#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g1p s LEU 3 N 0.00 2.78 0.13 2.46 2.96 -1.26 -1.06 118.68 124.69 3g1p s LEU 3 Ca 0.00 -0.69 0.06 0.00 -0.22 0.00 0.00 54.13 53.28 3g1p s LEU 3 Cb 0.00 -1.62 -0.04 0.00 0.50 0.00 0.00 46.19 45.03 3g1p s LEU 3 CO 0.00 -0.06 -0.14 0.42 -1.32 0.00 0.00 176.35 175.26 3g1p s THR 4 N 1.35 1.33 -0.07 3.68 -4.23 -0.18 -3.76 115.64 113.76 3g1p s THR 4 Ca 0.03 -1.78 0.01 0.00 -1.18 0.00 0.00 61.69 58.76 3g1p s THR 4 Cb -0.15 -1.59 0.02 0.00 1.34 0.00 0.00 72.50 72.12 3g1p s THR 4 CO -0.07 -0.47 -0.06 -0.22 -0.54 0.00 0.00 174.62 173.26 3g1p s LEU 5 N -2.59 1.28 -0.15 4.79 2.96 -0.29 -1.04 118.68 123.64 3g1p s LEU 5 Ca 0.10 -0.20 -0.02 0.00 -0.22 0.00 0.00 54.13 53.80 3g1p s LEU 5 Cb -0.04 -0.61 -0.02 0.00 0.50 0.00 0.00 46.19 46.02 3g1p s LEU 5 CO 0.03 -0.06 -0.08 -0.89 -1.32 0.00 0.00 176.35 174.02 3g1p s THR 6 N 1.14 3.46 -0.61 3.68 2.01 -0.06 0.32 115.64 125.58 3g1p s THR 6 Ca -0.07 -0.51 -0.24 0.00 0.31 0.00 0.00 61.69 61.18 3g1p s THR 6 Cb -0.14 -2.49 0.05 0.00 0.01 0.00 0.00 72.50 69.93 3g1p s THR 6 CO -0.01 0.50 1.01 -0.76 -0.69 0.00 0.00 174.62 174.67 3g1p s LEU 7 N 0.41 4.02 0.37 4.42 1.43 -0.34 -0.51 118.68 128.47 3g1p s LEU 7 Ca -0.07 -0.51 0.23 0.00 -1.03 0.00 0.00 54.13 52.75 3g1p s LEU 7 Cb -0.15 -2.71 0.24 0.00 0.03 0.00 0.00 46.19 43.60 3g1p s LEU 7 CO 0.04 -1.38 1.44 0.71 0.23 0.00 0.00 176.35 177.39 3g1p h THR 8 N 6.02 0.01 -2.86 5.49 1.35 -1.54 0.34 112.91 121.72 3g1p h THR 8 Ca -0.27 -1.02 -0.13 0.00 -0.55 0.00 0.00 66.41 64.44 3g1p h THR 8 Cb 1.07 1.86 -0.24 0.00 -1.73 0.00 0.00 68.15 69.11 3g1p h THR 8 CO 1.15 0.01 -0.27 -0.83 -0.25 0.00 0.00 175.52 175.32 3g1p s GLY 9 N -4.26 -0.26 -0.03 5.82 0.00 -1.06 -4.57 107.32 102.96 3g1p s GLY 9 Ca 0.05 0.93 0.05 0.00 0.00 0.00 0.00 44.72 45.74 3g1p s GLY 9 CO 0.71 0.77 0.92 -1.30 0.00 0.00 0.00 173.10 174.19 3g1p n THR 10 N 2.56 0.67 -3.88 0.90 -2.24 -0.61 -1.50 114.28 110.18 3g1p n THR 10 Ca -0.15 -0.77 -0.26 0.00 -2.27 0.00 0.00 64.05 60.60 3g1p n THR 10 Cb 0.57 0.43 -0.00 0.00 -2.10 0.00 0.00 70.33 69.23 3g1p n THR 10 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3g1p s GLY 11 N -1.23 2.37 0.05 3.38 0.00 0.37 -1.21 107.32 111.05 3g1p s GLY 11 Ca 0.08 -1.21 0.01 0.00 0.00 0.00 0.00 44.72 43.60 3g1p s GLY 11 CO 0.01 -1.95 0.07 0.61 0.00 0.00 0.00 173.10 171.84 3g1p n GLY 12 N -1.81 1.99 0.35 0.20 0.00 -1.26 -1.33 105.19 103.34 3g1p n GLY 12 Ca -0.02 -2.14 0.04 0.00 0.00 0.00 0.00 46.02 43.91 3g1p n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1p h ALA 13 N 0.48 1.62 -0.25 4.61 0.00 -1.96 -1.97 119.26 121.78 3g1p h ALA 13 Ca -0.03 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.70 3g1p h ALA 13 Cb 0.12 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3g1p h ALA 13 CO 0.04 0.29 -0.46 0.37 0.00 0.00 0.00 179.25 179.49 3g1p h GLN 14 N 0.84 0.64 -0.10 0.00 4.15 -1.97 -3.50 115.11 115.17 3g1p h GLN 14 Ca 0.30 -0.36 0.01 0.00 0.77 0.00 0.00 58.65 59.37 3g1p h GLN 14 Cb 0.13 0.02 -0.00 0.00 0.21 0.00 0.00 27.48 27.84 3g1p h GLN 14 CO -0.09 0.96 -0.02 0.41 -1.93 0.00 0.00 178.83 178.16 3g1p n GLY 15 N 0.12 -1.83 2.93 2.39 0.00 -0.74 -4.41 105.19 103.64 3g1p n GLY 15 Ca -0.02 -1.50 -0.27 0.00 0.00 0.00 0.00 46.02 44.23 3g1p n GLY 15 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g1p s VAL 16 N -1.84 1.06 0.42 1.61 1.01 -1.18 -3.11 120.40 118.36 3g1p s VAL 16 Ca 0.00 -0.33 -0.24 0.00 0.00 0.00 0.00 61.98 61.41 3g1p s VAL 16 Cb 0.00 -1.06 -0.08 0.00 0.00 0.00 0.00 36.38 35.24 3g1p s VAL 16 CO 0.00 0.37 1.11 -2.16 0.00 0.00 0.00 175.10 174.42 3g1p s PRO 17 N 1.54 4.00 0.33 2.72 0.04 -1.26 -0.59 135.00 141.77 3g1p s PRO 17 Ca 0.02 1.65 -0.28 0.00 0.04 0.00 0.00 61.00 62.43 3g1p s PRO 17 Cb -0.13 -2.51 -0.09 0.00 0.04 0.00 0.00 34.50 31.81 3g1p s PRO 17 CO -0.07 -0.32 1.18 0.00 0.04 0.00 0.00 177.00 177.84 3g1p s ALA 18 N -1.58 3.36 0.04 8.56 0.00 -1.18 -4.91 121.76 126.05 3g1p s ALA 18 Ca 0.60 1.03 -0.30 0.00 0.00 0.00 0.00 51.96 53.29 3g1p s ALA 18 Cb -0.26 -3.39 -0.09 0.00 0.00 0.00 0.00 23.12 19.39 3g1p s ALA 18 CO 0.32 -0.42 1.88 -0.46 0.00 0.00 0.00 175.76 177.08 3g1p s TRP 19 N -1.23 1.61 0.00 0.00 -0.00 -1.26 -1.20 118.94 116.86 3g1p s TRP 19 Ca 0.50 -0.24 0.00 0.00 -0.00 0.00 0.00 56.10 56.35 3g1p s TRP 19 Cb -0.34 -4.17 0.00 0.00 -0.00 0.00 0.00 33.47 28.96 3g1p s TRP 19 CO 0.44 -5.10 0.00 0.41 -0.00 0.00 0.00 176.95 172.70 3g1p n GLY 20 N 4.39 1.57 3.74 5.86 0.00 -1.26 -5.02 105.19 114.48 3g1p n GLY 20 Ca 0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 3g1p n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1p n GLU 22 N 1.91 2.33 -0.84 0.00 -0.58 -1.26 -4.47 120.64 117.73 3g1p n GLU 22 Ca -0.01 -2.83 -0.29 0.00 -0.42 0.00 0.00 57.16 53.61 3g1p n GLU 22 Cb 0.48 -1.75 0.21 0.00 -0.57 0.00 0.00 31.44 29.81 3g1p n GLU 22 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3g1p h ALA 24 N -2.22 1.46 -0.28 0.00 0.00 -1.96 -0.20 119.26 116.06 3g1p h ALA 24 Ca -0.57 -0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.12 3g1p h ALA 24 Cb 1.32 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.81 3g1p h ALA 24 CO 0.53 0.46 -0.51 0.00 0.00 0.00 0.00 179.25 179.72 3g1p h ALA 25 N 1.49 0.44 -0.21 0.00 0.00 -1.89 -1.53 119.26 117.55 3g1p h ALA 25 Ca 0.35 -0.50 -0.14 0.00 0.00 0.00 0.00 54.91 54.61 3g1p h ALA 25 Cb 0.03 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.74 3g1p h ALA 25 CO -0.10 0.63 -0.43 0.00 0.00 0.00 0.00 179.25 179.35 3g1p h ALA 27 N 0.61 1.18 -0.44 0.00 0.00 -1.06 -1.98 119.26 117.58 3g1p h ALA 27 Ca 0.01 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3g1p h ALA 27 Cb 1.03 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 3g1p h ALA 27 CO 0.10 0.61 0.28 -0.09 0.00 0.00 0.00 179.25 180.14 3g1p h ARG 28 N 1.27 0.59 -0.01 0.00 2.43 -1.11 -2.07 114.38 115.48 3g1p h ARG 28 Ca 0.34 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.40 3g1p h ARG 28 Cb -0.11 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.30 3g1p h ARG 28 CO -0.07 0.41 -0.28 0.00 -1.51 0.00 0.00 179.97 178.52 3g1p h ALA 29 N 1.14 1.52 -0.30 2.80 0.00 -0.98 0.24 119.26 123.68 3g1p h ALA 29 Ca 0.16 -0.26 -0.12 0.00 0.00 0.00 0.00 54.91 54.69 3g1p h ALA 29 Cb -0.04 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 3g1p h ALA 29 CO -0.03 0.36 -0.28 0.00 0.00 0.00 0.00 179.25 179.30 3g1p h ARG 30 N 0.02 0.72 -0.21 0.00 3.08 -1.04 -3.28 114.38 113.67 3g1p h ARG 30 Ca -0.00 -0.37 -0.15 0.00 0.07 0.00 0.00 59.98 59.53 3g1p h ARG 30 Cb 0.51 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.57 3g1p h ARG 30 CO 0.04 0.99 -0.47 -0.09 -1.07 0.00 0.00 179.97 179.37 3g1p h ARG 31 N 0.47 0.68 -3.68 0.04 2.43 -0.86 -3.40 114.38 110.05 3g1p h ARG 31 Ca 0.05 -0.46 -0.63 0.00 -0.81 0.00 0.00 59.98 58.13 3g1p h ARG 31 Cb 0.85 0.06 -0.40 0.00 -0.42 0.00 0.00 29.97 30.06 3g1p h ARG 31 CO 0.07 1.08 -0.70 -1.12 -1.51 0.00 0.00 179.97 177.79 3g1p s SER 32 N -6.73 4.24 0.63 -3.80 0.01 0.79 -5.00 113.70 103.85 3g1p s SER 32 Ca -0.12 -2.48 0.32 0.00 1.31 0.00 0.00 55.95 54.97 3g1p s SER 32 Cb 0.08 -1.38 1.73 0.00 0.21 0.00 0.00 66.02 66.66 3g1p s SER 32 CO 0.85 -0.31 2.04 -0.65 0.41 0.00 0.00 173.24 175.58 3g1p h PRO 33 N 7.09 0.00 0.00 12.44 0.11 -1.78 -1.28 132.00 148.58 3g1p h PRO 33 Ca -0.06 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.05 3g1p h PRO 33 Cb 0.95 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.06 3g1p h PRO 33 CO 0.56 0.00 -0.00 -0.56 -0.21 0.00 0.00 178.00 177.79 3g1p h GLN 34 N 0.00 0.00 -0.02 1.05 3.07 -1.93 -1.46 115.11 115.82 3g1p h GLN 34 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.80 3g1p h GLN 34 Cb 0.59 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.15 3g1p h GLN 34 CO -0.00 0.00 -0.04 0.66 0.09 0.00 0.00 178.83 179.54 3g1p n TYR 35 N -3.13 0.00 -2.02 0.06 4.01 -0.48 -4.58 117.16 111.02 3g1p n TYR 35 Ca -0.02 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.34 3g1p n TYR 35 Cb 0.11 -0.02 0.02 0.00 -0.31 0.00 0.00 39.34 39.14 3g1p n TYR 35 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 3g1p s ARG 36 N -2.08 3.38 -0.23 -0.72 0.52 -0.55 -4.74 118.95 114.53 3g1p s ARG 36 Ca 0.35 1.98 0.00 0.00 -0.52 0.00 0.00 55.73 57.54 3g1p s ARG 36 Cb 0.21 -2.28 0.06 0.00 0.52 0.00 0.00 34.95 33.46 3g1p s ARG 36 CO 0.36 -0.92 -0.04 1.03 0.02 0.00 0.00 175.30 175.75 3g1p s ARG 37 N -2.87 1.52 0.73 3.54 0.52 0.24 -4.47 118.95 118.16 3g1p s ARG 37 Ca 0.69 -0.93 -0.07 0.00 -0.52 0.00 0.00 55.73 54.90 3g1p s ARG 37 Cb -0.34 -2.54 0.08 0.00 0.52 0.00 0.00 34.95 32.67 3g1p s ARG 37 CO 0.40 -0.60 1.04 -0.65 0.02 0.00 0.00 175.30 175.51 3g1p s GLN 38 N 1.44 1.98 0.37 3.54 -0.21 -1.26 -3.12 119.66 122.39 3g1p s GLN 38 Ca -0.05 -0.37 -0.28 0.00 0.02 0.00 0.00 55.36 54.68 3g1p s GLN 38 Cb -0.19 -2.15 -0.11 0.00 1.00 0.00 0.00 33.01 31.56 3g1p s GLN 38 CO -0.06 -1.38 1.49 -2.30 -2.12 0.00 0.00 175.29 170.91 3g1p n PRO 39 N -3.00 2.65 -1.63 2.91 -0.02 -1.26 -0.48 135.00 134.17 3g1p n PRO 39 Ca 0.09 0.93 -0.55 0.00 -2.02 0.00 0.00 63.50 61.96 3g1p n PRO 39 Cb 0.60 -2.66 -0.07 0.00 -0.02 0.00 0.00 33.50 31.35 3g1p n PRO 39 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3g1p s SER 41 N 4.55 -0.36 0.15 0.00 1.04 -0.56 -4.73 113.70 113.79 3g1p s SER 41 Ca 1.01 -0.03 -0.10 0.00 0.48 0.00 0.00 55.95 57.31 3g1p s SER 41 Cb -0.99 0.40 -0.00 0.00 0.10 0.00 0.00 66.02 65.52 3g1p s SER 41 CO 0.61 -0.65 0.28 -0.83 0.98 0.00 0.00 173.24 173.63 3g1p s GLY 42 N -2.52 0.32 -0.12 7.32 0.00 -0.41 -1.33 107.32 110.58 3g1p s GLY 42 Ca 0.05 -0.74 0.01 0.00 0.00 0.00 0.00 44.72 44.04 3g1p s GLY 42 CO -0.08 -0.77 -0.12 0.14 0.00 0.00 0.00 173.10 172.27 3g1p s VAL 43 N -3.93 1.30 -0.21 1.40 1.01 0.33 -0.72 120.40 119.59 3g1p s VAL 43 Ca 0.13 -0.49 -0.09 0.00 0.00 0.00 0.00 61.98 61.53 3g1p s VAL 43 Cb 0.03 -1.24 -0.04 0.00 0.00 0.00 0.00 36.38 35.13 3g1p s VAL 43 CO -0.03 0.41 0.10 -0.69 0.00 0.00 0.00 175.10 174.88 3g1p s VAL 44 N 1.34 4.99 -0.24 2.92 1.01 0.49 -0.88 120.40 130.02 3g1p s VAL 44 Ca -0.00 0.04 -0.01 0.00 0.00 0.00 0.00 61.98 62.01 3g1p s VAL 44 Cb -0.14 -3.28 0.03 0.00 0.00 0.00 0.00 36.38 32.99 3g1p s VAL 44 CO -0.06 0.42 -0.08 -0.54 0.00 0.00 0.00 175.10 174.85 3g1p s LYS 45 N 0.65 2.81 -0.24 2.72 1.02 -0.21 -0.68 119.74 125.80 3g1p s LYS 45 Ca 0.05 -0.99 0.02 0.00 0.02 0.00 0.00 55.97 55.07 3g1p s LYS 45 Cb -0.13 -2.94 0.06 0.00 -0.52 0.00 0.00 37.83 34.29 3g1p s LYS 45 CO 0.01 -0.40 -0.09 0.12 -0.92 0.00 0.00 175.35 174.07 3g1p s PHE 46 N 1.31 2.82 0.00 3.18 5.36 -0.22 -1.01 117.98 129.41 3g1p s PHE 46 Ca -0.00 -1.99 0.00 0.00 -0.96 0.00 0.00 56.93 53.97 3g1p s PHE 46 Cb -0.17 -1.76 0.00 0.00 -0.34 0.00 0.00 43.02 40.75 3g1p s PHE 46 CO -0.05 -0.82 0.00 0.09 -1.46 0.00 0.00 175.22 172.98 3g1p n ASN 47 N 4.56 0.00 0.15 6.13 3.02 -0.22 -1.34 115.26 127.56 3g1p n ASN 47 Ca -0.14 0.00 0.11 0.00 -0.03 0.00 0.00 54.58 54.53 3g1p n ASN 47 Cb 0.44 0.00 0.06 0.00 -0.61 0.00 0.00 39.78 39.67 3g1p n ASN 47 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 3g1p h ASP 48 N 0.00 0.00 -3.56 6.41 5.19 -1.94 -3.48 116.42 119.04 3g1p h ASP 48 Ca 0.00 0.00 -0.52 0.00 -0.62 0.00 0.00 57.03 55.89 3g1p h ASP 48 Cb 0.00 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 39.48 3g1p h ASP 48 CO 0.00 0.02 0.14 0.00 -3.12 0.00 0.00 179.24 176.28 3g1p s ALA 49 N -3.29 3.42 -0.09 3.45 0.00 -0.45 -5.05 121.76 119.75 3g1p s ALA 49 Ca 0.02 0.25 0.03 0.00 0.00 0.00 0.00 51.96 52.27 3g1p s ALA 49 Cb 0.08 -2.88 0.01 0.00 0.00 0.00 0.00 23.12 20.32 3g1p s ALA 49 CO 0.75 0.31 -0.19 0.42 0.00 0.00 0.00 175.76 177.04 3g1p s ILE 50 N -1.39 1.68 -0.10 0.00 1.01 -1.26 -1.05 121.20 120.09 3g1p s ILE 50 Ca 0.40 -0.80 0.03 0.00 0.00 0.00 0.00 60.65 60.29 3g1p s ILE 50 Cb -0.19 -1.48 -0.01 0.00 0.01 0.00 0.00 42.46 40.80 3g1p s ILE 50 CO 0.23 0.48 -0.21 -0.89 0.00 0.00 0.00 174.94 174.54 3g1p s THR 51 N 0.48 2.37 -0.38 2.92 2.01 0.14 -0.74 115.64 122.45 3g1p s THR 51 Ca -0.17 -0.92 -0.15 0.00 0.31 0.00 0.00 61.69 60.76 3g1p s THR 51 Cb -0.17 -1.92 0.00 0.00 0.01 0.00 0.00 72.50 70.42 3g1p s THR 51 CO 0.07 0.55 0.31 -0.76 -0.69 0.00 0.00 174.62 174.10 3g1p s LEU 52 N 0.19 4.76 -0.44 4.42 1.02 -0.65 -0.38 118.68 127.60 3g1p s LEU 52 Ca -0.12 -0.59 -0.24 0.00 0.02 0.00 0.00 54.13 53.20 3g1p s LEU 52 Cb -0.16 -2.22 0.02 0.00 0.02 0.00 0.00 46.19 43.86 3g1p s LEU 52 CO 0.07 -0.38 0.84 -0.63 0.02 0.00 0.00 176.35 176.27 3g1p s ILE 53 N 1.82 4.59 0.35 -0.59 1.01 0.10 -0.34 121.20 128.14 3g1p s ILE 53 Ca 0.08 0.63 0.00 0.00 0.00 0.00 0.00 60.65 61.36 3g1p s ILE 53 Cb -0.18 -4.35 0.00 0.00 0.01 0.00 0.00 42.46 37.94 3g1p s ILE 53 CO 0.11 -0.72 0.00 0.47 0.00 0.00 0.00 174.94 174.80 3g1p n ASP 54 N 6.84 -6.24 -2.71 3.58 8.00 -0.11 -1.29 116.55 124.62 3g1p n ASP 54 Ca 0.04 0.74 -0.06 0.00 0.71 0.00 0.00 54.79 56.23 3g1p n ASP 54 Cb 0.48 -3.36 0.07 0.00 -0.02 0.00 0.00 41.12 38.29 3g1p n ASP 54 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3g1p n ALA 55 N -3.10 2.62 0.62 2.24 0.00 0.22 -4.74 120.51 118.37 3g1p n ALA 55 Ca -0.03 -2.29 0.12 0.00 0.00 0.00 0.00 53.44 51.24 3g1p n ALA 55 Cb 0.48 -0.93 0.23 0.00 0.00 0.00 0.00 19.45 19.24 3g1p n ALA 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g1p n GLY 56 N -0.52 -1.46 3.77 0.00 0.00 -1.23 0.57 105.19 106.33 3g1p n GLY 56 Ca 0.02 -0.21 -0.38 0.00 0.00 0.00 0.00 46.02 45.44 3g1p n GLY 56 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3g1p s LEU 57 N -4.17 4.20 0.00 0.99 1.43 -1.26 -4.43 118.68 115.43 3g1p s LEU 57 Ca 0.07 2.39 0.22 0.00 -1.03 0.00 0.00 54.13 55.79 3g1p s LEU 57 Cb 0.14 -4.00 0.57 0.00 0.03 0.00 0.00 46.19 42.93 3g1p s LEU 57 CO 0.69 -0.70 1.47 0.00 0.23 0.00 0.00 176.35 178.04 3g1p n HIS 58 N 0.09 0.33 -1.70 0.29 1.44 -1.26 -3.96 115.22 110.46 3g1p n HIS 58 Ca 0.04 -0.17 0.06 0.00 -2.01 0.00 0.00 57.72 55.64 3g1p n HIS 58 Cb 0.46 0.00 0.17 0.00 0.12 0.00 0.00 29.99 30.74 3g1p n HIS 58 CO 0.00 0.00 0.00 -0.40 -2.81 0.00 0.00 176.34 173.13 3g1p n ASP 59 N 0.90 1.62 -0.02 4.39 5.75 -1.26 -4.75 116.55 123.18 3g1p n ASP 59 Ca 0.17 -3.45 0.07 0.00 -0.01 0.00 0.00 54.79 51.57 3g1p n ASP 59 Cb 0.47 -0.47 0.45 0.00 -1.03 0.00 0.00 41.12 40.54 3g1p n ASP 59 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 3g1p h LEU 60 N 0.87 0.43 -1.74 -2.12 3.38 -1.88 -1.62 115.31 112.63 3g1p h LEU 60 Ca -0.04 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.93 3g1p h LEU 60 Cb 1.16 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.81 3g1p h LEU 60 CO 0.02 0.30 0.00 0.00 0.09 0.00 0.00 178.44 178.84 3g1p h ALA 61 N 1.74 1.00 0.00 1.53 0.00 -1.85 -0.66 119.26 121.01 3g1p h ALA 61 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.10 3g1p h ALA 61 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3g1p h ALA 61 CO -0.05 0.00 -1.59 -0.25 0.00 0.00 0.00 179.25 177.37 3g1p n ASP 62 N -2.98 0.34 0.06 0.00 8.00 -0.65 -4.30 116.55 117.02 3g1p n ASP 62 Ca -0.00 0.05 0.02 0.00 0.71 0.00 0.00 54.79 55.57 3g1p n ASP 62 Cb 0.24 1.40 -0.05 0.00 -0.02 0.00 0.00 41.12 42.68 3g1p n ASP 62 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 3g1p h ARG 63 N 0.00 0.00 -4.12 -1.24 3.08 -0.88 -3.48 114.38 107.74 3g1p h ARG 63 Ca 0.00 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 59.87 3g1p h ARG 63 Cb 0.96 0.00 -0.20 0.00 0.08 0.00 0.00 29.97 30.82 3g1p h ARG 63 CO 0.00 0.26 -0.70 -1.58 -1.07 0.00 0.00 179.97 176.88 3g1p s TRP 64 N -3.00 0.38 0.26 3.04 0.52 -0.33 -5.10 118.94 114.72 3g1p s TRP 64 Ca -0.02 -0.64 0.09 0.00 0.02 0.00 0.00 56.10 55.55 3g1p s TRP 64 Cb 0.09 -0.26 -0.04 0.00 -1.15 0.00 0.00 33.47 32.10 3g1p s TRP 64 CO 0.80 -0.21 0.06 -1.54 0.02 0.00 0.00 176.95 176.08 3g1p s SER 65 N -1.80 4.85 0.09 2.95 1.04 -1.26 -4.56 113.70 115.01 3g1p s SER 65 Ca -0.10 -0.53 -0.33 0.00 0.48 0.00 0.00 55.95 55.47 3g1p s SER 65 Cb -0.06 -1.01 -0.12 0.00 0.10 0.00 0.00 66.02 64.93 3g1p s SER 65 CO -0.03 -0.02 1.76 -2.65 0.98 0.00 0.00 173.24 173.29 3g1p n PRO 66 N -0.99 2.46 -0.12 4.02 -0.02 -1.26 -1.32 135.00 137.76 3g1p n PRO 66 Ca -0.07 0.89 0.00 0.00 -2.02 0.00 0.00 63.50 62.31 3g1p n PRO 66 Cb 0.59 -2.74 0.00 0.00 -0.02 0.00 0.00 33.50 31.33 3g1p n PRO 66 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3g1p n GLY 67 N 4.00 0.68 0.12 -1.23 0.00 -1.26 -4.92 105.19 102.58 3g1p n GLY 67 Ca 0.19 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.34 3g1p n GLY 67 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3g1p n SER 68 N 0.00 0.51 -4.08 1.61 3.41 -0.44 -4.82 113.62 109.82 3g1p n SER 68 Ca 0.00 -0.53 -0.09 0.00 -0.26 0.00 0.00 58.87 57.99 3g1p n SER 68 Cb 0.00 -0.06 -0.09 0.00 -0.26 0.00 0.00 64.21 63.80 3g1p n SER 68 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 3g1p s PHE 69 N -2.54 0.67 -0.14 7.33 -0.12 -1.26 -4.88 117.98 117.04 3g1p s PHE 69 Ca 0.26 -1.06 -0.04 0.00 -0.05 0.00 0.00 56.93 56.04 3g1p s PHE 69 Cb 0.20 -0.34 -0.25 0.00 -0.63 0.00 0.00 43.02 42.00 3g1p s PHE 69 CO 0.50 -0.56 0.30 1.04 -0.05 0.00 0.00 175.22 176.45 3g1p n GLN 70 N -0.10 0.74 -3.48 1.99 3.00 0.08 -4.96 117.38 114.65 3g1p n GLN 70 Ca -0.07 0.25 -0.10 0.00 -0.01 0.00 0.00 57.00 57.06 3g1p n GLN 70 Cb 0.63 -1.69 -0.02 0.00 0.00 0.00 0.00 30.24 29.17 3g1p n GLN 70 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.06 178.20 3g1p s GLN 71 N -2.56 1.07 0.15 -1.09 0.00 -1.22 -4.35 119.66 111.67 3g1p s GLN 71 Ca -0.23 -0.41 -0.11 0.00 -0.00 0.00 0.00 55.36 54.61 3g1p s GLN 71 Cb 0.07 0.48 -0.07 0.00 0.00 0.00 0.00 33.01 33.50 3g1p s GLN 71 CO 0.75 -0.47 0.50 -0.06 0.00 0.00 0.00 175.29 176.01 3g1p s PHE 72 N -3.43 3.54 -0.19 9.60 0.08 -0.32 -1.63 117.98 125.62 3g1p s PHE 72 Ca 0.04 0.91 0.00 0.00 0.12 0.00 0.00 56.93 58.00 3g1p s PHE 72 Cb -0.01 -2.26 0.05 0.00 -0.57 0.00 0.00 43.02 40.22 3g1p s PHE 72 CO -0.10 0.41 -0.07 -1.17 -0.10 0.00 0.00 175.22 174.18 3g1p s LEU 73 N -2.23 2.05 -0.09 -0.37 2.96 0.54 -0.82 118.68 120.72 3g1p s LEU 73 Ca 0.40 -0.86 -0.04 0.00 -0.22 0.00 0.00 54.13 53.41 3g1p s LEU 73 Cb -0.13 -1.08 -0.04 0.00 0.50 0.00 0.00 46.19 45.44 3g1p s LEU 73 CO 0.20 -0.18 0.06 -0.76 -1.32 0.00 0.00 176.35 174.35 3g1p s LEU 74 N 1.50 3.92 -0.03 -0.68 1.43 0.97 -0.93 118.68 124.84 3g1p s LEU 74 Ca -0.01 0.27 -0.15 0.00 -1.03 0.00 0.00 54.13 53.20 3g1p s LEU 74 Cb -0.16 -1.96 -0.32 0.00 0.03 0.00 0.00 46.19 43.77 3g1p s LEU 74 CO -0.08 0.38 0.79 0.71 0.23 0.00 0.00 176.35 178.38 3g1p h THR 75 N 3.99 1.16 -2.16 5.49 1.35 -1.88 -3.37 112.91 117.48 3g1p h THR 75 Ca -0.52 -2.55 0.22 0.00 -0.55 0.00 0.00 66.41 63.01 3g1p h THR 75 Cb 1.21 2.92 -0.08 0.00 -1.73 0.00 0.00 68.15 70.47 3g1p h THR 75 CO 0.57 0.79 0.62 -1.38 -0.25 0.00 0.00 175.52 175.87 3g1p s HIS 76 N -2.54 -0.04 -0.29 4.73 0.00 -1.26 -1.16 115.29 114.73 3g1p s HIS 76 Ca -0.14 -0.23 0.15 0.00 -3.00 0.00 0.00 55.06 51.84 3g1p s HIS 76 Cb 0.04 0.63 0.70 0.00 -4.00 0.00 0.00 32.58 29.95 3g1p s HIS 76 CO 0.86 -0.69 1.62 0.66 -1.00 0.00 0.00 174.74 176.19 3g1p n TYR 77 N -0.57 1.61 -1.73 0.38 4.01 -1.26 -4.69 117.16 114.91 3g1p n TYR 77 Ca -0.05 -0.77 -0.39 0.00 -0.16 0.00 0.00 57.90 56.52 3g1p n TYR 77 Cb 0.61 -0.42 0.03 0.00 -0.31 0.00 0.00 39.34 39.25 3g1p n TYR 77 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 3g1p n HIS 78 N 0.24 2.28 -0.30 -0.72 8.25 -1.26 -4.59 115.22 119.12 3g1p n HIS 78 Ca 0.25 0.45 0.08 0.00 -0.26 0.00 0.00 57.72 58.24 3g1p n HIS 78 Cb 1.06 -2.38 0.24 0.00 1.12 0.00 0.00 29.99 30.03 3g1p n HIS 78 CO 0.00 0.00 0.00 1.98 0.64 0.00 0.00 176.34 178.96 3g1p h MET 79 N 1.72 0.58 0.00 -0.41 4.05 -1.97 0.64 114.93 119.54 3g1p h MET 79 Ca -0.50 -0.04 0.00 0.00 -0.28 0.00 0.00 59.70 58.88 3g1p h MET 79 Cb 1.30 -0.13 0.00 0.00 -0.80 0.00 0.00 31.60 31.97 3g1p h MET 79 CO 0.58 0.39 0.00 -0.40 0.23 0.00 0.00 176.91 177.71 3g1p n ASP 80 N -4.89 0.00 -0.10 1.39 5.75 -1.26 -0.59 116.55 116.85 3g1p n ASP 80 Ca 0.18 0.24 0.05 0.00 -0.01 0.00 0.00 54.79 55.25 3g1p n ASP 80 Cb 0.46 -0.34 -0.04 0.00 -1.03 0.00 0.00 41.12 40.18 3g1p n ASP 80 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 3g1p n HIS 81 N -1.34 0.00 -0.41 2.11 8.25 0.20 -3.93 115.22 120.10 3g1p n HIS 81 Ca 0.04 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.50 3g1p n HIS 81 Cb 0.08 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.19 3g1p n HIS 81 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 3g1p n VAL 82 N -0.85 0.00 0.17 1.59 0.24 -0.91 -0.61 118.33 117.95 3g1p n VAL 82 Ca 0.03 -0.15 0.16 0.00 -2.04 0.00 0.00 64.34 62.34 3g1p n VAL 82 Cb 0.19 1.41 0.75 0.00 -1.47 0.00 0.00 33.84 34.72 3g1p n VAL 82 CO 0.00 0.00 0.00 0.06 -2.14 0.00 0.00 176.83 174.75 3g1p h GLN 83 N 0.00 0.00 0.00 7.34 3.07 -0.87 -0.15 115.11 124.50 3g1p h GLN 83 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 3g1p h GLN 83 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.76 3g1p h GLN 83 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 178.83 179.33 3g1p n GLY 84 N -1.49 -1.05 0.17 0.06 0.00 0.19 -2.68 105.19 100.38 3g1p n GLY 84 Ca 0.02 -0.07 0.05 0.00 0.00 0.00 0.00 46.02 46.02 3g1p n GLY 84 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3g1p h LEU 85 N 0.00 0.00 -0.62 0.99 3.38 -1.13 -3.35 115.31 114.58 3g1p h LEU 85 Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 3g1p h LEU 85 Cb 0.27 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.99 3g1p h LEU 85 CO 0.00 0.40 0.23 -0.26 0.09 0.00 0.00 178.44 178.90 3g1p h PHE 86 N 0.00 0.96 0.00 1.13 0.04 -1.67 -1.74 116.94 115.67 3g1p h PHE 86 Ca -0.00 -0.08 0.00 0.00 2.80 0.00 0.00 57.97 60.69 3g1p h PHE 86 Cb 1.17 -0.28 0.00 0.00 2.20 0.00 0.00 35.95 39.04 3g1p h PHE 86 CO 0.00 0.77 0.00 -2.30 -0.60 0.00 0.00 178.31 176.18 3g1p n PRO 87 N -4.42 0.67 -0.07 1.51 -0.02 -1.26 -3.56 135.00 127.84 3g1p n PRO 87 Ca 0.04 0.01 -0.08 0.00 -2.02 0.00 0.00 63.50 61.45 3g1p n PRO 87 Cb 0.18 -1.50 -0.11 0.00 -0.02 0.00 0.00 33.50 32.05 3g1p n PRO 87 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3g1p n LEU 88 N -1.02 0.40 0.25 2.45 4.77 -0.71 -4.67 117.00 118.47 3g1p n LEU 88 Ca 0.16 -0.01 0.08 0.00 -0.03 0.00 0.00 56.01 56.21 3g1p n LEU 88 Cb 0.08 0.22 0.61 0.00 -2.33 0.00 0.00 43.42 42.01 3g1p n LEU 88 CO 0.13 0.42 0.97 0.08 -1.33 0.00 0.00 177.39 177.65 3g1p h ARG 89 N 0.00 0.00 -0.77 3.23 0.11 -1.45 -1.42 114.38 114.09 3g1p h ARG 89 Ca -0.39 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 59.66 3g1p h ARG 89 Cb 1.85 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.92 3g1p h ARG 89 CO 0.01 0.12 0.03 0.91 0.10 0.00 0.00 179.97 181.14 3g1p n TRP 90 N -4.19 1.30 -1.49 4.08 5.03 -1.26 -1.43 117.44 119.48 3g1p n TRP 90 Ca -0.02 -0.50 -0.30 0.00 3.03 0.00 0.00 57.50 59.70 3g1p n TRP 90 Cb 0.20 -0.37 0.21 0.00 -1.03 0.00 0.00 31.31 30.32 3g1p n TRP 90 CO 0.00 0.00 0.00 0.20 -0.03 0.00 0.00 177.69 177.86 3g1p s GLY 91 N -0.46 1.68 -0.21 6.99 0.00 -0.53 -5.03 107.32 109.76 3g1p s GLY 91 Ca 0.33 -1.07 -0.03 0.00 0.00 0.00 0.00 44.72 43.95 3g1p s GLY 91 CO 0.09 -0.24 -0.06 0.14 0.00 0.00 0.00 173.10 173.03 3g1p s VAL 92 N -3.43 3.28 -5.00 1.40 1.01 -1.26 -4.77 120.40 111.62 3g1p s VAL 92 Ca 0.72 -0.53 0.00 0.00 0.00 0.00 0.00 61.98 62.17 3g1p s VAL 92 Cb -0.07 -2.48 0.00 0.00 0.00 0.00 0.00 36.38 33.83 3g1p s VAL 92 CO 0.55 0.44 0.00 0.61 0.00 0.00 0.00 175.10 176.69 3g1p n GLY 93 N 4.66 -2.19 3.79 4.51 0.00 -1.26 -4.78 105.19 109.92 3g1p n GLY 93 Ca -0.18 -1.31 -0.32 0.00 0.00 0.00 0.00 46.02 44.21 3g1p n GLY 93 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3g1p s ASP 94 N -1.66 5.10 0.44 1.61 1.01 -1.26 -4.98 116.67 116.93 3g1p s ASP 94 Ca 0.00 1.77 -0.25 0.00 0.71 0.00 0.00 52.55 54.78 3g1p s ASP 94 Cb 0.00 -2.52 -0.09 0.00 1.01 0.00 0.00 42.92 41.32 3g1p s ASP 94 CO 0.00 -1.63 1.29 -2.65 0.21 0.00 0.00 175.17 172.38 3g1p n PRO 95 N -2.99 1.93 -3.90 8.23 -0.02 -1.26 -4.90 135.00 132.08 3g1p n PRO 95 Ca 0.09 0.69 -0.35 0.00 -2.02 0.00 0.00 63.50 61.90 3g1p n PRO 95 Cb 0.53 -2.42 -0.14 0.00 -0.02 0.00 0.00 33.50 31.45 3g1p n PRO 95 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3g1p s ILE 96 N -1.21 3.31 0.30 4.25 1.01 0.54 -4.95 121.20 124.44 3g1p s ILE 96 Ca 0.62 -0.66 -0.29 0.00 0.00 0.00 0.00 60.65 60.32 3g1p s ILE 96 Cb -0.49 -2.57 -0.10 0.00 0.01 0.00 0.00 42.46 39.30 3g1p s ILE 96 CO 0.57 0.32 1.41 -2.84 0.00 0.00 0.00 174.94 174.40 3g1p s PRO 97 N 1.44 4.27 -0.28 2.79 0.02 -1.26 -0.65 135.00 141.33 3g1p s PRO 97 Ca 0.04 2.33 0.03 0.00 0.02 0.00 0.00 61.00 63.42 3g1p s PRO 97 Cb -0.15 -3.07 0.07 0.00 0.02 0.00 0.00 34.50 31.37 3g1p s PRO 97 CO -0.03 -0.37 -0.05 0.08 -0.33 0.00 0.00 177.00 176.30 3g1p s VAL 98 N -0.57 2.13 0.07 3.83 1.01 0.28 -1.17 120.40 125.98 3g1p s VAL 98 Ca 0.55 -1.82 -0.19 0.00 0.00 0.00 0.00 61.98 60.52 3g1p s VAL 98 Cb -0.42 -2.36 -0.07 0.00 0.00 0.00 0.00 36.38 33.54 3g1p s VAL 98 CO 0.50 -0.22 0.56 -0.31 0.00 0.00 0.00 175.10 175.63 3g1p s TYR 99 N 1.07 3.80 -0.96 5.22 2.02 0.00 -3.81 117.35 124.69 3g1p s TYR 99 Ca -0.02 1.25 0.00 0.00 -0.37 0.00 0.00 57.07 57.93 3g1p s TYR 99 Cb -0.20 -2.49 0.00 0.00 -0.40 0.00 0.00 41.96 38.88 3g1p s TYR 99 CO -0.06 0.59 0.00 0.41 -1.57 0.00 0.00 175.55 174.91 3g1p n GLY 100 N 1.75 -1.37 3.78 0.71 0.00 -1.18 -0.02 105.19 108.86 3g1p n GLY 100 Ca -0.10 -0.99 -0.33 0.00 0.00 0.00 0.00 46.02 44.59 3g1p n GLY 100 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3g1p s PRO 101 N -1.31 2.92 -0.99 1.61 0.04 -1.26 -1.48 135.00 134.52 3g1p s PRO 101 Ca 0.00 1.36 -0.08 0.00 0.04 0.00 0.00 61.00 62.32 3g1p s PRO 101 Cb 0.00 -1.97 -0.13 0.00 0.04 0.00 0.00 34.50 32.44 3g1p s PRO 101 CO 0.00 -1.15 2.95 -0.35 0.04 0.00 0.00 177.00 178.49 3g1p n PRO 102 N -2.31 2.84 -2.25 0.56 -0.04 -1.26 -4.84 135.00 127.70 3g1p n PRO 102 Ca 0.10 -1.67 -0.42 0.00 -0.04 0.00 0.00 63.50 61.47 3g1p n PRO 102 Cb 0.52 -2.47 -0.03 0.00 -0.04 0.00 0.00 33.50 31.48 3g1p n PRO 102 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 3g1p s ASP 103 N 2.34 6.86 0.42 3.54 -1.08 -1.26 -4.91 116.67 122.58 3g1p s ASP 103 Ca 0.62 2.01 0.23 0.00 -0.52 0.00 0.00 52.55 54.89 3g1p s ASP 103 Cb 0.20 -2.55 0.49 0.00 -1.46 0.00 0.00 42.92 39.61 3g1p s ASP 103 CO -0.04 -0.75 1.65 -0.33 0.52 0.00 0.00 175.17 176.22 3g1p h GLU 104 N 8.19 0.00 0.03 4.34 5.08 -2.02 -3.33 114.58 126.88 3g1p h GLU 104 Ca -0.35 0.00 -0.36 0.00 -1.00 0.00 0.00 59.36 57.65 3g1p h GLU 104 Cb 1.16 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.35 3g1p h GLU 104 CO 0.93 0.14 -2.20 1.04 -1.00 0.00 0.00 179.01 177.91 3g1p n GLN 105 N -3.16 0.68 0.00 2.33 1.13 -1.26 -5.07 117.38 112.03 3g1p n GLN 105 Ca 0.03 0.15 0.00 0.00 -1.94 0.00 0.00 57.00 55.24 3g1p n GLN 105 Cb 0.53 -1.61 0.00 0.00 0.11 0.00 0.00 30.24 29.27 3g1p n GLN 105 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3g1p n GLY 106 N 1.91 0.83 2.79 1.08 0.00 -1.25 -4.74 105.19 105.81 3g1p n GLY 106 Ca -0.33 -0.83 -0.17 0.00 0.00 0.00 0.00 46.02 44.68 3g1p n GLY 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g1p n ASP 108 N 4.37 0.00 -1.84 0.00 2.03 -1.26 -2.12 116.55 117.73 3g1p n ASP 108 Ca -0.22 0.00 -0.08 0.00 0.52 0.00 0.00 54.79 55.00 3g1p n ASP 108 Cb 0.50 0.00 0.26 0.00 -0.72 0.00 0.00 41.12 41.16 3g1p n ASP 108 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 3g1p n ASP 109 N 1.38 4.20 -0.12 1.67 5.75 -1.26 -4.59 116.55 123.58 3g1p n ASP 109 Ca 0.00 -3.37 -0.05 0.00 -0.01 0.00 0.00 54.79 51.36 3g1p n ASP 109 Cb 0.00 -0.74 0.03 0.00 -1.03 0.00 0.00 41.12 39.39 3g1p n ASP 109 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 3g1p h LEU 110 N 2.00 0.11 -0.30 -2.12 3.38 -1.70 -0.22 115.31 116.46 3g1p h LEU 110 Ca 0.32 0.05 -0.11 0.00 0.09 0.00 0.00 57.88 58.24 3g1p h LEU 110 Cb 2.29 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 43.09 3g1p h LEU 110 CO 0.73 0.10 -0.23 -0.26 0.09 0.00 0.00 178.44 178.87 3g1p h PHE 111 N 0.28 0.80 -0.40 1.13 0.04 -1.82 -2.30 116.94 114.67 3g1p h PHE 111 Ca 0.19 -0.22 -0.09 0.00 2.80 0.00 0.00 57.97 60.65 3g1p h PHE 111 Cb 0.20 -0.17 -0.02 0.00 2.20 0.00 0.00 35.95 38.15 3g1p h PHE 111 CO -0.17 0.95 -0.13 0.87 -0.60 0.00 0.00 178.31 179.23 3g1p h LYS 112 N 0.42 0.73 -2.18 1.51 1.57 -1.86 -3.35 116.57 113.40 3g1p h LYS 112 Ca 0.06 -0.24 -0.59 0.00 -1.87 0.00 0.00 60.65 58.00 3g1p h LYS 112 Cb 0.78 -0.06 -0.41 0.00 0.08 0.00 0.00 32.23 32.62 3g1p h LYS 112 CO 0.06 0.83 -0.77 0.72 -0.57 0.00 0.00 179.45 179.71 3g1p n HIS 113 N -4.16 2.15 0.65 -1.35 8.25 -0.11 -4.95 115.22 115.70 3g1p n HIS 113 Ca 0.01 -3.94 0.13 0.00 -0.26 0.00 0.00 57.72 53.66 3g1p n HIS 113 Cb 0.37 -0.47 0.39 0.00 1.12 0.00 0.00 29.99 31.40 3g1p n HIS 113 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 3g1p n PRO 114 N 1.16 0.25 0.00 -0.41 -0.04 -0.87 -4.68 135.00 130.40 3g1p n PRO 114 Ca 0.26 0.18 0.00 0.00 -0.04 0.00 0.00 63.50 63.91 3g1p n PRO 114 Cb 0.45 -1.77 0.00 0.00 -0.04 0.00 0.00 33.50 32.14 3g1p n PRO 114 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3g1p n GLY 115 N 1.33 3.69 0.13 0.55 0.00 -1.26 -1.35 105.19 108.27 3g1p n GLY 115 Ca 0.05 0.02 0.15 0.00 0.00 0.00 0.00 46.02 46.25 3g1p n GLY 115 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 3g1p n LEU 116 N 0.00 0.43 -4.72 0.99 -0.00 -0.51 -4.83 117.00 108.35 3g1p n LEU 116 Ca 0.00 -0.11 -0.40 0.00 -0.00 0.00 0.00 56.01 55.50 3g1p n LEU 116 Cb 0.00 -0.04 -0.04 0.00 -0.00 0.00 0.00 43.42 43.34 3g1p n LEU 116 CO 0.00 0.07 0.51 -0.76 -0.00 0.00 0.00 177.39 177.21 3g1p s LEU 117 N -2.09 4.38 -0.54 1.47 1.43 -0.46 -0.34 118.68 122.54 3g1p s LEU 117 Ca 0.42 1.43 -0.07 0.00 -1.03 0.00 0.00 54.13 54.88 3g1p s LEU 117 Cb 0.21 -3.29 0.14 0.00 0.03 0.00 0.00 46.19 43.29 3g1p s LEU 117 CO 0.38 -0.11 0.39 -0.62 0.23 0.00 0.00 176.35 176.62 3g1p s ASP 118 N 0.56 5.62 0.00 2.29 2.15 0.18 -4.80 116.67 122.68 3g1p s ASP 118 Ca 0.42 -2.27 0.15 0.00 0.43 0.00 0.00 52.55 51.29 3g1p s ASP 118 Cb -0.20 -1.96 0.67 0.00 -0.30 0.00 0.00 42.92 41.13 3g1p s ASP 118 CO 0.23 -0.57 1.46 0.49 -0.17 0.00 0.00 175.17 176.61 3g1p n PHE 119 N 4.38 0.16 0.48 -5.34 3.72 -1.26 -0.56 117.46 119.03 3g1p n PHE 119 Ca -0.00 -0.08 0.10 0.00 -0.05 0.00 0.00 57.45 57.42 3g1p n PHE 119 Cb 0.41 0.00 0.42 0.00 -0.94 0.00 0.00 39.48 39.37 3g1p n PHE 119 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3g1p n SER 120 N -0.13 0.39 -2.56 4.37 3.41 -1.26 -4.16 113.62 113.68 3g1p n SER 120 Ca 0.12 0.59 -0.25 0.00 -0.26 0.00 0.00 58.87 59.07 3g1p n SER 120 Cb 0.19 -0.67 -0.09 0.00 -0.26 0.00 0.00 64.21 63.37 3g1p n SER 120 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3g1p n HIS 121 N -1.92 1.23 -2.29 7.33 8.25 -1.25 -4.95 115.22 121.63 3g1p n HIS 121 Ca 0.03 -2.06 -0.35 0.00 -0.26 0.00 0.00 57.72 55.08 3g1p n HIS 121 Cb 0.22 -1.70 -0.00 0.00 1.12 0.00 0.00 29.99 29.63 3g1p n HIS 121 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 3g1p s THR 122 N -0.16 3.26 0.41 1.59 -4.23 -1.26 -3.08 115.64 112.16 3g1p s THR 122 Ca 0.63 0.78 0.06 0.00 -1.18 0.00 0.00 61.69 61.98 3g1p s THR 122 Cb 0.30 -3.31 -0.07 0.00 1.34 0.00 0.00 72.50 70.76 3g1p s THR 122 CO -0.09 -0.17 0.02 0.68 -0.54 0.00 0.00 174.62 174.51 3g1p s VAL 123 N -1.81 1.76 0.03 2.29 -7.23 -0.55 -4.87 120.40 110.01 3g1p s VAL 123 Ca 0.72 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.95 3g1p s VAL 123 Cb -0.23 -2.87 -0.02 0.00 0.56 0.00 0.00 36.38 33.82 3g1p s VAL 123 CO 0.26 0.00 -0.17 -1.61 -0.31 0.00 0.00 175.10 173.27 3g1p s GLU 124 N -3.76 1.22 0.01 4.82 2.02 -1.26 -4.42 118.70 117.33 3g1p s GLU 124 Ca 0.32 -0.77 -0.37 0.00 0.02 0.00 0.00 54.97 54.17 3g1p s GLU 124 Cb 0.09 -1.25 -0.16 0.00 0.10 0.00 0.00 34.13 32.91 3g1p s GLU 124 CO 0.16 0.32 1.50 -2.30 0.02 0.00 0.00 175.26 174.97 3g1p n PRO 125 N 2.11 1.39 -1.12 0.39 -0.02 -1.26 -2.01 135.00 134.48 3g1p n PRO 125 Ca -0.17 0.50 -0.04 0.00 -2.02 0.00 0.00 63.50 61.78 3g1p n PRO 125 Cb 0.54 -2.19 -0.02 0.00 -0.02 0.00 0.00 33.50 31.81 3g1p n PRO 125 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3g1p n PHE 126 N 3.57 0.00 -3.65 6.00 3.72 -0.16 -4.96 117.46 121.99 3g1p n PHE 126 Ca 0.20 0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 57.21 3g1p n PHE 126 Cb 0.20 -1.67 -0.12 0.00 -0.94 0.00 0.00 39.48 36.96 3g1p n PHE 126 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 3g1p s VAL 127 N -1.67 4.50 0.30 -4.37 1.01 -0.85 -4.95 120.40 114.36 3g1p s VAL 127 Ca 0.00 -0.66 -0.29 0.00 0.00 0.00 0.00 61.98 61.03 3g1p s VAL 127 Cb 0.00 -3.40 -0.10 0.00 0.00 0.00 0.00 36.38 32.88 3g1p s VAL 127 CO 0.00 -0.07 1.25 -0.69 0.00 0.00 0.00 175.10 175.59 3g1p s VAL 128 N 1.57 3.00 0.22 2.92 1.01 -1.26 -4.40 120.40 123.46 3g1p s VAL 128 Ca 0.03 0.98 0.05 0.00 0.00 0.00 0.00 61.98 63.04 3g1p s VAL 128 Cb -0.18 -3.62 -0.05 0.00 0.00 0.00 0.00 36.38 32.53 3g1p s VAL 128 CO 0.06 0.22 -0.04 0.72 0.00 0.00 0.00 175.10 176.06 3g1p s PHE 129 N -1.00 1.60 -0.17 5.22 -0.12 -0.28 -4.96 117.98 118.27 3g1p s PHE 129 Ca 0.49 -0.83 -0.02 0.00 -0.05 0.00 0.00 56.93 56.52 3g1p s PHE 129 Cb -0.37 -0.90 -0.01 0.00 -0.63 0.00 0.00 43.02 41.11 3g1p s PHE 129 CO 0.48 0.07 -0.10 0.34 -0.05 0.00 0.00 175.22 175.96 3g1p s ASP 130 N -3.31 4.06 -0.44 1.98 2.15 -1.26 -0.47 116.67 119.38 3g1p s ASP 130 Ca 0.26 -0.38 -0.02 0.00 0.43 0.00 0.00 52.55 52.85 3g1p s ASP 130 Cb 0.04 -1.65 0.12 0.00 -0.30 0.00 0.00 42.92 41.13 3g1p s ASP 130 CO 0.08 0.08 0.23 -0.76 -0.17 0.00 0.00 175.17 174.63 3g1p s LEU 131 N 0.86 5.14 -1.64 -1.34 1.43 0.15 -4.75 118.68 118.54 3g1p s LEU 131 Ca -0.03 -2.24 -0.14 0.00 -1.03 0.00 0.00 54.13 50.70 3g1p s LEU 131 Cb -0.15 -1.80 0.12 0.00 0.03 0.00 0.00 46.19 44.39 3g1p s LEU 131 CO 0.00 -0.48 0.66 0.00 0.23 0.00 0.00 176.35 176.76 3g1p n GLN 132 N 4.28 -2.99 0.00 1.70 3.00 -1.26 -0.87 117.38 121.25 3g1p n GLN 132 Ca 0.01 0.36 0.00 0.00 -0.01 0.00 0.00 57.00 57.35 3g1p n GLN 132 Cb 0.40 -4.87 0.00 0.00 0.00 0.00 0.00 30.24 25.77 3g1p n GLN 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3g1p n GLY 133 N -1.59 3.07 3.71 1.08 0.00 -1.26 -4.97 105.19 105.23 3g1p n GLY 133 Ca -0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 3g1p n GLY 133 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3g1p s LEU 134 N 0.00 4.36 -0.23 0.99 2.96 -0.05 -4.92 118.68 121.79 3g1p s LEU 134 Ca 0.00 1.81 -0.19 0.00 -0.22 0.00 0.00 54.13 55.53 3g1p s LEU 134 Cb 0.00 -3.57 -0.03 0.00 0.50 0.00 0.00 46.19 43.09 3g1p s LEU 134 CO 0.00 -0.38 0.56 -1.10 -1.32 0.00 0.00 176.35 174.11 3g1p s GLN 135 N 1.17 4.13 -0.12 1.98 -1.52 -0.35 -0.68 119.66 124.27 3g1p s GLN 135 Ca 0.55 0.44 0.03 0.00 -1.95 0.00 0.00 55.36 54.43 3g1p s GLN 135 Cb -0.25 -3.61 0.00 0.00 -0.22 0.00 0.00 33.01 28.93 3g1p s GLN 135 CO 0.28 -0.29 -0.22 0.08 -0.25 0.00 0.00 175.29 174.89 3g1p s VAL 136 N 2.10 2.16 -0.21 1.09 1.01 0.38 -0.39 120.40 126.55 3g1p s VAL 136 Ca 0.24 -0.96 0.00 0.00 0.00 0.00 0.00 61.98 61.26 3g1p s VAL 136 Cb -0.16 -1.85 0.02 0.00 0.00 0.00 0.00 36.38 34.39 3g1p s VAL 136 CO 0.09 0.55 -0.14 -0.89 0.00 0.00 0.00 175.10 174.71 3g1p s THR 137 N 0.59 2.39 0.28 3.92 2.01 -0.12 -1.12 115.64 123.59 3g1p s THR 137 Ca -0.12 -0.97 -0.29 0.00 0.31 0.00 0.00 61.69 60.61 3g1p s THR 137 Cb -0.17 -2.10 -0.10 0.00 0.01 0.00 0.00 72.50 70.15 3g1p s THR 137 CO 0.03 0.40 1.23 -2.84 -0.69 0.00 0.00 174.62 172.75 3g1p s PRO 138 N 1.30 4.47 -0.17 4.92 0.02 -1.26 -1.12 135.00 143.16 3g1p s PRO 138 Ca 0.03 2.02 0.00 0.00 0.02 0.00 0.00 61.00 63.07 3g1p s PRO 138 Cb -0.15 -3.15 0.04 0.00 0.02 0.00 0.00 34.50 31.26 3g1p s PRO 138 CO -0.09 -0.06 -0.09 -0.51 -0.33 0.00 0.00 177.00 175.92 3g1p s LEU 139 N -1.25 1.81 0.34 -5.54 1.43 0.68 -0.99 118.68 115.17 3g1p s LEU 139 Ca 0.49 -0.67 -0.29 0.00 -1.03 0.00 0.00 54.13 52.64 3g1p s LEU 139 Cb -0.36 -1.07 -0.11 0.00 0.03 0.00 0.00 46.19 44.69 3g1p s LEU 139 CO 0.45 -0.14 1.48 -2.84 0.23 0.00 0.00 176.35 175.53 3g1p s PRO 140 N 1.53 4.16 0.43 1.29 0.02 -1.26 -0.37 135.00 140.80 3g1p s PRO 140 Ca 0.01 2.51 0.07 0.00 0.02 0.00 0.00 61.00 63.61 3g1p s PRO 140 Cb -0.15 -3.00 -0.05 0.00 0.02 0.00 0.00 34.50 31.32 3g1p s PRO 140 CO -0.09 -0.50 0.14 -0.51 -0.33 0.00 0.00 177.00 175.72 3g1p s LEU 141 N -1.60 2.95 -0.52 -5.54 1.43 -0.50 -4.50 118.68 110.40 3g1p s LEU 141 Ca 0.55 -1.21 -0.13 0.00 -1.03 0.00 0.00 54.13 52.31 3g1p s LEU 141 Cb -0.46 -1.23 0.13 0.00 0.03 0.00 0.00 46.19 44.66 3g1p s LEU 141 CO 0.57 -0.59 0.44 0.21 0.23 0.00 0.00 176.35 177.21 3g1p s ASN 142 N -3.89 5.98 0.20 2.29 2.47 -1.26 -4.69 114.94 116.05 3g1p s ASN 142 Ca 0.36 -1.87 -0.19 0.00 0.42 0.00 0.00 52.86 51.58 3g1p s ASN 142 Cb 0.05 -2.12 0.03 0.00 -1.45 0.00 0.00 41.25 37.76 3g1p s ASN 142 CO 0.20 -0.78 0.56 -2.28 -3.72 0.00 0.00 177.10 171.08 3g1p s HIS 143 N 1.45 -0.19 -0.66 0.43 2.46 -1.26 -0.89 115.29 116.63 3g1p s HIS 143 Ca 0.05 -0.15 0.24 0.00 0.47 0.00 0.00 55.06 55.66 3g1p s HIS 143 Cb -0.28 0.46 0.91 0.00 -0.13 0.00 0.00 32.58 33.54 3g1p s HIS 143 CO 0.01 -0.95 1.72 -1.13 -2.47 0.00 0.00 174.74 171.91 3g1p n SER 144 N -0.36 0.57 -4.53 9.88 3.41 -1.26 -4.63 113.62 116.70 3g1p n SER 144 Ca -0.10 0.61 -0.25 0.00 -0.26 0.00 0.00 58.87 58.87 3g1p n SER 144 Cb 0.62 -0.74 -0.09 0.00 -0.26 0.00 0.00 64.21 63.74 3g1p n SER 144 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3g1p s LYS 145 N -3.19 1.90 -0.16 4.33 1.02 -1.26 -5.07 119.74 117.30 3g1p s LYS 145 Ca 0.07 -1.52 -0.33 0.00 0.02 0.00 0.00 55.97 54.21 3g1p s LYS 145 Cb 0.11 -1.97 -0.11 0.00 -0.52 0.00 0.00 37.83 35.34 3g1p s LYS 145 CO 0.44 0.38 2.00 -0.11 -0.92 0.00 0.00 175.35 177.14 3g1p n LEU 146 N -0.38 3.17 -3.83 3.17 7.94 -1.26 -4.93 117.00 120.87 3g1p n LEU 146 Ca -0.08 0.74 -0.18 0.00 -1.11 0.00 0.00 56.01 55.38 3g1p n LEU 146 Cb 0.58 -1.38 -0.16 0.00 0.53 0.00 0.00 43.42 42.99 3g1p n LEU 146 CO 0.36 -0.28 -0.38 -0.89 -1.11 0.00 0.00 177.39 175.09 3g1p s THR 147 N 5.41 0.24 -0.07 1.96 2.01 -1.26 -4.58 115.64 119.35 3g1p s THR 147 Ca 0.97 0.05 0.02 0.00 0.31 0.00 0.00 61.69 63.05 3g1p s THR 147 Cb -0.67 -0.32 -0.02 0.00 0.01 0.00 0.00 72.50 71.50 3g1p s THR 147 CO 0.49 0.16 -0.13 -0.36 -0.69 0.00 0.00 174.62 174.08 3g1p s PHE 148 N 1.01 2.76 0.71 4.92 0.08 -0.31 -1.41 117.98 125.74 3g1p s PHE 148 Ca -0.10 -0.26 0.02 0.00 0.12 0.00 0.00 56.93 56.71 3g1p s PHE 148 Cb -0.14 -1.70 0.13 0.00 -0.57 0.00 0.00 43.02 40.75 3g1p s PHE 148 CO -0.01 0.10 0.98 0.20 -0.10 0.00 0.00 175.22 176.38 3g1p s GLY 149 N -0.45 1.74 -0.01 4.36 0.00 0.50 -4.37 107.32 109.08 3g1p s GLY 149 Ca 0.06 -1.90 -0.01 0.00 0.00 0.00 0.00 44.72 42.87 3g1p s GLY 149 CO 0.02 -1.32 0.03 -0.19 0.00 0.00 0.00 173.10 171.65 3g1p s TYR 150 N -3.08 -0.03 -0.11 1.90 2.02 -0.35 -0.23 117.35 117.48 3g1p s TYR 150 Ca 0.67 0.10 -0.17 0.00 -0.37 0.00 0.00 57.07 57.30 3g1p s TYR 150 Cb -0.05 -0.04 -0.04 0.00 -0.40 0.00 0.00 41.96 41.43 3g1p s TYR 150 CO 0.44 -0.03 0.44 -1.17 -1.57 0.00 0.00 175.55 173.65 3g1p s LEU 151 N 0.25 4.30 -0.17 -1.29 2.96 -0.28 -0.35 118.68 124.10 3g1p s LEU 151 Ca -0.02 0.78 -0.01 0.00 -0.22 0.00 0.00 54.13 54.66 3g1p s LEU 151 Cb -0.03 -2.62 -0.01 0.00 0.50 0.00 0.00 46.19 44.03 3g1p s LEU 151 CO -0.01 0.06 -0.11 -0.76 -1.32 0.00 0.00 176.35 174.22 3g1p s LEU 152 N 0.36 2.70 -0.02 -0.68 1.43 0.79 -0.95 118.68 122.31 3g1p s LEU 152 Ca 0.24 -0.39 0.01 0.00 -1.03 0.00 0.00 54.13 52.96 3g1p s LEU 152 Cb -0.15 -1.64 0.01 0.00 0.03 0.00 0.00 46.19 44.44 3g1p s LEU 152 CO 0.10 0.08 -0.03 -0.70 0.23 0.00 0.00 176.35 176.02 3g1p s GLU 153 N 0.85 0.42 -0.07 1.70 2.12 0.48 -0.91 118.70 123.29 3g1p s GLU 153 Ca -0.03 -0.09 -0.03 0.00 0.36 0.00 0.00 54.97 55.17 3g1p s GLU 153 Cb -0.15 -0.46 0.04 0.00 0.26 0.00 0.00 34.13 33.82 3g1p s GLU 153 CO 0.00 0.01 0.16 -0.08 -0.54 0.00 0.00 175.26 174.81 3g1p s THR 154 N 0.33 -0.05 -1.33 -1.70 -1.32 -0.67 -1.21 115.64 109.68 3g1p s THR 154 Ca -0.03 0.17 -0.09 0.00 -1.21 0.00 0.00 61.69 60.53 3g1p s THR 154 Cb -0.07 -0.25 0.00 0.00 -1.51 0.00 0.00 72.50 70.67 3g1p s THR 154 CO -0.00 0.07 0.50 0.00 -2.21 0.00 0.00 174.62 172.97 3g1p n ALA 155 N 4.13 -2.20 -0.84 11.08 0.00 -1.26 -0.59 120.51 130.83 3g1p n ALA 155 Ca -0.25 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 52.88 3g1p n ALA 155 Cb 0.52 -2.19 0.00 0.00 0.00 0.00 0.00 19.45 17.79 3g1p n ALA 155 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3g1p n HIS 156 N -4.43 0.00 -3.33 0.00 -0.00 -1.26 -4.94 115.22 101.27 3g1p n HIS 156 Ca -0.24 0.00 -0.39 0.00 -0.00 0.00 0.00 57.72 57.09 3g1p n HIS 156 Cb 0.65 -1.79 -0.07 0.00 -0.00 0.00 0.00 29.99 28.78 3g1p n HIS 156 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.34 175.22 3g1p s SER 157 N -1.81 6.50 -0.07 0.41 0.01 0.24 -5.00 113.70 113.99 3g1p s SER 157 Ca 0.00 0.60 0.03 0.00 1.31 0.00 0.00 55.95 57.89 3g1p s SER 157 Cb 0.00 -2.26 0.00 0.00 0.21 0.00 0.00 66.02 63.98 3g1p s SER 157 CO 0.00 -0.11 -0.17 -0.13 0.41 0.00 0.00 173.24 173.24 3g1p s ARG 158 N 1.39 2.04 -0.07 12.44 0.52 -1.26 -1.68 118.95 132.33 3g1p s ARG 158 Ca 0.21 -0.58 0.04 0.00 -0.52 0.00 0.00 55.73 54.88 3g1p s ARG 158 Cb -0.15 -1.66 0.00 0.00 0.52 0.00 0.00 34.95 33.66 3g1p s ARG 158 CO 0.09 0.13 -0.20 0.08 0.02 0.00 0.00 175.30 175.42 3g1p s VAL 159 N 0.39 1.67 -0.13 3.52 1.01 -0.09 -1.25 120.40 125.53 3g1p s VAL 159 Ca -0.12 -0.82 -0.04 0.00 0.00 0.00 0.00 61.98 61.00 3g1p s VAL 159 Cb -0.15 -1.45 -0.03 0.00 0.00 0.00 0.00 36.38 34.75 3g1p s VAL 159 CO 0.04 0.47 0.01 0.00 0.00 0.00 0.00 175.10 175.63 3g1p s ALA 160 N 0.26 3.24 -0.36 5.51 0.00 -0.46 -0.15 121.76 129.80 3g1p s ALA 160 Ca -0.11 -0.79 -0.05 0.00 0.00 0.00 0.00 51.96 51.00 3g1p s ALA 160 Cb -0.15 -1.61 0.06 0.00 0.00 0.00 0.00 23.12 21.42 3g1p s ALA 160 CO 0.05 0.39 0.12 -0.46 0.00 0.00 0.00 175.76 175.86 3g1p s TRP 161 N -0.24 3.32 -0.60 0.00 -0.11 0.53 -0.51 118.94 121.33 3g1p s TRP 161 Ca 0.06 -1.69 0.06 0.00 1.22 0.00 0.00 56.10 55.75 3g1p s TRP 161 Cb -0.12 -2.51 0.21 0.00 -1.50 0.00 0.00 33.47 29.55 3g1p s TRP 161 CO 0.02 -0.80 0.59 1.28 -4.62 0.00 0.00 176.95 173.41 3g1p n LEU 162 N 4.76 2.53 -3.86 5.86 4.77 0.69 -1.21 117.00 130.54 3g1p n LEU 162 Ca -0.11 -5.14 -0.11 0.00 -0.03 0.00 0.00 56.01 50.62 3g1p n LEU 162 Cb 0.44 -0.38 -0.11 0.00 -2.33 0.00 0.00 43.42 41.04 3g1p n LEU 162 CO 0.32 1.94 -0.20 -0.55 -1.33 0.00 0.00 177.39 177.57 3g1p s SER 163 N -1.67 -0.02 0.08 -1.43 0.15 -1.26 -1.03 113.70 108.51 3g1p s SER 163 Ca 0.33 -0.04 -0.13 0.00 0.70 0.00 0.00 55.95 56.81 3g1p s SER 163 Cb 0.08 0.23 -0.06 0.00 -1.71 0.00 0.00 66.02 64.56 3g1p s SER 163 CO -0.10 -0.24 0.46 -1.81 1.20 0.00 0.00 173.24 172.74 3g1p s ASP 164 N -0.84 6.77 -0.08 5.45 1.01 -1.26 -4.71 116.67 123.01 3g1p s ASP 164 Ca -0.09 0.95 -0.30 0.00 0.71 0.00 0.00 52.55 53.81 3g1p s ASP 164 Cb -0.05 -2.24 0.09 0.00 1.01 0.00 0.00 42.92 41.73 3g1p s ASP 164 CO 0.01 0.20 0.79 0.28 0.21 0.00 0.00 175.17 176.66 3g1p s THR 165 N -1.31 0.00 -0.25 -1.27 -1.32 -1.24 -4.57 115.64 105.67 3g1p s THR 165 Ca 0.32 0.00 0.01 0.00 -1.21 0.00 0.00 61.69 60.80 3g1p s THR 165 Cb -0.15 -1.00 0.04 0.00 -1.51 0.00 0.00 72.50 69.88 3g1p s THR 165 CO 0.17 0.00 -0.09 0.00 -2.21 0.00 0.00 174.62 172.49 3g1p s ALA 166 N -1.29 2.61 0.03 11.08 0.00 -0.07 -1.39 121.76 132.73 3g1p s ALA 166 Ca -0.07 -1.60 0.00 0.00 0.00 0.00 0.00 51.96 50.29 3g1p s ALA 166 Cb -0.00 -1.61 0.00 0.00 0.00 0.00 0.00 23.12 21.51 3g1p s ALA 166 CO 0.06 -0.97 0.00 0.41 0.00 0.00 0.00 175.76 175.26 3g1p n GLY 167 N 4.56 -0.91 3.77 0.00 0.00 -1.26 -4.55 105.19 106.80 3g1p n GLY 167 Ca -0.16 -0.03 -0.38 0.00 0.00 0.00 0.00 46.02 45.46 3g1p n GLY 167 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3g1p s LEU 168 N -0.09 4.12 0.62 0.99 1.43 -1.26 -4.54 118.68 119.95 3g1p s LEU 168 Ca 0.00 2.40 -0.18 0.00 -1.03 0.00 0.00 54.13 55.32 3g1p s LEU 168 Cb 0.00 -4.09 -0.04 0.00 0.03 0.00 0.00 46.19 42.09 3g1p s LEU 168 CO 0.00 -0.83 1.01 -2.65 0.23 0.00 0.00 176.35 174.11 3g1p n PRO 169 N -0.16 0.90 -0.17 1.29 -0.02 -1.26 -4.70 135.00 130.87 3g1p n PRO 169 Ca 0.05 0.35 -0.03 0.00 -2.02 0.00 0.00 63.50 61.85 3g1p n PRO 169 Cb 0.46 -2.22 0.06 0.00 -0.02 0.00 0.00 33.50 31.79 3g1p n PRO 169 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3g1p h GLU 170 N 0.44 0.47 -0.50 -0.52 4.39 -1.96 0.55 114.58 117.45 3g1p h GLU 170 Ca -0.49 -0.03 -0.06 0.00 0.34 0.00 0.00 59.36 59.13 3g1p h GLU 170 Cb 1.36 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 29.88 3g1p h GLU 170 CO 0.51 0.31 0.09 -0.22 -1.16 0.00 0.00 179.01 178.54 3g1p h LYS 171 N 0.49 0.78 -0.22 2.33 3.64 -1.97 0.23 116.57 121.85 3g1p h LYS 171 Ca 0.24 -0.17 -0.08 0.00 -1.27 0.00 0.00 60.65 59.37 3g1p h LYS 171 Cb 0.18 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 31.88 3g1p h LYS 171 CO -0.18 0.73 -0.19 1.15 -2.27 0.00 0.00 179.45 178.69 3g1p h THR 172 N 0.75 1.32 -0.36 1.00 2.02 -1.68 -0.49 112.91 115.46 3g1p h THR 172 Ca 0.16 -1.33 0.04 0.00 0.77 0.00 0.00 66.41 66.06 3g1p h THR 172 Cb 0.33 1.68 -0.04 0.00 -1.74 0.00 0.00 68.15 68.38 3g1p h THR 172 CO 0.00 0.41 0.14 0.25 0.37 0.00 0.00 175.52 176.69 3g1p h LEU 173 N 0.22 0.16 -0.41 2.58 5.85 -0.64 -0.77 115.31 122.29 3g1p h LEU 173 Ca 0.04 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 3g1p h LEU 173 Cb 0.72 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.75 3g1p h LEU 173 CO 0.05 0.13 0.19 0.50 -0.34 0.00 0.00 178.44 178.96 3g1p h LYS 174 N 0.29 0.59 -0.62 1.25 3.64 -0.93 -1.14 116.57 119.65 3g1p h LYS 174 Ca 0.16 -0.09 0.04 0.00 -1.27 0.00 0.00 60.65 59.49 3g1p h LYS 174 Cb 0.13 -0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 31.80 3g1p h LYS 174 CO -0.16 0.52 0.37 0.35 -2.27 0.00 0.00 179.45 178.26 3g1p h PHE 175 N 0.52 0.68 -0.46 1.91 3.57 -0.83 -0.99 116.94 121.34 3g1p h PHE 175 Ca 0.14 0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.56 3g1p h PHE 175 Cb 0.13 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.64 3g1p h PHE 175 CO -0.01 0.37 -0.11 -0.07 -2.23 0.00 0.00 178.31 176.25 3g1p h LEU 176 N 0.71 0.83 -0.98 0.59 3.38 -0.84 0.36 115.31 119.36 3g1p h LEU 176 Ca 0.26 -0.26 0.02 0.00 0.09 0.00 0.00 57.88 58.00 3g1p h LEU 176 Cb 0.08 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.55 3g1p h LEU 176 CO -0.13 0.96 0.65 -0.09 0.09 0.00 0.00 178.44 179.92 3g1p h ARG 177 N 0.75 1.25 0.00 1.13 2.43 -0.69 -2.60 114.38 116.66 3g1p h ARG 177 Ca 0.12 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 3g1p h ARG 177 Cb 0.62 -0.28 0.00 0.00 -0.42 0.00 0.00 29.97 29.88 3g1p h ARG 177 CO 0.04 0.83 -0.25 0.09 -1.51 0.00 0.00 179.97 179.17 3g1p n ASN 178 N -4.43 0.32 -2.98 -3.80 3.02 -0.42 -3.86 115.26 103.10 3g1p n ASN 178 Ca 0.12 0.18 -0.21 0.00 -0.03 0.00 0.00 54.58 54.65 3g1p n ASN 178 Cb 0.05 -0.17 -0.02 0.00 -0.61 0.00 0.00 39.78 39.03 3g1p n ASN 178 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3g1p n ASN 179 N -1.61 2.46 -4.69 6.41 3.02 0.06 -5.07 115.26 115.84 3g1p n ASN 179 Ca 0.06 -3.26 -0.55 0.00 -0.03 0.00 0.00 54.58 50.80 3g1p n ASN 179 Cb 0.35 -0.58 -0.07 0.00 -0.61 0.00 0.00 39.78 38.88 3g1p n ASN 179 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 3g1p n GLN 180 N -0.00 1.38 -2.67 3.52 7.27 -1.01 -4.81 117.38 121.05 3g1p n GLN 180 Ca 0.26 0.50 -0.40 0.00 0.07 0.00 0.00 57.00 57.43 3g1p n GLN 180 Cb 0.59 -2.25 -0.05 0.00 2.41 0.00 0.00 30.24 30.94 3g1p n GLN 180 CO 0.00 0.00 0.00 -2.14 0.07 0.00 0.00 177.06 174.99 3g1p s PRO 181 N 3.90 4.76 0.38 3.69 0.02 -1.26 -4.79 135.00 141.69 3g1p s PRO 181 Ca 0.98 1.57 0.14 0.00 0.02 0.00 0.00 61.00 63.70 3g1p s PRO 181 Cb -0.97 -3.28 0.74 0.00 0.02 0.00 0.00 34.50 31.00 3g1p s PRO 181 CO 0.62 0.35 1.83 1.96 -0.33 0.00 0.00 177.00 181.42 3g1p h GLN 182 N 4.50 0.00 -3.70 5.54 7.50 -1.52 -3.37 115.11 124.05 3g1p h GLN 182 Ca -0.45 0.00 -0.28 0.00 0.50 0.00 0.00 58.65 58.42 3g1p h GLN 182 Cb 1.21 0.00 -0.31 0.00 0.05 0.00 0.00 27.48 28.43 3g1p h GLN 182 CO 0.69 0.37 -0.73 0.08 -1.50 0.00 0.00 178.83 177.74 3g1p s VAL 183 N -4.14 0.04 -0.13 -0.54 1.01 -1.16 -3.14 120.40 112.33 3g1p s VAL 183 Ca -0.03 0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.02 3g1p s VAL 183 Cb 0.14 -0.10 0.02 0.00 0.00 0.00 0.00 36.38 36.44 3g1p s VAL 183 CO 0.72 0.06 -0.11 -0.32 0.00 0.00 0.00 175.10 175.45 3g1p s MET 184 N 0.51 1.92 -0.31 2.72 1.75 -0.42 -1.35 119.30 124.12 3g1p s MET 184 Ca -0.04 -0.41 -0.15 0.00 -1.25 0.00 0.00 55.69 53.83 3g1p s MET 184 Cb -0.07 -1.84 -0.02 0.00 2.84 0.00 0.00 34.83 35.73 3g1p s MET 184 CO -0.01 -0.24 0.37 0.08 -0.65 0.00 0.00 175.02 174.57 3g1p s VAL 185 N 1.57 5.16 -0.07 10.11 1.01 0.33 -0.30 120.40 138.22 3g1p s VAL 185 Ca 0.04 0.32 0.02 0.00 0.00 0.00 0.00 61.98 62.37 3g1p s VAL 185 Cb -0.13 -3.76 0.01 0.00 0.00 0.00 0.00 36.38 32.50 3g1p s VAL 185 CO -0.09 0.03 -0.12 -0.32 0.00 0.00 0.00 175.10 174.60 3g1p s MET 186 N 2.07 1.67 -0.05 2.72 0.00 -0.21 -0.22 119.30 125.27 3g1p s MET 186 Ca 0.14 -0.40 -0.33 0.00 0.00 0.00 0.00 55.69 55.10 3g1p s MET 186 Cb -0.16 -1.39 -0.11 0.00 0.00 0.00 0.00 34.83 33.17 3g1p s MET 186 CO 0.11 0.02 1.91 -3.47 0.00 0.00 0.00 175.02 173.59 3g1p n ASP 187 N 3.84 3.69 -3.36 1.11 -0.08 -0.20 -0.85 116.55 120.70 3g1p n ASP 187 Ca -0.23 0.95 -0.26 0.00 -1.51 0.00 0.00 54.79 53.74 3g1p n ASP 187 Cb 0.52 -1.42 -0.09 0.00 2.34 0.00 0.00 41.12 42.46 3g1p n ASP 187 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3g1p h SER 189 N 5.57 0.70 -3.64 0.00 0.02 -1.42 -3.39 113.55 111.39 3g1p h SER 189 Ca 0.26 -0.21 -0.67 0.00 -0.84 0.00 0.00 61.79 60.32 3g1p h SER 189 Cb 0.92 -0.19 -0.17 0.00 0.14 0.00 0.00 62.40 63.10 3g1p h SER 189 CO 0.36 0.86 -0.74 -1.00 -1.14 0.00 0.00 176.83 175.16 3g1p s HIS 190 N -4.74 2.74 1.11 3.45 3.76 -1.03 -1.96 115.29 118.62 3g1p s HIS 190 Ca -0.09 -0.15 -0.13 0.00 -0.15 0.00 0.00 55.06 54.55 3g1p s HIS 190 Cb 0.14 -1.48 0.25 0.00 1.11 0.00 0.00 32.58 32.61 3g1p s HIS 190 CO 0.81 0.38 1.05 -1.25 -0.85 0.00 0.00 174.74 174.89 3g1p s PRO 191 N -1.90 -0.49 0.26 8.40 0.04 -1.26 -1.96 135.00 138.08 3g1p s PRO 191 Ca 0.19 0.65 -0.31 0.00 0.04 0.00 0.00 61.00 61.58 3g1p s PRO 191 Cb -0.11 -1.62 -0.13 0.00 0.04 0.00 0.00 34.50 32.68 3g1p s PRO 191 CO 0.11 -3.39 1.49 -0.35 0.04 0.00 0.00 177.00 174.90 3g1p n PRO 192 N -4.65 2.30 -4.31 0.56 -0.04 -1.26 -4.02 135.00 123.57 3g1p n PRO 192 Ca 0.03 0.82 -0.21 0.00 -0.04 0.00 0.00 63.50 64.10 3g1p n PRO 192 Cb 0.56 -2.53 -0.11 0.00 -0.04 0.00 0.00 33.50 31.38 3g1p n PRO 192 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3g1p s ARG 193 N -0.37 1.20 0.50 0.54 1.81 -1.26 -4.95 118.95 116.42 3g1p s ARG 193 Ca 0.67 -1.33 0.29 0.00 -1.72 0.00 0.00 55.73 53.64 3g1p s ARG 193 Cb -0.59 -1.26 1.07 0.00 -0.45 0.00 0.00 34.95 33.72 3g1p s ARG 193 CO 0.48 0.26 1.88 0.00 -0.68 0.00 0.00 175.30 177.24 3g1p h ALA 194 N 3.44 1.00 -3.95 2.13 0.00 -2.05 -3.44 119.26 116.39 3g1p h ALA 194 Ca -0.42 -0.08 -0.48 0.00 0.00 0.00 0.00 54.91 53.93 3g1p h ALA 194 Cb 1.20 -0.01 -0.26 0.00 0.00 0.00 0.00 17.79 18.71 3g1p h ALA 194 CO 0.49 0.11 -0.81 -0.51 0.00 0.00 0.00 179.25 178.53 3g1p s ASP 195 N -5.94 1.81 -0.00 0.00 1.01 -1.26 -5.11 116.67 107.18 3g1p s ASP 195 Ca 0.02 -0.41 -0.30 0.00 0.71 0.00 0.00 52.55 52.57 3g1p s ASP 195 Cb 0.09 -0.15 -0.06 0.00 1.01 0.00 0.00 42.92 43.81 3g1p s ASP 195 CO 0.59 0.10 1.56 0.00 0.21 0.00 0.00 175.17 177.63 3g1p s ALA 196 N -0.68 3.63 0.84 5.23 0.00 -1.26 -4.96 121.76 124.55 3g1p s ALA 196 Ca 0.04 0.98 -0.11 0.00 0.00 0.00 0.00 51.96 52.87 3g1p s ALA 196 Cb -0.07 -3.68 0.10 0.00 0.00 0.00 0.00 23.12 19.47 3g1p s ALA 196 CO 0.01 -1.15 1.09 -2.14 0.00 0.00 0.00 175.76 173.57 3g1p s PRO 197 N 3.08 1.67 0.04 0.00 0.02 -1.26 -5.00 135.00 133.55 3g1p s PRO 197 Ca 0.70 0.99 -0.19 0.00 0.02 0.00 0.00 61.00 62.52 3g1p s PRO 197 Cb -0.34 -1.84 -0.17 0.00 0.02 0.00 0.00 34.50 32.17 3g1p s PRO 197 CO 0.29 -2.00 1.26 -0.09 -0.33 0.00 0.00 177.00 176.12 3g1p h ARG 198 N -1.38 0.45 0.00 5.54 2.43 -1.97 -3.40 114.38 116.05 3g1p h ARG 198 Ca -0.47 -0.32 0.00 0.00 -0.81 0.00 0.00 59.98 58.38 3g1p h ARG 198 Cb 1.26 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.86 3g1p h ARG 198 CO 0.53 0.94 -0.53 0.09 -1.51 0.00 0.00 179.97 179.49 3g1p n ASN 199 N -4.36 0.99 -3.79 -3.80 4.13 -1.26 -4.57 115.26 102.60 3g1p n ASN 199 Ca -0.07 -0.51 -0.13 0.00 1.68 0.00 0.00 54.58 55.55 3g1p n ASN 199 Cb 0.51 1.07 -0.11 0.00 -1.54 0.00 0.00 39.78 39.71 3g1p n ASN 199 CO 0.00 0.00 0.00 -1.00 0.28 0.00 0.00 177.26 176.54 3g1p s HIS 200 N -1.80 -0.21 0.63 3.10 3.76 -1.25 -3.44 115.29 116.08 3g1p s HIS 200 Ca 0.01 0.47 -0.17 0.00 -0.15 0.00 0.00 55.06 55.23 3g1p s HIS 200 Cb 0.05 0.07 -0.01 0.00 1.11 0.00 0.00 32.58 33.80 3g1p s HIS 200 CO 0.27 -0.22 1.16 0.00 -0.85 0.00 0.00 174.74 175.10 3g1p s ASP 202 N -2.04 5.39 0.23 0.00 -4.77 -1.26 -1.89 116.67 112.34 3g1p s ASP 202 Ca 0.72 -0.59 -0.06 0.00 -3.30 0.00 0.00 52.55 49.32 3g1p s ASP 202 Cb -0.25 -0.48 0.30 0.00 -1.09 0.00 0.00 42.92 41.39 3g1p s ASP 202 CO 0.37 -0.81 1.85 0.25 0.70 0.00 0.00 175.17 177.53 3g1p h LEU 203 N 0.69 0.82 -1.34 2.11 5.85 -1.53 -2.05 115.31 119.86 3g1p h LEU 203 Ca -0.39 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.33 3g1p h LEU 203 Cb 1.28 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 42.12 3g1p h LEU 203 CO 0.48 0.53 0.25 0.78 -0.34 0.00 0.00 178.44 180.14 3g1p h ASN 204 N 0.95 0.62 -0.38 1.25 2.35 -1.88 -0.99 115.58 117.51 3g1p h ASN 204 Ca 0.35 -0.05 -0.06 0.00 -0.55 0.00 0.00 56.30 55.99 3g1p h ASN 204 Cb 0.13 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.33 3g1p h ASN 204 CO -0.16 0.53 -0.01 0.74 -1.65 0.00 0.00 177.43 176.88 3g1p h THR 205 N 0.70 1.26 -0.85 2.81 2.02 -1.76 -1.68 112.91 115.41 3g1p h THR 205 Ca 0.18 -1.01 -0.02 0.00 0.77 0.00 0.00 66.41 66.32 3g1p h THR 205 Cb 0.06 1.17 -0.04 0.00 -1.74 0.00 0.00 68.15 67.60 3g1p h THR 205 CO -0.03 0.34 0.44 0.58 0.37 0.00 0.00 175.52 177.22 3g1p h VAL 206 N 0.49 1.26 -0.57 3.16 2.07 -0.94 -0.20 116.25 121.52 3g1p h VAL 206 Ca 0.11 -0.68 -0.04 0.00 0.82 0.00 0.00 66.70 66.91 3g1p h VAL 206 Cb 0.48 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.36 3g1p h VAL 206 CO 0.02 0.30 0.19 -0.07 0.02 0.00 0.00 177.57 178.03 3g1p h LEU 207 N 1.20 0.82 -0.55 2.57 3.38 -1.06 -1.06 115.31 120.61 3g1p h LEU 207 Ca 0.30 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 3g1p h LEU 207 Cb 0.08 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 3g1p h LEU 207 CO -0.04 0.80 0.32 0.00 0.09 0.00 0.00 178.44 179.60 3g1p h ALA 208 N 1.05 0.71 -0.77 1.53 0.00 -0.80 -2.40 119.26 118.57 3g1p h ALA 208 Ca 0.19 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 3g1p h ALA 208 Cb 0.26 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 3g1p h ALA 208 CO -0.01 0.21 0.29 -0.07 0.00 0.00 0.00 179.25 179.67 3g1p h LEU 209 N 0.75 1.08 -0.10 0.00 3.38 -0.69 -2.59 115.31 117.14 3g1p h LEU 209 Ca 0.20 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3g1p h LEU 209 Cb 0.01 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.48 3g1p h LEU 209 CO -0.03 0.97 0.00 -3.20 0.09 0.00 0.00 178.44 176.26 3g1p n ASN 210 N -4.27 0.40 0.22 -0.43 5.15 -0.43 -1.51 115.26 114.39 3g1p n ASN 210 Ca 0.07 0.55 0.08 0.00 -0.60 0.00 0.00 54.58 54.68 3g1p n ASN 210 Cb 0.20 -0.65 0.48 0.00 -0.53 0.00 0.00 39.78 39.28 3g1p n ASN 210 CO 0.00 0.00 0.00 1.56 1.40 0.00 0.00 177.26 180.22 3g1p h GLN 211 N 0.00 0.00 0.07 1.20 1.08 -1.02 0.21 115.11 116.65 3g1p h GLN 211 Ca 0.00 0.00 -0.27 0.00 -1.45 0.00 0.00 58.65 56.93 3g1p h GLN 211 Cb 0.54 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.95 3g1p h GLN 211 CO 0.00 0.27 -1.45 0.28 -0.95 0.00 0.00 178.83 176.98 3g1p h VAL 212 N 0.00 0.91 0.15 -0.54 2.07 -1.39 -3.40 116.25 114.05 3g1p h VAL 212 Ca -0.00 -2.30 -0.31 0.00 0.82 0.00 0.00 66.70 64.91 3g1p h VAL 212 Cb 0.65 2.50 0.03 0.00 -1.52 0.00 0.00 31.29 32.95 3g1p h VAL 212 CO 0.03 0.60 -1.30 0.40 0.02 0.00 0.00 177.57 177.33 3g1p h ILE 213 N -0.50 1.30 -3.49 4.57 2.04 -1.29 -3.44 117.51 116.69 3g1p h ILE 213 Ca -0.34 -2.56 -0.30 0.00 1.00 0.00 0.00 64.86 62.66 3g1p h ILE 213 Cb 1.63 2.78 0.05 0.00 -0.74 0.00 0.00 36.82 40.54 3g1p h ILE 213 CO -0.04 0.77 -0.46 0.54 0.00 0.00 0.00 178.15 178.97 3g1p n ARG 214 N -3.75 -3.76 -2.10 2.37 1.74 0.73 -4.68 116.66 107.20 3g1p n ARG 214 Ca -0.14 0.68 -0.42 0.00 -0.77 0.00 0.00 57.85 57.21 3g1p n ARG 214 Cb 1.01 -5.06 -0.03 0.00 -1.02 0.00 0.00 32.46 27.36 3g1p n ARG 214 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 3g1p s SER 215 N -2.80 6.76 0.03 0.55 0.15 -1.26 -4.91 113.70 112.22 3g1p s SER 215 Ca 0.23 2.50 0.21 0.00 0.70 0.00 0.00 55.95 59.59 3g1p s SER 215 Cb -0.10 -2.61 0.88 0.00 -1.71 0.00 0.00 66.02 62.48 3g1p s SER 215 CO 0.29 -0.65 1.66 -0.81 1.20 0.00 0.00 173.24 174.94 3g1p n PRO 216 N 2.96 0.02 -3.48 5.44 -0.04 -1.26 -4.54 135.00 134.11 3g1p n PRO 216 Ca 0.08 0.17 -0.20 0.00 -0.04 0.00 0.00 63.50 63.52 3g1p n PRO 216 Cb 0.41 -1.54 -0.12 0.00 -0.04 0.00 0.00 33.50 32.21 3g1p n PRO 216 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 3g1p s ARG 217 N -3.03 0.22 -0.21 0.54 3.52 -1.19 -4.76 118.95 114.05 3g1p s ARG 217 Ca 0.10 0.00 -0.05 0.00 -0.13 0.00 0.00 55.73 55.64 3g1p s ARG 217 Cb 0.13 -1.07 -0.02 0.00 -1.56 0.00 0.00 34.95 32.43 3g1p s ARG 217 CO 0.38 -0.81 0.01 0.08 -0.81 0.00 0.00 175.30 174.15 3g1p s VAL 218 N 2.30 3.94 -0.23 7.11 1.01 -0.53 -1.31 120.40 132.71 3g1p s VAL 218 Ca 0.08 -0.31 -0.05 0.00 0.00 0.00 0.00 61.98 61.70 3g1p s VAL 218 Cb -0.15 -2.80 -0.02 0.00 0.00 0.00 0.00 36.38 33.41 3g1p s VAL 218 CO -0.21 0.41 -0.01 -0.63 0.00 0.00 0.00 175.10 174.66 3g1p s ILE 219 N 1.21 3.67 0.07 2.22 1.01 0.59 -0.89 121.20 129.09 3g1p s ILE 219 Ca 0.03 -0.39 -0.25 0.00 0.00 0.00 0.00 60.65 60.04 3g1p s ILE 219 Cb -0.15 -2.69 -0.06 0.00 0.01 0.00 0.00 42.46 39.58 3g1p s ILE 219 CO 0.01 0.40 0.78 -0.76 0.00 0.00 0.00 174.94 175.37 3g1p s LEU 220 N 1.48 4.48 0.00 2.97 1.43 0.31 -1.04 118.68 128.31 3g1p s LEU 220 Ca 0.06 1.51 0.05 0.00 -1.03 0.00 0.00 54.13 54.71 3g1p s LEU 220 Cb -0.14 -3.27 -0.02 0.00 0.03 0.00 0.00 46.19 42.79 3g1p s LEU 220 CO -0.01 0.05 0.17 1.07 0.23 0.00 0.00 176.35 177.86 3g1p n THR 221 N 2.57 0.00 -3.55 5.49 5.66 -0.03 -0.32 114.28 124.10 3g1p n THR 221 Ca -0.03 -1.68 -0.24 0.00 -3.05 0.00 0.00 64.05 59.06 3g1p n THR 221 Cb 0.50 0.78 0.08 0.00 -1.55 0.00 0.00 70.33 70.14 3g1p n THR 221 CO 0.00 0.00 0.00 1.57 -3.05 0.00 0.00 175.07 173.59 3g1p n HIS 222 N -0.49 -2.80 -2.54 1.09 -0.00 -0.36 -0.89 115.22 109.23 3g1p n HIS 222 Ca 0.03 0.98 -0.42 0.00 -0.00 0.00 0.00 57.72 58.30 3g1p n HIS 222 Cb 0.42 -4.96 -0.03 0.00 -0.00 0.00 0.00 29.99 25.42 3g1p n HIS 222 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 3g1p s ILE 223 N -3.31 4.44 0.58 3.57 -1.09 -0.35 -3.55 121.20 121.50 3g1p s ILE 223 Ca 0.56 1.74 -0.08 0.00 -2.23 0.00 0.00 60.65 60.64 3g1p s ILE 223 Cb -0.25 -4.12 -0.02 0.00 -1.58 0.00 0.00 42.46 36.49 3g1p s ILE 223 CO 0.70 0.03 0.94 -0.94 -1.23 0.00 0.00 174.94 174.44 3g1p s SER 224 N 1.28 6.00 0.47 3.58 1.04 -0.83 -4.17 113.70 121.07 3g1p s SER 224 Ca 0.54 1.09 0.13 0.00 0.48 0.00 0.00 55.95 58.18 3g1p s SER 224 Cb -0.23 -2.17 1.10 0.00 0.10 0.00 0.00 66.02 64.81 3g1p s SER 224 CO 0.22 -0.89 2.10 1.12 0.98 0.00 0.00 173.24 176.77 3g1p h HIS 225 N -0.18 0.19 -0.56 5.02 2.07 -1.88 -0.90 115.15 118.90 3g1p h HIS 225 Ca -0.45 0.00 -0.11 0.00 -2.85 0.00 0.00 60.37 56.96 3g1p h HIS 225 Cb 1.22 -0.06 -0.02 0.00 2.57 0.00 0.00 27.41 31.11 3g1p h HIS 225 CO 0.58 0.14 -0.06 1.96 -3.07 0.00 0.00 177.93 177.47 3g1p h GLN 226 N 0.20 1.03 -0.42 5.12 7.50 -1.93 -0.81 115.11 125.79 3g1p h GLN 226 Ca 0.05 -0.35 -0.10 0.00 0.50 0.00 0.00 58.65 58.75 3g1p h GLN 226 Cb 0.01 -0.08 -0.01 0.00 0.05 0.00 0.00 27.48 27.45 3g1p h GLN 226 CO -0.01 1.04 -0.14 0.35 -1.50 0.00 0.00 178.83 178.58 3g1p h PHE 227 N 0.93 0.96 -0.72 2.96 3.57 -1.56 -1.71 116.94 121.36 3g1p h PHE 227 Ca 0.15 -0.22 0.06 0.00 3.53 0.00 0.00 57.97 61.49 3g1p h PHE 227 Cb 0.62 -0.23 -0.06 0.00 2.79 0.00 0.00 35.95 39.08 3g1p h PHE 227 CO 0.04 0.97 0.42 -0.44 -2.23 0.00 0.00 178.31 177.07 3g1p h ASP 228 N 0.67 0.63 -0.84 0.41 3.32 -0.99 0.11 116.42 119.73 3g1p h ASP 228 Ca 0.10 0.02 0.03 0.00 0.02 0.00 0.00 57.03 57.21 3g1p h ASP 228 Cb 0.68 -0.10 -0.05 0.00 0.22 0.00 0.00 39.33 40.08 3g1p h ASP 228 CO 0.05 0.41 0.55 0.00 -1.72 0.00 0.00 179.24 178.52 3g1p h ALA 229 N 1.36 1.10 -0.60 3.45 0.00 -0.94 -1.56 119.26 122.08 3g1p h ALA 229 Ca 0.32 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.13 3g1p h ALA 229 Cb 0.17 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 3g1p h ALA 229 CO -0.18 0.40 0.17 2.35 0.00 0.00 0.00 179.25 181.99 3g1p h TRP 230 N 1.07 0.99 0.00 0.00 7.01 -0.41 -2.68 115.95 121.93 3g1p h TRP 230 Ca 0.33 -0.11 -0.02 0.00 2.11 0.00 0.00 58.89 61.21 3g1p h TRP 230 Cb -0.02 -0.28 -0.00 0.00 -2.10 0.00 0.00 29.16 26.76 3g1p h TRP 230 CO -0.02 0.83 -0.07 -0.07 -2.79 0.00 0.00 178.44 176.31 3g1p h LEU 231 N 0.86 0.00 -1.05 0.65 3.38 -0.22 -0.76 115.31 118.18 3g1p h LEU 231 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 3g1p h LEU 231 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 3g1p h LEU 231 CO -0.00 0.07 0.00 0.24 0.09 0.00 0.00 178.44 178.84 3g1p h MET 232 N 0.00 0.00 0.00 1.13 2.86 -0.94 -3.24 114.93 114.74 3g1p h MET 232 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3g1p h MET 232 Cb 0.38 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.04 3g1p h MET 232 CO 0.01 0.00 0.00 0.39 1.06 0.00 0.00 176.91 178.37 3g1p n GLU 233 N -2.80 1.32 -3.80 1.72 1.02 -0.42 -5.05 120.64 112.63 3g1p n GLU 233 Ca 0.02 -0.32 -0.13 0.00 -0.02 0.00 0.00 57.16 56.71 3g1p n GLU 233 Cb 0.31 -0.81 -0.14 0.00 -0.02 0.00 0.00 31.44 30.78 3g1p n GLU 233 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 3g1p s ASN 234 N -0.28 -0.10 0.24 1.62 0.01 -0.44 -5.12 114.94 110.88 3g1p s ASN 234 Ca 0.00 0.23 -0.13 0.00 -0.71 0.00 0.00 52.86 52.25 3g1p s ASN 234 Cb 0.00 0.19 -0.08 0.00 0.41 0.00 0.00 41.25 41.77 3g1p s ASN 234 CO 0.00 -0.08 0.62 0.00 -1.51 0.00 0.00 177.10 176.13 3g1p s ALA 235 N 0.45 3.48 0.45 0.60 0.00 -1.26 -4.45 121.76 121.03 3g1p s ALA 235 Ca -0.03 -0.11 -0.20 0.00 0.00 0.00 0.00 51.96 51.62 3g1p s ALA 235 Cb -0.05 -2.59 -0.10 0.00 0.00 0.00 0.00 23.12 20.38 3g1p s ALA 235 CO -0.02 0.43 0.96 -0.51 0.00 0.00 0.00 175.76 176.62 3g1p s LEU 236 N -2.60 3.89 0.81 0.00 1.43 -1.26 -5.05 118.68 115.90 3g1p s LEU 236 Ca 0.47 1.69 -0.11 0.00 -1.03 0.00 0.00 54.13 55.15 3g1p s LEU 236 Cb -0.12 -4.54 0.08 0.00 0.03 0.00 0.00 46.19 41.64 3g1p s LEU 236 CO 0.20 -0.43 1.13 -2.84 0.23 0.00 0.00 176.35 174.63 3g1p s PRO 237 N -3.32 1.83 0.25 1.29 0.02 -1.26 -4.92 135.00 128.89 3g1p s PRO 237 Ca 0.62 1.39 -0.30 0.00 0.02 0.00 0.00 61.00 62.73 3g1p s PRO 237 Cb -0.10 -1.83 -0.14 0.00 0.02 0.00 0.00 34.50 32.45 3g1p s PRO 237 CO 0.16 -2.00 1.13 0.45 -0.33 0.00 0.00 177.00 176.42 3g1p n SER 238 N -3.61 1.63 0.00 2.53 2.88 -1.26 -2.45 113.62 113.33 3g1p n SER 238 Ca 0.11 1.16 0.00 0.00 -1.33 0.00 0.00 58.87 58.81 3g1p n SER 238 Cb 0.52 -1.30 0.00 0.00 -0.75 0.00 0.00 64.21 62.68 3g1p n SER 238 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3g1p n GLY 239 N 1.58 0.54 3.06 0.46 0.00 -1.26 -5.05 105.19 104.53 3g1p n GLY 239 Ca 0.11 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.91 3g1p n GLY 239 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3g1p s PHE 240 N -2.26 1.25 0.05 1.61 0.08 -1.03 -1.45 117.98 116.23 3g1p s PHE 240 Ca 0.00 -0.32 -0.01 0.00 0.12 0.00 0.00 56.93 56.71 3g1p s PHE 240 Cb 0.00 -0.86 -0.03 0.00 -0.57 0.00 0.00 43.02 41.56 3g1p s PHE 240 CO 0.00 -0.11 -0.02 -1.83 -0.10 0.00 0.00 175.22 173.16 3g1p s GLU 241 N 0.08 0.57 -0.12 0.44 -1.05 -0.07 -4.73 118.70 113.82 3g1p s GLU 241 Ca -0.02 -1.09 -0.16 0.00 -0.15 0.00 0.00 54.97 53.55 3g1p s GLU 241 Cb -0.09 0.20 -0.05 0.00 -0.44 0.00 0.00 34.13 33.75 3g1p s GLU 241 CO 0.01 -0.11 0.39 0.54 0.95 0.00 0.00 175.26 177.04 3g1p s VAL 242 N -3.46 5.22 0.81 1.83 0.11 -1.26 -0.53 120.40 123.11 3g1p s VAL 242 Ca 0.03 0.76 -0.11 0.00 -2.93 0.00 0.00 61.98 59.73 3g1p s VAL 242 Cb 0.05 -3.72 0.08 0.00 -1.53 0.00 0.00 36.38 31.25 3g1p s VAL 242 CO -0.08 0.39 1.09 -0.83 -3.33 0.00 0.00 175.10 172.33 3g1p s GLY 243 N 0.31 1.64 0.06 6.54 0.00 0.56 -4.84 107.32 111.59 3g1p s GLY 243 Ca 0.22 0.01 -0.09 0.00 0.00 0.00 0.00 44.72 44.85 3g1p s GLY 243 CO 0.08 0.42 0.20 -0.11 0.00 0.00 0.00 173.10 173.68 3g1p s PHE 244 N -3.00 0.10 0.14 1.90 -0.12 -1.26 -4.95 117.98 110.78 3g1p s PHE 244 Ca 0.61 -0.42 -0.31 0.00 -0.05 0.00 0.00 56.93 56.76 3g1p s PHE 244 Cb -0.16 -0.04 -0.10 0.00 -0.63 0.00 0.00 43.02 42.09 3g1p s PHE 244 CO 0.56 -0.49 1.72 -0.51 -0.05 0.00 0.00 175.22 176.45 3g1p s ASP 245 N -2.47 6.48 0.00 1.98 1.11 -1.26 -1.61 116.67 120.89 3g1p s ASP 245 Ca -0.00 2.71 0.00 0.00 0.18 0.00 0.00 52.55 55.44 3g1p s ASP 245 Cb 0.02 -2.58 0.00 0.00 1.07 0.00 0.00 42.92 41.43 3g1p s ASP 245 CO -0.07 -0.94 0.00 0.61 1.18 0.00 0.00 175.17 175.94 3g1p n GLY 246 N 4.04 0.81 3.72 0.21 0.00 0.12 -5.02 105.19 109.06 3g1p n GLY 246 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 3g1p n GLY 246 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 3g1p n MET 247 N -2.00 2.54 -4.16 1.61 0.00 -0.64 -4.73 117.12 109.75 3g1p n MET 247 Ca 0.00 0.91 -0.34 0.00 0.00 0.00 0.00 57.70 58.27 3g1p n MET 247 Cb 0.00 -2.68 -0.11 0.00 0.00 0.00 0.00 33.22 30.43 3g1p n MET 247 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 175.97 174.76 3g1p s GLU 248 N 0.03 3.83 -0.14 2.12 2.02 -1.26 -1.20 118.70 124.10 3g1p s GLU 248 Ca 0.69 -0.43 0.01 0.00 0.02 0.00 0.00 54.97 55.27 3g1p s GLU 248 Cb -0.54 -3.09 0.00 0.00 0.10 0.00 0.00 34.13 30.60 3g1p s GLU 248 CO 0.44 0.24 -0.19 0.42 0.02 0.00 0.00 175.26 176.19 3g1p s ILE 249 N 0.43 2.35 0.49 -1.63 1.01 0.15 -4.99 121.20 119.02 3g1p s ILE 249 Ca 0.00 -0.88 0.07 0.00 0.00 0.00 0.00 60.65 59.84 3g1p s ILE 249 Cb -0.13 -1.97 0.02 0.00 0.01 0.00 0.00 42.46 40.39 3g1p s ILE 249 CO 0.02 0.53 0.45 -0.83 0.00 0.00 0.00 174.94 175.11 3g1p s GLY 250 N 0.79 2.17 0.00 6.18 0.00 -1.26 -1.14 107.32 114.05 3g1p s GLY 250 Ca -0.07 -1.68 0.00 0.00 0.00 0.00 0.00 44.72 42.97 3g1p s GLY 250 CO -0.00 -1.80 0.28 -0.62 0.00 0.00 0.00 173.10 170.96