#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 -1.09 -0.84 1.96 2.03 -2.00 -1.15 116.42 115.33 2k2n h ASP 32 Ca 0.00 0.16 0.14 0.00 -0.73 0.00 0.00 57.03 56.60 2k2n h ASP 32 Cb 0.00 0.46 -0.09 0.00 -0.83 0.00 0.00 39.33 38.87 2k2n h ASP 32 CO 0.00 -0.37 0.44 -0.61 -1.03 0.00 0.00 179.24 177.67 2k2n h GLN 33 N -0.40 0.63 0.03 4.15 4.15 -2.00 -1.06 115.11 120.60 2k2n h GLN 33 Ca 0.10 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.48 2k2n h GLN 33 Cb 0.57 -0.14 -0.00 0.00 0.21 0.00 0.00 27.48 28.11 2k2n h GLN 33 CO -0.39 0.41 -0.03 0.82 -1.93 0.00 0.00 178.83 177.72 2k2n h ILE 34 N 0.64 0.94 -0.37 2.39 1.08 -1.67 -2.84 117.51 117.68 2k2n h ILE 34 Ca 0.45 0.00 0.02 0.00 -0.39 0.00 0.00 64.86 64.95 2k2n h ILE 34 Cb 0.61 0.94 -0.03 0.00 -3.07 0.00 0.00 36.82 35.27 2k2n h ILE 34 CO -0.34 0.00 0.19 -0.07 -0.69 0.00 0.00 178.15 177.24 2k2n h LEU 35 N -0.06 0.29 -1.04 1.44 3.38 -0.34 -1.45 115.31 117.53 2k2n h LEU 35 Ca 0.00 0.01 0.23 0.00 0.09 0.00 0.00 57.88 58.21 2k2n h LEU 35 Cb 0.06 -0.04 -0.12 0.00 0.09 0.00 0.00 40.66 40.65 2k2n h LEU 35 CO -0.01 0.21 0.61 -0.09 0.09 0.00 0.00 178.44 179.25 2k2n h ARG 36 N 0.40 0.62 0.00 1.13 2.43 -1.07 1.49 114.38 119.37 2k2n h ARG 36 Ca 0.15 -0.04 -0.11 0.00 -0.81 0.00 0.00 59.98 59.18 2k2n h ARG 36 Cb 0.05 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.44 2k2n h ARG 36 CO -0.10 0.41 -0.51 0.00 -1.51 0.00 0.00 179.97 178.26 2k2n h ALA 37 N 1.69 1.10 -0.07 2.80 0.00 -1.08 -2.81 119.26 120.88 2k2n h ALA 37 Ca 0.62 -0.46 -0.21 0.00 0.00 0.00 0.00 54.91 54.85 2k2n h ALA 37 Cb 1.12 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.85 2k2n h ALA 37 CO -0.43 0.64 -0.77 1.15 0.00 0.00 0.00 179.25 179.84 2k2n h THR 38 N 0.00 1.32 -0.18 0.00 2.02 0.29 -2.95 112.91 113.41 2k2n h THR 38 Ca -0.01 -2.03 -0.19 0.00 0.77 0.00 0.00 66.41 64.95 2k2n h THR 38 Cb 0.93 2.24 0.00 0.00 -1.74 0.00 0.00 68.15 69.58 2k2n h THR 38 CO 0.07 0.63 -0.65 1.62 0.37 0.00 0.00 175.52 177.55 2k2n h VAL 39 N 0.31 1.31 -0.43 3.16 3.04 -0.45 -2.60 116.25 120.58 2k2n h VAL 39 Ca -0.07 -1.90 -0.11 0.00 -1.01 0.00 0.00 66.70 63.61 2k2n h VAL 39 Cb 1.42 1.87 -0.01 0.00 -2.01 0.00 0.00 31.29 32.55 2k2n h VAL 39 CO 0.15 0.60 -0.14 -0.33 -1.01 0.00 0.00 177.57 176.84 2k2n h GLU 40 N 0.48 0.86 -0.29 4.17 4.39 -1.60 -2.71 114.58 119.89 2k2n h GLU 40 Ca -0.02 -0.35 -0.06 0.00 0.34 0.00 0.00 59.36 59.27 2k2n h GLU 40 Cb 1.24 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.84 2k2n h GLU 40 CO 0.13 0.99 -0.07 1.49 -1.16 0.00 0.00 179.01 180.39 2k2n h GLU 41 N 0.69 0.55 -0.57 2.33 4.57 -1.55 -3.08 114.58 117.52 2k2n h GLU 41 Ca 0.10 -0.21 -0.02 0.00 -1.18 0.00 0.00 59.36 58.06 2k2n h GLU 41 Cb 0.69 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 29.22 2k2n h GLU 41 CO 0.05 0.75 0.27 0.28 -1.18 0.00 0.00 179.01 179.18 2k2n h VAL 42 N 0.31 1.19 -0.26 0.32 2.07 -1.48 -2.77 116.25 115.64 2k2n h VAL 42 Ca 0.07 -0.53 0.01 0.00 0.82 0.00 0.00 66.70 67.06 2k2n h VAL 42 Cb 0.54 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 2k2n h VAL 42 CO 0.03 0.22 0.17 -0.09 0.02 0.00 0.00 177.57 177.92 2k2n h ARG 43 N 0.80 0.33 -0.57 1.57 9.65 -1.40 -1.56 114.38 123.22 2k2n h ARG 43 Ca 0.20 -0.02 0.09 0.00 -1.10 0.00 0.00 59.98 59.15 2k2n h ARG 43 Cb 0.09 -0.08 -0.03 0.00 -1.39 0.00 0.00 29.97 28.56 2k2n h ARG 43 CO -0.03 0.22 0.38 0.00 2.80 0.00 0.00 179.97 183.35 2k2n h ALA 44 N 1.10 2.03 -0.09 2.80 0.00 -1.41 2.25 119.26 125.94 2k2n h ALA 44 Ca 0.10 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.79 2k2n h ALA 44 Cb -0.03 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.70 2k2n h ALA 44 CO -0.03 -0.16 -0.77 0.35 0.00 0.00 0.00 179.25 178.65 2k2n h PHE 45 N 0.38 0.95 0.00 0.00 3.57 -1.29 -3.31 116.94 117.23 2k2n h PHE 45 Ca 0.26 -0.45 -0.24 0.00 3.53 0.00 0.00 57.97 61.07 2k2n h PHE 45 Cb 0.53 -0.13 -0.04 0.00 2.79 0.00 0.00 35.95 39.09 2k2n h PHE 45 CO -0.00 1.27 -1.42 -0.07 -2.23 0.00 0.00 178.31 175.86 2k2n h LEU 46 N 0.35 0.00 0.92 0.59 3.38 -0.44 -3.47 115.31 116.65 2k2n h LEU 46 Ca -0.07 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.75 2k2n h LEU 46 Cb 1.41 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 42.10 2k2n h LEU 46 CO 0.16 0.90 -0.14 0.61 0.09 0.00 0.00 178.44 180.06 2k2n n GLY 47 N 1.46 0.72 0.00 0.83 0.00 0.75 -4.84 105.19 104.11 2k2n n GLY 47 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 2k2n n GLY 47 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2k2n n THR 48 N -1.48 0.00 0.00 2.61 -2.24 -1.26 -5.02 114.28 106.89 2k2n n THR 48 Ca -0.08 0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 2k2n n THR 48 Cb 0.26 -0.99 0.00 0.00 -2.10 0.00 0.00 70.33 67.51 2k2n n THR 48 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2k2n n ASP 49 N 0.00 0.00 -3.66 3.42 2.03 -1.13 -4.83 116.55 112.38 2k2n n ASP 49 Ca 0.00 0.00 -0.06 0.00 0.52 0.00 0.00 54.79 55.25 2k2n n ASP 49 Cb 0.00 0.32 -0.07 0.00 -0.72 0.00 0.00 41.12 40.65 2k2n n ASP 49 CO 0.00 0.00 0.00 -0.60 -1.92 0.00 0.00 177.20 174.68 2k2n s ARG 50 N -1.85 0.56 -0.03 -0.67 3.52 -1.14 -2.91 118.95 116.42 2k2n s ARG 50 Ca 0.00 1.17 0.00 0.00 -0.13 0.00 0.00 55.73 56.78 2k2n s ARG 50 Cb 0.00 0.33 0.03 0.00 -1.56 0.00 0.00 34.95 33.74 2k2n s ARG 50 CO 0.00 -0.18 -0.01 0.54 -0.81 0.00 0.00 175.30 174.84 2k2n s VAL 51 N 2.07 0.25 0.05 7.11 0.11 -1.21 0.68 120.40 129.46 2k2n s VAL 51 Ca -0.08 0.05 -0.01 0.00 -2.93 0.00 0.00 61.98 59.02 2k2n s VAL 51 Cb -0.09 -0.34 -0.04 0.00 -1.53 0.00 0.00 36.38 34.39 2k2n s VAL 51 CO -0.17 0.17 -0.02 -1.59 -3.33 0.00 0.00 175.10 170.15 2k2n s LYS 52 N 1.07 0.60 -0.15 1.54 -2.85 -1.04 -2.69 119.74 116.22 2k2n s LYS 52 Ca -0.09 -1.17 -0.08 0.00 -1.00 0.00 0.00 55.97 53.62 2k2n s LYS 52 Cb -0.14 0.21 -0.04 0.00 -2.06 0.00 0.00 37.83 35.80 2k2n s LYS 52 CO -0.02 -0.11 0.14 0.08 0.10 0.00 0.00 175.35 175.55 2k2n s VAL 53 N -3.75 5.46 -0.30 1.79 1.01 -0.84 -2.71 120.40 121.06 2k2n s VAL 53 Ca 0.05 0.22 0.00 0.00 0.00 0.00 0.00 61.98 62.26 2k2n s VAL 53 Cb 0.07 -3.43 0.06 0.00 0.00 0.00 0.00 36.38 33.08 2k2n s VAL 53 CO -0.09 0.55 -0.02 -0.47 0.00 0.00 0.00 175.10 175.06 2k2n s TYR 54 N -0.51 3.33 -0.11 5.22 5.04 0.12 -3.62 117.35 126.83 2k2n s TYR 54 Ca 0.13 -2.18 -0.26 0.00 -2.44 0.00 0.00 57.07 52.31 2k2n s TYR 54 Cb -0.12 -2.19 -0.02 0.00 0.35 0.00 0.00 41.96 39.98 2k2n s TYR 54 CO 0.02 -0.86 0.86 0.50 -1.34 0.00 0.00 175.55 174.73 2k2n s ARG 55 N 1.16 4.40 -0.04 4.97 6.06 -1.20 0.91 118.95 135.21 2k2n s ARG 55 Ca -0.04 1.13 -0.15 0.00 -2.50 0.00 0.00 55.73 54.16 2k2n s ARG 55 Cb -0.20 -3.52 -0.05 0.00 0.06 0.00 0.00 34.95 31.24 2k2n s ARG 55 CO -0.03 -0.19 0.41 0.12 -2.50 0.00 0.00 175.30 173.10 2k2n s PHE 56 N 1.63 3.66 -0.06 5.12 5.36 0.20 -2.69 117.98 131.19 2k2n s PHE 56 Ca 0.42 0.93 0.00 0.00 -0.96 0.00 0.00 56.93 57.33 2k2n s PHE 56 Cb -0.18 -2.34 -0.03 0.00 -0.34 0.00 0.00 43.02 40.13 2k2n s PHE 56 CO 0.17 0.51 -0.03 -0.51 -1.46 0.00 0.00 175.22 173.90 2k2n s ASP 57 N -0.60 4.92 0.58 6.13 1.11 -1.26 -4.84 116.67 122.71 2k2n s ASP 57 Ca 0.23 0.03 0.33 0.00 0.18 0.00 0.00 52.55 53.32 2k2n s ASP 57 Cb -0.16 -1.30 1.38 0.00 1.07 0.00 0.00 42.92 43.92 2k2n s ASP 57 CO 0.12 0.35 1.69 -0.65 1.18 0.00 0.00 175.17 177.86 2k2n h PRO 58 N 5.06 0.00 0.00 8.23 0.11 -1.98 1.63 132.00 145.04 2k2n h PRO 58 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2k2n h PRO 58 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2k2n h PRO 58 CO 0.54 0.00 -0.45 0.93 -0.21 0.00 0.00 178.00 178.80 2k2n h GLU 59 N 0.00 0.00 0.00 1.05 5.08 -2.04 -3.47 114.58 115.20 2k2n h GLU 59 Ca 0.45 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.81 2k2n h GLU 59 Cb 2.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.43 2k2n h GLU 59 CO -0.00 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.42 2k2n n GLY 60 N 1.21 1.50 3.56 -3.84 0.00 0.56 -4.92 105.19 103.25 2k2n n GLY 60 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 2k2n n GLY 60 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2k2n s HIS 61 N -2.25 2.40 0.24 1.61 3.76 -1.26 -4.56 115.29 115.23 2k2n s HIS 61 Ca 0.00 -0.56 -0.08 0.00 -0.15 0.00 0.00 55.06 54.27 2k2n s HIS 61 Cb 0.00 -4.58 -0.06 0.00 1.11 0.00 0.00 32.58 29.04 2k2n s HIS 61 CO 0.00 -1.91 0.54 0.20 -0.85 0.00 0.00 174.74 172.72 2k2n s GLY 62 N 5.47 2.15 0.07 -2.22 0.00 -1.26 -4.08 107.32 107.45 2k2n s GLY 62 Ca 0.50 -0.37 0.08 0.00 0.00 0.00 0.00 44.72 44.93 2k2n s GLY 62 CO -0.07 -0.25 -0.22 -0.51 0.00 0.00 0.00 173.10 172.04 2k2n s THR 63 N -1.90 1.82 -0.42 0.90 -4.23 -1.10 -3.27 115.64 107.45 2k2n s THR 63 Ca 0.46 -1.38 -0.29 0.00 -1.18 0.00 0.00 61.69 59.31 2k2n s THR 63 Cb -0.11 -1.60 0.01 0.00 1.34 0.00 0.00 72.50 72.15 2k2n s THR 63 CO 0.24 0.15 1.36 -0.69 -0.54 0.00 0.00 174.62 175.15 2k2n s VAL 64 N -0.92 3.96 -1.77 2.29 1.01 -1.19 -3.20 120.40 120.57 2k2n s VAL 64 Ca 0.09 0.99 0.16 0.00 0.00 0.00 0.00 61.98 63.21 2k2n s VAL 64 Cb -0.09 -4.26 0.22 0.00 0.00 0.00 0.00 36.38 32.24 2k2n s VAL 64 CO 0.03 -0.78 1.11 0.52 0.00 0.00 0.00 175.10 175.97 2k2n n VAL 65 N 6.99 0.30 -3.65 2.92 0.31 -1.24 -2.99 118.33 120.97 2k2n n VAL 65 Ca 0.16 -0.65 -0.03 0.00 -0.01 0.00 0.00 64.34 63.81 2k2n n VAL 65 Cb 0.48 1.08 -0.05 0.00 -0.91 0.00 0.00 33.84 34.44 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 -1.22 -1.97 -0.08 3.52 0.00 -1.26 -4.11 121.76 116.64 2k2n s ALA 66 Ca 0.23 2.34 -0.03 0.00 0.00 0.00 0.00 51.96 54.49 2k2n s ALA 66 Cb 0.14 -1.67 0.04 0.00 0.00 0.00 0.00 23.12 21.63 2k2n s ALA 66 CO 0.20 -0.78 0.17 -2.00 0.00 0.00 0.00 175.76 173.35 2k2n s GLU 67 N 2.56 0.12 -0.02 0.00 2.56 -1.26 -1.99 118.70 120.67 2k2n s GLU 67 Ca -0.07 0.41 0.04 0.00 0.00 0.00 0.00 54.97 55.35 2k2n s GLU 67 Cb -0.10 -0.16 -0.01 0.00 2.00 0.00 0.00 34.13 35.86 2k2n s GLU 67 CO -0.19 -0.16 -0.15 0.00 -0.56 0.00 0.00 175.26 174.20 2k2n s ALA 68 N 1.18 1.23 0.01 6.30 0.00 -1.09 -4.78 121.76 124.61 2k2n s ALA 68 Ca -0.09 -0.62 -0.01 0.00 0.00 0.00 0.00 51.96 51.24 2k2n s ALA 68 Cb -0.11 -0.33 -0.01 0.00 0.00 0.00 0.00 23.12 22.67 2k2n s ALA 68 CO -0.07 0.29 0.01 -0.98 0.00 0.00 0.00 175.76 175.02 2k2n s ARG 69 N -0.27 0.21 0.35 0.00 1.70 -1.26 -3.30 118.95 116.37 2k2n s ARG 69 Ca 0.04 -0.31 0.14 0.00 -0.47 0.00 0.00 55.73 55.12 2k2n s ARG 69 Cb -0.06 0.08 1.01 0.00 -0.57 0.00 0.00 34.95 35.41 2k2n s ARG 69 CO -0.00 -0.04 1.71 0.78 -1.08 0.00 0.00 175.30 176.67 2k2n h GLY 70 N 5.22 1.78 0.00 3.88 0.00 -1.88 -3.47 103.07 108.60 2k2n h GLY 70 Ca -0.29 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 46.78 2k2n h GLY 70 CO 0.44 -0.29 0.00 0.61 0.00 0.00 0.00 176.54 177.30 2k2n n GLY 71 N -1.35 -0.62 0.55 4.60 0.00 -1.26 -4.94 105.19 102.18 2k2n n GLY 71 Ca 0.28 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.69 2k2n n GLY 71 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2k2n n GLU 72 N 0.00 0.63 -0.03 1.61 -0.00 -1.26 -3.42 120.64 118.17 2k2n n GLU 72 Ca 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 57.16 57.01 2k2n n GLU 72 Cb 0.00 -1.30 -0.12 0.00 -0.00 0.00 0.00 31.44 30.02 2k2n n GLU 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2k2n h ARG 73 N 0.41 0.15 -6.76 3.44 3.08 -1.96 -3.46 114.38 109.29 2k2n h ARG 73 Ca 0.00 -0.17 -0.66 0.00 0.07 0.00 0.00 59.98 59.21 2k2n h ARG 73 Cb 0.34 0.05 -0.22 0.00 0.08 0.00 0.00 29.97 30.23 2k2n h ARG 73 CO 0.00 0.94 -0.86 -0.51 -1.07 0.00 0.00 179.97 178.47 2k2n s LEU 74 N -8.46 2.33 0.70 3.04 1.43 -1.22 -5.14 118.68 111.37 2k2n s LEU 74 Ca -0.16 -0.75 -0.12 0.00 -1.03 0.00 0.00 54.13 52.06 2k2n s LEU 74 Cb 0.00 -1.16 0.02 0.00 0.03 0.00 0.00 46.19 45.09 2k2n s LEU 74 CO 0.74 0.15 1.09 -2.16 0.23 0.00 0.00 176.35 176.40 2k2n s PRO 75 N -2.09 2.68 -0.13 1.29 0.04 -1.26 -4.86 135.00 130.67 2k2n s PRO 75 Ca 0.13 1.19 -0.14 0.00 0.04 0.00 0.00 61.00 62.22 2k2n s PRO 75 Cb -0.10 -1.95 -0.05 0.00 0.04 0.00 0.00 34.50 32.45 2k2n s PRO 75 CO 0.06 -1.32 0.32 -1.54 0.04 0.00 0.00 177.00 174.56 2k2n s SER 76 N -3.17 6.51 -0.09 6.66 1.04 -1.26 -4.96 113.70 118.43 2k2n s SER 76 Ca 0.62 0.60 0.09 0.00 0.48 0.00 0.00 55.95 57.74 2k2n s SER 76 Cb -0.17 -2.20 0.41 0.00 0.10 0.00 0.00 66.02 64.17 2k2n s SER 76 CO 0.49 0.14 1.20 0.18 0.98 0.00 0.00 173.24 176.23 2k2n n LEU 77 N 3.25 3.14 -4.71 2.42 4.77 -1.26 -4.93 117.00 119.68 2k2n n LEU 77 Ca -0.12 -1.59 -0.42 0.00 -0.03 0.00 0.00 56.01 53.85 2k2n n LEU 77 Cb 0.52 -0.51 -0.03 0.00 -2.33 0.00 0.00 43.42 41.08 2k2n n LEU 77 CO 0.39 0.47 1.01 -0.22 -1.33 0.00 0.00 177.39 177.71 2k2n s LEU 78 N -1.34 4.35 0.00 2.23 2.96 -1.26 -2.65 118.68 122.97 2k2n s LEU 78 Ca 0.28 2.15 0.00 0.00 -0.22 0.00 0.00 54.13 56.35 2k2n s LEU 78 Cb 0.20 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 43.31 2k2n s LEU 78 CO 0.11 -0.60 0.00 0.61 -1.32 0.00 0.00 176.35 175.15 2k2n n GLY 79 N 3.42 2.14 3.84 7.98 0.00 -1.16 -5.02 105.19 116.40 2k2n n GLY 79 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 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 3.88 -0.13 0.99 1.43 -1.08 -4.85 118.68 118.91 2k2n s LEU 80 Ca 0.00 1.43 -0.04 0.00 -1.03 0.00 0.00 54.13 54.49 2k2n s LEU 80 Cb 0.00 -4.29 -0.03 0.00 0.03 0.00 0.00 46.19 41.89 2k2n s LEU 80 CO 0.00 -0.38 -0.00 -0.89 0.23 0.00 0.00 176.35 175.31 2k2n s THR 81 N -2.27 4.24 0.38 5.49 2.01 -1.26 -3.19 115.64 121.03 2k2n s THR 81 Ca 0.57 -0.25 -0.14 0.00 0.31 0.00 0.00 61.69 62.18 2k2n s THR 81 Cb -0.10 -2.83 -0.08 0.00 0.01 0.00 0.00 72.50 69.50 2k2n s THR 81 CO 0.22 0.53 0.79 -0.36 -0.69 0.00 0.00 174.62 175.12 2k2n s PHE 82 N -0.16 3.41 0.18 4.92 0.40 -1.20 -5.01 117.98 120.51 2k2n s PHE 82 Ca 0.05 1.21 -0.31 0.00 -0.60 0.00 0.00 56.93 57.27 2k2n s PHE 82 Cb -0.13 -2.55 -0.10 0.00 0.51 0.00 0.00 43.02 40.76 2k2n s PHE 82 CO 0.02 -0.04 1.55 -1.25 0.70 0.00 0.00 175.22 176.20 2k2n s PRO 83 N -3.42 4.22 0.18 0.24 0.04 -1.26 -4.56 135.00 130.44 2k2n s PRO 83 Ca 0.54 2.36 -0.31 0.00 0.04 0.00 0.00 61.00 63.63 2k2n s PRO 83 Cb -0.10 -3.15 -0.10 0.00 0.04 0.00 0.00 34.50 31.19 2k2n s PRO 83 CO 0.24 -0.59 1.51 0.00 0.04 0.00 0.00 177.00 178.20 2k2n s ALA 84 N 0.99 3.71 0.00 8.56 0.00 -1.26 -2.49 121.76 131.27 2k2n s ALA 84 Ca 0.69 1.33 0.00 0.00 0.00 0.00 0.00 51.96 53.98 2k2n s ALA 84 Cb -0.44 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.09 2k2n s ALA 84 CO 0.33 -0.75 0.00 0.41 0.00 0.00 0.00 175.76 175.75 2k2n n GLY 85 N 3.27 0.72 0.23 0.00 0.00 -1.26 -4.94 105.19 103.21 2k2n n GLY 85 Ca 0.12 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.29 2k2n n GLY 85 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2k2n h ASP 86 N 0.00 0.00 -3.36 1.61 2.03 -1.85 -3.35 116.42 111.51 2k2n h ASP 86 Ca 0.00 0.00 -0.73 0.00 -0.73 0.00 0.00 57.03 55.57 2k2n h ASP 86 Cb 0.00 0.00 -0.27 0.00 -0.83 0.00 0.00 39.33 38.23 2k2n h ASP 86 CO 0.00 0.00 -0.40 -0.63 -1.03 0.00 0.00 179.24 177.18 2k2n s ILE 87 N -3.73 4.47 0.00 4.15 1.01 -1.26 -5.08 121.20 120.75 2k2n s ILE 87 Ca -0.02 -1.46 0.00 0.00 0.00 0.00 0.00 60.65 59.17 2k2n s ILE 87 Cb 0.09 -3.79 0.00 0.00 0.01 0.00 0.00 42.46 38.77 2k2n s ILE 87 CO 0.33 -0.62 0.00 -2.65 0.00 0.00 0.00 174.94 172.00 2k2n n PRO 88 N 4.99 2.56 -0.05 2.79 -0.02 -1.26 -4.85 135.00 139.16 2k2n n PRO 88 Ca -0.10 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 61.27 2k2n n PRO 88 Cb 0.42 0.00 -0.04 0.00 -0.02 0.00 0.00 33.50 33.87 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 0.00 0.30 -0.13 -0.52 4.07 -1.26 -4.31 120.64 118.79 2k2n n GLU 89 Ca 0.00 0.13 -0.09 0.00 -0.06 0.00 0.00 57.16 57.14 2k2n n GLU 89 Cb 0.00 -1.02 -0.01 0.00 -0.06 0.00 0.00 31.44 30.35 2k2n n GLU 89 CO 0.00 0.00 0.00 1.49 -0.06 0.00 0.00 177.13 178.56 2k2n h GLU 90 N -0.54 0.60 -0.11 5.31 4.57 -1.98 -2.77 114.58 119.66 2k2n h GLU 90 Ca -0.21 -0.11 -0.02 0.00 -1.18 0.00 0.00 59.36 57.85 2k2n h GLU 90 Cb 0.97 -0.10 -0.00 0.00 -0.16 0.00 0.00 28.75 29.46 2k2n h GLU 90 CO -0.12 0.57 -0.00 0.00 -1.18 0.00 0.00 179.01 178.27 2k2n h ALA 91 N 1.00 0.15 -0.65 2.92 0.00 -1.97 -3.02 119.26 117.69 2k2n h ALA 91 Ca 0.13 -0.19 0.09 0.00 0.00 0.00 0.00 54.91 54.94 2k2n h ALA 91 Cb 0.20 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 2k2n h ALA 91 CO -0.01 -0.15 0.43 -0.09 0.00 0.00 0.00 179.25 179.43 2k2n h ARG 92 N -0.08 0.52 -0.42 0.00 2.43 -1.74 -0.84 114.38 114.24 2k2n h ARG 92 Ca 0.03 -0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 59.11 2k2n h ARG 92 Cb 0.37 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.78 2k2n h ARG 92 CO 0.01 0.34 0.03 -0.09 -1.51 0.00 0.00 179.97 178.74 2k2n h ARG 93 N 0.53 0.66 -0.70 0.20 2.43 -1.36 -2.48 114.38 113.65 2k2n h ARG 93 Ca 0.30 -0.15 -0.04 0.00 -0.81 0.00 0.00 59.98 59.28 2k2n h ARG 93 Cb 0.47 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.89 2k2n h ARG 93 CO -0.09 0.66 0.28 -0.07 -1.51 0.00 0.00 179.97 179.23 2k2n h LEU 94 N 0.63 0.95 -1.98 3.80 3.38 -1.09 -0.30 115.31 120.69 2k2n h LEU 94 Ca 0.13 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2k2n h LEU 94 Cb 0.35 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 2k2n h LEU 94 CO 0.01 0.84 -0.01 -0.26 0.09 0.00 0.00 178.44 179.11 2k2n h PHE 95 N 1.01 0.00 0.00 1.13 0.04 -1.32 0.81 116.94 118.62 2k2n h PHE 95 Ca 0.24 0.00 -0.16 0.00 2.80 0.00 0.00 57.97 60.85 2k2n h PHE 95 Cb 0.19 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.32 2k2n h PHE 95 CO 0.02 0.01 -0.98 -0.09 -0.60 0.00 0.00 178.31 176.67 2k2n h ARG 96 N 0.00 0.00 0.01 1.51 2.43 -1.10 -3.22 114.38 114.01 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 0.02 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.52 2k2n h ARG 96 CO 0.00 0.51 -2.22 1.28 -1.51 0.00 0.00 179.97 178.04 2k2n n LEU 97 N -3.12 2.22 -0.14 3.80 4.77 -0.25 -4.41 117.00 119.87 2k2n n LEU 97 Ca -0.04 0.24 0.04 0.00 -0.03 0.00 0.00 56.01 56.23 2k2n n LEU 97 Cb 0.83 -0.90 -0.01 0.00 -2.33 0.00 0.00 43.42 41.00 2k2n n LEU 97 CO 0.43 0.62 0.14 0.00 -1.33 0.00 0.00 177.39 177.25 2k2n n ALA 98 N -3.74 2.81 -3.69 -1.18 0.00 0.27 -5.04 120.51 109.94 2k2n n ALA 98 Ca -0.46 -0.36 -0.30 0.00 0.00 0.00 0.00 53.44 52.32 2k2n n ALA 98 Cb 0.88 -0.29 0.01 0.00 0.00 0.00 0.00 19.45 20.06 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 -0.52 -1.69 0.00 0.00 1.13 -1.12 -4.94 117.38 110.24 2k2n n GLN 99 Ca 0.03 1.00 0.00 0.00 -1.94 0.00 0.00 57.00 56.09 2k2n n GLN 99 Cb 0.16 -2.22 0.00 0.00 0.11 0.00 0.00 30.24 28.29 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 -1.75 0.00 -3.64 5.09 3.14 -1.26 -4.91 118.33 114.99 2k2n n VAL 100 Ca -0.24 0.00 -0.05 0.00 -2.96 0.00 0.00 64.34 61.09 2k2n n VAL 100 Cb 0.69 0.00 -0.07 0.00 -1.06 0.00 0.00 33.84 33.40 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 0.44 0.05 1.45 6.06 -1.23 -4.87 118.95 120.85 2k2n s ARG 101 Ca 0.00 0.64 -0.13 0.00 -2.50 0.00 0.00 55.73 53.73 2k2n s ARG 101 Cb 0.00 0.15 0.02 0.00 0.06 0.00 0.00 34.95 35.18 2k2n s ARG 101 CO 0.00 -0.07 0.30 0.14 -2.50 0.00 0.00 175.30 173.17 2k2n s VAL 102 N 0.83 0.09 -0.10 7.11 -7.23 -1.26 -1.46 120.40 118.37 2k2n s VAL 102 Ca -0.03 -0.70 0.00 0.00 -1.81 0.00 0.00 61.98 59.43 2k2n s VAL 102 Cb -0.04 -0.96 -0.02 0.00 0.56 0.00 0.00 36.38 35.91 2k2n s VAL 102 CO -0.11 -0.39 -0.10 -0.63 -0.31 0.00 0.00 175.10 173.56 2k2n s ILE 103 N -2.65 3.41 0.46 -0.62 1.01 0.37 -4.93 121.20 118.24 2k2n s ILE 103 Ca -0.04 -0.56 -0.01 0.00 0.00 0.00 0.00 60.65 60.04 2k2n s ILE 103 Cb -0.01 -2.42 -0.01 0.00 0.01 0.00 0.00 42.46 40.04 2k2n s ILE 103 CO -0.04 0.55 0.70 0.68 0.00 0.00 0.00 174.94 176.82 2k2n s VAL 104 N -0.15 4.16 -0.34 2.92 -7.23 -1.26 -2.80 120.40 115.70 2k2n s VAL 104 Ca 0.01 -0.37 -0.42 0.00 -1.81 0.00 0.00 61.98 59.39 2k2n s VAL 104 Cb -0.13 -3.55 -0.17 0.00 0.56 0.00 0.00 36.38 33.09 2k2n s VAL 104 CO 0.03 -0.42 1.71 0.47 -0.31 0.00 0.00 175.10 176.58 2k2n n ASP 105 N -2.12 2.08 0.32 4.85 8.00 -1.26 -4.60 116.55 123.82 2k2n n ASP 105 Ca 0.01 1.10 0.17 0.00 0.71 0.00 0.00 54.79 56.79 2k2n n ASP 105 Cb 0.57 -1.07 0.90 0.00 -0.02 0.00 0.00 41.12 41.50 2k2n n ASP 105 CO 0.00 0.00 0.00 1.62 -0.39 0.00 0.00 177.20 178.43 2k2n h VAL 106 N 5.17 0.05 -0.32 2.53 3.04 -1.81 0.34 116.25 125.24 2k2n h VAL 106 Ca -0.46 0.00 -0.05 0.00 -1.01 0.00 0.00 66.70 65.18 2k2n h VAL 106 Cb 1.33 0.74 -0.01 0.00 -2.01 0.00 0.00 31.29 31.34 2k2n h VAL 106 CO 0.97 0.00 0.01 -0.08 -1.01 0.00 0.00 177.57 177.46 2k2n h GLU 107 N 0.00 0.56 0.00 4.17 4.81 -1.88 -1.31 114.58 120.94 2k2n h GLU 107 Ca 0.02 -0.17 0.00 0.00 -0.13 0.00 0.00 59.36 59.07 2k2n h GLU 107 Cb 0.55 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.88 2k2n h GLU 107 CO -0.00 0.69 0.00 0.00 -0.73 0.00 0.00 179.01 178.97 2k2n n ALA 108 N -2.37 1.42 -3.49 2.92 0.00 0.10 -4.91 120.51 114.18 2k2n n ALA 108 Ca -0.02 0.09 -0.20 0.00 0.00 0.00 0.00 53.44 53.31 2k2n n ALA 108 Cb 0.25 -1.30 0.01 0.00 0.00 0.00 0.00 19.45 18.41 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 -2.05 -1.63 -2.36 0.00 -0.06 -0.49 -4.90 117.38 105.88 2k2n n GLN 109 Ca 0.01 1.16 -0.42 0.00 -2.00 0.00 0.00 57.00 55.76 2k2n n GLN 109 Cb 0.14 -3.35 -0.03 0.00 -4.06 0.00 0.00 30.24 22.94 2k2n n GLN 109 CO 0.00 0.00 0.00 0.45 -0.20 0.00 0.00 177.06 177.31 2k2n s SER 110 N -2.70 7.04 -0.07 1.69 0.15 -1.26 -5.01 113.70 113.54 2k2n s SER 110 Ca 0.09 2.15 0.05 0.00 0.70 0.00 0.00 55.95 58.93 2k2n s SER 110 Cb -0.01 -2.59 -0.01 0.00 -1.71 0.00 0.00 66.02 61.70 2k2n s SER 110 CO 0.85 -0.46 -0.22 -0.60 1.20 0.00 0.00 173.24 174.00 2k2n s ARG 111 N 0.56 2.74 0.14 5.44 3.52 -1.23 -4.21 118.95 125.90 2k2n s ARG 111 Ca 0.57 -0.86 -0.05 0.00 -0.13 0.00 0.00 55.73 55.26 2k2n s ARG 111 Cb -0.32 -2.26 -0.02 0.00 -1.56 0.00 0.00 34.95 30.79 2k2n s ARG 111 CO 0.32 0.35 0.17 -1.54 -0.81 0.00 0.00 175.30 173.79 2k2n s SER 112 N -0.07 0.18 -0.03 -2.12 1.04 0.40 -4.70 113.70 108.40 2k2n s SER 112 Ca -0.06 -0.99 0.05 0.00 0.48 0.00 0.00 55.95 55.44 2k2n s SER 112 Cb -0.14 0.36 -0.01 0.00 0.10 0.00 0.00 66.02 66.32 2k2n s SER 112 CO 0.05 -0.80 -0.19 0.27 0.98 0.00 0.00 173.24 173.55 2k2n s ILE 113 N -3.99 1.52 -0.75 -1.02 -4.36 -1.26 -3.99 121.20 107.35 2k2n s ILE 113 Ca 0.18 -0.80 0.00 0.00 -0.26 0.00 0.00 60.65 59.77 2k2n s ILE 113 Cb 0.05 -1.28 0.00 0.00 1.25 0.00 0.00 42.46 42.48 2k2n s ILE 113 CO -0.01 0.43 0.62 -1.54 0.24 0.00 0.00 174.94 174.68 2k2n n SER 114 N 2.80 1.49 -3.86 4.36 3.41 -1.26 -4.39 113.62 116.16 2k2n n SER 114 Ca -0.16 -1.99 -0.28 0.00 -0.26 0.00 0.00 58.87 56.18 2k2n n SER 114 Cb 0.53 -0.50 -0.12 0.00 -0.26 0.00 0.00 64.21 63.87 2k2n n SER 114 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2k2n n GLN 115 N 0.13 1.88 -2.91 4.33 1.13 -1.26 -5.08 117.38 115.59 2k2n n GLN 115 Ca 0.00 -4.50 -0.32 0.00 -1.94 0.00 0.00 57.00 50.24 2k2n n GLN 115 Cb 0.31 -2.28 -0.05 0.00 0.11 0.00 0.00 30.24 28.33 2k2n n GLN 115 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 2k2n s PRO 116 N -1.54 4.01 0.32 -1.09 0.04 -1.26 -4.97 135.00 130.51 2k2n s PRO 116 Ca 0.26 0.78 0.02 0.00 0.04 0.00 0.00 61.00 62.10 2k2n s PRO 116 Cb -0.02 -2.32 0.56 0.00 0.04 0.00 0.00 34.50 32.75 2k2n s PRO 116 CO -0.16 0.02 1.90 0.93 0.04 0.00 0.00 177.00 179.73 2k2n h GLU 117 N 1.82 0.70 0.00 4.56 4.39 -1.98 -3.48 114.58 120.58 2k2n h GLU 117 Ca -0.48 -0.11 0.00 0.00 0.34 0.00 0.00 59.36 59.11 2k2n h GLU 117 Cb 1.18 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.71 2k2n h GLU 117 CO 0.63 0.61 0.00 0.45 -1.16 0.00 0.00 179.01 179.54 2k2n n SER 118 N -4.33 0.00 -4.78 1.42 2.88 -1.26 -5.14 113.62 102.41 2k2n n SER 118 Ca 0.03 0.00 -0.36 0.00 -1.33 0.00 0.00 58.87 57.21 2k2n n SER 118 Cb 0.18 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.62 2k2n n SER 118 CO 0.00 0.00 0.00 0.86 -1.23 0.00 0.00 175.04 174.67 2k2n s TRP 119 N 2.23 2.97 0.99 0.66 -0.00 -1.26 -5.04 118.94 119.49 2k2n s TRP 119 Ca 0.00 1.57 -0.17 0.00 -0.00 0.00 0.00 56.10 57.50 2k2n s TRP 119 Cb 0.00 -3.27 0.22 0.00 -0.00 0.00 0.00 33.47 30.42 2k2n s TRP 119 CO 0.00 -1.21 1.35 0.20 -0.00 0.00 0.00 176.95 177.28 2k2n s GLY 120 N -1.52 1.81 0.00 5.86 0.00 -1.26 -3.75 107.32 108.46 2k2n s GLY 120 Ca 0.63 -1.29 0.00 0.00 0.00 0.00 0.00 44.72 44.06 2k2n s GLY 120 CO 0.31 -0.47 0.00 1.04 0.00 0.00 0.00 173.10 173.97 2k2n n LEU 121 N -3.86 0.72 0.27 0.66 4.32 -1.26 -4.70 117.00 113.15 2k2n n LEU 121 Ca 0.16 0.00 0.15 0.00 -0.02 0.00 0.00 56.01 56.30 2k2n n LEU 121 Cb 0.59 -1.56 0.70 0.00 -1.62 0.00 0.00 43.42 41.54 2k2n n LEU 121 CO 0.44 -0.56 0.96 0.77 -1.22 0.00 0.00 177.39 177.78 2k2n h SER 122 N 0.00 0.00 0.26 -1.43 4.64 -1.98 -2.30 113.55 112.73 2k2n h SER 122 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2k2n h SER 122 Cb 0.40 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.49 2k2n h SER 122 CO 0.00 0.09 -0.06 0.00 -0.87 0.00 0.00 176.83 175.99 2k2n h ALA 123 N 1.91 1.28 -5.97 5.18 0.00 -1.87 -3.48 119.26 116.31 2k2n h ALA 123 Ca -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2k2n h ALA 123 Cb 0.47 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 2k2n h ALA 123 CO 0.01 0.08 -0.46 -2.13 0.00 0.00 0.00 179.25 176.74 2k2n n ARG 124 N -3.57 -1.74 -3.80 0.00 0.63 -0.87 -5.02 116.66 102.29 2k2n n ARG 124 Ca -0.02 1.58 -0.12 0.00 -0.92 0.00 0.00 57.85 58.36 2k2n n ARG 124 Cb 0.17 -1.70 -0.09 0.00 0.45 0.00 0.00 32.46 31.29 2k2n n ARG 124 CO 0.00 0.00 0.00 0.14 -2.51 0.00 0.00 177.63 175.26 2k2n s VAL 125 N -0.34 0.07 0.14 5.15 -7.23 -1.26 -5.06 120.40 111.87 2k2n s VAL 125 Ca -0.05 -0.58 -0.02 0.00 -1.81 0.00 0.00 61.98 59.52 2k2n s VAL 125 Cb 0.00 -0.58 -0.17 0.00 0.56 0.00 0.00 36.38 36.19 2k2n s VAL 125 CO 0.16 -0.32 1.32 1.55 -0.31 0.00 0.00 175.10 177.50 2k2n h PRO 126 N 3.96 0.35 -0.61 4.82 0.13 -2.03 -3.24 132.00 135.37 2k2n h PRO 126 Ca -0.30 -0.38 -0.03 0.00 -0.87 0.00 0.00 66.00 64.42 2k2n h PRO 126 Cb 1.18 0.11 -0.03 0.00 0.13 0.00 0.00 31.00 32.39 2k2n h PRO 126 CO 0.41 1.06 0.25 -0.07 -0.23 0.00 0.00 178.00 179.42 2k2n h LEU 127 N 0.19 0.81 -1.22 1.56 3.38 -2.03 -3.47 115.31 114.53 2k2n h LEU 127 Ca -0.07 -0.10 -0.14 0.00 0.09 0.00 0.00 57.88 57.65 2k2n h LEU 127 Cb 1.56 -0.21 0.06 0.00 0.09 0.00 0.00 40.66 42.16 2k2n h LEU 127 CO 0.15 0.72 -0.27 0.61 0.09 0.00 0.00 178.44 179.75 2k2n n GLY 128 N -1.04 0.31 2.31 0.83 0.00 -1.22 -5.00 105.19 101.38 2k2n n GLY 128 Ca 0.05 -0.30 -0.24 0.00 0.00 0.00 0.00 46.02 45.53 2k2n n GLY 128 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2k2n n GLU 129 N -2.20 1.43 -0.08 1.61 1.02 -1.26 -5.05 120.64 116.10 2k2n n GLU 129 Ca -0.03 -3.76 0.00 0.00 -0.02 0.00 0.00 57.16 53.35 2k2n n GLU 129 Cb 0.54 -1.64 0.00 0.00 -0.02 0.00 0.00 31.44 30.31 2k2n n GLU 129 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 2k2n n PRO 130 N 0.98 0.21 0.05 3.49 -0.04 -1.26 -5.00 135.00 133.43 2k2n n PRO 130 Ca 0.25 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.68 2k2n n PRO 130 Cb 0.50 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.89 2k2n n PRO 130 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2k2n h LEU 131 N 0.00 0.00 -0.94 1.53 3.38 -1.96 -3.34 115.31 113.98 2k2n h LEU 131 Ca 0.00 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 2k2n h LEU 131 Cb 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 2k2n h LEU 131 CO 0.00 0.71 -0.03 1.56 0.09 0.00 0.00 178.44 180.77 2k2n h GLN 132 N 0.00 0.74 0.95 1.13 1.08 -1.94 -3.23 115.11 113.83 2k2n h GLN 132 Ca -0.12 -0.21 -0.05 0.00 -1.45 0.00 0.00 58.65 56.83 2k2n h GLN 132 Cb 1.65 -0.08 0.01 0.00 -0.05 0.00 0.00 27.48 29.01 2k2n h GLN 132 CO 0.07 0.77 -0.45 0.00 -0.95 0.00 0.00 178.83 178.27 2k2n h ARG 133 N 0.69 -1.22 -5.08 1.46 -0.00 -1.96 -3.44 114.38 104.82 2k2n h ARG 133 Ca 0.13 0.08 -0.51 0.00 -0.50 0.00 0.00 59.98 59.18 2k2n h ARG 133 Cb 0.47 0.28 0.15 0.00 0.00 0.00 0.00 29.97 30.86 2k2n h ARG 133 CO 0.02 -0.82 -0.92 -2.30 0.00 0.00 0.00 179.97 175.96 2k2n n PRO 134 N -5.57 0.00 -2.79 0.04 -0.02 -1.22 -4.90 135.00 120.55 2k2n n PRO 134 Ca -0.16 0.00 -0.35 0.00 -2.02 0.00 0.00 63.50 60.97 2k2n n PRO 134 Cb 0.50 -0.85 -0.07 0.00 -0.02 0.00 0.00 33.50 33.07 2k2n n PRO 134 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2k2n s VAL 135 N -1.60 4.28 -0.04 -1.45 0.11 -1.26 -4.48 120.40 115.95 2k2n s VAL 135 Ca 0.49 1.62 -0.17 0.00 -2.93 0.00 0.00 61.98 60.99 2k2n s VAL 135 Cb -0.46 -3.77 -0.05 0.00 -1.53 0.00 0.00 36.38 30.56 2k2n s VAL 135 CO 0.55 -0.11 0.45 -0.62 -3.33 0.00 0.00 175.10 172.04 2k2n s ASP 136 N -1.91 6.79 0.65 3.54 -1.08 -1.26 -0.46 116.67 122.93 2k2n s ASP 136 Ca 0.57 0.94 0.10 0.00 -0.52 0.00 0.00 52.55 53.64 2k2n s ASP 136 Cb -0.14 -2.28 0.43 0.00 -1.46 0.00 0.00 42.92 39.48 2k2n s ASP 136 CO 0.18 0.20 1.19 -0.65 0.52 0.00 0.00 175.17 176.61 2k2n h PRO 137 N 5.46 0.00 -0.12 4.34 0.11 -1.83 0.18 132.00 140.14 2k2n h PRO 137 Ca -0.47 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.57 2k2n h PRO 137 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2k2n h PRO 137 CO 0.67 0.00 -0.21 0.00 -0.21 0.00 0.00 178.00 178.25 2k2n h HIS 139 N -0.08 0.00 -0.46 0.00 -0.00 -1.37 -3.22 115.15 110.03 2k2n h HIS 139 Ca 0.01 0.00 -0.02 0.00 -0.00 0.00 0.00 60.37 60.36 2k2n h HIS 139 Cb 0.79 0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 28.18 2k2n h HIS 139 CO 0.10 0.91 0.21 -0.24 -0.00 0.00 0.00 177.93 178.91 2k2n h VAL 140 N 0.00 1.19 -0.01 5.26 3.04 -1.56 -1.79 116.25 122.38 2k2n h VAL 140 Ca -0.11 -0.56 -0.10 0.00 -1.01 0.00 0.00 66.70 64.92 2k2n h VAL 140 Cb 1.79 0.71 -0.01 0.00 -2.01 0.00 0.00 31.29 31.77 2k2n h VAL 140 CO 0.10 0.21 -0.47 -0.74 -1.01 0.00 0.00 177.57 175.66 2k2n h HIS 141 N 0.60 0.03 -0.73 3.17 6.17 -1.69 -1.26 115.15 121.45 2k2n h HIS 141 Ca 0.16 -0.01 0.04 0.00 0.71 0.00 0.00 60.37 61.26 2k2n h HIS 141 Cb 0.14 -0.01 -0.05 0.00 2.52 0.00 0.00 27.41 30.02 2k2n h HIS 141 CO -0.01 0.50 0.45 -0.92 0.71 0.00 0.00 177.93 178.66 2k2n h TYR 142 N 0.02 0.85 -0.18 5.26 3.20 -1.38 0.99 116.97 125.73 2k2n h TYR 142 Ca -0.00 0.02 -0.21 0.00 3.14 0.00 0.00 58.73 61.68 2k2n h TYR 142 Cb 0.85 -0.27 0.01 0.00 1.54 0.00 0.00 36.73 38.85 2k2n h TYR 142 CO 0.00 0.47 -0.72 -0.07 -1.64 0.00 0.00 178.16 176.19 2k2n h LEU 143 N 0.87 0.95 -1.09 2.82 3.38 -1.04 -2.69 115.31 118.51 2k2n h LEU 143 Ca 0.30 -0.61 0.20 0.00 0.09 0.00 0.00 57.88 57.86 2k2n h LEU 143 Cb 0.06 -0.28 -0.10 0.00 0.09 0.00 0.00 40.66 40.43 2k2n h LEU 143 CO -0.13 1.40 0.61 0.50 0.09 0.00 0.00 178.44 180.92 2k2n h LYS 144 N 0.56 0.67 0.00 1.13 1.63 -0.48 2.85 116.57 122.92 2k2n h LYS 144 Ca -0.04 -0.04 -0.02 0.00 -0.85 0.00 0.00 60.65 59.71 2k2n h LYS 144 Cb 1.35 -0.15 -0.00 0.00 -0.60 0.00 0.00 32.23 32.83 2k2n h LYS 144 CO 0.15 0.44 -0.08 0.77 -3.45 0.00 0.00 179.45 177.29 2k2n h SER 145 N 0.69 0.00 -0.06 4.20 0.02 -0.50 -0.18 113.55 117.71 2k2n h SER 145 Ca 0.57 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.52 2k2n h SER 145 Cb 1.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.54 2k2n h SER 145 CO -0.36 0.08 0.00 0.23 -1.14 0.00 0.00 176.83 175.64 2k2n n MET 146 N -3.42 1.98 -1.30 3.45 2.81 0.93 -4.92 117.12 116.65 2k2n n MET 146 Ca -0.01 -1.44 -0.07 0.00 -1.81 0.00 0.00 57.70 54.37 2k2n n MET 146 Cb 0.22 -1.47 -0.03 0.00 -0.71 0.00 0.00 33.22 31.24 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 1.26 0.80 3.59 3.03 0.00 0.03 -5.02 105.19 108.88 2k2n n GLY 147 Ca 0.17 -0.74 -0.33 0.00 0.00 0.00 0.00 46.02 45.12 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 -2.26 3.67 -0.16 1.61 1.01 -0.82 -4.72 120.40 118.73 2k2n s VAL 148 Ca 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 61.98 61.32 2k2n s VAL 148 Cb 0.00 -2.56 -0.10 0.00 0.00 0.00 0.00 36.38 33.71 2k2n s VAL 148 CO 0.00 0.47 -0.15 0.00 0.00 0.00 0.00 175.10 175.42 2k2n n ALA 149 N 1.79 1.67 -3.64 5.51 0.00 -1.21 -3.60 120.51 121.03 2k2n n ALA 149 Ca -0.16 -0.69 -0.23 0.00 0.00 0.00 0.00 53.44 52.36 2k2n n ALA 149 Cb 0.53 0.14 -0.17 0.00 0.00 0.00 0.00 19.45 19.95 2k2n n ALA 149 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2k2n s SER 150 N -5.65 1.47 -0.12 0.00 0.01 -1.21 -2.25 113.70 105.96 2k2n s SER 150 Ca -0.22 -0.20 0.03 0.00 1.31 0.00 0.00 55.95 56.86 2k2n s SER 150 Cb 0.06 -0.63 -0.00 0.00 0.21 0.00 0.00 66.02 65.66 2k2n s SER 150 CO 0.37 -0.05 -0.21 -0.94 0.41 0.00 0.00 173.24 172.82 2k2n s SER 151 N 1.08 3.35 -0.18 2.44 1.04 -1.12 -2.46 113.70 117.85 2k2n s SER 151 Ca -0.08 -0.50 -0.04 0.00 0.48 0.00 0.00 55.95 55.81 2k2n s SER 151 Cb -0.14 -1.47 -0.02 0.00 0.10 0.00 0.00 66.02 64.48 2k2n s SER 151 CO -0.01 0.15 -0.04 -0.22 0.98 0.00 0.00 173.24 174.10 2k2n s LEU 152 N 0.43 3.12 -0.20 2.42 2.96 -0.53 0.14 118.68 127.02 2k2n s LEU 152 Ca -0.15 -0.22 -0.02 0.00 -0.22 0.00 0.00 54.13 53.52 2k2n s LEU 152 Cb -0.17 -1.77 -0.00 0.00 0.50 0.00 0.00 46.19 44.75 2k2n s LEU 152 CO 0.06 0.11 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.42 2k2n s VAL 153 N 0.73 2.99 -0.14 1.68 1.01 -0.54 -0.76 120.40 125.37 2k2n s VAL 153 Ca -0.02 -0.63 -0.00 0.00 0.00 0.00 0.00 61.98 61.33 2k2n s VAL 153 Cb -0.15 -2.33 0.03 0.00 0.00 0.00 0.00 36.38 33.94 2k2n s VAL 153 CO 0.02 0.46 -0.08 -0.69 0.00 0.00 0.00 175.10 174.81 2k2n s VAL 154 N 1.37 1.20 0.41 2.92 1.01 -0.61 -3.56 120.40 123.14 2k2n s VAL 154 Ca 0.05 -0.52 -0.24 0.00 0.00 0.00 0.00 61.98 61.27 2k2n s VAL 154 Cb -0.14 -1.25 -0.08 0.00 0.00 0.00 0.00 36.38 34.91 2k2n s VAL 154 CO -0.06 0.29 1.13 -2.16 0.00 0.00 0.00 175.10 174.31 2k2n s PRO 155 N 1.62 4.02 -0.58 2.72 0.04 -1.26 -3.21 135.00 138.35 2k2n s PRO 155 Ca 0.03 1.72 0.06 0.00 0.04 0.00 0.00 61.00 62.85 2k2n s PRO 155 Cb -0.14 -2.57 0.32 0.00 0.04 0.00 0.00 34.50 32.15 2k2n s PRO 155 CO -0.09 -0.32 0.89 1.28 0.04 0.00 0.00 177.00 178.80 2k2n n LEU 156 N -0.10 4.03 0.00 -3.56 4.77 -1.26 -4.83 117.00 116.04 2k2n n LEU 156 Ca 0.05 -5.58 0.00 0.00 -0.03 0.00 0.00 56.01 50.46 2k2n n LEU 156 Cb 0.48 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2k2n n LEU 156 CO 0.48 2.29 0.00 1.15 -1.33 0.00 0.00 177.39 179.98 2k2n n MET 157 N 0.04 0.00 -2.12 3.23 0.00 -1.26 -4.56 117.12 112.45 2k2n n MET 157 Ca 0.30 0.00 -0.21 0.00 0.00 0.00 0.00 57.70 57.79 2k2n n MET 157 Cb 0.41 0.00 0.12 0.00 0.00 0.00 0.00 33.22 33.76 2k2n n MET 157 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 175.97 176.69 2k2n n HIS 158 N 0.00 -3.27 0.03 3.17 8.25 -0.80 -4.91 115.22 117.68 2k2n n HIS 158 Ca 0.00 -1.38 -0.10 0.00 -0.26 0.00 0.00 57.72 55.97 2k2n n HIS 158 Cb 0.00 -0.70 -0.08 0.00 1.12 0.00 0.00 29.99 30.33 2k2n n HIS 158 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2k2n h HIS 159 N -0.87 -0.15 -0.56 4.41 2.76 -1.97 -3.36 115.15 115.41 2k2n h HIS 159 Ca -0.31 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.86 2k2n h HIS 159 Cb 1.05 0.05 0.00 0.00 1.55 0.00 0.00 27.41 30.06 2k2n h HIS 159 CO 0.00 0.33 0.00 1.04 -1.30 0.00 0.00 177.93 178.00 2k2n n GLN 160 N -4.87 2.94 -3.81 5.26 6.02 -1.26 -4.56 117.38 117.11 2k2n n GLN 160 Ca -0.07 -2.48 -0.13 0.00 -0.01 0.00 0.00 57.00 54.30 2k2n n GLN 160 Cb 0.27 -1.52 -0.13 0.00 1.02 0.00 0.00 30.24 29.88 2k2n n GLN 160 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 2k2n s GLU 161 N -1.21 0.11 -0.22 -1.09 2.12 -1.26 -5.05 118.70 112.10 2k2n s GLU 161 Ca 0.40 0.22 -0.04 0.00 0.36 0.00 0.00 54.97 55.91 2k2n s GLU 161 Cb 0.22 -0.02 -0.01 0.00 0.26 0.00 0.00 34.13 34.59 2k2n s GLU 161 CO 0.25 -0.06 -0.04 -1.17 -0.54 0.00 0.00 175.26 173.69 2k2n s LEU 162 N 0.41 2.94 -0.16 2.70 0.20 -1.26 -1.91 118.68 121.59 2k2n s LEU 162 Ca -0.03 -0.42 -0.06 0.00 0.69 0.00 0.00 54.13 54.31 2k2n s LEU 162 Cb -0.04 -1.74 -0.23 0.00 -0.43 0.00 0.00 46.19 43.75 2k2n s LEU 162 CO -0.02 -0.03 0.19 0.79 -0.29 0.00 0.00 176.35 176.99 2k2n n TRP 163 N 4.80 0.91 -3.51 5.38 7.02 -1.26 -4.87 117.44 125.90 2k2n n TRP 163 Ca -0.18 0.21 -0.06 0.00 -1.02 0.00 0.00 57.50 56.45 2k2n n TRP 163 Cb 0.51 -1.12 0.02 0.00 -2.42 0.00 0.00 31.31 28.30 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 1.99 1.34 2.81 6.99 0.00 -1.26 0.58 105.19 117.65 2k2n n GLY 164 Ca -0.36 -1.17 -0.14 0.00 0.00 0.00 0.00 46.02 44.36 2k2n n GLY 164 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2k2n s LEU 165 N 0.00 1.41 -0.14 0.99 1.43 0.26 -4.29 118.68 118.34 2k2n s LEU 165 Ca 0.10 0.03 -0.05 0.00 -1.03 0.00 0.00 54.13 53.18 2k2n s LEU 165 Cb -0.03 -0.03 -0.04 0.00 0.03 0.00 0.00 46.19 46.12 2k2n s LEU 165 CO 0.08 -0.08 0.03 -0.22 0.23 0.00 0.00 176.35 176.39 2k2n s LEU 166 N 0.68 3.71 -0.00 1.79 2.96 -1.20 0.14 118.68 126.76 2k2n s LEU 166 Ca -0.06 0.11 0.00 0.00 -0.22 0.00 0.00 54.13 53.96 2k2n s LEU 166 Cb -0.08 -1.90 0.00 0.00 0.50 0.00 0.00 46.19 44.71 2k2n s LEU 166 CO -0.02 0.26 -0.00 0.54 -1.32 0.00 0.00 176.35 175.81 2k2n s VAL 167 N -0.18 0.06 -0.11 1.68 0.11 -1.10 -1.57 120.40 119.29 2k2n s VAL 167 Ca 0.06 0.00 0.01 0.00 -2.93 0.00 0.00 61.98 59.12 2k2n s VAL 167 Cb -0.12 -0.08 -0.02 0.00 -1.53 0.00 0.00 36.38 34.63 2k2n s VAL 167 CO 0.02 0.04 -0.14 -0.44 -3.33 0.00 0.00 175.10 171.24 2k2n s SER 168 N 0.17 3.97 -0.10 3.54 0.01 0.06 -2.51 113.70 118.85 2k2n s SER 168 Ca -0.01 -0.31 -0.01 0.00 1.31 0.00 0.00 55.95 56.93 2k2n s SER 168 Cb -0.03 -1.43 -0.03 0.00 0.21 0.00 0.00 66.02 64.75 2k2n s SER 168 CO -0.00 0.21 -0.05 -1.00 0.41 0.00 0.00 173.24 172.80 2k2n s HIS 169 N 0.10 2.98 -0.06 2.43 3.76 0.21 -1.46 115.29 123.27 2k2n s HIS 169 Ca -0.06 -0.06 0.02 0.00 -0.15 0.00 0.00 55.06 54.80 2k2n s HIS 169 Cb -0.15 -1.79 0.01 0.00 1.11 0.00 0.00 32.58 31.77 2k2n s HIS 169 CO 0.05 0.23 -0.11 -1.58 -0.85 0.00 0.00 174.74 172.49 2k2n s HIS 170 N -0.47 1.28 -0.39 1.40 2.46 -1.03 -2.84 115.29 115.70 2k2n s HIS 170 Ca 0.07 -0.45 -0.03 0.00 0.47 0.00 0.00 55.06 55.13 2k2n s HIS 170 Cb -0.12 -0.96 0.13 0.00 -0.13 0.00 0.00 32.58 31.49 2k2n s HIS 170 CO 0.02 -0.24 2.47 0.00 -2.47 0.00 0.00 174.74 174.52 2k2n n ALA 171 N 3.81 5.91 -3.04 1.58 0.00 -1.26 -3.30 120.51 124.21 2k2n n ALA 171 Ca -0.23 -2.46 -0.11 0.00 0.00 0.00 0.00 53.44 50.64 2k2n n ALA 171 Cb 0.52 -1.83 -0.10 0.00 0.00 0.00 0.00 19.45 18.04 2k2n n ALA 171 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2k2n s GLU 172 N -1.74 0.48 0.12 0.00 0.41 -1.26 -4.94 118.70 111.77 2k2n s GLU 172 Ca 0.48 -0.48 0.20 0.00 -0.41 0.00 0.00 54.97 54.76 2k2n s GLU 172 Cb 0.33 0.20 0.83 0.00 -1.78 0.00 0.00 34.13 33.71 2k2n s GLU 172 CO -0.12 -0.11 1.63 -0.35 -0.49 0.00 0.00 175.26 175.81 2k2n n PRO 173 N 1.35 0.10 -1.40 0.39 -0.04 -1.26 -4.53 135.00 129.62 2k2n n PRO 173 Ca -0.22 0.30 -0.49 0.00 -0.04 0.00 0.00 63.50 63.05 2k2n n PRO 173 Cb 0.56 -1.68 -0.13 0.00 -0.04 0.00 0.00 33.50 32.21 2k2n n PRO 173 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2k2n n ARG 174 N -1.87 0.07 -0.74 0.54 1.74 -1.26 -4.77 116.66 110.37 2k2n n ARG 174 Ca 0.03 0.01 -0.33 0.00 -0.77 0.00 0.00 57.85 56.79 2k2n n ARG 174 Cb 0.23 -1.59 0.14 0.00 -1.02 0.00 0.00 32.46 30.22 2k2n n ARG 174 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 2k2n n PRO 175 N 8.09 -1.17 -3.70 5.56 -0.02 -1.26 -4.95 135.00 137.55 2k2n n PRO 175 Ca 0.60 -0.32 -0.37 0.00 -2.02 0.00 0.00 63.50 61.38 2k2n n PRO 175 Cb 0.02 -1.60 -0.07 0.00 -0.02 0.00 0.00 33.50 31.84 2k2n n PRO 175 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 2k2n s TYR 176 N -2.21 3.57 0.16 6.00 -0.85 -1.26 -5.09 117.35 117.66 2k2n s TYR 176 Ca 0.53 0.62 0.11 0.00 -0.52 0.00 0.00 57.07 57.80 2k2n s TYR 176 Cb -0.10 -2.13 -0.04 0.00 0.38 0.00 0.00 41.96 40.06 2k2n s TYR 176 CO 0.67 0.55 -0.25 -1.12 -1.52 0.00 0.00 175.55 173.88 2k2n s SER 177 N -0.52 3.29 0.50 -0.18 0.01 -1.26 -5.01 113.70 110.53 2k2n s SER 177 Ca 0.16 -0.81 0.28 0.00 1.31 0.00 0.00 55.95 56.89 2k2n s SER 177 Cb -0.13 -0.23 1.38 0.00 0.21 0.00 0.00 66.02 67.25 2k2n s SER 177 CO 0.05 0.13 1.87 -0.61 0.41 0.00 0.00 173.24 175.09 2k2n h GLN 178 N 3.51 0.11 -0.67 12.44 5.75 -2.01 0.27 115.11 134.51 2k2n h GLN 178 Ca -0.48 -0.01 0.09 0.00 -0.15 0.00 0.00 58.65 58.11 2k2n h GLN 178 Cb 1.19 -0.02 -0.04 0.00 1.07 0.00 0.00 27.48 29.68 2k2n h GLN 178 CO 0.44 0.07 0.44 0.93 -2.65 0.00 0.00 178.83 178.07 2k2n h GLU 179 N 0.11 0.53 -0.47 1.69 4.39 -1.99 -0.11 114.58 118.72 2k2n h GLU 179 Ca 0.45 -0.03 -0.04 0.00 0.34 0.00 0.00 59.36 60.07 2k2n h GLU 179 Cb 1.59 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 30.10 2k2n h GLU 179 CO -0.06 0.35 0.13 0.93 -1.16 0.00 0.00 179.01 179.20 2k2n h GLU 180 N 0.55 0.75 -0.26 2.33 4.39 -0.86 -2.69 114.58 118.79 2k2n h GLU 180 Ca 0.31 -0.17 -0.10 0.00 0.34 0.00 0.00 59.36 59.73 2k2n h GLU 180 Cb 0.47 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 29.00 2k2n h GLU 180 CO -0.10 0.72 -0.28 -0.07 -1.16 0.00 0.00 179.01 178.13 2k2n h LEU 181 N 0.64 0.53 -1.03 1.33 4.07 -1.27 -2.95 115.31 116.62 2k2n h LEU 181 Ca 0.15 -0.19 0.12 0.00 0.08 0.00 0.00 57.88 58.04 2k2n h LEU 181 Cb 0.30 -0.14 -0.08 0.00 1.08 0.00 0.00 40.66 41.81 2k2n h LEU 181 CO -0.00 0.79 0.63 -0.61 -1.08 0.00 0.00 178.44 178.17 2k2n h GLN 182 N 0.45 0.96 0.12 1.13 -0.00 -0.74 0.18 115.11 117.21 2k2n h GLN 182 Ca 0.06 -0.06 -0.01 0.00 -0.00 0.00 0.00 58.65 58.65 2k2n h GLN 182 Cb 0.72 -0.22 0.00 0.00 0.00 0.00 0.00 27.48 27.98 2k2n h GLN 182 CO 0.06 0.63 -0.06 0.28 0.00 0.00 0.00 178.83 179.74 2k2n h VAL 183 N 0.98 1.07 -0.14 2.39 2.07 -1.34 -3.29 116.25 118.00 2k2n h VAL 183 Ca 0.49 -1.04 -0.16 0.00 0.82 0.00 0.00 66.70 66.81 2k2n h VAL 183 Cb 0.49 1.69 -0.01 0.00 -1.52 0.00 0.00 31.29 31.94 2k2n h VAL 183 CO -0.25 0.24 -0.58 0.58 0.02 0.00 0.00 177.57 177.58 2k2n h VAL 184 N -0.68 1.34 -0.64 2.57 2.07 -1.49 -3.18 116.25 116.25 2k2n h VAL 184 Ca -0.02 -1.87 0.13 0.00 0.82 0.00 0.00 66.70 65.76 2k2n h VAL 184 Cb 0.51 1.87 -0.10 0.00 -1.52 0.00 0.00 31.29 32.05 2k2n h VAL 184 CO 0.03 0.57 0.10 -0.61 0.02 0.00 0.00 177.57 177.68 2k2n h GLN 185 N 0.33 0.21 -0.45 1.57 5.75 -0.74 2.10 115.11 123.89 2k2n h GLN 185 Ca 0.00 -0.01 -0.14 0.00 -0.15 0.00 0.00 58.65 58.35 2k2n h GLN 185 Cb 1.10 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 29.60 2k2n h GLN 185 CO 0.10 0.14 -0.28 -0.07 -2.65 0.00 0.00 178.83 176.07 2k2n h LEU 186 N 0.21 1.02 0.09 -2.39 3.38 -1.62 -2.72 115.31 113.27 2k2n h LEU 186 Ca 0.34 -0.42 -0.29 0.00 0.09 0.00 0.00 57.88 57.60 2k2n h LEU 186 Cb 0.54 -0.28 0.02 0.00 0.09 0.00 0.00 40.66 41.03 2k2n h LEU 186 CO -0.47 1.22 -1.23 0.25 0.09 0.00 0.00 178.44 178.30 2k2n h LEU 187 N 0.82 0.68 -1.08 1.67 5.85 -1.26 -3.14 115.31 118.85 2k2n h LEU 187 Ca 0.09 -0.66 -0.00 0.00 0.84 0.00 0.00 57.88 58.15 2k2n h LEU 187 Cb 0.87 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.64 2k2n h LEU 187 CO 0.08 1.48 0.54 0.00 -0.34 0.00 0.00 178.44 180.20 2k2n h ALA 188 N 0.44 1.31 -0.70 1.25 0.00 0.33 0.68 119.26 122.57 2k2n h ALA 188 Ca -0.16 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.62 2k2n h ALA 188 Cb 1.92 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 19.32 2k2n h ALA 188 CO 0.22 0.60 0.27 -0.44 0.00 0.00 0.00 179.25 179.90 2k2n h ASP 189 N 1.19 0.98 0.49 0.00 3.32 -1.54 1.35 116.42 122.21 2k2n h ASP 189 Ca 0.31 -0.18 -0.09 0.00 0.02 0.00 0.00 57.03 57.10 2k2n h ASP 189 Cb -0.08 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.21 2k2n h ASP 189 CO -0.06 0.89 -0.41 1.56 -1.72 0.00 0.00 179.24 179.50 2k2n h GLN 190 N 1.01 0.00 0.09 3.56 1.08 -1.32 -1.63 115.11 117.90 2k2n h GLN 190 Ca 0.23 0.00 -0.17 0.00 -1.45 0.00 0.00 58.65 57.26 2k2n h GLN 190 Cb 0.23 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.66 2k2n h GLN 190 CO -0.02 0.41 -0.81 0.28 -0.95 0.00 0.00 178.83 177.75 2k2n h VAL 191 N 0.00 1.41 -0.84 -0.54 2.07 -0.07 -3.00 116.25 115.28 2k2n h VAL 191 Ca -0.00 -2.43 0.16 0.00 0.82 0.00 0.00 66.70 65.25 2k2n h VAL 191 Cb 0.77 3.04 -0.06 0.00 -1.52 0.00 0.00 31.29 33.52 2k2n h VAL 191 CO 0.05 0.65 0.55 -1.28 0.02 0.00 0.00 177.57 177.56 2k2n h SER 192 N -0.56 0.50 -0.20 0.57 0.87 0.18 0.93 113.55 115.85 2k2n h SER 192 Ca -0.17 0.03 -0.06 0.00 -1.23 0.00 0.00 61.79 60.36 2k2n h SER 192 Cb 1.49 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 63.37 2k2n h SER 192 CO 0.06 0.25 -0.07 0.40 -0.53 0.00 0.00 176.83 176.94 2k2n h ILE 193 N 0.53 1.22 -0.44 2.23 2.04 -1.34 -1.39 117.51 120.36 2k2n h ILE 193 Ca 0.42 -0.93 -0.14 0.00 1.00 0.00 0.00 64.86 65.22 2k2n h ILE 193 Cb 0.86 1.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.97 2k2n h ILE 193 CO -0.17 0.31 -0.27 0.00 0.00 0.00 0.00 178.15 178.02 2k2n h ALA 194 N 1.43 0.68 -0.27 1.87 0.00 0.92 0.41 119.26 124.31 2k2n h ALA 194 Ca 0.10 -0.41 0.01 0.00 0.00 0.00 0.00 54.91 54.61 2k2n h ALA 194 Cb 0.43 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 2k2n h ALA 194 CO 0.02 0.67 0.17 0.82 0.00 0.00 0.00 179.25 180.93 2k2n h ILE 195 N 0.80 1.04 -0.11 0.00 1.08 -0.21 0.86 117.51 120.97 2k2n h ILE 195 Ca 0.09 -0.12 -0.07 0.00 -0.39 0.00 0.00 64.86 64.38 2k2n h ILE 195 Cb 0.85 0.67 0.00 0.00 -3.07 0.00 0.00 36.82 35.27 2k2n h ILE 195 CO 0.07 0.06 -0.20 0.00 -0.69 0.00 0.00 178.15 177.40 2k2n h ALA 196 N 1.11 0.17 -0.27 1.87 0.00 -1.16 -2.41 119.26 118.58 2k2n h ALA 196 Ca 0.11 -0.37 -0.05 0.00 0.00 0.00 0.00 54.91 54.60 2k2n h ALA 196 Cb -0.01 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2k2n h ALA 196 CO -0.04 0.11 -0.02 1.96 0.00 0.00 0.00 179.25 181.27 2k2n h GLN 197 N -0.09 0.49 -0.20 0.00 1.08 -0.07 -3.05 115.11 113.27 2k2n h GLN 197 Ca 0.01 -0.17 -0.05 0.00 -1.45 0.00 0.00 58.65 56.99 2k2n h GLN 197 Cb 0.78 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 28.15 2k2n h GLN 197 CO 0.05 0.67 -0.12 0.00 -0.95 0.00 0.00 178.83 178.47 2k2n h ALA 198 N 0.81 1.44 -0.35 3.87 0.00 0.67 -2.67 119.26 123.02 2k2n h ALA 198 Ca 0.08 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 54.78 2k2n h ALA 198 Cb 0.46 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2k2n h ALA 198 CO 0.02 0.39 0.24 1.49 0.00 0.00 0.00 179.25 181.38 2k2n h GLU 199 N 0.30 0.40 -0.47 0.00 4.81 -1.32 -1.77 114.58 116.53 2k2n h GLU 199 Ca 0.06 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.25 2k2n h GLU 199 Cb 0.39 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.66 2k2n h GLU 199 CO 0.02 0.27 0.23 -0.07 -0.73 0.00 0.00 179.01 178.73 2k2n h LEU 200 N 0.42 0.58 0.34 1.64 3.38 -1.50 -2.93 115.31 117.24 2k2n h LEU 200 Ca 0.14 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 2k2n h LEU 200 Cb 0.05 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 2k2n h LEU 200 CO -0.03 0.49 -0.30 0.77 0.09 0.00 0.00 178.44 179.46 2k2n h SER 201 N 0.66 -0.81 0.00 -0.43 4.64 -1.44 -3.53 113.55 112.64 2k2n h SER 201 Ca 0.17 0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 2k2n h SER 201 Cb 0.06 0.27 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 2k2n h SER 201 CO -0.02 -0.44 0.00 -0.11 -0.87 0.00 0.00 176.83 175.38