#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k2n h ASP 32 N 0.00 -0.22 -0.53 1.96 5.19 -1.99 -0.47 116.42 120.36 2k2n h ASP 32 Ca 0.00 -0.01 0.06 0.00 -0.62 0.00 0.00 57.03 56.46 2k2n h ASP 32 Cb 0.00 0.06 -0.05 0.00 0.18 0.00 0.00 39.33 39.51 2k2n h ASP 32 CO 0.00 -0.13 0.23 -0.61 -3.12 0.00 0.00 179.24 175.61 2k2n h GLN 33 N -0.29 0.43 -0.15 3.56 -0.00 -2.00 0.15 115.11 116.82 2k2n h GLN 33 Ca -0.03 -0.03 -0.00 0.00 -0.00 0.00 0.00 58.65 58.60 2k2n h GLN 33 Cb 0.22 -0.10 -0.01 0.00 0.00 0.00 0.00 27.48 27.60 2k2n h GLN 33 CO 0.04 0.29 0.08 0.82 0.00 0.00 0.00 178.83 180.06 2k2n h ILE 34 N 0.44 1.09 -0.27 2.39 1.08 -1.94 -2.60 117.51 117.71 2k2n h ILE 34 Ca 0.25 -0.24 0.01 0.00 -0.39 0.00 0.00 64.86 64.50 2k2n h ILE 34 Cb 0.23 0.98 -0.02 0.00 -3.07 0.00 0.00 36.82 34.94 2k2n h ILE 34 CO -0.22 0.08 0.14 -0.07 -0.69 0.00 0.00 178.15 177.40 2k2n h LEU 35 N 0.15 0.22 -1.05 1.44 3.38 -0.61 -0.50 115.31 118.34 2k2n h LEU 35 Ca 0.05 0.01 0.17 0.00 0.09 0.00 0.00 57.88 58.20 2k2n h LEU 35 Cb 0.06 -0.04 -0.10 0.00 0.09 0.00 0.00 40.66 40.68 2k2n h LEU 35 CO -0.01 0.16 0.62 -0.09 0.09 0.00 0.00 178.44 179.21 2k2n h ARG 36 N 0.30 0.79 0.00 1.13 2.43 -0.86 0.77 114.38 118.94 2k2n h ARG 36 Ca 0.11 -0.05 -0.10 0.00 -0.81 0.00 0.00 59.98 59.13 2k2n h ARG 36 Cb 0.02 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.38 2k2n h ARG 36 CO -0.07 0.52 -0.48 0.00 -1.51 0.00 0.00 179.97 178.44 2k2n h ALA 37 N 1.61 1.12 -0.08 2.80 0.00 -0.95 -2.87 119.26 120.88 2k2n h ALA 37 Ca 0.54 -0.44 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 2k2n h ALA 37 Cb 0.78 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2k2n h ALA 37 CO -0.32 0.60 -0.36 1.15 0.00 0.00 0.00 179.25 180.32 2k2n h THR 38 N 0.00 1.41 -0.25 0.00 2.02 0.20 -2.81 112.91 113.48 2k2n h THR 38 Ca -0.00 -1.74 -0.11 0.00 0.77 0.00 0.00 66.41 65.32 2k2n h THR 38 Cb 0.90 2.29 -0.01 0.00 -1.74 0.00 0.00 68.15 69.58 2k2n h THR 38 CO 0.06 0.51 -0.33 1.62 0.37 0.00 0.00 175.52 177.75 2k2n h VAL 39 N -0.09 1.29 -0.26 3.16 3.04 -0.72 -2.45 116.25 120.21 2k2n h VAL 39 Ca -0.02 -1.43 -0.13 0.00 -1.01 0.00 0.00 66.70 64.10 2k2n h VAL 39 Cb 1.00 1.45 -0.00 0.00 -2.01 0.00 0.00 31.29 31.73 2k2n h VAL 39 CO 0.07 0.45 -0.36 -0.33 -1.01 0.00 0.00 177.57 176.39 2k2n h GLU 40 N 0.45 0.70 0.34 4.17 4.39 -1.59 -3.01 114.58 120.03 2k2n h GLU 40 Ca 0.05 -0.41 -0.02 0.00 0.34 0.00 0.00 59.36 59.32 2k2n h GLU 40 Cb 0.79 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.48 2k2n h GLU 40 CO 0.06 1.03 -0.16 0.93 -1.16 0.00 0.00 179.01 179.71 2k2n h GLU 41 N 0.43 -0.44 -1.00 2.33 5.08 -1.45 -3.13 114.58 116.40 2k2n h GLU 41 Ca 0.03 0.03 0.17 0.00 -1.00 0.00 0.00 59.36 58.58 2k2n h GLU 41 Cb 0.95 0.10 -0.10 0.00 0.50 0.00 0.00 28.75 30.20 2k2n h GLU 41 CO 0.09 -0.14 0.62 -0.39 -1.00 0.00 0.00 179.01 178.18 2k2n h VAL 42 N -0.74 0.78 -0.89 3.13 -1.51 -1.55 0.02 116.25 115.49 2k2n h VAL 42 Ca -0.05 -0.29 0.14 0.00 -1.23 0.00 0.00 66.70 65.28 2k2n h VAL 42 Cb 0.50 -0.13 -0.09 0.00 -2.13 0.00 0.00 31.29 29.44 2k2n h VAL 42 CO 0.08 0.15 0.50 -0.09 -1.23 0.00 0.00 177.57 176.98 2k2n h ARG 43 N 0.84 0.70 -0.85 5.19 1.12 -1.47 0.11 114.38 120.01 2k2n h ARG 43 Ca 0.55 -0.04 0.02 0.00 -1.11 0.00 0.00 59.98 59.40 2k2n h ARG 43 Cb 0.76 -0.16 -0.05 0.00 -0.01 0.00 0.00 29.97 30.52 2k2n h ARG 43 CO -0.33 0.46 0.56 0.00 -3.11 0.00 0.00 179.97 177.55 2k2n h ALA 44 N 1.56 1.44 -0.02 2.80 0.00 -0.98 3.45 119.26 127.50 2k2n h ALA 44 Ca 0.48 -0.05 -0.19 0.00 0.00 0.00 0.00 54.91 55.15 2k2n h ALA 44 Cb 0.63 -0.32 0.01 0.00 0.00 0.00 0.00 17.79 18.12 2k2n h ALA 44 CO -0.34 0.50 -0.72 0.74 0.00 0.00 0.00 179.25 179.43 2k2n h PHE 45 N 1.10 0.76 0.00 0.00 0.04 -0.88 -3.32 116.94 114.65 2k2n h PHE 45 Ca 0.33 -0.40 -0.17 0.00 2.80 0.00 0.00 57.97 60.52 2k2n h PHE 45 Cb -0.04 -0.09 -0.03 0.00 2.20 0.00 0.00 35.95 37.99 2k2n h PHE 45 CO -0.00 1.22 -1.12 -0.07 -0.60 0.00 0.00 178.31 177.74 2k2n h LEU 46 N 0.09 0.00 1.00 1.54 3.38 -0.63 -3.47 115.31 117.22 2k2n h LEU 46 Ca -0.08 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.57 2k2n h LEU 46 Cb 1.41 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 42.03 2k2n h LEU 46 CO 0.14 0.68 -0.29 0.61 0.09 0.00 0.00 178.44 179.68 2k2n n GLY 47 N 1.36 1.47 3.77 0.83 0.00 1.14 -4.90 105.19 108.86 2k2n n GLY 47 Ca -0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.58 2k2n n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k2n s THR 48 N -2.31 3.42 0.21 2.61 2.01 -1.25 -4.93 115.64 115.40 2k2n s THR 48 Ca 0.00 1.23 -0.20 0.00 0.31 0.00 0.00 61.69 63.03 2k2n s THR 48 Cb 0.00 -3.70 0.17 0.00 0.01 0.00 0.00 72.50 68.97 2k2n s THR 48 CO 0.00 0.14 1.50 0.47 -0.69 0.00 0.00 174.62 176.04 2k2n n ASP 49 N 0.37 -0.72 -3.72 3.53 8.00 -1.15 -4.45 116.55 118.41 2k2n n ASP 49 Ca 0.03 1.69 -0.12 0.00 0.71 0.00 0.00 54.79 57.11 2k2n n ASP 49 Cb 0.47 -0.35 -0.12 0.00 -0.02 0.00 0.00 41.12 41.10 2k2n n ASP 49 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2k2n s ARG 50 N -5.82 0.31 -0.06 -1.24 0.52 -1.22 -1.13 118.95 110.32 2k2n s ARG 50 Ca -0.13 0.62 0.01 0.00 -0.52 0.00 0.00 55.73 55.71 2k2n s ARG 50 Cb 0.18 -0.03 0.02 0.00 0.52 0.00 0.00 34.95 35.64 2k2n s ARG 50 CO 0.67 -0.14 -0.06 0.08 0.02 0.00 0.00 175.30 175.87 2k2n s VAL 51 N 1.12 0.71 0.04 3.52 1.01 -1.03 -0.84 120.40 124.92 2k2n s VAL 51 Ca -0.08 -0.20 -0.02 0.00 0.00 0.00 0.00 61.98 61.68 2k2n s VAL 51 Cb -0.08 -0.72 -0.02 0.00 0.00 0.00 0.00 36.38 35.56 2k2n s VAL 51 CO -0.09 0.27 0.02 -1.59 0.00 0.00 0.00 175.10 173.71 2k2n s LYS 52 N 1.05 0.51 -0.08 2.72 -2.85 -1.11 -1.16 119.74 118.82 2k2n s LYS 52 Ca -0.08 -0.85 0.03 0.00 -1.00 0.00 0.00 55.97 54.06 2k2n s LYS 52 Cb -0.14 0.19 -0.02 0.00 -2.06 0.00 0.00 37.83 35.79 2k2n s LYS 52 CO -0.01 -0.10 -0.16 0.08 0.10 0.00 0.00 175.35 175.26 2k2n s VAL 53 N -2.65 2.88 -0.08 1.79 1.01 0.74 -2.73 120.40 121.36 2k2n s VAL 53 Ca -0.05 -0.76 -0.01 0.00 0.00 0.00 0.00 61.98 61.16 2k2n s VAL 53 Cb -0.01 -2.15 0.03 0.00 0.00 0.00 0.00 36.38 34.25 2k2n s VAL 53 CO -0.05 0.56 -0.02 -0.72 0.00 0.00 0.00 175.10 174.87 2k2n s TYR 54 N -0.24 0.91 0.29 5.22 -0.85 -1.08 -2.90 117.35 118.69 2k2n s TYR 54 Ca 0.01 -0.34 -0.29 0.00 -0.52 0.00 0.00 57.07 55.93 2k2n s TYR 54 Cb -0.13 -0.93 -0.10 0.00 0.38 0.00 0.00 41.96 41.19 2k2n s TYR 54 CO 0.03 -0.38 1.11 1.03 -1.52 0.00 0.00 175.55 175.81 2k2n s ARG 55 N 1.89 4.61 -0.31 -3.49 0.52 -1.20 -1.95 118.95 119.02 2k2n s ARG 55 Ca 0.05 1.81 -0.18 0.00 -0.52 0.00 0.00 55.73 56.89 2k2n s ARG 55 Cb -0.12 -3.16 -0.01 0.00 0.52 0.00 0.00 34.95 32.17 2k2n s ARG 55 CO -0.06 0.18 0.52 0.12 0.02 0.00 0.00 175.30 176.08 2k2n s PHE 56 N -1.18 3.21 0.02 -0.53 2.19 -0.11 -3.25 117.98 118.34 2k2n s PHE 56 Ca 0.45 0.40 -0.13 0.00 0.33 0.00 0.00 56.93 57.97 2k2n s PHE 56 Cb -0.32 -2.85 -0.06 0.00 -1.31 0.00 0.00 43.02 38.48 2k2n s PHE 56 CO 0.41 -0.43 0.40 0.16 1.83 0.00 0.00 175.22 177.59 2k2n s ASP 57 N 1.67 6.76 0.30 6.13 -4.77 -1.26 -4.91 116.67 120.59 2k2n s ASP 57 Ca 0.20 0.92 0.04 0.00 -3.30 0.00 0.00 52.55 50.41 2k2n s ASP 57 Cb -0.15 -2.23 0.21 0.00 -1.09 0.00 0.00 42.92 39.66 2k2n s ASP 57 CO 0.12 0.29 0.90 -2.65 0.70 0.00 0.00 175.17 174.52 2k2n n PRO 58 N 1.58 0.04 0.01 2.11 -0.02 -1.26 0.20 135.00 137.66 2k2n n PRO 58 Ca -0.12 0.47 -0.14 0.00 -2.02 0.00 0.00 63.50 61.69 2k2n n PRO 58 Cb 0.52 -2.20 -0.14 0.00 -0.02 0.00 0.00 33.50 31.67 2k2n n PRO 58 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2k2n h GLU 59 N 0.00 0.13 0.00 -0.52 5.08 -2.02 -3.48 114.58 113.77 2k2n h GLU 59 Ca 0.00 -0.22 0.00 0.00 -1.00 0.00 0.00 59.36 58.14 2k2n h GLU 59 Cb 1.17 0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.50 2k2n h GLU 59 CO 0.00 0.86 0.00 0.41 -1.00 0.00 0.00 179.01 179.28 2k2n n GLY 60 N 1.67 0.75 0.23 -3.84 0.00 0.54 -4.38 105.19 100.17 2k2n n GLY 60 Ca -0.19 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.72 2k2n n GLY 60 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 2k2n h HIS 61 N 0.00 0.85 -2.32 1.61 3.86 -1.75 -3.38 115.15 114.02 2k2n h HIS 61 Ca 0.00 -0.16 0.09 0.00 -1.16 0.00 0.00 60.37 59.14 2k2n h HIS 61 Cb 0.00 -0.22 -0.05 0.00 1.06 0.00 0.00 27.41 28.20 2k2n h HIS 61 CO 0.00 0.85 -0.48 0.41 0.86 0.00 0.00 177.93 179.57 2k2n n GLY 62 N -0.32 -1.48 3.26 2.45 0.00 -1.26 -2.42 105.19 105.42 2k2n n GLY 62 Ca -0.00 -0.38 -0.25 0.00 0.00 0.00 0.00 46.02 45.39 2k2n n GLY 62 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2k2n s THR 63 N -4.68 1.67 -0.50 2.61 -4.23 -1.20 -3.13 115.64 106.18 2k2n s THR 63 Ca 0.00 -1.29 -0.28 0.00 -1.18 0.00 0.00 61.69 58.94 2k2n s THR 63 Cb 0.00 -1.47 0.01 0.00 1.34 0.00 0.00 72.50 72.37 2k2n s THR 63 CO 0.00 0.13 1.46 -0.69 -0.54 0.00 0.00 174.62 174.99 2k2n s VAL 64 N -0.90 3.78 -1.77 2.29 1.01 -1.23 -3.24 120.40 120.35 2k2n s VAL 64 Ca 0.07 0.72 0.16 0.00 0.00 0.00 0.00 61.98 62.93 2k2n s VAL 64 Cb -0.09 -4.28 0.08 0.00 0.00 0.00 0.00 36.38 32.09 2k2n s VAL 64 CO 0.02 -0.96 0.94 0.52 0.00 0.00 0.00 175.10 175.62 2k2n n VAL 65 N 7.00 0.00 -3.57 2.92 0.31 -1.14 -3.27 118.33 120.58 2k2n n VAL 65 Ca 0.15 -0.44 -0.03 0.00 -0.01 0.00 0.00 64.34 64.01 2k2n n VAL 65 Cb 0.49 1.27 -0.05 0.00 -0.91 0.00 0.00 33.84 34.64 2k2n n VAL 65 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2k2n s ALA 66 N -1.53 -1.79 -0.08 3.52 0.00 -1.16 -4.07 121.76 116.65 2k2n s ALA 66 Ca 0.16 1.98 -0.04 0.00 0.00 0.00 0.00 51.96 54.06 2k2n s ALA 66 Cb 0.13 -1.71 0.04 0.00 0.00 0.00 0.00 23.12 21.58 2k2n s ALA 66 CO 0.27 -0.96 0.18 -2.00 0.00 0.00 0.00 175.76 173.25 2k2n s GLU 67 N 2.80 0.12 0.05 0.00 2.12 -1.26 -0.18 118.70 122.34 2k2n s GLU 67 Ca -0.00 0.44 0.07 0.00 0.36 0.00 0.00 54.97 55.84 2k2n s GLU 67 Cb -0.13 -0.17 -0.03 0.00 0.26 0.00 0.00 34.13 34.07 2k2n s GLU 67 CO -0.17 -0.18 -0.20 0.00 -0.54 0.00 0.00 175.26 174.17 2k2n s ALA 68 N 1.32 1.70 -0.02 6.30 0.00 -0.31 -4.80 121.76 125.96 2k2n s ALA 68 Ca -0.08 -1.06 -0.03 0.00 0.00 0.00 0.00 51.96 50.79 2k2n s ALA 68 Cb -0.11 -0.32 0.00 0.00 0.00 0.00 0.00 23.12 22.69 2k2n s ALA 68 CO -0.07 0.37 0.07 -0.98 0.00 0.00 0.00 175.76 175.16 2k2n s ARG 69 N -1.26 0.18 0.36 0.00 1.70 -1.26 -2.48 118.95 116.19 2k2n s ARG 69 Ca 0.07 -0.05 0.05 0.00 -0.47 0.00 0.00 55.73 55.32 2k2n s ARG 69 Cb -0.09 0.08 0.71 0.00 -0.57 0.00 0.00 34.95 35.08 2k2n s ARG 69 CO 0.02 -0.03 1.99 0.78 -1.08 0.00 0.00 175.30 176.97 2k2n h GLY 70 N 5.60 0.90 -1.13 3.88 0.00 -1.34 -3.46 103.07 107.52 2k2n h GLY 70 Ca -0.26 -0.31 0.05 0.00 0.00 0.00 0.00 47.33 46.81 2k2n h GLY 70 CO 0.44 0.26 0.40 0.61 0.00 0.00 0.00 176.54 178.25 2k2n n GLY 71 N -1.45 0.85 2.35 4.60 0.00 -1.26 -5.02 105.19 105.26 2k2n n GLY 71 Ca 0.09 -1.20 -0.17 0.00 0.00 0.00 0.00 46.02 44.73 2k2n n GLY 71 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2k2n n GLU 72 N -0.60 1.94 -0.08 1.61 2.13 -1.26 -4.24 120.64 120.14 2k2n n GLU 72 Ca -0.06 -1.17 -0.20 0.00 0.66 0.00 0.00 57.16 56.39 2k2n n GLU 72 Cb 0.57 -2.20 -0.12 0.00 0.27 0.00 0.00 31.44 29.96 2k2n n GLU 72 CO 0.00 0.00 0.00 -0.09 -0.41 0.00 0.00 177.13 176.63 2k2n h ARG 73 N 5.00 0.04 -6.80 5.31 2.43 -1.97 -3.47 114.38 114.93 2k2n h ARG 73 Ca 0.37 -0.07 -0.69 0.00 -0.81 0.00 0.00 59.98 58.78 2k2n h ARG 73 Cb 0.60 0.03 -0.23 0.00 -0.42 0.00 0.00 29.97 29.94 2k2n h ARG 73 CO 0.94 1.03 -0.86 -0.51 -1.51 0.00 0.00 179.97 179.07 2k2n s LEU 74 N -7.91 2.36 0.30 3.80 1.43 -1.26 -5.12 118.68 112.28 2k2n s LEU 74 Ca -0.25 -0.64 -0.29 0.00 -1.03 0.00 0.00 54.13 51.92 2k2n s LEU 74 Cb 0.03 -1.32 -0.10 0.00 0.03 0.00 0.00 46.19 44.84 2k2n s LEU 74 CO 0.65 0.21 1.30 -2.16 0.23 0.00 0.00 176.35 176.58 2k2n s PRO 75 N -1.76 4.38 0.21 1.29 0.04 -1.26 -4.95 135.00 132.96 2k2n s PRO 75 Ca 0.14 2.16 -0.32 0.00 0.04 0.00 0.00 61.00 63.02 2k2n s PRO 75 Cb -0.10 -3.10 -0.12 0.00 0.04 0.00 0.00 34.50 31.22 2k2n s PRO 75 CO 0.05 -0.18 1.71 -1.12 0.04 0.00 0.00 177.00 177.50 2k2n s SER 76 N -0.33 6.39 0.00 6.66 0.01 -1.26 -4.87 113.70 120.29 2k2n s SER 76 Ca 0.50 2.86 0.18 0.00 1.31 0.00 0.00 55.95 60.80 2k2n s SER 76 Cb -0.39 -2.60 0.54 0.00 0.21 0.00 0.00 66.02 63.78 2k2n s SER 76 CO 0.49 -0.96 1.42 0.18 0.41 0.00 0.00 173.24 174.78 2k2n n LEU 77 N 3.90 2.21 -4.71 2.44 4.77 -1.26 -4.95 117.00 119.40 2k2n n LEU 77 Ca 0.15 -1.01 -0.43 0.00 -0.03 0.00 0.00 56.01 54.69 2k2n n LEU 77 Cb 0.35 -0.21 -0.03 0.00 -2.33 0.00 0.00 43.42 41.20 2k2n n LEU 77 CO 0.64 0.51 1.37 -0.11 -1.33 0.00 0.00 177.39 178.46 2k2n n LEU 78 N 0.68 3.92 0.00 2.23 7.94 -1.26 -1.55 117.00 128.95 2k2n n LEU 78 Ca 0.16 1.06 0.00 0.00 -1.11 0.00 0.00 56.01 56.11 2k2n n LEU 78 Cb 0.38 -1.56 0.00 0.00 0.53 0.00 0.00 43.42 42.78 2k2n n LEU 78 CO 0.12 0.14 0.00 0.61 -1.11 0.00 0.00 177.39 177.15 2k2n n GLY 79 N 3.94 2.04 3.85 -3.96 0.00 -1.20 -5.03 105.19 104.83 2k2n n GLY 79 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 2k2n n GLY 79 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2k2n s LEU 80 N 0.00 3.82 -0.12 0.99 1.43 -0.60 -4.93 118.68 119.27 2k2n s LEU 80 Ca 0.00 1.39 -0.03 0.00 -1.03 0.00 0.00 54.13 54.46 2k2n s LEU 80 Cb 0.00 -4.27 -0.03 0.00 0.03 0.00 0.00 46.19 41.92 2k2n s LEU 80 CO 0.00 -0.42 -0.01 0.42 0.23 0.00 0.00 176.35 176.57 2k2n s THR 81 N -2.36 4.16 0.37 5.49 -4.23 -1.26 -3.53 115.64 114.27 2k2n s THR 81 Ca 0.56 -0.28 -0.09 0.00 -1.18 0.00 0.00 61.69 60.69 2k2n s THR 81 Cb -0.10 -2.79 -0.06 0.00 1.34 0.00 0.00 72.50 70.89 2k2n s THR 81 CO 0.26 0.55 0.71 -0.36 -0.54 0.00 0.00 174.62 175.24 2k2n s PHE 82 N -0.27 3.47 0.04 3.99 0.40 -1.02 -5.02 117.98 119.57 2k2n s PHE 82 Ca 0.05 0.95 -0.30 0.00 -0.60 0.00 0.00 56.93 57.03 2k2n s PHE 82 Cb -0.12 -2.36 -0.07 0.00 0.51 0.00 0.00 43.02 40.97 2k2n s PHE 82 CO 0.02 -0.03 1.55 -1.25 0.70 0.00 0.00 175.22 176.22 2k2n s PRO 83 N -3.72 4.23 0.32 0.24 0.04 -1.26 -4.20 135.00 130.65 2k2n s PRO 83 Ca 0.50 2.18 -0.29 0.00 0.04 0.00 0.00 61.00 63.42 2k2n s PRO 83 Cb -0.10 -3.60 -0.11 0.00 0.04 0.00 0.00 34.50 30.73 2k2n s PRO 83 CO 0.30 -0.67 1.48 0.00 0.04 0.00 0.00 177.00 178.15 2k2n s ALA 84 N 2.59 3.62 0.00 8.56 0.00 -1.26 -2.82 121.76 132.46 2k2n s ALA 84 Ca 0.70 1.48 0.00 0.00 0.00 0.00 0.00 51.96 54.14 2k2n s ALA 84 Cb -0.36 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.17 2k2n s ALA 84 CO 0.30 -0.91 0.00 0.41 0.00 0.00 0.00 175.76 175.56 2k2n n GLY 85 N 1.33 0.60 0.37 0.00 0.00 -1.26 -4.91 105.19 101.32 2k2n n GLY 85 Ca 0.04 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.15 2k2n n GLY 85 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2k2n h ASP 86 N 0.00 0.81 -3.59 1.61 3.32 -1.78 -3.36 116.42 113.43 2k2n h ASP 86 Ca 0.00 0.04 -0.59 0.00 0.02 0.00 0.00 57.03 56.50 2k2n h ASP 86 Cb 0.00 -0.12 -0.09 0.00 0.22 0.00 0.00 39.33 39.34 2k2n h ASP 86 CO 0.00 0.43 0.66 -0.63 -1.72 0.00 0.00 179.24 177.98 2k2n s ILE 87 N -5.84 4.47 0.00 0.35 -1.09 -1.26 -5.04 121.20 112.80 2k2n s ILE 87 Ca -0.11 1.03 0.00 0.00 -2.23 0.00 0.00 60.65 59.34 2k2n s ILE 87 Cb 0.22 -4.42 0.00 0.00 -1.58 0.00 0.00 42.46 36.68 2k2n s ILE 87 CO 0.80 -0.74 0.00 -2.65 -1.23 0.00 0.00 174.94 171.12 2k2n n PRO 88 N 7.12 1.35 -0.08 2.79 -0.02 -1.26 -4.91 135.00 140.00 2k2n n PRO 88 Ca 0.08 0.00 -0.16 0.00 -2.02 0.00 0.00 63.50 61.39 2k2n n PRO 88 Cb 0.48 0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 33.91 2k2n n PRO 88 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2k2n n GLU 89 N -0.27 0.35 -0.20 -0.52 4.07 -1.26 -4.27 120.64 118.55 2k2n n GLU 89 Ca 0.00 0.15 -0.09 0.00 -0.06 0.00 0.00 57.16 57.16 2k2n n GLU 89 Cb 0.00 -1.10 0.02 0.00 -0.06 0.00 0.00 31.44 30.30 2k2n n GLU 89 CO 0.00 0.00 0.00 0.93 -0.06 0.00 0.00 177.13 178.00 2k2n h GLU 90 N -0.61 0.96 -0.39 5.31 5.08 -2.00 -2.62 114.58 120.32 2k2n h GLU 90 Ca -0.37 -0.28 -0.11 0.00 -1.00 0.00 0.00 59.36 57.60 2k2n h GLU 90 Cb 1.26 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.40 2k2n h GLU 90 CO -0.22 0.94 -0.19 0.00 -1.00 0.00 0.00 179.01 178.55 2k2n h ALA 91 N 0.98 0.54 -0.69 3.43 0.00 -1.97 -3.01 119.26 118.54 2k2n h ALA 91 Ca 0.16 -0.36 -0.06 0.00 0.00 0.00 0.00 54.91 54.65 2k2n h ALA 91 Cb 0.48 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 2k2n h ALA 91 CO 0.02 0.49 0.20 -0.09 0.00 0.00 0.00 179.25 179.87 2k2n h ARG 92 N 0.61 1.07 -0.38 0.00 2.43 -1.73 -2.49 114.38 113.90 2k2n h ARG 92 Ca 0.09 -0.23 -0.03 0.00 -0.81 0.00 0.00 59.98 59.00 2k2n h ARG 92 Cb 0.74 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 30.12 2k2n h ARG 92 CO 0.06 0.93 0.12 -0.09 -1.51 0.00 0.00 179.97 179.47 2k2n h ARG 93 N 1.03 0.54 -0.20 0.20 2.43 -1.43 -1.80 114.38 115.15 2k2n h ARG 93 Ca 0.22 -0.08 -0.12 0.00 -0.81 0.00 0.00 59.98 59.19 2k2n h ARG 93 Cb 0.32 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 2k2n h ARG 93 CO -0.00 0.48 -0.40 -0.07 -1.51 0.00 0.00 179.97 178.46 2k2n h LEU 94 N 0.53 0.48 -1.95 3.80 3.38 -1.32 -2.35 115.31 117.89 2k2n h LEU 94 Ca 0.13 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 2k2n h LEU 94 Cb 0.16 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 2k2n h LEU 94 CO -0.01 0.83 -0.11 0.15 0.09 0.00 0.00 178.44 179.39 2k2n h PHE 95 N 0.38 0.00 0.00 1.13 3.04 -0.94 1.16 116.94 121.71 2k2n h PHE 95 Ca 0.03 0.00 -0.19 0.00 3.98 0.00 0.00 57.97 61.80 2k2n h PHE 95 Cb 0.87 0.00 -0.03 0.00 2.56 0.00 0.00 35.95 39.36 2k2n h PHE 95 CO 0.03 0.11 -0.95 -0.09 -2.02 0.00 0.00 178.31 175.39 2k2n h ARG 96 N 0.00 0.00 0.02 1.11 2.43 -1.14 -3.08 114.38 113.72 2k2n h ARG 96 Ca -0.00 0.00 -0.39 0.00 -0.81 0.00 0.00 59.98 58.78 2k2n h ARG 96 Cb 0.26 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.75 2k2n h ARG 96 CO 0.01 0.77 -2.38 1.28 -1.51 0.00 0.00 179.97 178.14 2k2n n LEU 97 N -3.26 2.80 -0.05 3.80 4.77 -0.48 -4.39 117.00 120.19 2k2n n LEU 97 Ca -0.02 -0.02 0.03 0.00 -0.03 0.00 0.00 56.01 55.97 2k2n n LEU 97 Cb 0.89 -0.94 -0.02 0.00 -2.33 0.00 0.00 43.42 41.02 2k2n n LEU 97 CO 0.45 0.88 0.06 0.00 -1.33 0.00 0.00 177.39 177.44 2k2n n ALA 98 N -3.32 2.73 -3.36 -1.18 0.00 0.39 -4.95 120.51 110.81 2k2n n ALA 98 Ca -0.44 -0.24 -0.25 0.00 0.00 0.00 0.00 53.44 52.51 2k2n n ALA 98 Cb 0.98 -0.22 0.03 0.00 0.00 0.00 0.00 19.45 20.24 2k2n n ALA 98 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2k2n n GLN 99 N -0.86 -1.49 0.00 0.00 1.13 -1.15 -4.97 117.38 110.04 2k2n n GLN 99 Ca 0.02 1.30 0.00 0.00 -1.94 0.00 0.00 57.00 56.37 2k2n n GLN 99 Cb 0.11 -1.98 0.00 0.00 0.11 0.00 0.00 30.24 28.48 2k2n n GLN 99 CO 0.00 0.00 0.00 1.55 -1.44 0.00 0.00 177.06 177.17 2k2n n VAL 100 N 0.28 0.00 -3.71 5.09 3.14 -1.26 -4.89 118.33 116.98 2k2n n VAL 100 Ca -0.05 0.00 -0.13 0.00 -2.96 0.00 0.00 64.34 61.20 2k2n n VAL 100 Cb 0.60 0.00 -0.09 0.00 -1.06 0.00 0.00 33.84 33.29 2k2n n VAL 100 CO 0.00 0.00 0.00 -0.60 -6.46 0.00 0.00 176.83 169.77 2k2n s ARG 101 N 0.00 0.56 -0.15 1.45 6.06 -1.25 -4.84 118.95 120.78 2k2n s ARG 101 Ca 0.00 0.69 -0.28 0.00 -2.50 0.00 0.00 55.73 53.64 2k2n s ARG 101 Cb 0.00 0.26 0.08 0.00 0.06 0.00 0.00 34.95 35.35 2k2n s ARG 101 CO 0.00 -0.07 0.74 0.08 -2.50 0.00 0.00 175.30 173.55 2k2n s VAL 102 N 0.35 0.00 -0.12 7.11 1.01 -1.26 -1.72 120.40 125.76 2k2n s VAL 102 Ca -0.01 0.00 -0.02 0.00 0.00 0.00 0.00 61.98 61.96 2k2n s VAL 102 Cb -0.04 -1.00 -0.03 0.00 0.00 0.00 0.00 36.38 35.32 2k2n s VAL 102 CO -0.00 0.00 -0.06 -0.63 0.00 0.00 0.00 175.10 174.41 2k2n s ILE 103 N -0.55 3.72 0.50 2.22 1.01 0.20 -4.74 121.20 123.56 2k2n s ILE 103 Ca -0.06 -0.44 -0.01 0.00 0.00 0.00 0.00 60.65 60.15 2k2n s ILE 103 Cb -0.02 -2.58 0.01 0.00 0.01 0.00 0.00 42.46 39.88 2k2n s ILE 103 CO 0.05 0.54 0.74 0.68 0.00 0.00 0.00 174.94 176.95 2k2n s VAL 104 N -0.09 3.61 -0.35 2.92 -7.23 -1.26 -2.76 120.40 115.24 2k2n s VAL 104 Ca 0.01 -0.45 -0.42 0.00 -1.81 0.00 0.00 61.98 59.32 2k2n s VAL 104 Cb -0.13 -3.36 -0.17 0.00 0.56 0.00 0.00 36.38 33.28 2k2n s VAL 104 CO 0.03 -0.27 1.72 -0.67 -0.31 0.00 0.00 175.10 175.60 2k2n n ASP 105 N -2.24 2.06 0.28 4.85 2.03 -1.26 -4.62 116.55 117.65 2k2n n ASP 105 Ca 0.03 1.09 0.18 0.00 0.52 0.00 0.00 54.79 56.62 2k2n n ASP 105 Cb 0.58 -1.07 0.93 0.00 -0.72 0.00 0.00 41.12 40.84 2k2n n ASP 105 CO 0.00 0.00 0.00 1.62 -1.92 0.00 0.00 177.20 176.90 2k2n h VAL 106 N 5.24 0.17 -0.39 5.18 3.04 -1.73 -0.24 116.25 127.53 2k2n h VAL 106 Ca -0.45 0.00 -0.05 0.00 -1.01 0.00 0.00 66.70 65.19 2k2n h VAL 106 Cb 1.33 0.81 -0.01 0.00 -2.01 0.00 0.00 31.29 31.40 2k2n h VAL 106 CO 0.97 0.00 0.04 -0.08 -1.01 0.00 0.00 177.57 177.49 2k2n h GLU 107 N 0.00 0.65 0.00 4.17 4.81 -1.87 -0.74 114.58 121.61 2k2n h GLU 107 Ca 0.04 -0.19 0.00 0.00 -0.13 0.00 0.00 59.36 59.08 2k2n h GLU 107 Cb 0.46 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.77 2k2n h GLU 107 CO -0.00 0.73 0.00 0.00 -0.73 0.00 0.00 179.01 179.01 2k2n n ALA 108 N -2.38 1.33 -3.60 2.92 0.00 -0.11 -4.90 120.51 113.78 2k2n n ALA 108 Ca -0.01 0.02 -0.21 0.00 0.00 0.00 0.00 53.44 53.24 2k2n n ALA 108 Cb 0.25 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.53 2k2n n ALA 108 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2k2n n GLN 109 N -1.70 -1.56 -2.44 0.00 7.27 -0.28 -4.90 117.38 113.77 2k2n n GLN 109 Ca 0.01 0.99 -0.42 0.00 0.07 0.00 0.00 57.00 57.66 2k2n n GLN 109 Cb 0.10 -3.03 -0.03 0.00 2.41 0.00 0.00 30.24 29.68 2k2n n GLN 109 CO 0.00 0.00 0.00 -1.54 0.07 0.00 0.00 177.06 175.59 2k2n s SER 110 N -2.85 7.13 -0.11 1.69 1.04 -1.26 -5.02 113.70 114.32 2k2n s SER 110 Ca 0.04 2.08 0.03 0.00 0.48 0.00 0.00 55.95 58.58 2k2n s SER 110 Cb -0.01 -2.59 -0.00 0.00 0.10 0.00 0.00 66.02 63.52 2k2n s SER 110 CO 0.86 -0.38 -0.21 -0.60 0.98 0.00 0.00 173.24 173.89 2k2n s ARG 111 N 0.37 3.11 0.13 4.02 3.52 -1.26 -4.21 118.95 124.63 2k2n s ARG 111 Ca 0.55 -0.84 0.08 0.00 -0.13 0.00 0.00 55.73 55.40 2k2n s ARG 111 Cb -0.30 -2.39 -0.04 0.00 -1.56 0.00 0.00 34.95 30.66 2k2n s ARG 111 CO 0.32 0.15 -0.20 -1.54 -0.81 0.00 0.00 175.30 173.22 2k2n s SER 112 N 0.44 2.64 0.35 -2.12 1.04 -1.25 -4.75 113.70 110.05 2k2n s SER 112 Ca -0.15 -0.76 -0.10 0.00 0.48 0.00 0.00 55.95 55.42 2k2n s SER 112 Cb -0.17 -0.15 0.03 0.00 0.10 0.00 0.00 66.02 65.82 2k2n s SER 112 CO 0.06 0.03 0.62 0.27 0.98 0.00 0.00 173.24 175.21 2k2n s ILE 113 N -1.51 0.00 0.96 -1.02 -4.36 -1.26 -3.80 121.20 110.21 2k2n s ILE 113 Ca 0.11 -1.29 -0.12 0.00 -0.26 0.00 0.00 60.65 59.09 2k2n s ILE 113 Cb -0.08 -2.66 0.10 0.00 1.25 0.00 0.00 42.46 41.07 2k2n s ILE 113 CO 0.05 0.00 0.75 -1.20 0.24 0.00 0.00 174.94 174.78 2k2n n SER 114 N -1.26 -1.02 -4.22 4.36 7.64 -1.26 -5.03 113.62 112.83 2k2n n SER 114 Ca -0.04 0.32 -0.18 0.00 1.01 0.00 0.00 58.87 59.98 2k2n n SER 114 Cb 0.61 -1.32 -0.11 0.00 -1.01 0.00 0.00 64.21 62.38 2k2n n SER 114 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 2k2n s GLN 115 N -4.11 0.96 -0.06 1.43 -1.52 -1.26 -5.08 119.66 110.03 2k2n s GLN 115 Ca 0.62 -1.14 -0.22 0.00 -1.95 0.00 0.00 55.36 52.67 2k2n s GLN 115 Cb -0.22 -0.90 -0.17 0.00 -0.22 0.00 0.00 33.01 31.50 2k2n s GLN 115 CO 0.63 0.18 0.89 -1.00 -0.25 0.00 0.00 175.29 175.75 2k2n h PRO 116 N 3.80 -0.17 -0.53 2.91 0.13 -2.02 -3.32 132.00 132.82 2k2n h PRO 116 Ca -0.41 0.01 -0.10 0.00 -0.87 0.00 0.00 66.00 64.63 2k2n h PRO 116 Cb 1.19 0.04 -0.02 0.00 0.13 0.00 0.00 31.00 32.34 2k2n h PRO 116 CO 0.47 0.31 -0.07 0.93 -0.23 0.00 0.00 178.00 179.40 2k2n h GLU 117 N -0.83 0.97 -3.17 0.86 3.07 -2.04 -3.49 114.58 109.95 2k2n h GLU 117 Ca -0.02 -0.34 0.17 0.00 -0.50 0.00 0.00 59.36 58.66 2k2n h GLU 117 Cb 0.55 -0.07 -0.09 0.00 -0.84 0.00 0.00 28.75 28.30 2k2n h GLU 117 CO 0.03 1.02 -0.92 0.45 -1.40 0.00 0.00 179.01 178.19 2k2n n SER 118 N -4.22 -6.37 0.00 1.42 2.88 -1.25 -4.81 113.62 101.27 2k2n n SER 118 Ca 0.01 1.29 0.00 0.00 -1.33 0.00 0.00 58.87 58.84 2k2n n SER 118 Cb 0.37 -4.32 0.00 0.00 -0.75 0.00 0.00 64.21 59.51 2k2n n SER 118 CO 0.00 0.00 0.00 0.79 -1.23 0.00 0.00 175.04 174.60 2k2n n TRP 119 N -3.45 -0.00 -2.14 0.66 8.01 -1.26 -4.82 117.44 114.43 2k2n n TRP 119 Ca -0.05 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.14 2k2n n TRP 119 Cb 0.48 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.78 2k2n n TRP 119 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2k2n n GLY 120 N 0.00 1.77 5.04 6.99 0.00 -1.26 -4.85 105.19 112.88 2k2n n GLY 120 Ca 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.49 2k2n n GLY 120 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2k2n n LEU 121 N 0.00 0.00 0.24 0.99 7.94 -1.26 -2.74 117.00 122.17 2k2n n LEU 121 Ca 0.00 0.00 0.07 0.00 -1.11 0.00 0.00 56.01 54.97 2k2n n LEU 121 Cb 0.00 0.00 0.57 0.00 0.53 0.00 0.00 43.42 44.52 2k2n n LEU 121 CO 0.00 0.00 0.97 0.77 -1.11 0.00 0.00 177.39 178.02 2k2n h SER 122 N 0.00 0.00 -0.47 1.96 4.64 -1.89 -1.96 113.55 115.84 2k2n h SER 122 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 2k2n h SER 122 Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 2k2n h SER 122 CO 0.00 0.11 0.17 0.00 -0.87 0.00 0.00 176.83 176.23 2k2n h ALA 123 N 1.89 0.61 0.31 5.18 0.00 -1.91 -0.89 119.26 124.46 2k2n h ALA 123 Ca -0.00 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 2k2n h ALA 123 Cb 0.19 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2k2n h ALA 123 CO 0.01 0.25 -0.15 0.00 0.00 0.00 0.00 179.25 179.36 2k2n h ARG 124 N 0.62 -0.40 -3.12 0.00 3.08 -1.69 -3.41 114.38 109.46 2k2n h ARG 124 Ca 0.15 0.03 -0.62 0.00 0.07 0.00 0.00 59.98 59.61 2k2n h ARG 124 Cb 0.24 0.09 -0.41 0.00 0.08 0.00 0.00 29.97 29.97 2k2n h ARG 124 CO -0.01 -0.27 -0.65 0.08 -1.07 0.00 0.00 179.97 178.05 2k2n s VAL 125 N -3.11 2.34 0.73 2.04 1.01 -0.79 -5.09 120.40 117.53 2k2n s VAL 125 Ca -0.06 -3.52 -0.17 0.00 0.00 0.00 0.00 61.98 58.23 2k2n s VAL 125 Cb 0.01 -2.58 -0.09 0.00 0.00 0.00 0.00 36.38 33.71 2k2n s VAL 125 CO 0.18 -0.93 0.02 -2.65 0.00 0.00 0.00 175.10 171.72 2k2n n PRO 126 N 2.71 0.11 -3.29 2.72 -0.02 -0.34 -3.62 135.00 133.28 2k2n n PRO 126 Ca 0.13 0.06 -0.16 0.00 -2.02 0.00 0.00 63.50 61.51 2k2n n PRO 126 Cb 0.35 -1.39 0.07 0.00 -0.02 0.00 0.00 33.50 32.50 2k2n n PRO 126 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2k2n n LEU 127 N 1.36 -5.39 -2.96 2.45 4.77 -1.26 -4.98 117.00 110.99 2k2n n LEU 127 Ca 0.06 -0.72 -0.14 0.00 -0.03 0.00 0.00 56.01 55.19 2k2n n LEU 127 Cb 0.51 -3.17 0.03 0.00 -2.33 0.00 0.00 43.42 38.45 2k2n n LEU 127 CO 0.52 0.14 0.05 0.61 -1.33 0.00 0.00 177.39 177.38 2k2n n GLY 128 N -1.25 2.03 2.58 -0.72 0.00 -1.24 -5.03 105.19 101.57 2k2n n GLY 128 Ca -0.09 -0.82 -0.27 0.00 0.00 0.00 0.00 46.02 44.84 2k2n n GLY 128 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2k2n n GLU 129 N 0.43 1.56 -1.11 1.61 0.00 -1.26 -4.84 120.64 117.03 2k2n n GLU 129 Ca 0.15 -4.12 -0.35 0.00 0.00 0.00 0.00 57.16 52.84 2k2n n GLU 129 Cb 0.67 -2.02 0.01 0.00 0.00 0.00 0.00 31.44 30.10 2k2n n GLU 129 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.13 174.83 2k2n n PRO 130 N 1.75 0.00 0.15 3.44 -0.02 -1.26 -4.76 135.00 134.31 2k2n n PRO 130 Ca 0.25 0.00 0.11 0.00 -2.02 0.00 0.00 63.50 61.84 2k2n n PRO 130 Cb 0.42 -0.90 0.55 0.00 -0.02 0.00 0.00 33.50 33.54 2k2n n PRO 130 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2k2n n LEU 131 N 2.35 0.62 -4.57 2.45 4.77 -1.26 -4.24 117.00 117.12 2k2n n LEU 131 Ca 0.06 0.72 -0.41 0.00 -0.03 0.00 0.00 56.01 56.36 2k2n n LEU 131 Cb 0.43 -0.73 -0.02 0.00 -2.33 0.00 0.00 43.42 40.78 2k2n n LEU 131 CO 0.49 -0.79 1.72 -1.10 -1.33 0.00 0.00 177.39 176.37 2k2n s GLN 132 N -3.46 3.71 -0.22 3.23 -0.21 -1.26 -4.90 119.66 116.56 2k2n s GLN 132 Ca 0.00 -1.52 0.02 0.00 0.02 0.00 0.00 55.36 53.88 2k2n s GLN 132 Cb 0.08 -5.43 0.04 0.00 1.00 0.00 0.00 33.01 28.69 2k2n s GLN 132 CO 0.28 -2.33 -0.15 1.03 -2.12 0.00 0.00 175.29 172.00 2k2n s ARG 133 N 4.73 2.56 0.24 2.91 0.52 -1.26 -5.12 118.95 123.54 2k2n s ARG 133 Ca 0.51 -1.10 -0.30 0.00 -0.52 0.00 0.00 55.73 54.33 2k2n s ARG 133 Cb 0.02 -2.73 -0.09 0.00 0.52 0.00 0.00 34.95 32.67 2k2n s ARG 133 CO -0.00 -0.40 0.94 -1.25 0.02 0.00 0.00 175.30 174.60 2k2n s PRO 134 N 1.20 4.83 -0.23 3.54 0.04 -1.26 -4.63 135.00 138.49 2k2n s PRO 134 Ca -0.02 1.47 -0.06 0.00 0.04 0.00 0.00 61.00 62.42 2k2n s PRO 134 Cb -0.17 -3.25 -0.02 0.00 0.04 0.00 0.00 34.50 31.10 2k2n s PRO 134 CO -0.09 0.51 0.03 0.54 0.04 0.00 0.00 177.00 178.03 2k2n s VAL 135 N -1.21 4.03 0.26 -0.36 0.11 -1.26 -4.41 120.40 117.57 2k2n s VAL 135 Ca 0.41 -0.27 -0.27 0.00 -2.93 0.00 0.00 61.98 58.92 2k2n s VAL 135 Cb -0.25 -2.86 -0.15 0.00 -1.53 0.00 0.00 36.38 31.58 2k2n s VAL 135 CO 0.31 0.38 0.74 -0.90 -3.33 0.00 0.00 175.10 172.31 2k2n n ASP 136 N 4.70 -0.07 -0.31 3.54 5.75 -1.25 -3.87 116.55 125.05 2k2n n ASP 136 Ca -0.17 1.13 0.03 0.00 -0.01 0.00 0.00 54.79 55.78 2k2n n ASP 136 Cb 0.51 -1.12 0.11 0.00 -1.03 0.00 0.00 41.12 39.59 2k2n n ASP 136 CO 0.00 0.00 0.00 -0.65 -0.11 0.00 0.00 177.20 176.44 2k2n h PRO 137 N 1.43 -0.00 -0.72 0.11 0.11 -1.85 -2.37 132.00 128.70 2k2n h PRO 137 Ca -0.34 0.00 0.16 0.00 0.11 0.00 0.00 66.00 65.92 2k2n h PRO 137 Cb 1.39 0.00 -0.14 0.00 0.11 0.00 0.00 31.00 32.36 2k2n h PRO 137 CO 0.58 -0.00 -0.14 0.00 -0.21 0.00 0.00 178.00 178.23 2k2n h HIS 139 N 0.00 0.00 0.13 0.00 -0.00 -1.75 -3.13 115.15 110.39 2k2n h HIS 139 Ca 0.37 0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 60.73 2k2n h HIS 139 Cb 0.61 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.02 2k2n h HIS 139 CO -0.52 0.57 -0.06 0.28 -0.00 0.00 0.00 177.93 178.20 2k2n h VAL 140 N 0.00 1.02 0.00 5.26 2.07 0.22 -2.11 116.25 122.71 2k2n h VAL 140 Ca -0.02 -0.62 -0.04 0.00 0.82 0.00 0.00 66.70 66.84 2k2n h VAL 140 Cb 1.45 1.40 -0.01 0.00 -1.52 0.00 0.00 31.29 32.62 2k2n h VAL 140 CO 0.07 0.15 -0.17 -0.74 0.02 0.00 0.00 177.57 176.90 2k2n h HIS 141 N -0.47 0.00 -0.57 1.57 6.17 -1.31 0.48 115.15 121.02 2k2n h HIS 141 Ca -0.02 0.00 0.01 0.00 0.71 0.00 0.00 60.37 61.07 2k2n h HIS 141 Cb 0.37 0.00 -0.03 0.00 2.52 0.00 0.00 27.41 30.27 2k2n h HIS 141 CO 0.02 0.17 0.38 -0.92 0.71 0.00 0.00 177.93 178.29 2k2n h TYR 142 N 0.00 0.72 -0.15 5.26 3.20 -1.43 0.17 116.97 124.73 2k2n h TYR 142 Ca -0.00 0.02 -0.18 0.00 3.14 0.00 0.00 58.73 61.70 2k2n h TYR 142 Cb 0.31 -0.24 0.01 0.00 1.54 0.00 0.00 36.73 38.34 2k2n h TYR 142 CO 0.00 0.46 -0.62 -0.07 -1.64 0.00 0.00 178.16 176.28 2k2n h LEU 143 N 0.77 0.82 -1.05 2.82 3.38 -0.67 -2.69 115.31 118.69 2k2n h LEU 143 Ca 0.21 -0.62 0.21 0.00 0.09 0.00 0.00 57.88 57.77 2k2n h LEU 143 Cb -0.09 -0.24 -0.11 0.00 0.09 0.00 0.00 40.66 40.32 2k2n h LEU 143 CO -0.04 1.30 0.61 0.50 0.09 0.00 0.00 178.44 180.89 2k2n h LYS 144 N 0.39 0.67 0.00 1.13 3.11 -0.51 2.66 116.57 124.03 2k2n h LYS 144 Ca -0.03 -0.04 -0.02 0.00 -2.81 0.00 0.00 60.65 57.74 2k2n h LYS 144 Cb 1.25 -0.15 -0.00 0.00 -1.00 0.00 0.00 32.23 32.33 2k2n h LYS 144 CO 0.13 0.45 -0.11 0.77 -2.81 0.00 0.00 179.45 177.88 2k2n h SER 145 N 0.69 0.00 0.01 4.20 0.02 -0.36 0.70 113.55 118.82 2k2n h SER 145 Ca 0.59 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.54 2k2n h SER 145 Cb 1.01 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.55 2k2n h SER 145 CO -0.39 0.11 -0.02 0.23 -1.14 0.00 0.00 176.83 175.62 2k2n n MET 146 N -4.00 1.53 -1.30 3.45 2.81 0.88 -4.91 117.12 115.57 2k2n n MET 146 Ca -0.02 -0.83 -0.05 0.00 -1.81 0.00 0.00 57.70 54.98 2k2n n MET 146 Cb 0.19 -1.48 -0.02 0.00 -0.71 0.00 0.00 33.22 31.20 2k2n n MET 146 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2k2n n GLY 147 N 1.17 0.70 3.62 3.03 0.00 0.24 -5.02 105.19 108.94 2k2n n GLY 147 Ca 0.19 -0.79 -0.33 0.00 0.00 0.00 0.00 46.02 45.09 2k2n n GLY 147 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2k2n s VAL 148 N -2.21 3.88 -0.16 1.61 1.01 -0.85 -4.33 120.40 119.35 2k2n s VAL 148 Ca 0.00 -0.55 0.05 0.00 0.00 0.00 0.00 61.98 61.47 2k2n s VAL 148 Cb 0.00 -2.66 -0.13 0.00 0.00 0.00 0.00 36.38 33.60 2k2n s VAL 148 CO 0.00 0.49 -0.09 0.00 0.00 0.00 0.00 175.10 175.51 2k2n n ALA 149 N 1.83 1.65 -3.73 5.51 0.00 -0.89 -3.63 120.51 121.25 2k2n n ALA 149 Ca -0.17 -0.76 -0.16 0.00 0.00 0.00 0.00 53.44 52.35 2k2n n ALA 149 Cb 0.53 0.07 -0.16 0.00 0.00 0.00 0.00 19.45 19.89 2k2n n ALA 149 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2k2n s SER 150 N -5.30 0.32 -0.07 0.00 0.15 -1.07 -1.84 113.70 105.90 2k2n s SER 150 Ca -0.17 0.00 0.03 0.00 0.70 0.00 0.00 55.95 56.51 2k2n s SER 150 Cb 0.05 -0.16 -0.02 0.00 -1.71 0.00 0.00 66.02 64.18 2k2n s SER 150 CO 0.43 -0.12 -0.15 -0.44 1.20 0.00 0.00 173.24 174.16 2k2n s SER 151 N 1.10 3.92 -0.05 5.45 0.01 -1.11 -2.11 113.70 120.90 2k2n s SER 151 Ca -0.09 -0.26 0.05 0.00 1.31 0.00 0.00 55.95 56.96 2k2n s SER 151 Cb -0.13 -1.01 -0.02 0.00 0.21 0.00 0.00 66.02 65.07 2k2n s SER 151 CO -0.02 0.29 -0.20 -0.22 0.41 0.00 0.00 173.24 173.50 2k2n s LEU 152 N -0.43 2.36 -0.19 2.44 2.96 -0.79 0.60 118.68 125.63 2k2n s LEU 152 Ca 0.05 -0.37 0.00 0.00 -0.22 0.00 0.00 54.13 53.59 2k2n s LEU 152 Cb -0.12 -1.45 0.05 0.00 0.50 0.00 0.00 46.19 45.17 2k2n s LEU 152 CO 0.02 0.30 -0.07 -0.69 -1.32 0.00 0.00 176.35 174.58 2k2n s VAL 153 N -0.45 1.40 -0.36 1.68 1.01 -0.70 -0.18 120.40 122.80 2k2n s VAL 153 Ca 0.05 -0.90 -0.05 0.00 0.00 0.00 0.00 61.98 61.08 2k2n s VAL 153 Cb -0.12 -1.56 0.06 0.00 0.00 0.00 0.00 36.38 34.77 2k2n s VAL 153 CO 0.01 0.09 0.12 -0.69 0.00 0.00 0.00 175.10 174.63 2k2n s VAL 154 N 1.49 3.51 -0.29 2.92 1.01 -1.18 -3.74 120.40 124.13 2k2n s VAL 154 Ca -0.01 -1.45 -0.43 0.00 0.00 0.00 0.00 61.98 60.08 2k2n s VAL 154 Cb -0.16 -3.12 -0.19 0.00 0.00 0.00 0.00 36.38 32.91 2k2n s VAL 154 CO -0.08 -0.32 1.44 -2.65 0.00 0.00 0.00 175.10 173.49 2k2n n PRO 155 N 4.72 0.19 -2.17 2.72 -0.02 -1.26 -4.31 135.00 134.88 2k2n n PRO 155 Ca -0.10 0.07 -0.28 0.00 -2.02 0.00 0.00 63.50 61.17 2k2n n PRO 155 Cb 0.43 -1.60 0.02 0.00 -0.02 0.00 0.00 33.50 32.33 2k2n n PRO 155 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 2k2n n LEU 156 N 3.28 5.37 0.00 2.45 7.94 -1.26 -4.80 117.00 129.98 2k2n n LEU 156 Ca 0.26 -4.94 -0.13 0.00 -1.11 0.00 0.00 56.01 50.09 2k2n n LEU 156 Cb 0.02 -0.54 -0.03 0.00 0.53 0.00 0.00 43.42 43.40 2k2n n LEU 156 CO 0.78 2.08 0.13 1.15 -1.11 0.00 0.00 177.39 180.42 2k2n n MET 157 N -0.60 0.60 -1.03 1.96 0.00 -1.26 -4.46 117.12 112.32 2k2n n MET 157 Ca 0.44 -2.47 -0.30 0.00 0.00 0.00 0.00 57.70 55.37 2k2n n MET 157 Cb 0.71 2.35 0.25 0.00 0.00 0.00 0.00 33.22 36.53 2k2n n MET 157 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 175.97 174.39 2k2n s HIS 158 N -3.19 0.26 -0.00 3.17 2.46 -1.06 -4.93 115.29 112.00 2k2n s HIS 158 Ca 0.26 0.45 -0.25 0.00 0.47 0.00 0.00 55.06 55.99 2k2n s HIS 158 Cb -0.01 -3.44 -0.18 0.00 -0.13 0.00 0.00 32.58 28.82 2k2n s HIS 158 CO 0.19 -4.04 1.29 1.25 -2.47 0.00 0.00 174.74 170.96 2k2n h HIS 159 N -2.70 -0.12 0.00 3.88 2.76 -1.97 -3.40 115.15 113.60 2k2n h HIS 159 Ca -0.44 -0.00 -0.29 0.00 -2.20 0.00 0.00 60.37 57.44 2k2n h HIS 159 Cb 1.29 0.04 -0.05 0.00 1.55 0.00 0.00 27.41 30.24 2k2n h HIS 159 CO -2.44 0.25 -2.09 0.94 -1.30 0.00 0.00 177.93 173.29 2k2n n GLN 160 N -4.97 0.63 -3.35 5.26 7.27 -1.26 -4.65 117.38 116.31 2k2n n GLN 160 Ca -0.09 0.09 -0.38 0.00 0.07 0.00 0.00 57.00 56.70 2k2n n GLN 160 Cb 0.23 -1.39 -0.06 0.00 2.41 0.00 0.00 30.24 31.43 2k2n n GLN 160 CO 0.00 0.00 0.00 -2.00 0.07 0.00 0.00 177.06 175.13 2k2n s GLU 161 N -2.38 4.12 -0.30 3.69 2.12 -1.26 -4.76 118.70 119.94 2k2n s GLU 161 Ca -0.23 0.62 -0.08 0.00 0.36 0.00 0.00 54.97 55.64 2k2n s GLU 161 Cb 0.06 -3.25 0.00 0.00 0.26 0.00 0.00 34.13 31.21 2k2n s GLU 161 CO 0.47 0.62 0.10 -1.17 -0.54 0.00 0.00 175.26 174.73 2k2n s LEU 162 N -0.95 3.90 -0.15 2.70 0.20 -1.26 -2.55 118.68 120.56 2k2n s LEU 162 Ca 0.27 -0.62 -0.07 0.00 0.69 0.00 0.00 54.13 54.40 2k2n s LEU 162 Cb -0.18 -1.92 -0.24 0.00 -0.43 0.00 0.00 46.19 43.42 2k2n s LEU 162 CO 0.17 -0.18 0.26 0.79 -0.29 0.00 0.00 176.35 177.09 2k2n n TRP 163 N 4.90 1.05 -3.47 5.38 7.02 -1.26 -4.76 117.44 126.30 2k2n n TRP 163 Ca -0.14 0.24 -0.04 0.00 -1.02 0.00 0.00 57.50 56.54 2k2n n TRP 163 Cb 0.49 -1.13 0.00 0.00 -2.42 0.00 0.00 31.31 28.24 2k2n n TRP 163 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2k2n n GLY 164 N 1.96 2.03 2.94 6.99 0.00 -1.26 -0.94 105.19 116.92 2k2n n GLY 164 Ca -0.34 -1.24 -0.14 0.00 0.00 0.00 0.00 46.02 44.30 2k2n n GLY 164 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2k2n s LEU 165 N 0.00 0.49 -0.19 0.99 2.96 -0.82 -4.56 118.68 117.55 2k2n s LEU 165 Ca 0.08 0.36 -0.12 0.00 -0.22 0.00 0.00 54.13 54.23 2k2n s LEU 165 Cb -0.01 0.44 -0.05 0.00 0.50 0.00 0.00 46.19 47.07 2k2n s LEU 165 CO 0.06 -0.17 0.22 -0.22 -1.32 0.00 0.00 176.35 174.92 2k2n s LEU 166 N 1.41 4.21 -0.02 -0.68 2.96 -1.26 -2.63 118.68 122.67 2k2n s LEU 166 Ca -0.07 0.35 0.01 0.00 -0.22 0.00 0.00 54.13 54.20 2k2n s LEU 166 Cb -0.11 -2.24 0.00 0.00 0.50 0.00 0.00 46.19 44.34 2k2n s LEU 166 CO -0.07 0.11 -0.05 0.54 -1.32 0.00 0.00 176.35 175.57 2k2n s VAL 167 N 0.56 0.44 0.09 1.68 0.11 -1.10 -3.12 120.40 119.07 2k2n s VAL 167 Ca 0.12 -0.19 0.06 0.00 -2.93 0.00 0.00 61.98 59.05 2k2n s VAL 167 Cb -0.12 -0.41 -0.04 0.00 -1.53 0.00 0.00 36.38 34.28 2k2n s VAL 167 CO 0.02 0.15 -0.06 -0.44 -3.33 0.00 0.00 175.10 171.44 2k2n s SER 168 N 0.21 4.65 -0.07 3.54 0.01 0.75 -2.75 113.70 120.04 2k2n s SER 168 Ca -0.02 -0.29 0.03 0.00 1.31 0.00 0.00 55.95 56.98 2k2n s SER 168 Cb -0.06 -0.99 0.00 0.00 0.21 0.00 0.00 66.02 65.19 2k2n s SER 168 CO -0.00 0.18 -0.18 -1.00 0.41 0.00 0.00 173.24 172.65 2k2n s HIS 169 N -1.24 1.96 -0.17 2.43 3.76 -0.02 -1.88 115.29 120.13 2k2n s HIS 169 Ca 0.23 -0.73 -0.01 0.00 -0.15 0.00 0.00 55.06 54.40 2k2n s HIS 169 Cb -0.11 -1.35 0.04 0.00 1.11 0.00 0.00 32.58 32.28 2k2n s HIS 169 CO 0.15 -0.31 -0.04 -1.58 -0.85 0.00 0.00 174.74 172.12 2k2n s HIS 170 N 0.39 1.59 -0.36 1.40 2.46 -0.90 -2.95 115.29 116.92 2k2n s HIS 170 Ca -0.14 -1.04 0.26 0.00 0.47 0.00 0.00 55.06 54.61 2k2n s HIS 170 Cb -0.16 -1.26 1.06 0.00 -0.13 0.00 0.00 32.58 32.10 2k2n s HIS 170 CO 0.05 -0.61 1.77 0.00 -2.47 0.00 0.00 174.74 173.48 2k2n h ALA 171 N 8.14 1.00 -3.36 1.58 0.00 -1.87 -2.31 119.26 122.44 2k2n h ALA 171 Ca -0.22 0.00 -0.65 0.00 0.00 0.00 0.00 54.91 54.04 2k2n h ALA 171 Cb 1.11 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.76 2k2n h ALA 171 CO 0.38 0.00 -0.72 -1.21 0.00 0.00 0.00 179.25 177.71 2k2n s GLU 172 N -3.39 2.20 -0.82 0.00 2.02 -1.26 -4.35 118.70 113.09 2k2n s GLU 172 Ca 0.04 -1.05 -0.25 0.00 0.02 0.00 0.00 54.97 53.72 2k2n s GLU 172 Cb 0.09 -2.32 -0.05 0.00 0.10 0.00 0.00 34.13 31.96 2k2n s GLU 172 CO 0.42 0.49 1.95 -1.25 0.02 0.00 0.00 175.26 176.90 2k2n s PRO 173 N -2.42 2.52 -0.49 0.39 0.04 -1.26 -4.72 135.00 129.06 2k2n s PRO 173 Ca 0.23 -0.01 0.04 0.00 0.04 0.00 0.00 61.00 61.30 2k2n s PRO 173 Cb -0.11 -4.88 0.13 0.00 0.04 0.00 0.00 34.50 29.68 2k2n s PRO 173 CO 0.15 -3.27 0.23 1.03 0.04 0.00 0.00 177.00 175.18 2k2n s ARG 174 N 7.12 1.86 0.67 4.56 1.81 -1.26 -5.11 118.95 128.60 2k2n s ARG 174 Ca 0.71 -2.48 -0.17 0.00 -1.72 0.00 0.00 55.73 52.07 2k2n s ARG 174 Cb -0.09 -3.22 -0.06 0.00 -0.45 0.00 0.00 34.95 31.13 2k2n s ARG 174 CO 0.05 -1.09 0.49 -2.30 -0.68 0.00 0.00 175.30 171.77 2k2n n PRO 175 N 3.29 0.37 -4.40 3.54 -0.02 -1.26 -4.99 135.00 131.53 2k2n n PRO 175 Ca 0.05 0.16 -0.33 0.00 -2.02 0.00 0.00 63.50 61.36 2k2n n PRO 175 Cb 0.33 -1.75 -0.10 0.00 -0.02 0.00 0.00 33.50 31.97 2k2n n PRO 175 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 2k2n s TYR 176 N -1.84 2.99 0.37 6.00 2.02 -1.26 -5.09 117.35 120.54 2k2n s TYR 176 Ca 0.66 0.04 0.05 0.00 -0.37 0.00 0.00 57.07 57.44 2k2n s TYR 176 Cb -0.38 -1.66 -0.06 0.00 -0.40 0.00 0.00 41.96 39.45 2k2n s TYR 176 CO 0.57 0.41 0.05 0.45 -1.57 0.00 0.00 175.55 175.46 2k2n s SER 177 N -1.35 2.99 0.53 2.29 0.15 -1.26 -5.00 113.70 112.05 2k2n s SER 177 Ca 0.17 -1.42 0.31 0.00 0.70 0.00 0.00 55.95 55.71 2k2n s SER 177 Cb -0.11 -0.08 1.46 0.00 -1.71 0.00 0.00 66.02 65.58 2k2n s SER 177 CO 0.07 -0.61 1.88 1.56 1.20 0.00 0.00 173.24 177.35 2k2n h GLN 178 N 1.92 0.03 -0.76 5.44 1.08 -2.00 0.28 115.11 121.10 2k2n h GLN 178 Ca -0.41 -0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 56.74 2k2n h GLN 178 Cb 1.25 -0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 28.64 2k2n h GLN 178 CO 0.72 0.02 0.30 0.93 -0.95 0.00 0.00 178.83 179.85 2k2n h GLU 179 N 0.03 1.14 -0.40 1.46 4.39 -1.99 -0.81 114.58 118.39 2k2n h GLU 179 Ca 0.44 -0.21 -0.03 0.00 0.34 0.00 0.00 59.36 59.91 2k2n h GLU 179 Cb 1.71 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 30.16 2k2n h GLU 179 CO -0.02 0.93 0.15 0.93 -1.16 0.00 0.00 179.01 179.84 2k2n h GLU 180 N 1.11 0.61 -0.51 2.33 4.39 -0.84 -2.64 114.58 119.03 2k2n h GLU 180 Ca 0.25 -0.12 -0.05 0.00 0.34 0.00 0.00 59.36 59.78 2k2n h GLU 180 Cb 0.22 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.75 2k2n h GLU 180 CO -0.02 0.59 0.10 -0.07 -1.16 0.00 0.00 179.01 178.45 2k2n h LEU 181 N 0.51 0.74 -1.34 1.33 4.07 -1.32 -2.56 115.31 116.74 2k2n h LEU 181 Ca 0.13 -0.14 0.14 0.00 0.08 0.00 0.00 57.88 58.09 2k2n h LEU 181 Cb 0.22 -0.19 -0.06 0.00 1.08 0.00 0.00 40.66 41.70 2k2n h LEU 181 CO -0.01 0.75 0.55 -0.61 -1.08 0.00 0.00 178.44 178.04 2k2n h GLN 182 N 0.76 0.64 0.27 1.13 5.75 -0.79 0.22 115.11 123.10 2k2n h GLN 182 Ca 0.17 -0.04 -0.01 0.00 -0.15 0.00 0.00 58.65 58.61 2k2n h GLN 182 Cb 0.31 -0.14 0.00 0.00 1.07 0.00 0.00 27.48 28.72 2k2n h GLN 182 CO 0.00 0.42 -0.13 0.28 -2.65 0.00 0.00 178.83 176.75 2k2n h VAL 183 N 0.66 0.69 0.09 2.39 2.07 -1.31 -3.30 116.25 117.54 2k2n h VAL 183 Ca 0.42 -0.78 -0.23 0.00 0.82 0.00 0.00 66.70 66.92 2k2n h VAL 183 Cb 0.69 1.06 0.02 0.00 -1.52 0.00 0.00 31.29 31.55 2k2n h VAL 183 CO -0.18 0.14 -0.97 0.58 0.02 0.00 0.00 177.57 177.16 2k2n h VAL 184 N -0.83 1.37 -0.89 2.57 2.07 -1.52 -3.14 116.25 115.89 2k2n h VAL 184 Ca -0.04 -2.36 0.24 0.00 0.82 0.00 0.00 66.70 65.36 2k2n h VAL 184 Cb 0.51 2.77 -0.15 0.00 -1.52 0.00 0.00 31.29 32.90 2k2n h VAL 184 CO 0.06 0.70 0.16 1.56 0.02 0.00 0.00 177.57 180.08 2k2n h GLN 185 N 0.04 0.14 0.00 1.57 1.08 -0.71 2.08 115.11 119.30 2k2n h GLN 185 Ca -0.15 -0.01 -0.25 0.00 -1.45 0.00 0.00 58.65 56.80 2k2n h GLN 185 Cb 1.69 -0.03 0.01 0.00 -0.05 0.00 0.00 27.48 29.10 2k2n h GLN 185 CO 0.19 0.09 -1.00 -0.07 -0.95 0.00 0.00 178.83 177.09 2k2n h LEU 186 N 0.14 0.72 0.09 1.46 4.07 -1.67 -2.99 115.31 117.14 2k2n h LEU 186 Ca 0.55 -0.58 -0.25 0.00 0.08 0.00 0.00 57.88 57.68 2k2n h LEU 186 Cb 1.12 -0.22 0.03 0.00 1.08 0.00 0.00 40.66 42.66 2k2n h LEU 186 CO -0.72 1.38 -1.05 0.25 -1.08 0.00 0.00 178.44 177.21 2k2n h LEU 187 N 0.31 0.76 -0.90 1.67 5.85 -0.73 -3.20 115.31 119.07 2k2n h LEU 187 Ca -0.11 -0.83 -0.03 0.00 0.84 0.00 0.00 57.88 57.76 2k2n h LEU 187 Cb 1.64 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 42.39 2k2n h LEU 187 CO 0.18 1.51 0.42 0.00 -0.34 0.00 0.00 178.44 180.22 2k2n h ALA 188 N 0.27 1.15 -0.98 1.25 0.00 0.31 -1.51 119.26 119.74 2k2n h ALA 188 Ca -0.16 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 54.66 2k2n h ALA 188 Cb 1.75 -0.34 -0.06 0.00 0.00 0.00 0.00 17.79 19.14 2k2n h ALA 188 CO 0.20 0.66 0.64 -0.44 0.00 0.00 0.00 179.25 180.30 2k2n h ASP 189 N 1.20 1.02 0.94 0.00 3.32 -1.60 0.83 116.42 122.13 2k2n h ASP 189 Ca 0.29 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.30 2k2n h ASP 189 Cb 0.09 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.42 2k2n h ASP 189 CO -0.04 0.66 -0.24 1.56 -1.72 0.00 0.00 179.24 179.46 2k2n h GLN 190 N 1.16 0.00 0.02 3.56 1.08 -1.37 -2.21 115.11 117.36 2k2n h GLN 190 Ca 0.41 0.00 -0.09 0.00 -1.45 0.00 0.00 58.65 57.52 2k2n h GLN 190 Cb 0.13 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.56 2k2n h GLN 190 CO -0.15 0.24 -0.46 0.28 -0.95 0.00 0.00 178.83 177.79 2k2n h VAL 191 N 0.00 1.53 -0.76 -0.54 2.07 0.26 -2.94 116.25 115.86 2k2n h VAL 191 Ca -0.00 -2.34 0.15 0.00 0.82 0.00 0.00 66.70 65.33 2k2n h VAL 191 Cb 0.78 3.08 -0.05 0.00 -1.52 0.00 0.00 31.29 33.58 2k2n h VAL 191 CO 0.03 0.57 0.51 0.77 0.02 0.00 0.00 177.57 179.46 2k2n h SER 192 N -0.88 0.39 -0.08 0.57 4.64 0.53 1.06 113.55 119.78 2k2n h SER 192 Ca -0.11 0.02 -0.07 0.00 -0.47 0.00 0.00 61.79 61.16 2k2n h SER 192 Cb 1.19 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 63.21 2k2n h SER 192 CO -0.02 0.20 -0.15 0.40 -0.87 0.00 0.00 176.83 176.39 2k2n h ILE 193 N 0.41 1.23 -0.37 0.95 2.04 -1.45 -1.91 117.51 118.40 2k2n h ILE 193 Ca 0.37 -1.01 -0.13 0.00 1.00 0.00 0.00 64.86 65.09 2k2n h ILE 193 Cb 0.86 1.20 -0.01 0.00 -0.74 0.00 0.00 36.82 38.13 2k2n h ILE 193 CO -0.12 0.32 -0.30 0.00 0.00 0.00 0.00 178.15 178.05 2k2n h ALA 194 N 1.45 0.77 -0.37 1.87 0.00 0.12 0.18 119.26 123.28 2k2n h ALA 194 Ca 0.07 -0.41 0.01 0.00 0.00 0.00 0.00 54.91 54.58 2k2n h ALA 194 Cb 0.49 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2k2n h ALA 194 CO 0.03 0.65 0.23 0.82 0.00 0.00 0.00 179.25 180.99 2k2n h ILE 195 N 0.68 1.07 -0.11 0.00 1.08 -0.32 0.79 117.51 120.70 2k2n h ILE 195 Ca 0.08 -0.16 -0.06 0.00 -0.39 0.00 0.00 64.86 64.32 2k2n h ILE 195 Cb 0.85 0.55 -0.00 0.00 -3.07 0.00 0.00 36.82 35.15 2k2n h ILE 195 CO 0.07 0.09 -0.18 0.00 -0.69 0.00 0.00 178.15 177.44 2k2n h ALA 196 N 1.15 0.17 -0.32 1.87 0.00 -1.23 -2.36 119.26 118.53 2k2n h ALA 196 Ca 0.14 -0.35 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 2k2n h ALA 196 Cb -0.03 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2k2n h ALA 196 CO -0.05 0.09 -0.02 1.96 0.00 0.00 0.00 179.25 181.23 2k2n h GLN 197 N -0.12 0.59 -0.22 0.00 4.20 -0.53 -3.06 115.11 115.97 2k2n h GLN 197 Ca 0.01 -0.20 -0.06 0.00 0.06 0.00 0.00 58.65 58.45 2k2n h GLN 197 Cb 0.75 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.47 2k2n h GLN 197 CO 0.04 0.73 -0.15 0.00 -0.67 0.00 0.00 178.83 178.78 2k2n h ALA 198 N 0.83 1.34 -0.28 3.87 0.00 0.53 -2.77 119.26 122.78 2k2n h ALA 198 Ca 0.09 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 2k2n h ALA 198 Cb 0.49 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2k2n h ALA 198 CO 0.02 0.44 0.16 1.49 0.00 0.00 0.00 179.25 181.37 2k2n h GLU 199 N 0.34 0.38 -0.38 0.00 4.57 -1.31 -1.87 114.58 116.30 2k2n h GLU 199 Ca 0.06 -0.03 -0.05 0.00 -1.18 0.00 0.00 59.36 58.17 2k2n h GLU 199 Cb 0.47 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.96 2k2n h GLU 199 CO 0.03 0.27 0.05 -0.07 -1.18 0.00 0.00 179.01 178.11 2k2n h LEU 200 N 0.39 0.54 0.15 1.64 3.38 -1.50 -3.01 115.31 116.89 2k2n h LEU 200 Ca 0.10 -0.09 0.01 0.00 0.09 0.00 0.00 57.88 57.99 2k2n h LEU 200 Cb -0.01 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 2k2n h LEU 200 CO -0.02 0.58 -0.27 0.28 0.09 0.00 0.00 178.44 179.10 2k2n h SER 201 N 0.57 -0.77 0.00 -0.43 0.02 -1.43 -3.53 113.55 107.98 2k2n h SER 201 Ca 0.13 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.16 2k2n h SER 201 Cb 0.29 0.29 0.00 0.00 0.14 0.00 0.00 62.40 63.12 2k2n h SER 201 CO 0.00 -0.37 0.00 0.18 -1.14 0.00 0.00 176.83 175.51