0.00 0.50 0.00 0.00 46.19 44.89 3g2q s LEU 198 CO 0.03 -0.13 0.51 -1.00 -1.32 0.00 0.00 176.35 174.45 3g2q s HIS 199 N 1.32 3.17 -0.11 5.38 3.76 -1.26 -4.14 115.29 123.41 3g2q s HIS 199 Ca 0.00 0.09 0.01 0.00 -0.15 0.00 0.00 55.06 55.01 3g2q s HIS 199 Cb -0.17 -2.95 -0.01 0.00 1.11 0.00 0.00 32.58 30.56 3g2q s HIS 199 CO -0.04 -0.58 -0.15 0.08 -0.85 0.00 0.00 174.74 173.19 3g2q s VAL 200 N 2.39 2.90 0.04 -0.90 1.01 -1.23 -5.01 120.40 119.60 3g2q s VAL 200 Ca 0.18 -0.73 0.06 0.00 0.00 0.00 0.00 61.98 61.50 3g2q s VAL 200 Cb -0.16 -2.19 -0.02 0.00 0.00 0.00 0.00 36.38 34.01 3g2q s VAL 200 CO 0.14 0.54 -0.18 -0.13 0.00 0.00 0.00 175.10 175.46 3g2q s ARG 201 N 0.16 1.24 -0.32 2.72 0.52 -1.26 -2.08 118.95 119.94 3g2q s ARG 201 Ca -0.08 -0.87 -0.08 0.00 -0.52 0.00 0.00 55.73 54.18 3g2q s ARG 201 Cb -0.15 -1.32 0.01 0.00 0.52 0.00 0.00 34.95 34.01 3g2q s ARG 201 CO 0.05 0.33 0.11 -1.01 0.02 0.00 0.00 175.30 174.81 3g2q s HIS 202 N -0.80 3.18 -0.14 -0.53 3.76 -1.26 -5.10 115.29 114.41 3g2q s HIS 202 Ca 0.06 -1.00 -0.10 0.00 -0.15 0.00 0.00 55.06 53.86 3g2q s HIS 202 Cb -0.08 -2.30 -0.05 0.00 1.11 0.00 0.00 32.58 31.26 3g2q s HIS 202 CO 0.02 -0.60 0.20 -0.51 -0.85 0.00 0.00 174.74 173.00 3g2q s LEU 203 N 1.50 4.32 0.29 0.89 1.43 -1.26 -4.69 118.68 121.16 3g2q s LEU 203 Ca 0.02 0.47 -0.29 0.00 -1.03 0.00 0.00 54.13 53.30 3g2q s LEU 203 Cb -0.18 -2.20 -0.10 0.00 0.03 0.00 0.00 46.19 43.74 3g2q s LEU 203 CO 0.04 0.27 1.37 -2.16 0.23 0.00 0.00 176.35 176.10 3g2q s PRO 204 N -0.33 4.31 -0.02 1.29 0.04 -1.26 -4.92 135.00 134.11 3g2q s PRO 204 Ca 0.14 2.25 -0.01 0.00 0.04 0.00 0.00 61.00 63.43 3g2q s PRO 204 Cb -0.12 -3.09 -0.01 0.00 0.04 0.00 0.00 34.50 31.31 3g2q s PRO 204 CO 0.03 -0.31 -0.03 0.00 0.04 0.00 0.00 177.00 176.74 3g2q n ALA 205 N 1.61 2.87 -3.43 8.56 0.00 -1.26 -4.60 120.51 124.26 3g2q n ALA 205 Ca 0.03 -0.08 -0.12 0.00 0.00 0.00 0.00 53.44 53.28 3g2q n ALA 205 Cb 0.41 0.47 -0.11 0.00 0.00 0.00 0.00 19.45 20.22 3g2q n ALA 205 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3g2q s GLU 206 N -2.04 0.34 0.34 0.00 2.12 -1.26 -1.76 118.70 116.44 3g2q s GLU 206 Ca -0.03 0.54 0.05 0.00 0.36 0.00 0.00 54.97 55.90 3g2q s GLU 206 Cb 0.01 0.07 -0.07 0.00 0.26 0.00 0.00 34.13 34.40 3g2q s GLU 206 CO 0.03 -0.10 0.02 -1.21 -0.54 0.00 0.00 175.26 173.47 3g2q s GLU 207 N 0.68 1.71 -0.25 4.30 2.02 0.59 -4.99 118.70 122.77 3g2q s GLU 207 Ca -0.04 -1.94 -0.07 0.00 0.02 0.00 0.00 54.97 52.94 3g2q s GLU 207 Cb -0.05 -1.12 -0.03 0.00 0.10 0.00 0.00 34.13 33.04 3g2q s GLU 207 CO -0.04 -0.11 0.05 0.42 0.02 0.00 0.00 175.26 175.60 3g2q s ILE 208 N -3.10 4.17 -0.31 -1.63 1.01 -1.26 -0.22 121.20 119.87 3g2q s ILE 208 Ca 0.35 -0.22 -0.26 0.00 0.00 0.00 0.00 60.65 60.52 3g2q s ILE 208 Cb 0.08 -2.95 0.01 0.00 0.01 0.00 0.00 42.46 39.61 3g2q s ILE 208 CO 0.16 0.35 0.91 -1.58 0.00 0.00 0.00 174.94 174.77 3g2q s GLN 209 N 1.60 4.01 -0.18 2.79 0.74 0.88 -4.91 119.66 124.58 3g2q s GLN 209 Ca 0.06 0.80 -0.03 0.00 0.05 0.00 0.00 55.36 56.25 3g2q s GLN 209 Cb -0.15 -3.73 -0.01 0.00 1.10 0.00 0.00 33.01 30.22 3g2q s GLN 209 CO 0.03 -0.77 -0.07 -2.00 -0.55 0.00 0.00 175.29 171.92 3g2q s GLU 210 N 3.24 3.41 0.15 1.67 2.12 -1.26 -1.20 118.70 126.83 3g2q s GLU 210 Ca 0.38 -0.63 0.11 0.00 0.36 0.00 0.00 54.97 55.18 3g2q s GLU 210 Cb -0.13 -2.87 -0.04 0.00 0.26 0.00 0.00 34.13 31.35 3g2q s GLU 210 CO 0.13 -0.01 -0.25 0.96 -0.54 0.00 0.00 175.26 175.56 3g2q s ILE 211 N 0.97 2.37 -0.05 -3.70 -4.36 -0.47 -5.00 121.20 110.95 3g2q s ILE 211 Ca -0.01 -1.83 -0.01 0.00 -0.26 0.00 0.00 60.65 58.54 3g2q s ILE 211 Cb -0.15 -2.09 0.03 0.00 1.25 0.00 0.00 42.46 41.50 3g2q s ILE 211 CO -0.00 0.01 0.02 -0.89 0.24 0.00 0.00 174.94 174.32 3g2q s THR 212 N -1.31 0.21 -0.07 8.37 2.01 -1.26 -2.40 115.64 121.20 3g2q s THR 212 Ca 0.17 0.19 0.04 0.00 0.31 0.00 0.00 61.69 62.40 3g2q s THR 212 Cb -0.09 -0.38 -0.00 0.00 0.01 0.00 0.00 72.50 72.03 3g2q s THR 212 CO 0.08 0.22 -0.21 -0.63 -0.69 0.00 0.00 174.62 173.38 3g2q s ILE 213 N 1.80 1.82 0.14 1.82 1.01 0.18 -4.96 121.20 123.00 3g2q s ILE 213 Ca 0.02 -0.91 -0.10 0.00 0.00 0.00 0.00 60.65 59.66 3g2q s ILE 213 Cb -0.13 -1.56 0.00 0.00 0.01 0.00 0.00 42.46 40.78 3g2q s ILE 213 CO -0.04 0.51 0.29 -1.38 0.00 0.00 0.00 174.94 174.32 3g2q s HIS 214 N 0.18 0.22 0.47 3.97 -3.43 -1.26 0.16 115.29 115.60 3g2q s HIS 214 Ca -0.11 -0.60 -0.23 0.00 -0.80 0.00 0.00 55.06 53.32 3g2q s HIS 214 Cb -0.15 0.01 -0.07 0.00 -1.43 0.00 0.00 32.58 30.94 3g2q s HIS 214 CO 0.05 -0.68 1.27 -2.14 -2.00 0.00 0.00 174.74 171.24 3g2q s PRO 215 N -3.91 3.62 0.56 -0.38 0.02 -1.26 -4.91 135.00 128.73 3g2q s PRO 215 Ca 0.11 2.04 0.28 0.00 0.02 0.00 0.00 61.00 63.45 3g2q s PRO 215 Cb 0.03 -2.46 1.64 0.00 0.02 0.00 0.00 34.50 33.73 3g2q s PRO 215 CO -0.05 -0.74 2.17 0.00 -0.33 0.00 0.00 177.00 178.06 3g2q h ALA 216 N 2.05 1.46 -3.00 -1.55 0.00 -2.01 -3.42 119.26 112.79 3g2q h ALA 216 Ca -0.50 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.36 3g2q h ALA 216 Cb 1.26 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.05 3g2q h ALA 216 CO 0.60 0.07 0.00 -0.25 0.00 0.00 0.00 179.25 179.67 3g2q n ASP 217 N -3.81 0.00 0.00 0.00 9.92 -1.26 -5.06 116.55 116.34 3g2q n ASP 217 Ca -0.03 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.23 3g2q n ASP 217 Cb 0.15 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.63 3g2q n ASP 217 CO 0.00 0.00 0.00 1.21 0.13 0.00 0.00 177.20 178.54 3g2q n GLU 218 N 0.00 1.64 0.00 -1.24 2.13 -1.26 -5.00 120.64 116.91 3g2q n GLU 218 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 3g2q n GLU 218 Cb 0.00 -0.37 0.00 0.00 0.27 0.00 0.00 31.44 31.34 3g2q n GLU 218 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 3g2q n THR 219 N -0.31 0.00 0.00 6.31 -2.24 -1.26 -4.79 114.28 111.98 3g2q n THR 219 Ca 0.00 0.27 0.00 0.00 -2.27 0.00 0.00 64.05 62.05 3g2q n THR 219 Cb 0.00 -0.72 0.00 0.00 -2.10 0.00 0.00 70.33 67.51 3g2q n THR 219 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 3g2q n THR 220 N -0.12 0.00 -2.32 4.28 -1.04 -1.26 -4.47 114.28 109.34 3g2q n THR 220 Ca 0.00 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 62.00 3g2q n THR 220 Cb 0.00 0.00 -0.00 0.00 -1.82 0.00 0.00 70.33 68.51 3g2q n THR 220 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 3g2q n ASP 221 N 0.06 -5.96 -4.76 8.00 -0.08 -1.26 -4.88 116.55 107.67 3g2q n ASP 221 Ca 0.00 1.55 -0.36 0.00 -1.51 0.00 0.00 54.79 54.47 3g2q n ASP 221 Cb 0.00 -4.04 0.02 0.00 2.34 0.00 0.00 41.12 39.44 3g2q n ASP 221 CO 0.00 0.00 0.00 -2.16 0.12 0.00 0.00 177.20 175.16 3g2q s PRO 222 N -0.41 3.15 -0.59 -0.67 0.04 -1.26 -5.11 135.00 130.14 3g2q s PRO 222 Ca -0.03 1.80 -0.18 0.00 0.04 0.00 0.00 61.00 62.63 3g2q s PRO 222 Cb 0.00 -2.01 0.11 0.00 0.04 0.00 0.00 34.50 32.64 3g2q s PRO 222 CO 0.08 -1.06 0.67 0.12 0.04 0.00 0.00 177.00 176.85 3g2q s PHE 223 N -1.61 3.08 -0.29 0.56 5.36 0.63 -4.99 117.98 120.72 3g2q s PHE 223 Ca 0.75 -1.08 -0.17 0.00 -0.96 0.00 0.00 56.93 55.47 3g2q s PHE 223 Cb -0.29 -3.97 -0.02 0.00 -0.34 0.00 0.00 43.02 38.39 3g2q s PHE 223 CO 0.33 -1.23 0.47 0.14 -1.46 0.00 0.00 175.22 173.46 3g2q s VAL 224 N 2.36 5.09 -0.31 3.12 -7.23 -1.26 -0.72 120.40 121.45 3g2q s VAL 224 Ca 0.10 0.61 -0.11 0.00 -1.81 0.00 0.00 61.98 60.77 3g2q s VAL 224 Cb -0.25 -3.83 -0.02 0.00 0.56 0.00 0.00 36.38 32.85 3g2q s VAL 224 CO 0.05 0.02 0.18 -0.69 -0.31 0.00 0.00 175.10 174.34 3g2q s VAL 225 N 2.25 4.86 -0.25 1.32 1.01 0.41 -4.44 120.40 125.55 3g2q s VAL 225 Ca 0.18 -0.29 -0.11 0.00 0.00 0.00 0.00 61.98 61.77 3g2q s VAL 225 Cb -0.16 -3.45 -0.05 0.00 0.00 0.00 0.00 36.38 32.72 3g2q s VAL 225 CO 0.11 0.08 0.17 0.00 0.00 0.00 0.00 175.10 175.46 3g2q s THR 227 N 1.32 2.09 -0.22 0.00 -4.23 0.14 0.49 115.64 115.23 3g2q s THR 227 Ca 0.07 -2.26 -0.27 0.00 -1.18 0.00 0.00 61.69 58.05 3g2q s THR 227 Cb -0.14 -2.14 0.11 0.00 1.34 0.00 0.00 72.50 71.67 3g2q s THR 227 CO 0.07 -0.46 0.93 -2.28 -0.54 0.00 0.00 174.62 172.34 3g2q s HIS 228 N -2.62 -0.51 -0.13 3.99 2.46 -1.01 -0.44 115.29 117.03 3g2q s HIS 228 Ca 0.25 1.11 0.01 0.00 0.47 0.00 0.00 55.06 56.90 3g2q s HIS 228 Cb -0.03 0.38 0.02 0.00 -0.13 0.00 0.00 32.58 32.82 3g2q s HIS 228 CO 0.10 -0.33 -0.15 1.03 -2.47 0.00 0.00 174.74 172.92 3g2q s ARG 229 N -0.32 2.31 0.11 2.88 0.52 -1.26 -1.37 118.95 121.82 3g2q s ARG 229 Ca -0.01 -0.58 0.04 0.00 -0.52 0.00 0.00 55.73 54.67 3g2q s ARG 229 Cb -0.03 -2.04 -0.04 0.00 0.52 0.00 0.00 34.95 33.36 3g2q s ARG 229 CO -0.01 -0.15 -0.10 -0.98 0.02 0.00 0.00 175.30 174.08 3g2q s ARG 230 N 1.24 0.92 0.45 3.54 1.70 -0.34 -4.98 118.95 121.48 3g2q s ARG 230 Ca -0.00 -1.28 -0.24 0.00 -0.47 0.00 0.00 55.73 53.73 3g2q s ARG 230 Cb -0.14 -0.52 -0.07 0.00 -0.57 0.00 0.00 34.95 33.65 3g2q s ARG 230 CO -0.06 0.07 1.30 0.50 -1.08 0.00 0.00 175.30 176.02 3g2q s ARG 231 N -3.27 3.70 -0.30 3.89 3.52 -1.26 -0.09 118.95 125.15 3g2q s ARG 231 Ca 0.10 2.13 -0.01 0.00 -0.13 0.00 0.00 55.73 57.82 3g2q s ARG 231 Cb 0.00 -2.56 0.13 0.00 -1.56 0.00 0.00 34.95 30.96 3g2q s ARG 231 CO -0.01 -0.71 0.24 -1.17 -0.81 0.00 0.00 175.30 172.85 3g2q s LEU 232 N -2.84 0.04 0.36 -0.88 2.96 0.70 -4.71 118.68 114.31 3g2q s LEU 232 Ca 0.62 -1.00 -0.22 0.00 -0.22 0.00 0.00 54.13 53.32 3g2q s LEU 232 Cb -0.37 0.22 -0.10 0.00 0.50 0.00 0.00 46.19 46.43 3g2q s LEU 232 CO 0.47 -0.40 0.90 -0.76 -1.32 0.00 0.00 176.35 175.24 3g2q s LEU 233 N 2.21 4.12 0.14 -0.68 1.43 -1.26 -0.30 118.68 124.34 3g2q s LEU 233 Ca 0.10 1.66 -0.30 0.00 -1.03 0.00 0.00 54.13 54.56 3g2q s LEU 233 Cb -0.15 -4.22 -0.07 0.00 0.03 0.00 0.00 46.19 41.78 3g2q s LEU 233 CO -0.32 -0.21 1.21 0.00 0.23 0.00 0.00 176.35 177.26 3g2q s ALA 234 N -1.91 3.43 0.31 4.21 0.00 -0.72 -4.82 121.76 122.27 3g2q s ALA 234 Ca 0.55 0.93 0.08 0.00 0.00 0.00 0.00 51.96 53.52 3g2q s ALA 234 Cb -0.13 -3.43 0.81 0.00 0.00 0.00 0.00 23.12 20.37 3g2q s ALA 234 CO 0.18 -0.41 1.76 -1.35 0.00 0.00 0.00 175.76 175.94 3g2q h PRO 235 N 5.84 0.66 0.00 0.00 0.11 -1.91 -0.83 132.00 135.88 3g2q h PRO 235 Ca -0.43 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.58 3g2q h PRO 235 Cb 1.21 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 3g2q h PRO 235 CO 0.77 0.44 -0.29 -0.44 -0.21 0.00 0.00 178.00 178.28 3g2q h ASP 236 N 0.68 0.00 -0.20 -2.05 3.32 -1.91 -1.66 116.42 114.60 3g2q h ASP 236 Ca 0.60 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.63 3g2q h ASP 236 Cb 1.04 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.58 3g2q h ASP 236 CO -0.41 0.29 0.03 -0.61 -1.72 0.00 0.00 179.24 176.82 3g2q h GLN 237 N 0.00 0.33 -0.72 3.56 5.75 -1.41 -1.21 115.11 121.43 3g2q h GLN 237 Ca -0.00 -0.09 -0.01 0.00 -0.15 0.00 0.00 58.65 58.40 3g2q h GLN 237 Cb 0.52 -0.04 -0.03 0.00 1.07 0.00 0.00 27.48 29.00 3g2q h GLN 237 CO 0.04 0.48 0.40 0.28 -2.65 0.00 0.00 178.83 177.38 3g2q h VAL 238 N 0.13 1.22 -0.30 2.39 2.07 -1.23 -0.27 116.25 120.26 3g2q h VAL 238 Ca 0.06 -0.53 0.02 0.00 0.82 0.00 0.00 66.70 67.07 3g2q h VAL 238 Cb 0.31 0.27 -0.03 0.00 -1.52 0.00 0.00 31.29 30.32 3g2q h VAL 238 CO 0.00 0.24 0.14 0.58 0.02 0.00 0.00 177.57 178.55 3g2q h VAL 239 N 0.98 0.98 -0.59 2.57 2.07 -1.25 0.18 116.25 121.20 3g2q h VAL 239 Ca 0.25 -0.10 0.07 0.00 0.82 0.00 0.00 66.70 67.74 3g2q h VAL 239 Cb 0.02 0.66 -0.06 0.00 -1.52 0.00 0.00 31.29 30.39 3g2q h VAL 239 CO -0.04 0.05 0.28 0.03 0.02 0.00 0.00 177.57 177.91 3g2q h ARG 240 N 0.29 0.50 -0.33 1.57 3.08 -0.89 -1.38 114.38 117.22 3g2q h ARG 240 Ca 0.12 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.13 3g2q h ARG 240 Cb 0.05 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 3g2q h ARG 240 CO -0.09 0.33 0.16 0.93 -1.07 0.00 0.00 179.97 180.23 3g2q h GLU 241 N 0.52 0.48 -0.22 0.04 5.08 -0.53 -1.18 114.58 118.78 3g2q h GLU 241 Ca 0.27 -0.07 0.04 0.00 -1.00 0.00 0.00 59.36 58.60 3g2q h GLU 241 Cb 0.24 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.36 3g2q h GLU 241 CO -0.22 0.45 -0.03 -0.07 -1.00 0.00 0.00 179.01 178.15 3g2q h LEU 242 N 0.40 -0.15 -0.54 1.33 3.38 -0.51 -0.87 115.31 118.35 3g2q h LEU 242 Ca 0.11 0.06 0.04 0.00 0.09 0.00 0.00 57.88 58.18 3g2q h LEU 242 Cb 0.13 0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.95 3g2q h LEU 242 CO -0.01 -0.04 0.29 0.58 0.09 0.00 0.00 178.44 179.35 3g2q h VAL 243 N 0.03 0.99 0.00 1.22 2.07 -1.16 -1.29 116.25 118.11 3g2q h VAL 243 Ca 0.11 -0.20 -0.03 0.00 0.82 0.00 0.00 66.70 67.40 3g2q h VAL 243 Cb 0.15 0.37 -0.00 0.00 -1.52 0.00 0.00 31.29 30.28 3g2q h VAL 243 CO -0.20 0.10 -0.13 -0.09 0.02 0.00 0.00 177.57 177.27 3g2q h ARG 244 N 0.57 0.00 -0.00 1.57 2.43 -1.00 -2.09 114.38 115.86 3g2q h ARG 244 Ca 0.23 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.40 3g2q h ARG 244 Cb 0.11 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 3g2q h ARG 244 CO -0.14 0.13 -0.04 0.43 -1.51 0.00 0.00 179.97 178.83 3g2q n SER 245 N -4.17 0.34 0.00 -3.80 7.64 -0.35 -4.91 113.62 108.36 3g2q n SER 245 Ca -0.02 -0.69 0.00 0.00 1.01 0.00 0.00 58.87 59.16 3g2q n SER 245 Cb 0.21 -0.09 0.00 0.00 -1.01 0.00 0.00 64.21 63.32 3g2q n SER 245 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3g2q n GLY 246 N 1.19 0.60 3.84 0.23 0.00 -0.78 -4.92 105.19 105.35 3g2q n GLY 246 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 3g2q n GLY 246 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3g2q s PHE 247 N -2.00 3.36 -0.29 1.61 0.08 -0.57 -4.24 117.98 115.93 3g2q s PHE 247 Ca 0.00 1.34 -0.14 0.00 0.12 0.00 0.00 56.93 58.25 3g2q s PHE 247 Cb 0.00 -2.64 -0.03 0.00 -0.57 0.00 0.00 43.02 39.78 3g2q s PHE 247 CO 0.00 0.00 0.34 -0.51 -0.10 0.00 0.00 175.22 174.95 3g2q s ASP 248 N -2.32 6.20 -0.42 1.36 1.11 0.81 -3.90 116.67 119.51 3g2q s ASP 248 Ca 0.57 0.14 -0.25 0.00 0.18 0.00 0.00 52.55 53.18 3g2q s ASP 248 Cb -0.10 -2.19 0.02 0.00 1.07 0.00 0.00 42.92 41.72 3g2q s ASP 248 CO 0.17 -0.19 0.89 -0.69 1.18 0.00 0.00 175.17 176.53 3g2q s VAL 249 N 2.01 4.56 -0.97 -1.27 1.01 -1.26 -0.81 120.40 123.67 3g2q s VAL 249 Ca 0.13 0.84 0.19 0.00 0.00 0.00 0.00 61.98 63.14 3g2q s VAL 249 Cb -0.16 -4.36 -0.19 0.00 0.00 0.00 0.00 36.38 31.67 3g2q s VAL 249 CO 0.10 -0.69 0.81 2.30 0.00 0.00 0.00 175.10 177.63 3g2q n ILE 250 N 6.19 0.00 -3.56 2.22 -5.35 -0.38 -4.97 119.36 113.52 3g2q n ILE 250 Ca 0.05 -0.08 -0.14 0.00 -0.27 0.00 0.00 62.75 62.32 3g2q n ILE 250 Cb 0.48 1.02 -0.06 0.00 -1.74 0.00 0.00 39.64 39.35 3g2q n ILE 250 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3g2q s ALA 251 N -2.73 -1.86 -0.09 -1.28 0.00 -1.23 -5.00 121.76 109.57 3g2q s ALA 251 Ca 0.08 1.49 -0.03 0.00 0.00 0.00 0.00 51.96 53.50 3g2q s ALA 251 Cb 0.14 -0.44 0.05 0.00 0.00 0.00 0.00 23.12 22.87 3g2q s ALA 251 CO 0.75 -0.33 0.15 -0.65 0.00 0.00 0.00 175.76 175.67 3g2q s GLN 252 N -1.08 0.03 -0.19 0.00 -0.21 -1.25 -1.18 119.66 115.77 3g2q s GLN 252 Ca -0.05 0.48 -0.00 0.00 0.02 0.00 0.00 55.36 55.81 3g2q s GLN 252 Cb -0.00 -0.44 0.05 0.00 1.00 0.00 0.00 33.01 33.62 3g2q s GLN 252 CO 0.05 -0.35 -0.05 0.99 -2.12 0.00 0.00 175.29 173.81 3g2q s THR 253 N 2.27 1.23 0.47 -0.19 2.01 0.14 -4.90 115.64 116.67 3g2q s THR 253 Ca 0.04 -0.82 -0.23 0.00 0.31 0.00 0.00 61.69 60.98 3g2q s THR 253 Cb -0.12 -1.45 -0.07 0.00 0.01 0.00 0.00 72.50 70.87 3g2q s THR 253 CO -0.06 0.04 1.21 -2.84 -0.69 0.00 0.00 174.62 172.28 3g2q s PRO 254 N 1.56 3.67 0.12 4.92 0.02 -1.26 0.37 135.00 144.41 3g2q s PRO 254 Ca -0.01 1.88 -0.18 0.00 0.02 0.00 0.00 61.00 62.70 3g2q s PRO 254 Cb -0.16 -2.41 0.04 0.00 0.02 0.00 0.00 34.50 31.99 3g2q s PRO 254 CO -0.07 -0.65 0.45 -0.59 -0.33 0.00 0.00 177.00 175.80 3g2q s PHE 255 N -1.48 -0.29 -0.18 6.54 -0.12 0.10 -4.89 117.98 117.67 3g2q s PHE 255 Ca 0.64 0.04 -0.17 0.00 -0.05 0.00 0.00 56.93 57.39 3g2q s PHE 255 Cb -0.31 0.32 -0.04 0.00 -0.63 0.00 0.00 43.02 42.36 3g2q s PHE 255 CO 0.38 -0.72 0.45 0.00 -0.05 0.00 0.00 175.22 175.28 3g2q s ALA 256 N -3.60 3.53 0.43 1.99 0.00 -1.26 -1.95 121.76 120.90 3g2q s ALA 256 Ca 0.01 -0.39 0.13 0.00 0.00 0.00 0.00 51.96 51.71 3g2q s ALA 256 Cb 0.01 -2.67 0.93 0.00 0.00 0.00 0.00 23.12 21.39 3g2q s ALA 256 CO -0.11 -0.23 1.97 0.66 0.00 0.00 0.00 175.76 178.05 3g2q h SER 257 N 7.17 0.07 -2.03 0.00 4.64 -1.90 -2.20 113.55 119.30 3g2q h SER 257 Ca -0.37 -0.01 -0.75 0.00 -0.47 0.00 0.00 61.79 60.19 3g2q h SER 257 Cb 1.16 -0.02 -0.30 0.00 -0.31 0.00 0.00 62.40 62.94 3g2q h SER 257 CO 0.74 0.25 0.76 0.61 -0.87 0.00 0.00 176.83 178.32 3g2q n GLY 258 N -0.97 5.76 2.00 -0.77 0.00 -1.26 -4.59 105.19 105.35 3g2q n GLY 258 Ca -0.02 -2.56 0.00 0.00 0.00 0.00 0.00 46.02 43.44 3g2q n GLY 258 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g2q n GLY 259 N -0.38 0.00 3.65 -0.02 0.00 -0.83 -4.59 105.19 103.03 3g2q n GLY 259 Ca 0.49 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.50 3g2q n GLY 259 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g2q s ALA 260 N -0.00 -2.14 0.00 4.61 0.00 -1.26 -4.97 121.76 118.00 3g2q s ALA 260 Ca 0.00 1.92 0.00 0.00 0.00 0.00 0.00 51.96 53.88 3g2q s ALA 260 Cb 0.00 -1.61 0.00 0.00 0.00 0.00 0.00 23.12 21.51 3g2q s ALA 260 CO 0.00 -0.23 0.00 0.41 0.00 0.00 0.00 175.76 175.94 3g2q n GLY 261 N 0.53 -1.18 3.75 0.00 0.00 -1.26 -4.88 105.19 102.14 3g2q n GLY 261 Ca 0.00 -2.10 -0.41 0.00 0.00 0.00 0.00 46.02 43.51 3g2q n GLY 261 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3g2q s ARG 262 N 0.00 4.14 -0.43 1.61 3.52 -1.26 -4.86 118.95 121.67 3g2q s ARG 262 Ca 0.00 2.55 -0.27 0.00 -0.13 0.00 0.00 55.73 57.88 3g2q s ARG 262 Cb 0.00 -3.03 -0.03 0.00 -1.56 0.00 0.00 34.95 30.33 3g2q s ARG 262 CO 0.00 -0.62 1.93 0.15 -0.81 0.00 0.00 175.30 175.95 3g2q s LYS 263 N -0.42 2.94 -0.19 5.12 1.02 -1.26 -4.53 119.74 122.41 3g2q s LYS 263 Ca 0.63 1.21 0.16 0.00 0.02 0.00 0.00 55.97 58.00 3g2q s LYS 263 Cb -0.47 -4.32 0.60 0.00 -0.52 0.00 0.00 37.83 33.11 3g2q s LYS 263 CO 0.47 -2.33 1.50 -0.40 -0.92 0.00 0.00 175.35 173.66 3g2q n ASP 264 N 11.88 4.30 -3.53 2.83 5.75 -0.95 -4.80 116.55 132.04 3g2q n ASP 264 Ca 0.24 -2.98 -0.16 0.00 -0.01 0.00 0.00 54.79 51.89 3g2q n ASP 264 Cb 0.49 -0.57 -0.05 0.00 -1.03 0.00 0.00 41.12 39.96 3g2q n ASP 264 CO 0.00 0.00 0.00 -0.32 -0.11 0.00 0.00 177.20 176.77 3g2q s MET 265 N -2.78 1.07 -0.03 0.11 1.75 -0.82 -1.33 119.30 117.27 3g2q s MET 265 Ca 0.45 -0.01 0.05 0.00 -1.25 0.00 0.00 55.69 54.93 3g2q s MET 265 Cb 0.36 0.50 -0.01 0.00 2.84 0.00 0.00 34.83 38.51 3g2q s MET 265 CO 0.11 -0.37 -0.18 0.08 -0.65 0.00 0.00 175.02 174.01 3g2q s VAL 266 N -1.93 1.45 -0.35 10.11 1.01 0.52 0.01 120.40 131.23 3g2q s VAL 266 Ca -0.08 -0.75 -0.12 0.00 0.00 0.00 0.00 61.98 61.03 3g2q s VAL 266 Cb -0.01 -1.22 0.00 0.00 0.00 0.00 0.00 36.38 35.15 3g2q s VAL 266 CO 0.03 0.41 0.21 -0.22 0.00 0.00 0.00 175.10 175.54 3g2q s LEU 267 N -0.18 4.54 -0.17 3.92 1.98 0.16 -1.07 118.68 127.86 3g2q s LEU 267 Ca 0.01 -0.69 -0.08 0.00 -2.89 0.00 0.00 54.13 50.48 3g2q s LEU 267 Cb -0.09 -2.07 -0.04 0.00 0.66 0.00 0.00 46.19 44.65 3g2q s LEU 267 CO 0.01 -0.30 0.10 -0.69 -1.89 0.00 0.00 176.35 173.58 3g2q s VAL 268 N 1.63 5.16 -0.13 1.68 1.01 0.52 -0.68 120.40 129.59 3g2q s VAL 268 Ca 0.04 0.09 -0.01 0.00 0.00 0.00 0.00 61.98 62.11 3g2q s VAL 268 Cb -0.18 -3.31 -0.02 0.00 0.00 0.00 0.00 36.38 32.87 3g2q s VAL 268 CO 0.08 0.49 -0.11 -1.61 0.00 0.00 0.00 175.10 173.95 3g2q s GLU 269 N 0.01 3.43 0.04 2.72 2.02 -0.33 -1.47 118.70 125.12 3g2q s GLU 269 Ca 0.08 -0.64 0.04 0.00 0.02 0.00 0.00 54.97 54.47 3g2q s GLU 269 Cb -0.12 -2.69 -0.02 0.00 0.10 0.00 0.00 34.13 31.40 3g2q s GLU 269 CO 0.00 0.24 -0.12 0.00 0.02 0.00 0.00 175.26 175.40 3g2q s ALA 270 N 0.31 1.01 0.20 5.21 0.00 0.23 -1.24 121.76 127.48 3g2q s ALA 270 Ca -0.09 -0.77 0.03 0.00 0.00 0.00 0.00 51.96 51.14 3g2q s ALA 270 Cb -0.15 -0.14 -0.05 0.00 0.00 0.00 0.00 23.12 22.78 3g2q s ALA 270 CO 0.05 0.17 -0.01 0.14 0.00 0.00 0.00 175.76 176.11 3g2q s VAL 271 N -0.88 0.95 0.07 0.00 -7.23 0.01 -0.73 120.40 112.59 3g2q s VAL 271 Ca -0.00 -2.02 -0.28 0.00 -1.81 0.00 0.00 61.98 57.86 3g2q s VAL 271 Cb -0.08 -2.23 -0.05 0.00 0.56 0.00 0.00 36.38 34.59 3g2q s VAL 271 CO 0.01 -0.41 0.89 -0.04 -0.31 0.00 0.00 175.10 175.24 3g2q s MET 272 N -3.86 4.61 0.06 4.82 -1.94 -1.26 -0.13 119.30 121.59 3g2q s MET 272 Ca 0.26 1.31 -0.31 0.00 -1.71 0.00 0.00 55.69 55.24 3g2q s MET 272 Cb 0.05 -3.39 -0.07 0.00 2.01 0.00 0.00 34.83 33.43 3g2q s MET 272 CO 0.06 0.19 1.53 -2.14 -0.01 0.00 0.00 175.02 174.65 3g2q s PRO 273 N 0.16 4.24 0.00 2.03 0.02 -1.26 -4.88 135.00 135.31 3g2q s PRO 273 Ca 0.45 2.18 0.00 0.00 0.02 0.00 0.00 61.00 63.65 3g2q s PRO 273 Cb -0.22 -3.50 0.00 0.00 0.02 0.00 0.00 34.50 30.80 3g2q s PRO 273 CO 0.27 -0.63 0.46 0.41 -0.33 0.00 0.00 177.00 177.18