#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 0.00 0.07 1.96 3.32 -1.99 -2.60 116.42 117.17 2k2n h ASP 32 Ca 0.00 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.92 2k2n h ASP 32 Cb 0.00 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.56 2k2n h ASP 32 CO 0.00 0.84 -0.56 1.56 -1.72 0.00 0.00 179.24 179.35 2k2n h GLN 33 N 0.00 0.26 -0.68 3.56 4.20 -2.01 -3.10 115.11 117.34 2k2n h GLN 33 Ca -0.01 -0.37 -0.07 0.00 0.06 0.00 0.00 58.65 58.26 2k2n h GLN 33 Cb 1.51 0.13 -0.03 0.00 0.30 0.00 0.00 27.48 29.39 2k2n h GLN 33 CO 0.11 1.13 0.14 -0.84 -0.67 0.00 0.00 178.83 178.70 2k2n h ILE 34 N -0.43 1.26 -0.46 2.54 3.07 -1.98 -2.99 117.51 118.52 2k2n h ILE 34 Ca -0.09 -1.00 0.01 0.00 1.55 0.00 0.00 64.86 65.33 2k2n h ILE 34 Cb 1.39 0.58 -0.02 0.00 -0.27 0.00 0.00 36.82 38.49 2k2n h ILE 34 CO 0.11 0.38 0.30 -0.07 -1.05 0.00 0.00 178.15 177.82 2k2n h LEU 35 N 1.05 0.51 -1.56 0.16 3.38 -1.57 -0.62 115.31 116.66 2k2n h LEU 35 Ca 0.21 -0.01 0.12 0.00 0.09 0.00 0.00 57.88 58.29 2k2n h LEU 35 Cb 0.40 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.98 2k2n h LEU 35 CO 0.01 0.37 0.46 -0.09 0.09 0.00 0.00 178.44 179.28 2k2n h ARG 36 N 0.61 0.46 -0.17 1.13 2.43 -1.44 0.20 114.38 117.60 2k2n h ARG 36 Ca 0.17 -0.03 -0.16 0.00 -0.81 0.00 0.00 59.98 59.15 2k2n h ARG 36 Cb -0.05 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.39 2k2n h ARG 36 CO -0.05 0.31 -0.57 0.00 -1.51 0.00 0.00 179.97 178.15 2k2n h ALA 37 N 1.66 0.70 -0.24 2.80 0.00 -1.11 -2.91 119.26 120.16 2k2n h ALA 37 Ca 0.33 -0.52 -0.11 0.00 0.00 0.00 0.00 54.91 54.60 2k2n h ALA 37 Cb 0.63 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 2k2n h ALA 37 CO -0.10 0.69 -0.29 1.79 0.00 0.00 0.00 179.25 181.34 2k2n h THR 38 N 0.40 1.32 -0.33 0.00 1.35 0.72 -2.81 112.91 113.56 2k2n h THR 38 Ca 0.00 -1.48 -0.11 0.00 -0.55 0.00 0.00 66.41 64.27 2k2n h THR 38 Cb 1.11 1.71 -0.01 0.00 -1.73 0.00 0.00 68.15 69.23 2k2n h THR 38 CO 0.10 0.46 -0.26 1.62 -0.25 0.00 0.00 175.52 177.20 2k2n h VAL 39 N 0.32 1.27 -0.22 6.82 3.04 -0.99 -2.23 116.25 124.26 2k2n h VAL 39 Ca 0.03 -1.35 -0.04 0.00 -1.01 0.00 0.00 66.70 64.33 2k2n h VAL 39 Cb 0.86 1.29 -0.01 0.00 -2.01 0.00 0.00 31.29 31.43 2k2n h VAL 39 CO 0.07 0.44 -0.00 -0.08 -1.01 0.00 0.00 177.57 176.99 2k2n h GLU 40 N 0.59 0.40 -0.27 4.17 4.57 -1.54 -2.93 114.58 119.56 2k2n h GLU 40 Ca 0.08 -0.13 -0.01 0.00 -1.18 0.00 0.00 59.36 58.12 2k2n h GLU 40 Cb 0.74 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.29 2k2n h GLU 40 CO 0.06 0.59 0.12 0.93 -1.18 0.00 0.00 179.01 179.53 2k2n h GLU 41 N 0.16 0.40 -0.68 1.92 4.39 -1.46 -2.99 114.58 116.33 2k2n h GLU 41 Ca 0.06 -0.07 0.12 0.00 0.34 0.00 0.00 59.36 59.81 2k2n h GLU 41 Cb 0.41 -0.07 -0.08 0.00 -0.10 0.00 0.00 28.75 28.91 2k2n h GLU 41 CO 0.01 0.41 0.26 0.28 -1.16 0.00 0.00 179.01 178.82 2k2n h VAL 42 N 0.30 0.72 -1.01 3.13 2.07 -1.41 -0.07 116.25 119.99 2k2n h VAL 42 Ca 0.09 -0.15 0.23 0.00 0.82 0.00 0.00 66.70 67.69 2k2n h VAL 42 Cb 0.15 0.25 -0.11 0.00 -1.52 0.00 0.00 31.29 30.06 2k2n h VAL 42 CO -0.01 0.08 0.61 -0.09 0.02 0.00 0.00 177.57 178.18 2k2n h ARG 43 N 0.43 0.61 -0.82 1.57 2.43 -1.36 0.27 114.38 117.51 2k2n h ARG 43 Ca 0.36 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.49 2k2n h ARG 43 Cb 0.49 -0.14 -0.04 0.00 -0.42 0.00 0.00 29.97 29.86 2k2n h ARG 43 CO -0.35 0.40 0.50 0.00 -1.51 0.00 0.00 179.97 179.01 2k2n h ALA 44 N 1.69 1.33 0.01 2.80 0.00 -1.02 3.20 119.26 127.26 2k2n h ALA 44 Ca 0.61 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 55.33 2k2n h ALA 44 Cb 1.14 -0.33 0.01 0.00 0.00 0.00 0.00 17.79 18.60 2k2n h ALA 44 CO -0.42 0.58 -0.39 0.74 0.00 0.00 0.00 179.25 179.76 2k2n h PHE 45 N 1.13 0.37 0.00 0.00 0.04 -0.48 -3.34 116.94 114.66 2k2n h PHE 45 Ca 0.30 -0.21 -0.20 0.00 2.80 0.00 0.00 57.97 60.66 2k2n h PHE 45 Cb -0.05 -0.04 -0.03 0.00 2.20 0.00 0.00 35.95 38.03 2k2n h PHE 45 CO 0.00 1.04 -1.20 -0.07 -0.60 0.00 0.00 178.31 177.48 2k2n h LEU 46 N -0.40 0.00 1.27 1.54 3.38 -0.88 -3.47 115.31 116.74 2k2n h LEU 46 Ca -0.05 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.57 2k2n h LEU 46 Cb 1.16 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 41.79 2k2n h LEU 46 CO 0.08 0.77 -0.34 0.61 0.09 0.00 0.00 178.44 179.65 2k2n n GLY 47 N 1.39 1.32 3.77 0.83 0.00 1.06 -4.91 105.19 108.65 2k2n n GLY 47 Ca -0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.57 2k2n n GLY 47 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2k2n s THR 48 N -2.52 3.55 0.31 2.61 -1.32 -1.25 -4.92 115.64 112.09 2k2n s THR 48 Ca 0.00 1.31 0.06 0.00 -1.21 0.00 0.00 61.69 61.84 2k2n s THR 48 Cb 0.00 -3.74 0.34 0.00 -1.51 0.00 0.00 72.50 67.59 2k2n s THR 48 CO 0.00 0.13 1.62 0.44 -2.21 0.00 0.00 174.62 174.60 2k2n h ASP 49 N 2.90 -0.01 -3.27 8.08 3.32 -1.88 -3.41 116.42 122.15 2k2n h ASP 49 Ca -0.48 0.22 -0.06 0.00 0.02 0.00 0.00 57.03 56.73 2k2n h ASP 49 Cb 1.22 0.30 -0.24 0.00 0.22 0.00 0.00 39.33 40.83 2k2n h ASP 49 CO 0.64 -0.23 -0.15 -0.13 -1.72 0.00 0.00 179.24 177.64 2k2n s ARG 50 N -5.87 0.54 -0.04 3.56 0.52 -1.21 -2.64 118.95 113.81 2k2n s ARG 50 Ca -0.12 0.93 0.00 0.00 -0.52 0.00 0.00 55.73 56.03 2k2n s ARG 50 Cb 0.28 0.09 0.02 0.00 0.52 0.00 0.00 34.95 35.86 2k2n s ARG 50 CO 0.78 -0.14 -0.02 0.54 0.02 0.00 0.00 175.30 176.47 2k2n s VAL 51 N 1.29 0.38 0.05 3.52 0.11 -1.20 0.05 120.40 124.59 2k2n s VAL 51 Ca -0.08 -0.01 0.01 0.00 -2.93 0.00 0.00 61.98 58.97 2k2n s VAL 51 Cb -0.06 -0.45 -0.03 0.00 -1.53 0.00 0.00 36.38 34.31 2k2n s VAL 51 CO -0.13 0.20 -0.05 -0.54 -3.33 0.00 0.00 175.10 171.25 2k2n s LYS 52 N 1.12 0.52 -0.14 1.54 1.02 -1.08 -2.44 119.74 120.27 2k2n s LYS 52 Ca -0.08 -0.91 -0.09 0.00 0.02 0.00 0.00 55.97 54.91 2k2n s LYS 52 Cb -0.14 -0.01 -0.04 0.00 -0.52 0.00 0.00 37.83 37.12 2k2n s LYS 52 CO -0.01 -0.04 0.15 0.08 -0.92 0.00 0.00 175.35 174.61 2k2n s VAL 53 N -2.40 5.45 -0.28 3.17 1.01 -0.19 -2.86 120.40 124.31 2k2n s VAL 53 Ca -0.04 0.24 -0.00 0.00 0.00 0.00 0.00 61.98 62.17 2k2n s VAL 53 Cb -0.03 -3.44 0.05 0.00 0.00 0.00 0.00 36.38 32.96 2k2n s VAL 53 CO -0.04 0.55 -0.05 -0.47 0.00 0.00 0.00 175.10 175.09 2k2n s TYR 54 N -0.51 3.23 -0.19 5.22 5.04 0.19 -3.52 117.35 126.81 2k2n s TYR 54 Ca 0.13 -1.98 -0.25 0.00 -2.44 0.00 0.00 57.07 52.53 2k2n s TYR 54 Cb -0.12 -2.03 -0.01 0.00 0.35 0.00 0.00 41.96 40.15 2k2n s TYR 54 CO 0.02 -0.82 0.84 0.50 -1.34 0.00 0.00 175.55 174.75 2k2n s ARG 55 N 1.21 4.27 0.11 4.97 3.00 -1.15 -0.43 118.95 130.93 2k2n s ARG 55 Ca -0.06 1.01 -0.19 0.00 -1.00 0.00 0.00 55.73 55.49 2k2n s ARG 55 Cb -0.19 -3.59 -0.07 0.00 0.00 0.00 0.00 34.95 31.09 2k2n s ARG 55 CO -0.03 -0.39 0.59 0.12 0.00 0.00 0.00 175.30 175.60 2k2n s PHE 56 N 2.36 3.77 -0.06 5.12 5.36 0.19 -2.40 117.98 132.31 2k2n s PHE 56 Ca 0.37 1.27 0.02 0.00 -0.96 0.00 0.00 56.93 57.64 2k2n s PHE 56 Cb -0.16 -2.50 -0.03 0.00 -0.34 0.00 0.00 43.02 39.99 2k2n s PHE 56 CO 0.11 0.53 -0.10 -0.51 -1.46 0.00 0.00 175.22 173.79 2k2n s ASP 57 N -1.27 4.39 0.53 6.13 1.11 -1.26 -4.86 116.67 121.45 2k2n s ASP 57 Ca 0.32 -0.09 0.39 0.00 0.18 0.00 0.00 52.55 53.35 2k2n s ASP 57 Cb -0.19 -1.03 1.57 0.00 1.07 0.00 0.00 42.92 44.34 2k2n s ASP 57 CO 0.20 0.36 1.74 -0.65 1.18 0.00 0.00 175.17 177.99 2k2n h PRO 58 N 5.29 0.03 0.00 8.23 0.11 -1.97 1.76 132.00 145.44 2k2n h PRO 58 Ca -0.48 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2k2n h PRO 58 Cb 1.16 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2k2n h PRO 58 CO 0.51 0.02 -0.11 1.49 -0.21 0.00 0.00 178.00 179.70 2k2n h GLU 59 N 0.03 0.00 0.00 1.05 4.81 -2.04 -3.47 114.58 114.96 2k2n h GLU 59 Ca 0.67 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.90 2k2n h GLU 59 Cb 2.59 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.97 2k2n h GLU 59 CO -0.04 0.00 0.00 0.41 -0.73 0.00 0.00 179.01 178.65 2k2n n GLY 60 N 1.14 0.93 3.56 1.92 0.00 0.60 -4.87 105.19 108.47 2k2n n GLY 60 Ca 0.04 0.00 -0.40 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 -2.09 2.47 0.25 1.61 3.76 -1.25 -4.48 115.29 115.55 2k2n s HIS 61 Ca 0.00 -0.70 -0.07 0.00 -0.15 0.00 0.00 55.06 54.14 2k2n s HIS 61 Cb 0.00 -4.65 -0.06 0.00 1.11 0.00 0.00 32.58 28.98 2k2n s HIS 61 CO 0.00 -1.93 0.54 0.20 -0.85 0.00 0.00 174.74 172.69 2k2n s GLY 62 N 5.17 2.09 0.09 -2.22 0.00 -1.26 -4.00 107.32 107.18 2k2n s GLY 62 Ca 0.47 -0.43 0.08 0.00 0.00 0.00 0.00 44.72 44.85 2k2n s GLY 62 CO -0.08 -0.31 -0.20 -0.51 0.00 0.00 0.00 173.10 172.00 2k2n s THR 63 N -1.93 1.63 -0.47 0.90 -4.23 -1.01 -3.13 115.64 107.41 2k2n s THR 63 Ca 0.45 -1.44 -0.29 0.00 -1.18 0.00 0.00 61.69 59.24 2k2n s THR 63 Cb -0.11 -1.47 0.02 0.00 1.34 0.00 0.00 72.50 72.28 2k2n s THR 63 CO 0.26 -0.02 1.27 -0.69 -0.54 0.00 0.00 174.62 174.89 2k2n s VAL 64 N -1.09 4.04 -1.77 2.29 1.01 -1.25 -2.92 120.40 120.70 2k2n s VAL 64 Ca 0.06 1.03 0.15 0.00 0.00 0.00 0.00 61.98 63.22 2k2n s VAL 64 Cb -0.10 -4.45 0.14 0.00 0.00 0.00 0.00 36.38 31.97 2k2n s VAL 64 CO 0.03 -0.96 0.99 0.52 0.00 0.00 0.00 175.10 175.69 2k2n n VAL 65 N 6.93 0.08 -3.59 2.92 0.31 -1.23 -3.52 118.33 120.23 2k2n n VAL 65 Ca 0.13 -0.54 -0.01 0.00 -0.01 0.00 0.00 64.34 63.91 2k2n n VAL 65 Cb 0.49 1.24 -0.04 0.00 -0.91 0.00 0.00 33.84 34.61 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 -1.20 -2.00 -0.11 3.52 0.00 -1.26 -4.11 121.76 116.62 2k2n s ALA 66 Ca 0.18 2.21 -0.07 0.00 0.00 0.00 0.00 51.96 54.28 2k2n s ALA 66 Cb 0.12 -1.79 0.04 0.00 0.00 0.00 0.00 23.12 21.49 2k2n s ALA 66 CO 0.18 -0.97 0.26 -1.83 0.00 0.00 0.00 175.76 173.40 2k2n s GLU 67 N 2.87 0.25 0.06 0.00 4.04 -1.26 -1.02 118.70 123.64 2k2n s GLU 67 Ca -0.02 0.48 0.05 0.00 0.04 0.00 0.00 54.97 55.52 2k2n s GLU 67 Cb -0.12 -0.01 -0.03 0.00 0.02 0.00 0.00 34.13 33.99 2k2n s GLU 67 CO -0.19 -0.11 -0.15 0.00 -1.84 0.00 0.00 175.26 172.97 2k2n s ALA 68 N 0.84 1.22 -0.00 -0.84 0.00 -1.02 -4.82 121.76 117.14 2k2n s ALA 68 Ca -0.06 -0.95 -0.02 0.00 0.00 0.00 0.00 51.96 50.92 2k2n s ALA 68 Cb -0.07 -0.14 -0.00 0.00 0.00 0.00 0.00 23.12 22.90 2k2n s ALA 68 CO -0.05 0.20 0.05 -0.98 0.00 0.00 0.00 175.76 174.98 2k2n s ARG 69 N -1.52 0.24 0.37 0.00 1.70 -1.26 -3.23 118.95 115.25 2k2n s ARG 69 Ca 0.00 -0.25 0.14 0.00 -0.47 0.00 0.00 55.73 55.16 2k2n s ARG 69 Cb -0.09 0.09 0.99 0.00 -0.57 0.00 0.00 34.95 35.37 2k2n s ARG 69 CO 0.02 -0.04 1.79 0.78 -1.08 0.00 0.00 175.30 176.77 2k2n h GLY 70 N 5.22 1.32 0.00 3.88 0.00 -1.75 -3.46 103.07 108.28 2k2n h GLY 70 Ca -0.28 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 46.80 2k2n h GLY 70 CO 0.44 -0.09 0.00 0.61 0.00 0.00 0.00 176.54 177.50 2k2n n GLY 71 N -1.44 0.88 1.86 4.60 0.00 -1.26 -4.99 105.19 104.84 2k2n n GLY 71 Ca 0.23 -0.81 -0.02 0.00 0.00 0.00 0.00 46.02 45.42 2k2n n GLY 71 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2k2n n GLU 72 N 0.00 0.77 -0.03 1.61 1.02 -1.26 -3.92 120.64 118.83 2k2n n GLU 72 Ca 0.00 -0.18 -0.19 0.00 -0.02 0.00 0.00 57.16 56.77 2k2n n GLU 72 Cb 0.00 -1.38 -0.13 0.00 -0.02 0.00 0.00 31.44 29.90 2k2n n GLU 72 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2k2n h ARG 73 N 2.84 0.15 -6.37 3.49 3.08 -1.96 -3.47 114.38 112.14 2k2n h ARG 73 Ca 0.03 -0.25 -0.60 0.00 0.07 0.00 0.00 59.98 59.24 2k2n h ARG 73 Cb 0.68 0.09 -0.21 0.00 0.08 0.00 0.00 29.97 30.61 2k2n h ARG 73 CO 0.10 1.12 -0.83 -0.51 -1.07 0.00 0.00 179.97 178.78 2k2n s LEU 74 N -7.85 2.33 0.90 3.04 1.43 -1.25 -5.14 118.68 112.14 2k2n s LEU 74 Ca -0.20 -0.73 -0.12 0.00 -1.03 0.00 0.00 54.13 52.05 2k2n s LEU 74 Cb 0.02 -0.99 0.13 0.00 0.03 0.00 0.00 46.19 45.39 2k2n s LEU 74 CO 0.73 0.08 1.09 -2.16 0.23 0.00 0.00 176.35 176.32 2k2n s PRO 75 N -2.10 1.19 -0.11 1.29 0.04 -1.26 -5.01 135.00 129.04 2k2n s PRO 75 Ca 0.10 0.81 -0.16 0.00 0.04 0.00 0.00 61.00 61.79 2k2n s PRO 75 Cb -0.09 -1.80 -0.05 0.00 0.04 0.00 0.00 34.50 32.60 2k2n s PRO 75 CO 0.05 -2.29 0.41 -1.54 0.04 0.00 0.00 177.00 173.68 2k2n s SER 76 N -3.41 6.64 0.00 6.66 1.04 -1.26 -4.95 113.70 118.42 2k2n s SER 76 Ca 0.64 0.75 0.13 0.00 0.48 0.00 0.00 55.95 57.95 2k2n s SER 76 Cb -0.18 -2.25 0.39 0.00 0.10 0.00 0.00 66.02 64.08 2k2n s SER 76 CO 0.57 0.09 1.32 0.18 0.98 0.00 0.00 173.24 176.37 2k2n n LEU 77 N 3.31 1.91 -4.72 2.42 4.77 -1.26 -4.94 117.00 118.50 2k2n n LEU 77 Ca -0.10 -0.93 -0.42 0.00 -0.03 0.00 0.00 56.01 54.53 2k2n n LEU 77 Cb 0.52 -0.22 -0.03 0.00 -2.33 0.00 0.00 43.42 41.36 2k2n n LEU 77 CO 0.41 0.47 1.31 -0.22 -1.33 0.00 0.00 177.39 178.02 2k2n s LEU 78 N -1.10 4.37 0.00 2.23 2.96 -1.26 -1.87 118.68 124.01 2k2n s LEU 78 Ca 0.26 2.78 0.00 0.00 -0.22 0.00 0.00 54.13 56.95 2k2n s LEU 78 Cb 0.14 -3.60 0.00 0.00 0.50 0.00 0.00 46.19 43.22 2k2n s LEU 78 CO 0.18 -0.91 0.00 0.61 -1.32 0.00 0.00 176.35 174.91 2k2n n GLY 79 N 3.74 2.44 3.83 7.98 0.00 -1.23 -5.03 105.19 116.92 2k2n n GLY 79 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 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 3.93 -0.18 0.99 1.43 -0.78 -4.95 118.68 119.11 2k2n s LEU 80 Ca 0.00 1.63 -0.07 0.00 -1.03 0.00 0.00 54.13 54.66 2k2n s LEU 80 Cb 0.00 -4.48 -0.04 0.00 0.03 0.00 0.00 46.19 41.71 2k2n s LEU 80 CO 0.00 -0.36 0.05 -0.89 0.23 0.00 0.00 176.35 175.38 2k2n s THR 81 N -2.19 4.64 -0.05 5.49 2.01 -1.26 -3.85 115.64 120.43 2k2n s THR 81 Ca 0.61 -0.09 -0.28 0.00 0.31 0.00 0.00 61.69 62.24 2k2n s THR 81 Cb -0.09 -3.08 -0.03 0.00 0.01 0.00 0.00 72.50 69.31 2k2n s THR 81 CO 0.15 0.46 0.90 -0.36 -0.69 0.00 0.00 174.62 175.08 2k2n s PHE 82 N 0.42 3.59 -0.23 4.92 0.40 -1.18 -4.96 117.98 120.94 2k2n s PHE 82 Ca 0.02 1.52 -0.43 0.00 -0.60 0.00 0.00 56.93 57.44 2k2n s PHE 82 Cb -0.13 -3.04 -0.20 0.00 0.51 0.00 0.00 43.02 40.17 2k2n s PHE 82 CO 0.01 -0.04 1.32 -2.30 0.70 0.00 0.00 175.22 174.91 2k2n n PRO 83 N 4.16 0.04 -1.89 0.24 -0.02 -1.26 -4.47 135.00 131.80 2k2n n PRO 83 Ca 0.04 0.01 -0.42 0.00 -2.02 0.00 0.00 63.50 61.12 2k2n n PRO 83 Cb 0.51 -1.52 -0.02 0.00 -0.02 0.00 0.00 33.50 32.44 2k2n n PRO 83 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2k2n s ALA 84 N 1.42 3.75 0.00 3.55 0.00 -1.26 -2.42 121.76 126.80 2k2n s ALA 84 Ca 0.97 1.44 0.00 0.00 0.00 0.00 0.00 51.96 54.37 2k2n s ALA 84 Cb -1.37 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 18.13 2k2n s ALA 84 CO 0.68 -0.84 0.00 0.41 0.00 0.00 0.00 175.76 176.01 2k2n n GLY 85 N 2.96 0.69 0.35 0.00 0.00 -1.26 -4.96 105.19 102.97 2k2n n GLY 85 Ca 0.11 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.21 2k2n n GLY 85 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2k2n h ASP 86 N 0.00 0.58 -3.38 1.61 3.58 -1.81 -3.38 116.42 113.62 2k2n h ASP 86 Ca 0.00 0.01 -0.58 0.00 0.42 0.00 0.00 57.03 56.88 2k2n h ASP 86 Cb 0.00 -0.11 -0.08 0.00 1.72 0.00 0.00 39.33 40.86 2k2n h ASP 86 CO 0.00 0.36 0.06 -0.63 -2.88 0.00 0.00 179.24 176.15 2k2n s ILE 87 N -5.59 5.06 0.00 2.25 1.01 -1.26 -5.07 121.20 117.60 2k2n s ILE 87 Ca -0.09 1.23 0.00 0.00 0.00 0.00 0.00 60.65 61.79 2k2n s ILE 87 Cb 0.20 -3.95 0.00 0.00 0.01 0.00 0.00 42.46 38.71 2k2n s ILE 87 CO 0.77 0.20 0.00 -0.81 0.00 0.00 0.00 174.94 175.10 2k2n n PRO 88 N 4.35 1.77 -0.00 2.79 -0.04 -1.26 -4.99 135.00 137.62 2k2n n PRO 88 Ca -0.02 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.43 2k2n n PRO 88 Cb 0.51 0.00 -0.00 0.00 -0.04 0.00 0.00 33.50 33.96 2k2n n PRO 88 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2k2n n GLU 89 N 0.00 0.04 -0.23 0.54 4.07 -1.26 -4.27 120.64 119.53 2k2n n GLU 89 Ca 0.00 0.02 0.04 0.00 -0.06 0.00 0.00 57.16 57.15 2k2n n GLU 89 Cb 0.00 -0.40 0.15 0.00 -0.06 0.00 0.00 31.44 31.13 2k2n n GLU 89 CO 0.00 0.00 0.00 1.05 -0.06 0.00 0.00 177.13 178.12 2k2n h GLU 90 N -0.07 0.21 -0.28 5.31 9.09 -2.00 -1.44 114.58 125.39 2k2n h GLU 90 Ca 0.00 -0.01 -0.04 0.00 0.05 0.00 0.00 59.36 59.35 2k2n h GLU 90 Cb 0.07 -0.05 -0.01 0.00 -1.65 0.00 0.00 28.75 27.12 2k2n h GLU 90 CO 0.00 0.14 0.01 0.00 0.05 0.00 0.00 179.01 179.21 2k2n h ALA 91 N 1.59 0.38 -0.56 1.06 0.00 -2.00 -3.01 119.26 116.72 2k2n h ALA 91 Ca 0.38 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 55.08 2k2n h ALA 91 Cb 0.63 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 2k2n h ALA 91 CO -0.51 0.11 0.37 -0.09 0.00 0.00 0.00 179.25 179.13 2k2n h ARG 92 N 0.29 0.70 -0.09 0.00 2.43 -1.54 -1.29 114.38 114.87 2k2n h ARG 92 Ca 0.08 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.17 2k2n h ARG 92 Cb 0.41 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 2k2n h ARG 92 CO 0.01 0.46 -0.12 -0.09 -1.51 0.00 0.00 179.97 178.72 2k2n h ARG 93 N 0.72 0.14 -0.24 0.20 2.43 -1.16 -2.12 114.38 114.34 2k2n h ARG 93 Ca 0.21 -0.03 -0.13 0.00 -0.81 0.00 0.00 59.98 59.23 2k2n h ARG 93 Cb -0.03 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.49 2k2n h ARG 93 CO -0.05 0.27 -0.39 -0.07 -1.51 0.00 0.00 179.97 178.22 2k2n h LEU 94 N 0.13 0.59 -1.89 3.80 3.38 -1.19 -2.17 115.31 117.96 2k2n h LEU 94 Ca 0.03 -0.25 0.03 0.00 0.09 0.00 0.00 57.88 57.77 2k2n h LEU 94 Cb 0.30 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2k2n h LEU 94 CO 0.02 0.91 0.13 -0.26 0.09 0.00 0.00 178.44 179.33 2k2n h PHE 95 N 0.46 0.14 0.00 1.13 0.04 -1.23 0.90 116.94 118.39 2k2n h PHE 95 Ca 0.04 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.73 2k2n h PHE 95 Cb 0.88 -0.05 -0.01 0.00 2.20 0.00 0.00 35.95 38.97 2k2n h PHE 95 CO 0.03 0.08 -0.67 0.00 -0.60 0.00 0.00 178.31 177.16 2k2n h ARG 96 N 0.15 0.00 0.00 1.51 3.08 -1.38 -3.23 114.38 114.51 2k2n h ARG 96 Ca 0.08 0.00 -0.44 0.00 0.07 0.00 0.00 59.98 59.70 2k2n h ARG 96 Cb 0.14 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.12 2k2n h ARG 96 CO -0.01 0.30 -2.45 1.28 -1.07 0.00 0.00 179.97 178.01 2k2n n LEU 97 N -3.06 2.20 -0.04 3.04 4.77 -0.13 -3.99 117.00 119.79 2k2n n LEU 97 Ca -0.00 0.23 0.03 0.00 -0.03 0.00 0.00 56.01 56.24 2k2n n LEU 97 Cb 0.70 -0.86 -0.03 0.00 -2.33 0.00 0.00 43.42 40.90 2k2n n LEU 97 CO 0.40 0.65 0.04 0.00 -1.33 0.00 0.00 177.39 177.15 2k2n n ALA 98 N -3.95 2.78 -3.40 -1.18 0.00 0.29 -5.05 120.51 110.00 2k2n n ALA 98 Ca -0.51 -0.24 -0.37 0.00 0.00 0.00 0.00 53.44 52.33 2k2n n ALA 98 Cb 0.90 -0.23 0.04 0.00 0.00 0.00 0.00 19.45 20.16 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 -0.92 -1.77 0.00 0.00 1.13 -1.12 -4.96 117.38 109.74 2k2n n GLN 99 Ca 0.02 1.33 0.00 0.00 -1.94 0.00 0.00 57.00 56.41 2k2n n GLN 99 Cb 0.11 -1.86 0.00 0.00 0.11 0.00 0.00 30.24 28.60 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 -0.10 0.00 -3.60 5.09 3.14 -1.26 -4.91 118.33 116.69 2k2n n VAL 100 Ca -0.08 0.00 -0.09 0.00 -2.96 0.00 0.00 64.34 61.21 2k2n n VAL 100 Cb 0.65 0.00 -0.06 0.00 -1.06 0.00 0.00 33.84 33.38 2k2n n VAL 100 CO 0.00 0.00 0.00 -0.13 -6.46 0.00 0.00 176.83 170.24 2k2n s ARG 101 N 0.00 0.51 -0.04 1.45 0.52 -1.25 -4.91 118.95 115.22 2k2n s ARG 101 Ca 0.00 0.26 -0.30 0.00 -0.52 0.00 0.00 55.73 55.18 2k2n s ARG 101 Cb 0.00 0.24 0.07 0.00 0.52 0.00 0.00 34.95 35.78 2k2n s ARG 101 CO 0.00 -0.13 0.66 0.08 0.02 0.00 0.00 175.30 175.93 2k2n s VAL 102 N -0.66 0.00 -0.12 3.52 1.01 -1.26 -2.27 120.40 120.62 2k2n s VAL 102 Ca 0.01 -0.03 -0.03 0.00 0.00 0.00 0.00 61.98 61.93 2k2n s VAL 102 Cb -0.02 -0.98 -0.03 0.00 0.00 0.00 0.00 36.38 35.35 2k2n s VAL 102 CO -0.02 -0.02 -0.02 -0.63 0.00 0.00 0.00 175.10 174.41 2k2n s ILE 103 N -1.26 4.09 0.45 2.22 1.01 0.25 -4.10 121.20 123.86 2k2n s ILE 103 Ca -0.11 -0.31 0.01 0.00 0.00 0.00 0.00 60.65 60.24 2k2n s ILE 103 Cb -0.00 -2.75 -0.00 0.00 0.01 0.00 0.00 42.46 39.71 2k2n s ILE 103 CO 0.09 0.54 0.66 0.68 0.00 0.00 0.00 174.94 176.91 2k2n s VAL 104 N -0.21 3.87 -0.35 2.92 -7.23 -1.26 -3.03 120.40 115.11 2k2n s VAL 104 Ca 0.04 -0.57 -0.41 0.00 -1.81 0.00 0.00 61.98 59.23 2k2n s VAL 104 Cb -0.13 -3.42 -0.16 0.00 0.56 0.00 0.00 36.38 33.23 2k2n s VAL 104 CO 0.02 -0.28 1.81 -0.90 -0.31 0.00 0.00 175.10 175.44 2k2n n ASP 105 N -2.05 1.98 0.30 4.85 5.68 -1.26 -4.68 116.55 121.35 2k2n n ASP 105 Ca 0.02 0.98 0.18 0.00 -0.50 0.00 0.00 54.79 55.47 2k2n n ASP 105 Cb 0.58 -1.08 0.93 0.00 -1.14 0.00 0.00 41.12 40.41 2k2n n ASP 105 CO 0.00 0.00 0.00 1.62 -1.33 0.00 0.00 177.20 177.49 2k2n h VAL 106 N 5.58 0.12 -0.45 2.12 3.04 -1.69 0.25 116.25 125.23 2k2n h VAL 106 Ca -0.40 0.00 -0.06 0.00 -1.01 0.00 0.00 66.70 65.23 2k2n h VAL 106 Cb 1.34 0.79 -0.02 0.00 -2.01 0.00 0.00 31.29 31.39 2k2n h VAL 106 CO 0.99 0.00 0.05 -0.08 -1.01 0.00 0.00 177.57 177.51 2k2n h GLU 107 N 0.00 0.76 0.00 4.17 4.81 -1.86 -0.68 114.58 121.78 2k2n h GLU 107 Ca 0.03 -0.22 0.00 0.00 -0.13 0.00 0.00 59.36 59.04 2k2n h GLU 107 Cb 0.47 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.77 2k2n h GLU 107 CO -0.00 0.79 0.00 0.00 -0.73 0.00 0.00 179.01 179.07 2k2n n ALA 108 N -2.40 1.35 -3.63 2.92 0.00 0.07 -4.90 120.51 113.93 2k2n n ALA 108 Ca 0.00 0.04 -0.20 0.00 0.00 0.00 0.00 53.44 53.28 2k2n n ALA 108 Cb 0.26 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.51 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 -1.79 -1.43 -2.54 0.00 7.27 -0.26 -4.92 117.38 113.71 2k2n n GLN 109 Ca 0.01 0.89 -0.42 0.00 0.07 0.00 0.00 57.00 57.56 2k2n n GLN 109 Cb 0.11 -3.16 -0.03 0.00 2.41 0.00 0.00 30.24 29.56 2k2n n GLN 109 CO 0.00 0.00 0.00 -1.12 0.07 0.00 0.00 177.06 176.01 2k2n s SER 110 N -3.03 7.24 -0.03 1.69 0.01 -1.26 -5.03 113.70 113.29 2k2n s SER 110 Ca 0.04 1.95 0.07 0.00 1.31 0.00 0.00 55.95 59.32 2k2n s SER 110 Cb -0.02 -2.59 -0.02 0.00 0.21 0.00 0.00 66.02 63.61 2k2n s SER 110 CO 0.86 -0.31 -0.25 -0.60 0.41 0.00 0.00 173.24 173.36 2k2n s ARG 111 N 0.48 2.22 0.10 12.44 3.52 -1.26 -4.32 118.95 132.13 2k2n s ARG 111 Ca 0.53 -0.90 0.09 0.00 -0.13 0.00 0.00 55.73 55.31 2k2n s ARG 111 Cb -0.27 -2.09 -0.04 0.00 -1.56 0.00 0.00 34.95 30.99 2k2n s ARG 111 CO 0.31 0.54 -0.22 0.45 -0.81 0.00 0.00 175.30 175.57 2k2n s SER 112 N -0.55 2.64 0.29 -2.12 0.15 -1.24 -4.73 113.70 108.14 2k2n s SER 112 Ca 0.08 -0.69 -0.12 0.00 0.70 0.00 0.00 55.95 55.92 2k2n s SER 112 Cb -0.11 -0.15 0.01 0.00 -1.71 0.00 0.00 66.02 64.06 2k2n s SER 112 CO -0.00 0.08 0.54 0.27 1.20 0.00 0.00 173.24 175.33 2k2n s ILE 113 N -1.14 0.00 0.67 6.45 -4.36 -1.26 -3.97 121.20 117.59 2k2n s ILE 113 Ca 0.07 -1.35 -0.15 0.00 -0.26 0.00 0.00 60.65 58.96 2k2n s ILE 113 Cb -0.10 -2.36 0.01 0.00 1.25 0.00 0.00 42.46 41.25 2k2n s ILE 113 CO 0.04 0.00 1.15 -0.94 0.24 0.00 0.00 174.94 175.44 2k2n s SER 114 N -3.06 4.81 0.03 4.36 1.04 -1.26 -5.05 113.70 114.57 2k2n s SER 114 Ca 0.22 2.16 0.00 0.00 0.48 0.00 0.00 55.95 58.81 2k2n s SER 114 Cb -0.02 -2.57 -0.02 0.00 0.10 0.00 0.00 66.02 63.51 2k2n s SER 114 CO 0.11 -1.84 -0.04 0.00 0.98 0.00 0.00 173.24 172.46 2k2n s GLN 115 N -3.93 0.41 0.15 4.02 -2.07 -1.26 -5.04 119.66 111.94 2k2n s GLN 115 Ca 0.71 -0.76 0.25 0.00 -1.82 0.00 0.00 55.36 53.74 2k2n s GLN 115 Cb -0.24 0.07 0.63 0.00 -1.09 0.00 0.00 33.01 32.38 2k2n s GLN 115 CO 0.41 -0.05 1.58 -0.35 -1.32 0.00 0.00 175.29 175.57 2k2n n PRO 116 N 1.26 0.25 -1.66 9.60 -0.04 -1.26 -4.91 135.00 138.24 2k2n n PRO 116 Ca -0.22 0.14 -0.40 0.00 -0.04 0.00 0.00 63.50 62.99 2k2n n PRO 116 Cb 0.56 -1.73 0.03 0.00 -0.04 0.00 0.00 33.50 32.32 2k2n n PRO 116 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2k2n n GLU 117 N -2.13 1.44 -0.96 0.54 1.02 -1.26 -4.95 120.64 114.34 2k2n n GLU 117 Ca 0.05 0.53 -0.30 0.00 -0.02 0.00 0.00 57.16 57.42 2k2n n GLU 117 Cb 0.43 -2.26 0.17 0.00 -0.02 0.00 0.00 31.44 29.76 2k2n n GLU 117 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2k2n s SER 118 N -0.85 2.74 0.27 1.62 0.01 -1.26 -5.03 113.70 111.20 2k2n s SER 118 Ca 0.67 1.60 -0.02 0.00 1.31 0.00 0.00 55.95 59.51 2k2n s SER 118 Cb -0.48 -2.25 -0.04 0.00 0.21 0.00 0.00 66.02 63.45 2k2n s SER 118 CO 0.53 -3.11 0.49 0.86 0.41 0.00 0.00 173.24 172.42 2k2n s TRP 119 N -2.77 3.48 0.00 2.43 -0.11 -1.26 -5.08 118.94 115.63 2k2n s TRP 119 Ca 0.65 0.47 0.00 0.00 1.22 0.00 0.00 56.10 58.44 2k2n s TRP 119 Cb -0.20 -1.97 0.00 0.00 -1.50 0.00 0.00 33.47 29.80 2k2n s TRP 119 CO 0.59 0.24 0.00 0.41 -4.62 0.00 0.00 176.95 173.57 2k2n n GLY 120 N -1.01 -0.73 3.17 5.86 0.00 -1.26 -5.09 105.19 106.13 2k2n n GLY 120 Ca -0.03 -1.04 -0.40 0.00 0.00 0.00 0.00 46.02 44.55 2k2n n GLY 120 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2k2n s LEU 121 N 0.00 5.75 0.24 0.99 2.96 -1.26 -4.87 118.68 122.49 2k2n s LEU 121 Ca 0.00 -2.89 0.25 0.00 -0.22 0.00 0.00 54.13 51.27 2k2n s LEU 121 Cb 0.00 -1.97 0.90 0.00 0.50 0.00 0.00 46.19 45.62 2k2n s LEU 121 CO 0.00 -0.41 1.75 -1.54 -1.32 0.00 0.00 176.35 174.83 2k2n n SER 122 N 3.52 0.76 -0.24 3.68 3.41 -1.26 -3.31 113.62 120.17 2k2n n SER 122 Ca 0.11 0.62 0.23 0.00 -0.26 0.00 0.00 58.87 59.57 2k2n n SER 122 Cb 0.41 -0.81 0.57 0.00 -0.26 0.00 0.00 64.21 64.12 2k2n n SER 122 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2k2n h ALA 123 N 2.39 2.40 -0.95 7.33 0.00 -1.94 0.10 119.26 128.59 2k2n h ALA 123 Ca 0.00 0.01 0.17 0.00 0.00 0.00 0.00 54.91 55.09 2k2n h ALA 123 Cb 0.56 0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.26 2k2n h ALA 123 CO 0.00 -0.70 0.55 0.00 0.00 0.00 0.00 179.25 179.10 2k2n h ARG 124 N 0.29 0.70 -3.37 0.00 3.08 -1.97 -3.19 114.38 109.92 2k2n h ARG 124 Ca 0.48 -0.04 -0.67 0.00 0.07 0.00 0.00 59.98 59.82 2k2n h ARG 124 Cb 1.39 -0.16 -0.38 0.00 0.08 0.00 0.00 29.97 30.91 2k2n h ARG 124 CO -0.15 0.46 -0.40 0.14 -1.07 0.00 0.00 179.97 178.96 2k2n s VAL 125 N -5.90 3.47 -0.52 2.04 -7.23 0.36 -5.02 120.40 107.60 2k2n s VAL 125 Ca -0.12 -3.52 -0.07 0.00 -1.81 0.00 0.00 61.98 56.46 2k2n s VAL 125 Cb 0.24 -3.26 -0.16 0.00 0.56 0.00 0.00 36.38 33.77 2k2n s VAL 125 CO 0.79 -0.94 1.62 -2.65 -0.31 0.00 0.00 175.10 173.61 2k2n n PRO 126 N 2.82 0.04 -3.82 4.82 -0.02 -1.21 -4.81 135.00 132.83 2k2n n PRO 126 Ca 0.13 -0.19 -0.12 0.00 -2.02 0.00 0.00 63.50 61.29 2k2n n PRO 126 Cb 0.36 -1.42 -0.13 0.00 -0.02 0.00 0.00 33.50 32.29 2k2n n PRO 126 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2k2n s LEU 127 N 2.40 1.48 0.00 2.45 2.96 -1.26 -4.84 118.68 121.86 2k2n s LEU 127 Ca 0.62 0.26 0.00 0.00 -0.22 0.00 0.00 54.13 54.79 2k2n s LEU 127 Cb -0.33 0.43 0.00 0.00 0.50 0.00 0.00 46.19 46.79 2k2n s LEU 127 CO 0.24 -0.05 0.00 0.61 -1.32 0.00 0.00 176.35 175.83 2k2n n GLY 128 N 3.07 0.86 2.78 7.98 0.00 -1.26 -4.56 105.19 114.05 2k2n n GLY 128 Ca -0.13 -0.10 -0.05 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.26 -1.86 0.10 1.61 1.02 -1.26 -4.94 120.64 113.05 2k2n n GLU 129 Ca 0.00 1.80 0.12 0.00 -0.02 0.00 0.00 57.16 59.06 2k2n n GLU 129 Cb 0.00 -5.30 0.18 0.00 -0.02 0.00 0.00 31.44 26.30 2k2n n GLU 129 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 2k2n h PRO 130 N 1.38 0.00 -0.49 3.49 0.13 -1.93 -3.31 132.00 131.26 2k2n h PRO 130 Ca 0.00 0.00 0.09 0.00 -0.87 0.00 0.00 66.00 65.22 2k2n h PRO 130 Cb 0.93 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.04 2k2n h PRO 130 CO 0.21 0.00 0.33 1.25 -0.23 0.00 0.00 178.00 179.56 2k2n h LEU 131 N 0.00 0.23 -7.80 1.56 5.85 -1.98 -3.40 115.31 109.78 2k2n h LEU 131 Ca 0.00 0.00 -0.43 0.00 0.84 0.00 0.00 57.88 58.29 2k2n h LEU 131 Cb 0.84 -0.05 -0.34 0.00 0.37 0.00 0.00 40.66 41.49 2k2n h LEU 131 CO 0.00 0.14 -0.78 0.00 -0.34 0.00 0.00 178.44 177.46 2k2n s GLN 132 N -5.26 1.04 0.05 1.25 -2.07 -1.25 -4.53 119.66 108.89 2k2n s GLN 132 Ca -0.07 -0.18 0.07 0.00 -1.82 0.00 0.00 55.36 53.36 2k2n s GLN 132 Cb 0.19 -0.98 -0.03 0.00 -1.09 0.00 0.00 33.01 31.11 2k2n s GLN 132 CO 0.73 -0.06 -0.19 1.03 -1.32 0.00 0.00 175.29 175.48 2k2n s ARG 133 N 0.86 1.25 0.29 9.60 1.81 -1.26 -4.94 118.95 126.56 2k2n s ARG 133 Ca -0.12 -0.92 -0.28 0.00 -1.72 0.00 0.00 55.73 52.69 2k2n s ARG 133 Cb -0.15 -1.35 -0.09 0.00 -0.45 0.00 0.00 34.95 32.91 2k2n s ARG 133 CO 0.01 0.34 1.02 -1.25 -0.68 0.00 0.00 175.30 174.74 2k2n s PRO 134 N -1.25 4.63 -0.20 3.54 0.04 -1.26 -4.68 135.00 135.81 2k2n s PRO 134 Ca 0.06 1.59 -0.05 0.00 0.04 0.00 0.00 61.00 62.64 2k2n s PRO 134 Cb -0.09 -3.06 -0.02 0.00 0.04 0.00 0.00 34.50 31.37 2k2n s PRO 134 CO 0.02 0.27 -0.01 0.14 0.04 0.00 0.00 177.00 177.45 2k2n s VAL 135 N -1.31 3.81 0.68 -0.36 -7.23 -1.26 -4.51 120.40 110.21 2k2n s VAL 135 Ca 0.46 -0.36 -0.17 0.00 -1.81 0.00 0.00 61.98 60.10 2k2n s VAL 135 Cb -0.26 -2.72 -0.14 0.00 0.56 0.00 0.00 36.38 33.82 2k2n s VAL 135 CO 0.33 0.43 -0.26 0.47 -0.31 0.00 0.00 175.10 175.76 2k2n n ASP 136 N 4.37 -4.10 0.30 4.85 9.92 -1.25 -3.73 116.55 126.91 2k2n n ASP 136 Ca -0.17 0.51 0.19 0.00 -0.53 0.00 0.00 54.79 54.78 2k2n n ASP 136 Cb 0.52 -0.87 0.99 0.00 -0.64 0.00 0.00 41.12 41.12 2k2n n ASP 136 CO 0.00 0.00 0.00 1.55 0.13 0.00 0.00 177.20 178.88 2k2n h PRO 137 N -0.35 0.00 -0.28 -0.24 0.13 -1.90 -2.77 132.00 126.59 2k2n h PRO 137 Ca -0.42 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.69 2k2n h PRO 137 Cb 1.39 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.51 2k2n h PRO 137 CO 0.36 0.00 0.12 0.00 -0.23 0.00 0.00 178.00 178.25 2k2n h HIS 139 N 0.31 0.00 0.27 0.00 -0.00 -1.81 -3.05 115.15 110.87 2k2n h HIS 139 Ca 0.09 0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 60.45 2k2n h HIS 139 Cb 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.58 2k2n h HIS 139 CO -0.01 0.71 -0.13 0.28 -0.00 0.00 0.00 177.93 178.79 2k2n h VAL 140 N 0.00 0.78 0.00 5.26 2.07 -1.46 -2.21 116.25 120.68 2k2n h VAL 140 Ca -0.03 -0.50 -0.05 0.00 0.82 0.00 0.00 66.70 66.94 2k2n h VAL 140 Cb 1.57 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 32.39 2k2n h VAL 140 CO 0.09 0.11 -0.23 -0.74 0.02 0.00 0.00 177.57 176.81 2k2n h HIS 141 N -0.63 0.00 -0.72 1.57 6.17 -1.60 -1.22 115.15 118.72 2k2n h HIS 141 Ca -0.04 0.00 0.02 0.00 0.71 0.00 0.00 60.37 61.06 2k2n h HIS 141 Cb 0.45 0.00 -0.04 0.00 2.52 0.00 0.00 27.41 30.34 2k2n h HIS 141 CO 0.01 0.23 0.46 -0.92 0.71 0.00 0.00 177.93 178.43 2k2n h TYR 142 N 0.00 0.87 -0.15 5.26 3.20 -1.39 0.11 116.97 124.88 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 0.47 -0.29 0.01 0.00 1.54 0.00 0.00 36.73 38.45 2k2n h TYR 142 CO 0.00 0.52 -0.76 -0.07 -1.64 0.00 0.00 178.16 176.21 2k2n h LEU 143 N 0.92 0.85 -1.10 2.82 3.38 -0.77 -2.72 115.31 118.69 2k2n h LEU 143 Ca 0.28 -0.55 0.18 0.00 0.09 0.00 0.00 57.88 57.88 2k2n h LEU 143 Cb -0.03 -0.25 -0.09 0.00 0.09 0.00 0.00 40.66 40.37 2k2n h LEU 143 CO -0.09 1.34 0.61 0.50 0.09 0.00 0.00 178.44 180.89 2k2n h LYS 144 N 0.49 0.73 0.00 1.13 1.63 -0.51 2.51 116.57 122.56 2k2n h LYS 144 Ca -0.04 -0.04 -0.00 0.00 -0.85 0.00 0.00 60.65 59.71 2k2n h LYS 144 Cb 1.37 -0.16 -0.00 0.00 -0.60 0.00 0.00 32.23 32.84 2k2n h LYS 144 CO 0.15 0.48 -0.01 0.66 -3.45 0.00 0.00 179.45 177.28 2k2n h SER 145 N 0.75 0.00 -0.18 4.20 4.64 -0.50 0.10 113.55 122.56 2k2n h SER 145 Ca 0.54 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.86 2k2n h SER 145 Cb 0.86 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.95 2k2n h SER 145 CO -0.32 0.01 0.00 0.23 -0.87 0.00 0.00 176.83 175.88 2k2n n MET 146 N -3.15 2.13 -1.42 4.77 2.81 0.83 -4.92 117.12 118.17 2k2n n MET 146 Ca -0.01 -1.68 -0.09 0.00 -1.81 0.00 0.00 57.70 54.11 2k2n n MET 146 Cb 0.19 -1.46 -0.03 0.00 -0.71 0.00 0.00 33.22 31.21 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 1.32 0.85 3.61 3.03 0.00 0.02 -5.01 105.19 109.01 2k2n n GLY 147 Ca 0.17 -0.63 -0.33 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.34 3.81 -0.03 1.61 1.01 -0.92 -4.40 120.40 119.15 2k2n s VAL 148 Ca 0.00 -0.60 0.14 0.00 0.00 0.00 0.00 61.98 61.52 2k2n s VAL 148 Cb 0.00 -2.63 -0.21 0.00 0.00 0.00 0.00 36.38 33.54 2k2n s VAL 148 CO 0.00 0.48 0.28 0.00 0.00 0.00 0.00 175.10 175.85 2k2n n ALA 149 N 1.80 2.43 -2.62 5.51 0.00 -0.54 -3.77 120.51 123.31 2k2n n ALA 149 Ca -0.16 -0.38 -0.09 0.00 0.00 0.00 0.00 53.44 52.80 2k2n n ALA 149 Cb 0.53 -0.43 -0.07 0.00 0.00 0.00 0.00 19.45 19.48 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 -3.69 0.07 -0.14 0.00 0.15 -1.10 -1.65 113.70 107.35 2k2n s SER 150 Ca -0.05 -0.64 -0.06 0.00 0.70 0.00 0.00 55.95 55.90 2k2n s SER 150 Cb 0.08 0.37 0.06 0.00 -1.71 0.00 0.00 66.02 64.82 2k2n s SER 150 CO 0.57 -0.76 0.31 -0.94 1.20 0.00 0.00 173.24 173.61 2k2n s SER 151 N -2.87 -0.16 -0.16 5.45 1.04 -1.17 -2.79 113.70 113.04 2k2n s SER 151 Ca 0.06 0.68 -0.03 0.00 0.48 0.00 0.00 55.95 57.14 2k2n s SER 151 Cb 0.04 0.67 -0.02 0.00 0.10 0.00 0.00 66.02 66.81 2k2n s SER 151 CO -0.10 -0.20 -0.06 -0.22 0.98 0.00 0.00 173.24 173.65 2k2n s LEU 152 N 1.74 3.10 -0.17 2.42 0.20 -0.84 0.88 118.68 126.01 2k2n s LEU 152 Ca -0.06 -0.20 0.01 0.00 0.69 0.00 0.00 54.13 54.57 2k2n s LEU 152 Cb -0.11 -1.74 0.02 0.00 -0.43 0.00 0.00 46.19 43.93 2k2n s LEU 152 CO -0.10 0.14 -0.19 -0.69 -0.29 0.00 0.00 176.35 175.22 2k2n s VAL 153 N 0.50 1.97 -0.42 1.68 1.01 -0.96 -1.07 120.40 123.11 2k2n s VAL 153 Ca -0.05 -0.89 0.02 0.00 0.00 0.00 0.00 61.98 61.07 2k2n s VAL 153 Cb -0.15 -1.78 0.12 0.00 0.00 0.00 0.00 36.38 34.58 2k2n s VAL 153 CO 0.03 0.53 0.19 0.68 0.00 0.00 0.00 175.10 176.53 2k2n s VAL 154 N 1.23 1.75 0.36 2.92 -7.23 -1.11 -3.76 120.40 114.56 2k2n s VAL 154 Ca 0.03 -2.54 -0.24 0.00 -1.81 0.00 0.00 61.98 57.42 2k2n s VAL 154 Cb -0.13 -2.25 -0.14 0.00 0.56 0.00 0.00 36.38 34.42 2k2n s VAL 154 CO -0.10 -0.79 0.55 -2.65 -0.31 0.00 0.00 175.10 171.79 2k2n n PRO 155 N 3.74 0.51 -2.97 4.82 -0.02 -1.26 -4.25 135.00 135.56 2k2n n PRO 155 Ca 0.05 0.18 -0.26 0.00 -2.02 0.00 0.00 63.50 61.45 2k2n n PRO 155 Cb 0.36 -1.39 -0.04 0.00 -0.02 0.00 0.00 33.50 32.41 2k2n n PRO 155 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2k2n n LEU 156 N 1.55 4.13 0.00 2.45 4.32 -1.26 -4.91 117.00 123.28 2k2n n LEU 156 Ca 0.12 -5.62 -0.14 0.00 -0.02 0.00 0.00 56.01 50.36 2k2n n LEU 156 Cb 0.36 -0.44 -0.03 0.00 -1.62 0.00 0.00 43.42 41.68 2k2n n LEU 156 CO 0.56 2.35 0.13 1.15 -1.22 0.00 0.00 177.39 180.35 2k2n n MET 157 N -0.17 0.60 -1.23 3.23 0.00 -1.26 -4.50 117.12 113.78 2k2n n MET 157 Ca 0.30 -2.56 -0.29 0.00 0.00 0.00 0.00 57.70 55.15 2k2n n MET 157 Cb 0.42 2.42 0.19 0.00 0.00 0.00 0.00 33.22 36.25 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 -3.14 1.65 0.07 3.17 2.46 -0.94 -4.98 115.29 113.59 2k2n s HIS 158 Ca 0.27 0.78 -0.24 0.00 0.47 0.00 0.00 55.06 56.34 2k2n s HIS 158 Cb -0.01 -3.38 -0.16 0.00 -0.13 0.00 0.00 32.58 28.90 2k2n s HIS 158 CO 0.19 -3.13 1.66 1.25 -2.47 0.00 0.00 174.74 172.24 2k2n h HIS 159 N -2.05 -0.07 0.00 3.88 2.76 -1.96 -3.37 115.15 114.34 2k2n h HIS 159 Ca -0.51 -0.00 -0.28 0.00 -2.20 0.00 0.00 60.37 57.38 2k2n h HIS 159 Cb 1.32 0.02 -0.05 0.00 1.55 0.00 0.00 27.41 30.25 2k2n h HIS 159 CO -0.50 0.03 -2.07 0.94 -1.30 0.00 0.00 177.93 175.03 2k2n n GLN 160 N -5.09 0.73 -3.28 5.26 -0.06 -1.26 -4.39 117.38 109.31 2k2n n GLN 160 Ca -0.08 0.08 -0.39 0.00 -2.00 0.00 0.00 57.00 54.62 2k2n n GLN 160 Cb 0.09 -1.38 -0.06 0.00 -4.06 0.00 0.00 30.24 24.83 2k2n n GLN 160 CO 0.00 0.00 0.00 -2.00 -0.20 0.00 0.00 177.06 174.86 2k2n s GLU 161 N -2.38 4.24 -0.26 3.69 2.56 -1.26 -4.64 118.70 120.65 2k2n s GLU 161 Ca -0.21 0.65 -0.07 0.00 0.00 0.00 0.00 54.97 55.34 2k2n s GLU 161 Cb 0.06 -3.31 -0.02 0.00 2.00 0.00 0.00 34.13 32.86 2k2n s GLU 161 CO 0.48 0.45 0.06 -1.17 -0.56 0.00 0.00 175.26 174.52 2k2n s LEU 162 N -0.41 3.50 -0.18 2.70 0.20 -1.26 -2.21 118.68 121.01 2k2n s LEU 162 Ca 0.29 -0.38 -0.11 0.00 0.69 0.00 0.00 54.13 54.62 2k2n s LEU 162 Cb -0.18 -1.89 -0.21 0.00 -0.43 0.00 0.00 46.19 43.48 2k2n s LEU 162 CO 0.16 -0.08 0.16 0.79 -0.29 0.00 0.00 176.35 177.09 2k2n n TRP 163 N 4.90 0.88 -3.53 5.38 7.02 -1.26 -4.84 117.44 125.98 2k2n n TRP 163 Ca -0.16 0.25 -0.05 0.00 -1.02 0.00 0.00 57.50 56.53 2k2n n TRP 163 Cb 0.50 -1.10 0.02 0.00 -2.42 0.00 0.00 31.31 28.31 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 1.78 1.28 2.88 6.99 0.00 -1.25 0.53 105.19 117.39 2k2n n GLY 164 Ca -0.36 -1.14 -0.13 0.00 0.00 0.00 0.00 46.02 44.39 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 1.75 -0.15 0.99 1.43 0.43 -4.19 118.68 118.94 2k2n s LEU 165 Ca 0.11 0.05 -0.06 0.00 -1.03 0.00 0.00 54.13 53.20 2k2n s LEU 165 Cb -0.03 0.07 -0.04 0.00 0.03 0.00 0.00 46.19 46.22 2k2n s LEU 165 CO 0.07 -0.03 0.06 -0.22 0.23 0.00 0.00 176.35 176.46 2k2n s LEU 166 N 0.21 3.86 -0.02 1.79 2.96 -1.26 -0.64 118.68 125.59 2k2n s LEU 166 Ca -0.02 0.17 -0.02 0.00 -0.22 0.00 0.00 54.13 54.05 2k2n s LEU 166 Cb -0.02 -1.95 0.00 0.00 0.50 0.00 0.00 46.19 44.72 2k2n s LEU 166 CO -0.01 0.27 0.04 0.54 -1.32 0.00 0.00 176.35 175.87 2k2n s VAL 167 N -0.19 0.00 -0.07 1.68 0.11 -1.14 -2.74 120.40 118.06 2k2n s VAL 167 Ca 0.08 -0.01 0.03 0.00 -2.93 0.00 0.00 61.98 59.15 2k2n s VAL 167 Cb -0.12 -0.07 -0.02 0.00 -1.53 0.00 0.00 36.38 34.63 2k2n s VAL 167 CO 0.01 -0.00 -0.14 -0.44 -3.33 0.00 0.00 175.10 171.20 2k2n s SER 168 N 0.01 4.03 -0.10 3.54 0.01 -0.23 -2.63 113.70 118.33 2k2n s SER 168 Ca -0.00 -0.22 0.00 0.00 1.31 0.00 0.00 55.95 57.04 2k2n s SER 168 Cb -0.00 -1.01 -0.03 0.00 0.21 0.00 0.00 66.02 65.19 2k2n s SER 168 CO 0.00 0.31 -0.09 -1.00 0.41 0.00 0.00 173.24 172.87 2k2n s HIS 169 N -0.51 2.89 -0.11 2.43 3.76 0.11 -1.98 115.29 121.88 2k2n s HIS 169 Ca 0.07 -0.22 0.00 0.00 -0.15 0.00 0.00 55.06 54.76 2k2n s HIS 169 Cb -0.12 -1.78 0.02 0.00 1.11 0.00 0.00 32.58 31.81 2k2n s HIS 169 CO 0.02 0.11 -0.10 -1.01 -0.85 0.00 0.00 174.74 172.91 2k2n s HIS 170 N -0.29 1.63 -0.79 1.40 3.76 -1.12 -2.85 115.29 117.02 2k2n s HIS 170 Ca 0.04 -0.80 0.24 0.00 -0.15 0.00 0.00 55.06 54.38 2k2n s HIS 170 Cb -0.13 -1.28 0.92 0.00 1.11 0.00 0.00 32.58 33.21 2k2n s HIS 170 CO 0.03 -0.50 1.74 0.00 -0.85 0.00 0.00 174.74 175.15 2k2n n ALA 171 N 4.69 2.02 -2.66 -1.40 0.00 -1.26 -1.46 120.51 120.43 2k2n n ALA 171 Ca -0.15 -0.02 -0.20 0.00 0.00 0.00 0.00 53.44 53.07 2k2n n ALA 171 Cb 0.50 -1.40 -0.13 0.00 0.00 0.00 0.00 19.45 18.43 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 -3.11 0.91 0.43 0.00 0.41 -1.26 -4.37 118.70 111.70 2k2n s GLU 172 Ca 0.09 -0.88 -0.22 0.00 -0.41 0.00 0.00 54.97 53.55 2k2n s GLU 172 Cb 0.13 -0.94 -0.13 0.00 -1.78 0.00 0.00 34.13 31.41 2k2n s GLU 172 CO 0.46 0.22 0.38 -2.30 -0.49 0.00 0.00 175.26 173.53 2k2n n PRO 173 N 1.55 0.36 -2.69 0.39 -0.02 -1.26 -4.85 135.00 128.48 2k2n n PRO 173 Ca -0.20 0.13 -0.03 0.00 -2.02 0.00 0.00 63.50 61.38 2k2n n PRO 173 Cb 0.54 -1.34 0.03 0.00 -0.02 0.00 0.00 33.50 32.71 2k2n n PRO 173 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 2k2n n ARG 174 N 0.80 0.20 -1.43 -0.52 0.63 -1.26 -5.14 116.66 109.94 2k2n n ARG 174 Ca 0.11 -1.05 -0.37 0.00 -0.92 0.00 0.00 57.85 55.62 2k2n n ARG 174 Cb 0.40 -0.23 0.05 0.00 0.45 0.00 0.00 32.46 33.14 2k2n n ARG 174 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 2k2n n PRO 175 N 2.59 0.52 -3.79 -0.14 -0.02 -1.26 -4.97 135.00 127.93 2k2n n PRO 175 Ca 0.12 0.21 -0.36 0.00 -2.02 0.00 0.00 63.50 61.45 2k2n n PRO 175 Cb 0.63 -1.84 -0.07 0.00 -0.02 0.00 0.00 33.50 32.21 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 -1.74 3.54 0.38 6.00 2.02 -1.26 -5.05 117.35 121.24 2k2n s TYR 176 Ca 0.69 0.49 0.04 0.00 -0.37 0.00 0.00 57.07 57.93 2k2n s TYR 176 Cb -0.41 -2.05 -0.05 0.00 -0.40 0.00 0.00 41.96 39.04 2k2n s TYR 176 CO 0.54 0.56 0.05 -1.12 -1.57 0.00 0.00 175.55 174.01 2k2n s SER 177 N -0.49 2.99 0.41 2.29 0.01 -1.26 -5.00 113.70 112.65 2k2n s SER 177 Ca 0.13 -1.46 0.19 0.00 1.31 0.00 0.00 55.95 56.12 2k2n s SER 177 Cb -0.12 0.03 1.11 0.00 0.21 0.00 0.00 66.02 67.25 2k2n s SER 177 CO 0.03 -0.66 1.81 -0.61 0.41 0.00 0.00 173.24 174.22 2k2n h GLN 178 N 1.89 0.38 0.01 12.44 5.75 -1.99 0.03 115.11 133.62 2k2n h GLN 178 Ca -0.41 -0.02 -0.00 0.00 -0.15 0.00 0.00 58.65 58.07 2k2n h GLN 178 Cb 1.26 -0.08 0.00 0.00 1.07 0.00 0.00 27.48 29.72 2k2n h GLN 178 CO 0.70 0.25 -0.00 1.49 -2.65 0.00 0.00 178.83 178.62 2k2n h GLU 179 N 0.39 -0.01 -0.62 1.69 4.57 -2.00 -1.49 114.58 117.10 2k2n h GLU 179 Ca 0.53 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.68 2k2n h GLU 179 Cb 1.37 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.93 2k2n h GLU 179 CO -0.22 0.11 0.27 0.93 -1.18 0.00 0.00 179.01 178.91 2k2n h GLU 180 N -0.13 0.89 -0.57 1.92 5.08 -1.45 -1.98 114.58 118.35 2k2n h GLU 180 Ca -0.00 -0.13 -0.02 0.00 -1.00 0.00 0.00 59.36 58.21 2k2n h GLU 180 Cb 0.13 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.19 2k2n h GLU 180 CO 0.00 0.72 0.29 1.25 -1.00 0.00 0.00 179.01 180.27 2k2n h LEU 181 N 0.88 0.71 -1.86 1.33 5.85 -0.86 -1.72 115.31 119.64 2k2n h LEU 181 Ca 0.21 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.86 2k2n h LEU 181 Cb 0.14 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 40.99 2k2n h LEU 181 CO -0.02 0.59 -0.06 -0.61 -0.34 0.00 0.00 178.44 178.00 2k2n h GLN 182 N 0.79 0.02 0.16 1.25 5.75 -0.48 -0.82 115.11 121.77 2k2n h GLN 182 Ca 0.20 -0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.69 2k2n h GLN 182 Cb 0.06 -0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.61 2k2n h GLN 182 CO -0.03 0.08 -0.08 0.28 -2.65 0.00 0.00 178.83 176.43 2k2n h VAL 183 N 0.02 0.94 0.08 2.39 2.07 -1.23 -3.23 116.25 117.28 2k2n h VAL 183 Ca 0.00 -1.06 -0.26 0.00 0.82 0.00 0.00 66.70 66.20 2k2n h VAL 183 Cb 0.12 1.53 0.01 0.00 -1.52 0.00 0.00 31.29 31.42 2k2n h VAL 183 CO 0.01 0.22 -1.12 -0.37 0.02 0.00 0.00 177.57 176.33 2k2n h VAL 184 N -0.78 1.42 -0.28 2.57 -1.51 -1.50 -2.93 116.25 113.25 2k2n h VAL 184 Ca -0.02 -2.71 0.05 0.00 -1.23 0.00 0.00 66.70 62.79 2k2n h VAL 184 Cb 0.53 2.69 -0.05 0.00 -2.13 0.00 0.00 31.29 32.33 2k2n h VAL 184 CO 0.04 0.80 -0.04 -0.61 -1.23 0.00 0.00 177.57 176.53 2k2n h GLN 185 N 0.17 0.03 -0.15 5.19 4.15 -1.29 1.93 115.11 125.14 2k2n h GLN 185 Ca -0.12 -0.00 -0.22 0.00 0.77 0.00 0.00 58.65 59.07 2k2n h GLN 185 Cb 1.80 -0.01 0.01 0.00 0.21 0.00 0.00 27.48 29.49 2k2n h GLN 185 CO 0.19 0.02 -0.78 1.25 -1.93 0.00 0.00 178.83 177.58 2k2n h LEU 186 N 0.03 0.93 0.21 -2.39 5.85 -1.67 -3.15 115.31 115.12 2k2n h LEU 186 Ca 0.13 -0.61 -0.32 0.00 0.84 0.00 0.00 57.88 57.92 2k2n h LEU 186 Cb 0.19 -0.28 0.04 0.00 0.37 0.00 0.00 40.66 40.99 2k2n h LEU 186 CO -0.26 1.41 -1.38 0.25 -0.34 0.00 0.00 178.44 178.12 2k2n h LEU 187 N 0.53 0.86 -1.37 2.25 5.85 -1.30 -2.40 115.31 119.73 2k2n h LEU 187 Ca -0.05 -0.89 0.11 0.00 0.84 0.00 0.00 57.88 57.89 2k2n h LEU 187 Cb 1.41 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 42.11 2k2n h LEU 187 CO 0.16 1.67 0.52 0.00 -0.34 0.00 0.00 178.44 180.45 2k2n h ALA 188 N 0.20 1.80 0.10 1.25 0.00 0.30 0.31 119.26 123.21 2k2n h ALA 188 Ca -0.23 -0.00 -0.29 0.00 0.00 0.00 0.00 54.91 54.39 2k2n h ALA 188 Cb 2.07 -0.15 0.02 0.00 0.00 0.00 0.00 17.79 19.73 2k2n h ALA 188 CO 0.26 0.02 -1.20 -0.44 0.00 0.00 0.00 179.25 177.90 2k2n h ASP 189 N 0.69 0.79 -0.37 0.00 3.32 -1.60 0.11 116.42 119.35 2k2n h ASP 189 Ca 0.37 -0.72 -0.05 0.00 0.02 0.00 0.00 57.03 56.65 2k2n h ASP 189 Cb 0.51 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.79 2k2n h ASP 189 CO -0.14 1.53 0.06 -0.61 -1.72 0.00 0.00 179.24 178.36 2k2n h GLN 190 N 0.26 0.70 0.21 3.56 4.15 -0.67 -0.71 115.11 122.62 2k2n h GLN 190 Ca -0.17 -0.15 -0.35 0.00 0.77 0.00 0.00 58.65 58.76 2k2n h GLN 190 Cb 1.87 -0.10 0.02 0.00 0.21 0.00 0.00 27.48 29.47 2k2n h GLN 190 CO 0.22 0.68 -1.66 -0.24 -1.93 0.00 0.00 178.83 175.89 2k2n h VAL 191 N 0.68 1.05 -0.82 2.39 3.04 -0.49 -3.23 116.25 118.87 2k2n h VAL 191 Ca 0.15 -2.57 0.14 0.00 -1.01 0.00 0.00 66.70 63.41 2k2n h VAL 191 Cb 0.32 2.86 -0.06 0.00 -2.01 0.00 0.00 31.29 32.40 2k2n h VAL 191 CO 0.01 0.84 0.54 0.28 -1.01 0.00 0.00 177.57 178.22 2k2n h SER 192 N 0.12 0.54 -0.49 3.17 0.02 -0.77 0.80 113.55 116.93 2k2n h SER 192 Ca -0.32 0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 60.65 2k2n h SER 192 Cb 2.12 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 64.56 2k2n h SER 192 CO 0.21 0.28 0.26 0.40 -1.14 0.00 0.00 176.83 176.84 2k2n h ILE 193 N 0.57 1.17 -0.36 3.27 2.04 -1.16 -0.64 117.51 122.40 2k2n h ILE 193 Ca 0.40 -0.46 -0.15 0.00 1.00 0.00 0.00 64.86 65.66 2k2n h ILE 193 Cb 0.74 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 2k2n h ILE 193 CO -0.16 0.19 -0.36 0.00 0.00 0.00 0.00 178.15 177.83 2k2n h ALA 194 N 1.56 0.69 -0.05 1.87 0.00 0.50 0.23 119.26 124.07 2k2n h ALA 194 Ca 0.18 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2k2n h ALA 194 Cb 0.06 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 2k2n h ALA 194 CO -0.03 0.67 0.03 0.82 0.00 0.00 0.00 179.25 180.74 2k2n h ILE 195 N 0.69 1.02 -0.13 0.00 1.08 0.12 0.60 117.51 120.89 2k2n h ILE 195 Ca 0.06 -0.04 -0.05 0.00 -0.39 0.00 0.00 64.86 64.45 2k2n h ILE 195 Cb 0.92 0.95 -0.00 0.00 -3.07 0.00 0.00 36.82 35.62 2k2n h ILE 195 CO 0.08 0.02 -0.11 0.00 -0.69 0.00 0.00 178.15 177.45 2k2n h ALA 196 N 1.01 0.19 -0.70 1.87 0.00 -1.10 -2.16 119.26 118.37 2k2n h ALA 196 Ca 0.02 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.57 2k2n h ALA 196 Cb -0.00 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 2k2n h ALA 196 CO -0.00 0.03 0.20 1.96 0.00 0.00 0.00 179.25 181.44 2k2n h GLN 197 N -0.07 1.10 0.00 0.00 1.08 -0.46 -2.78 115.11 113.98 2k2n h GLN 197 Ca 0.02 -0.25 -0.10 0.00 -1.45 0.00 0.00 58.65 56.88 2k2n h GLN 197 Cb 0.62 -0.15 -0.01 0.00 -0.05 0.00 0.00 27.48 27.88 2k2n h GLN 197 CO 0.03 0.96 -0.47 0.00 -0.95 0.00 0.00 178.83 178.39 2k2n h ALA 198 N 1.09 1.22 -0.64 3.87 0.00 0.20 -3.08 119.26 121.91 2k2n h ALA 198 Ca 0.22 -0.43 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 2k2n h ALA 198 Cb 0.33 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 2k2n h ALA 198 CO -0.00 0.59 0.23 1.49 0.00 0.00 0.00 179.25 181.56 2k2n h GLU 199 N 0.00 0.96 -0.16 0.00 4.57 -1.10 -2.35 114.58 116.50 2k2n h GLU 199 Ca -0.00 -0.17 -0.01 0.00 -1.18 0.00 0.00 59.36 57.99 2k2n h GLU 199 Cb 0.84 -0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 29.26 2k2n h GLU 199 CO 0.06 0.80 0.03 -0.07 -1.18 0.00 0.00 179.01 178.65 2k2n h LEU 200 N 0.93 0.20 -0.08 1.64 3.38 -1.50 -2.78 115.31 117.10 2k2n h LEU 200 Ca 0.22 -0.02 0.04 0.00 0.09 0.00 0.00 57.88 58.21 2k2n h LEU 200 Cb 0.22 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 2k2n h LEU 200 CO -0.01 0.22 -0.18 0.28 0.09 0.00 0.00 178.44 178.83 2k2n h SER 201 N 0.23 -0.55 0.00 -0.43 0.02 -1.51 -3.53 113.55 107.77 2k2n h SER 201 Ca 0.06 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 2k2n h SER 201 Cb 0.10 0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.89 2k2n h SER 201 CO -0.00 -0.24 0.00 -0.11 -1.14 0.00 0.00 176.83 175.34