#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 -0.37 -0.51 1.96 5.19 -1.99 0.03 116.42 120.74 2k2n h ASP 32 Ca 0.00 0.05 0.06 0.00 -0.62 0.00 0.00 57.03 56.52 2k2n h ASP 32 Cb 0.00 0.15 -0.05 0.00 0.18 0.00 0.00 39.33 39.60 2k2n h ASP 32 CO 0.00 -0.19 0.21 1.56 -3.12 0.00 0.00 179.24 177.71 2k2n h GLN 33 N -0.24 0.41 0.32 3.56 1.08 -2.00 -1.06 115.11 117.18 2k2n h GLN 33 Ca 0.03 -0.02 -0.02 0.00 -1.45 0.00 0.00 58.65 57.19 2k2n h GLN 33 Cb 0.28 -0.09 0.00 0.00 -0.05 0.00 0.00 27.48 27.62 2k2n h GLN 33 CO -0.10 0.27 -0.15 0.82 -0.95 0.00 0.00 178.83 178.72 2k2n h ILE 34 N 0.42 0.70 -0.76 2.54 2.04 -1.90 -2.92 117.51 117.63 2k2n h ILE 34 Ca 0.24 -0.15 0.11 0.00 1.00 0.00 0.00 64.86 66.05 2k2n h ILE 34 Cb 0.21 0.79 -0.08 0.00 -0.74 0.00 0.00 36.82 37.00 2k2n h ILE 34 CO -0.21 0.03 0.38 -0.07 0.00 0.00 0.00 178.15 178.28 2k2n h LEU 35 N -0.51 0.49 -1.46 1.44 3.38 -0.74 0.16 115.31 118.08 2k2n h LEU 35 Ca -0.04 0.07 0.15 0.00 0.09 0.00 0.00 57.88 58.15 2k2n h LEU 35 Cb 0.38 -0.01 -0.06 0.00 0.09 0.00 0.00 40.66 41.06 2k2n h LEU 35 CO 0.07 0.26 0.54 -0.09 0.09 0.00 0.00 178.44 179.31 2k2n h ARG 36 N 0.62 0.51 -0.19 1.13 2.43 -1.06 0.30 114.38 118.12 2k2n h ARG 36 Ca 0.38 -0.03 -0.16 0.00 -0.81 0.00 0.00 59.98 59.36 2k2n h ARG 36 Cb 0.44 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.87 2k2n h ARG 36 CO -0.30 0.34 -0.54 0.00 -1.51 0.00 0.00 179.97 177.96 2k2n h ALA 37 N 1.62 0.70 -0.25 2.80 0.00 -0.53 -2.86 119.26 120.74 2k2n h ALA 37 Ca 0.41 -0.51 -0.14 0.00 0.00 0.00 0.00 54.91 54.67 2k2n h ALA 37 Cb 0.82 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.53 2k2n h ALA 37 CO -0.16 0.69 -0.39 1.79 0.00 0.00 0.00 179.25 181.17 2k2n h THR 38 N 0.43 1.31 -0.28 0.00 1.35 0.34 -2.42 112.91 113.63 2k2n h THR 38 Ca 0.01 -1.59 -0.13 0.00 -0.55 0.00 0.00 66.41 64.15 2k2n h THR 38 Cb 1.08 1.71 -0.01 0.00 -1.73 0.00 0.00 68.15 69.19 2k2n h THR 38 CO 0.10 0.51 -0.36 1.62 -0.25 0.00 0.00 175.52 177.14 2k2n h VAL 39 N 0.45 1.29 -0.25 6.82 3.04 -0.87 -2.59 116.25 124.14 2k2n h VAL 39 Ca 0.02 -1.51 -0.17 0.00 -1.01 0.00 0.00 66.70 64.03 2k2n h VAL 39 Cb 0.99 1.46 0.00 0.00 -2.01 0.00 0.00 31.29 31.73 2k2n h VAL 39 CO 0.09 0.48 -0.53 -0.08 -1.01 0.00 0.00 177.57 176.53 2k2n h GLU 40 N 0.53 0.79 0.18 4.17 4.81 -1.54 -3.09 114.58 120.43 2k2n h GLU 40 Ca 0.05 -0.52 -0.01 0.00 -0.13 0.00 0.00 59.36 58.75 2k2n h GLU 40 Cb 0.87 0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.32 2k2n h GLU 40 CO 0.07 1.15 -0.09 1.49 -0.73 0.00 0.00 179.01 180.91 2k2n h GLU 41 N 0.54 -0.24 -0.67 1.92 4.81 -1.40 -2.85 114.58 116.70 2k2n h GLU 41 Ca 0.00 0.02 0.10 0.00 -0.13 0.00 0.00 59.36 59.35 2k2n h GLU 41 Cb 1.14 0.05 -0.04 0.00 0.63 0.00 0.00 28.75 30.53 2k2n h GLU 41 CO 0.12 -0.07 0.44 -0.39 -0.73 0.00 0.00 179.01 178.38 2k2n h VAL 42 N -0.36 0.90 -0.79 0.32 -1.51 -1.55 -1.28 116.25 111.97 2k2n h VAL 42 Ca -0.02 -0.17 0.11 0.00 -1.23 0.00 0.00 66.70 65.39 2k2n h VAL 42 Cb 0.28 0.37 -0.08 0.00 -2.13 0.00 0.00 31.29 29.72 2k2n h VAL 42 CO 0.04 0.09 0.41 -0.09 -1.23 0.00 0.00 177.57 176.79 2k2n h ARG 43 N 0.49 0.64 -0.54 5.19 2.43 -1.41 0.29 114.38 121.46 2k2n h ARG 43 Ca 0.31 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.44 2k2n h ARG 43 Cb 0.56 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.94 2k2n h ARG 43 CO -0.10 0.43 0.33 0.00 -1.51 0.00 0.00 179.97 179.12 2k2n h ALA 44 N 1.48 1.57 0.08 2.80 0.00 -1.24 3.37 119.26 127.32 2k2n h ALA 44 Ca 0.40 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 55.11 2k2n h ALA 44 Cb 0.46 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 18.04 2k2n h ALA 44 CO -0.29 0.38 -0.59 0.74 0.00 0.00 0.00 179.25 179.49 2k2n h PHE 45 N 0.74 0.44 0.04 0.00 0.04 -0.99 -3.36 116.94 113.85 2k2n h PHE 45 Ca 0.20 -0.30 -0.28 0.00 2.80 0.00 0.00 57.97 60.39 2k2n h PHE 45 Cb -0.04 -0.03 -0.03 0.00 2.20 0.00 0.00 35.95 38.05 2k2n h PHE 45 CO 0.00 1.19 -1.49 -0.07 -0.60 0.00 0.00 178.31 177.34 2k2n h LEU 46 N -0.43 0.12 1.49 1.54 3.38 -0.38 -3.47 115.31 117.56 2k2n h LEU 46 Ca -0.10 -0.19 -0.38 0.00 0.09 0.00 0.00 57.88 57.30 2k2n h LEU 46 Cb 1.41 -0.04 -0.12 0.00 0.09 0.00 0.00 40.66 42.01 2k2n h LEU 46 CO 0.11 1.16 -0.38 0.61 0.09 0.00 0.00 178.44 180.03 2k2n n GLY 47 N 1.55 1.19 3.77 0.83 0.00 1.12 -4.92 105.19 108.73 2k2n n GLY 47 Ca -0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.50 2k2n n GLY 47 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2k2n s THR 48 N -2.68 3.42 0.32 2.61 -4.23 -1.26 -4.91 115.64 108.92 2k2n s THR 48 Ca 0.00 1.31 0.09 0.00 -1.18 0.00 0.00 61.69 61.91 2k2n s THR 48 Cb 0.00 -3.79 0.36 0.00 1.34 0.00 0.00 72.50 70.41 2k2n s THR 48 CO 0.00 0.22 1.60 0.44 -0.54 0.00 0.00 174.62 176.35 2k2n h ASP 49 N 3.30 -0.02 -3.09 3.99 3.32 -1.83 -3.41 116.42 118.68 2k2n h ASP 49 Ca -0.48 0.24 -0.01 0.00 0.02 0.00 0.00 57.03 56.81 2k2n h ASP 49 Cb 1.22 0.33 -0.22 0.00 0.22 0.00 0.00 39.33 40.88 2k2n h ASP 49 CO 0.65 -0.30 -0.04 -0.60 -1.72 0.00 0.00 179.24 177.23 2k2n s ARG 50 N -5.81 0.65 -0.02 3.56 3.52 -1.17 -3.37 118.95 116.31 2k2n s ARG 50 Ca -0.11 1.13 0.00 0.00 -0.13 0.00 0.00 55.73 56.62 2k2n s ARG 50 Cb 0.30 0.12 0.03 0.00 -1.56 0.00 0.00 34.95 33.83 2k2n s ARG 50 CO 0.78 -0.15 0.01 0.54 -0.81 0.00 0.00 175.30 175.67 2k2n s VAL 51 N 1.53 0.10 0.04 7.11 0.11 -1.17 0.11 120.40 128.23 2k2n s VAL 51 Ca -0.09 0.12 -0.03 0.00 -2.93 0.00 0.00 61.98 59.04 2k2n s VAL 51 Cb -0.06 -0.21 -0.02 0.00 -1.53 0.00 0.00 36.38 34.57 2k2n s VAL 51 CO -0.18 0.12 0.04 -1.59 -3.33 0.00 0.00 175.10 170.16 2k2n s LYS 52 N 0.97 0.57 -0.16 1.54 -2.85 -1.04 -2.56 119.74 116.21 2k2n s LYS 52 Ca -0.09 -0.92 -0.09 0.00 -1.00 0.00 0.00 55.97 53.87 2k2n s LYS 52 Cb -0.13 0.21 -0.05 0.00 -2.06 0.00 0.00 37.83 35.81 2k2n s LYS 52 CO -0.02 -0.13 0.13 0.08 0.10 0.00 0.00 175.35 175.52 2k2n s VAL 53 N -3.01 5.45 -0.33 1.79 1.01 -0.12 -2.70 120.40 122.49 2k2n s VAL 53 Ca -0.01 0.20 -0.01 0.00 0.00 0.00 0.00 61.98 62.16 2k2n s VAL 53 Cb 0.01 -3.44 0.07 0.00 0.00 0.00 0.00 36.38 33.03 2k2n s VAL 53 CO -0.07 0.52 0.05 -0.47 0.00 0.00 0.00 175.10 175.13 2k2n s TYR 54 N -0.25 3.42 -0.05 5.22 5.04 0.91 -3.48 117.35 128.16 2k2n s TYR 54 Ca 0.11 -2.23 -0.30 0.00 -2.44 0.00 0.00 57.07 52.21 2k2n s TYR 54 Cb -0.11 -2.51 -0.03 0.00 0.35 0.00 0.00 41.96 39.66 2k2n s TYR 54 CO 0.01 -0.88 1.14 0.50 -1.34 0.00 0.00 175.55 174.98 2k2n s ARG 55 N 1.16 4.39 -0.03 4.97 3.52 -1.19 0.82 118.95 132.59 2k2n s ARG 55 Ca 0.00 1.60 -0.16 0.00 -0.13 0.00 0.00 55.73 57.04 2k2n s ARG 55 Cb -0.20 -3.52 -0.05 0.00 -1.56 0.00 0.00 34.95 29.61 2k2n s ARG 55 CO -0.03 -0.36 0.44 0.12 -0.81 0.00 0.00 175.30 174.66 2k2n s PHE 56 N 1.92 3.67 -0.09 5.12 5.36 0.37 -2.69 117.98 131.65 2k2n s PHE 56 Ca 0.54 0.99 -0.02 0.00 -0.96 0.00 0.00 56.93 57.48 2k2n s PHE 56 Cb -0.24 -2.39 -0.03 0.00 -0.34 0.00 0.00 43.02 40.02 2k2n s PHE 56 CO 0.22 0.49 0.01 -0.51 -1.46 0.00 0.00 175.22 173.98 2k2n s ASP 57 N -0.56 5.29 0.56 6.13 1.11 -1.26 -4.81 116.67 123.14 2k2n s ASP 57 Ca 0.25 0.16 0.37 0.00 0.18 0.00 0.00 52.55 53.51 2k2n s ASP 57 Cb -0.16 -1.50 1.50 0.00 1.07 0.00 0.00 42.92 43.83 2k2n s ASP 57 CO 0.13 0.38 1.72 -0.65 1.18 0.00 0.00 175.17 177.92 2k2n h PRO 58 N 5.13 0.00 0.00 8.23 0.11 -1.97 1.79 132.00 145.29 2k2n h PRO 58 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2k2n h PRO 58 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2k2n h PRO 58 CO 0.54 0.00 -0.29 0.93 -0.21 0.00 0.00 178.00 178.97 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 0.58 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.94 2k2n h GLU 59 Cb 2.47 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.72 2k2n h GLU 59 CO -0.01 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.41 2k2n n GLY 60 N 1.21 1.47 3.56 -3.84 0.00 0.61 -4.89 105.19 103.31 2k2n n GLY 60 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.24 2.37 0.24 1.61 3.76 -1.26 -4.47 115.29 115.30 2k2n s HIS 61 Ca 0.00 -0.50 -0.06 0.00 -0.15 0.00 0.00 55.06 54.36 2k2n s HIS 61 Cb 0.00 -4.58 -0.06 0.00 1.11 0.00 0.00 32.58 29.06 2k2n s HIS 61 CO 0.00 -1.93 0.50 0.20 -0.85 0.00 0.00 174.74 172.66 2k2n s GLY 62 N 5.42 2.03 0.08 -2.22 0.00 -1.26 -4.01 107.32 107.36 2k2n s GLY 62 Ca 0.49 -0.51 0.08 0.00 0.00 0.00 0.00 44.72 44.78 2k2n s GLY 62 CO -0.06 -0.41 -0.20 -0.51 0.00 0.00 0.00 173.10 171.93 2k2n s THR 63 N -1.92 1.66 -0.48 0.90 -4.23 -1.09 -3.32 115.64 107.16 2k2n s THR 63 Ca 0.44 -1.40 -0.28 0.00 -1.18 0.00 0.00 61.69 59.26 2k2n s THR 63 Cb -0.11 -1.49 0.01 0.00 1.34 0.00 0.00 72.50 72.25 2k2n s THR 63 CO 0.27 0.02 1.49 -0.69 -0.54 0.00 0.00 174.62 175.17 2k2n s VAL 64 N -1.03 3.77 -1.80 2.29 1.01 -1.23 -3.18 120.40 120.22 2k2n s VAL 64 Ca 0.06 0.72 0.16 0.00 0.00 0.00 0.00 61.98 62.92 2k2n s VAL 64 Cb -0.10 -4.22 0.08 0.00 0.00 0.00 0.00 36.38 32.15 2k2n s VAL 64 CO 0.03 -0.90 0.95 0.52 0.00 0.00 0.00 175.10 175.70 2k2n n VAL 65 N 7.04 0.00 -3.46 2.92 0.31 -1.23 -3.48 118.33 120.43 2k2n n VAL 65 Ca 0.16 -0.45 -0.01 0.00 -0.01 0.00 0.00 64.34 64.03 2k2n n VAL 65 Cb 0.49 1.28 -0.04 0.00 -0.91 0.00 0.00 33.84 34.66 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 -1.50 -1.89 -0.09 3.52 0.00 -1.25 -4.13 121.76 116.42 2k2n s ALA 66 Ca 0.17 1.92 -0.04 0.00 0.00 0.00 0.00 51.96 54.00 2k2n s ALA 66 Cb 0.13 -1.82 0.04 0.00 0.00 0.00 0.00 23.12 21.47 2k2n s ALA 66 CO 0.26 -1.06 0.20 -2.00 0.00 0.00 0.00 175.76 173.16 2k2n s GLU 67 N 2.81 0.16 -0.02 0.00 2.12 -1.26 -0.94 118.70 121.57 2k2n s GLU 67 Ca 0.05 0.44 0.03 0.00 0.36 0.00 0.00 54.97 55.85 2k2n s GLU 67 Cb -0.13 -0.12 -0.00 0.00 0.26 0.00 0.00 34.13 34.14 2k2n s GLU 67 CO -0.18 -0.15 -0.11 0.00 -0.54 0.00 0.00 175.26 174.27 2k2n s ALA 68 N 1.10 1.00 0.00 6.30 0.00 -1.06 -4.84 121.76 124.26 2k2n s ALA 68 Ca -0.08 -0.45 -0.05 0.00 0.00 0.00 0.00 51.96 51.37 2k2n s ALA 68 Cb -0.10 -0.32 -0.00 0.00 0.00 0.00 0.00 23.12 22.70 2k2n s ALA 68 CO -0.07 0.20 0.09 -0.98 0.00 0.00 0.00 175.76 175.01 2k2n s ARG 69 N -0.02 0.40 0.00 0.00 1.70 -1.26 -3.07 118.95 116.70 2k2n s ARG 69 Ca -0.00 -0.38 0.00 0.00 -0.47 0.00 0.00 55.73 54.88 2k2n s ARG 69 Cb -0.07 0.16 0.00 0.00 -0.57 0.00 0.00 34.95 34.47 2k2n s ARG 69 CO 0.00 -0.09 0.00 0.41 -1.08 0.00 0.00 175.30 174.55 2k2n n GLY 70 N 1.68 -2.94 3.79 3.88 0.00 -1.22 -4.96 105.19 105.43 2k2n n GLY 70 Ca -0.22 -0.31 -0.29 0.00 0.00 0.00 0.00 46.02 45.20 2k2n n GLY 70 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k2n n GLY 71 N 0.50 -1.66 1.87 -0.02 0.00 -1.26 -4.85 105.19 99.77 2k2n n GLY 71 Ca 0.00 -1.68 -0.02 0.00 0.00 0.00 0.00 46.02 44.31 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 -3.93 0.79 -0.02 1.61 1.02 -1.26 -3.95 120.64 114.90 2k2n n GLU 72 Ca 0.16 -0.20 -0.19 0.00 -0.02 0.00 0.00 57.16 56.92 2k2n n GLU 72 Cb 0.58 -1.40 -0.14 0.00 -0.02 0.00 0.00 31.44 30.46 2k2n n GLU 72 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 2k2n h ARG 73 N 2.91 0.15 -6.39 3.49 2.43 -1.98 -3.46 114.38 111.53 2k2n h ARG 73 Ca 0.04 -0.26 -0.67 0.00 -0.81 0.00 0.00 59.98 58.27 2k2n h ARG 73 Cb 0.69 0.10 -0.17 0.00 -0.42 0.00 0.00 29.97 30.17 2k2n h ARG 73 CO 0.11 1.13 -0.72 -0.51 -1.51 0.00 0.00 179.97 178.47 2k2n s LEU 74 N -7.90 3.12 0.77 3.80 1.43 -1.25 -5.12 118.68 113.53 2k2n s LEU 74 Ca -0.19 -0.24 -0.11 0.00 -1.03 0.00 0.00 54.13 52.57 2k2n s LEU 74 Cb 0.01 -1.84 0.06 0.00 0.03 0.00 0.00 46.19 44.45 2k2n s LEU 74 CO 0.74 0.24 1.09 -2.16 0.23 0.00 0.00 176.35 176.49 2k2n s PRO 75 N -1.73 2.25 -0.14 1.29 0.04 -1.26 -5.01 135.00 130.44 2k2n s PRO 75 Ca 0.19 1.13 -0.20 0.00 0.04 0.00 0.00 61.00 62.16 2k2n s PRO 75 Cb -0.11 -1.90 -0.03 0.00 0.04 0.00 0.00 34.50 32.50 2k2n s PRO 75 CO 0.10 -1.64 0.58 -1.12 0.04 0.00 0.00 177.00 174.96 2k2n s SER 76 N -3.43 6.74 -0.03 6.66 0.01 -1.26 -4.94 113.70 117.46 2k2n s SER 76 Ca 0.61 0.89 0.20 0.00 1.31 0.00 0.00 55.95 58.96 2k2n s SER 76 Cb -0.17 -2.34 0.62 0.00 0.21 0.00 0.00 66.02 64.35 2k2n s SER 76 CO 0.56 -0.13 1.52 0.18 0.41 0.00 0.00 173.24 175.78 2k2n n LEU 77 N 4.23 3.89 -4.73 2.44 4.77 -1.26 -4.96 117.00 121.38 2k2n n LEU 77 Ca -0.04 -1.95 -0.42 0.00 -0.03 0.00 0.00 56.01 53.58 2k2n n LEU 77 Cb 0.51 -0.49 -0.03 0.00 -2.33 0.00 0.00 43.42 41.08 2k2n n LEU 77 CO 0.44 0.87 0.91 -0.22 -1.33 0.00 0.00 177.39 178.07 2k2n s LEU 78 N -1.20 4.41 0.00 2.23 2.96 -1.26 -2.86 118.68 122.96 2k2n s LEU 78 Ca 0.46 2.19 0.00 0.00 -0.22 0.00 0.00 54.13 56.56 2k2n s LEU 78 Cb 0.26 -3.60 0.00 0.00 0.50 0.00 0.00 46.19 43.35 2k2n s LEU 78 CO 0.29 -0.45 0.00 0.61 -1.32 0.00 0.00 176.35 175.48 2k2n n GLY 79 N 2.70 1.92 3.87 7.98 0.00 -1.23 -5.03 105.19 115.41 2k2n n GLY 79 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 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 3.94 -0.16 0.99 1.43 -1.13 -4.92 118.68 118.83 2k2n s LEU 80 Ca 0.00 1.14 -0.06 0.00 -1.03 0.00 0.00 54.13 54.19 2k2n s LEU 80 Cb 0.00 -3.99 -0.04 0.00 0.03 0.00 0.00 46.19 42.19 2k2n s LEU 80 CO 0.00 -0.31 0.03 -0.89 0.23 0.00 0.00 176.35 175.42 2k2n s THR 81 N -2.20 4.54 0.36 5.49 2.01 -1.26 -3.53 115.64 121.05 2k2n s THR 81 Ca 0.52 -0.13 -0.13 0.00 0.31 0.00 0.00 61.69 62.26 2k2n s THR 81 Cb -0.10 -3.01 -0.08 0.00 0.01 0.00 0.00 72.50 69.32 2k2n s THR 81 CO 0.26 0.50 0.74 -0.36 -0.69 0.00 0.00 174.62 175.08 2k2n s PHE 82 N 0.07 3.42 0.23 4.92 0.40 -1.21 -5.02 117.98 120.78 2k2n s PHE 82 Ca 0.04 1.11 -0.30 0.00 -0.60 0.00 0.00 56.93 57.18 2k2n s PHE 82 Cb -0.13 -2.47 -0.10 0.00 0.51 0.00 0.00 43.02 40.83 2k2n s PHE 82 CO 0.01 0.01 1.50 -1.25 0.70 0.00 0.00 175.22 176.19 2k2n s PRO 83 N -3.38 4.23 0.18 0.24 0.04 -1.26 -4.55 135.00 130.50 2k2n s PRO 83 Ca 0.52 2.35 -0.31 0.00 0.04 0.00 0.00 61.00 63.61 2k2n s PRO 83 Cb -0.10 -3.11 -0.10 0.00 0.04 0.00 0.00 34.50 31.23 2k2n s PRO 83 CO 0.24 -0.50 1.49 0.00 0.04 0.00 0.00 177.00 178.26 2k2n s ALA 84 N 0.36 3.69 0.00 8.56 0.00 -1.26 -2.58 121.76 130.52 2k2n s ALA 84 Ca 0.63 1.30 0.00 0.00 0.00 0.00 0.00 51.96 53.89 2k2n s ALA 84 Cb -0.43 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.11 2k2n s ALA 84 CO 0.40 -0.73 0.00 0.41 0.00 0.00 0.00 175.76 175.84 2k2n n GLY 85 N 3.24 0.75 0.34 0.00 0.00 -1.26 -4.96 105.19 103.29 2k2n n GLY 85 Ca 0.11 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.23 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 0.37 -3.33 1.61 1.82 -1.84 -3.39 116.42 111.66 2k2n h ASP 86 Ca 0.00 0.00 -0.56 0.00 -0.39 0.00 0.00 57.03 56.08 2k2n h ASP 86 Cb 0.00 -0.08 -0.04 0.00 0.68 0.00 0.00 39.33 39.89 2k2n h ASP 86 CO 0.00 0.24 0.37 -0.63 -1.61 0.00 0.00 179.24 177.60 2k2n s ILE 87 N -5.39 4.89 0.00 2.25 1.09 -1.26 -5.06 121.20 117.72 2k2n s ILE 87 Ca -0.08 1.81 0.00 0.00 -1.10 0.00 0.00 60.65 61.28 2k2n s ILE 87 Cb 0.19 -4.21 0.00 0.00 -1.06 0.00 0.00 42.46 37.38 2k2n s ILE 87 CO 0.74 0.10 0.00 -0.81 -0.10 0.00 0.00 174.94 174.87 2k2n n PRO 88 N 4.52 0.18 -0.06 2.79 -0.04 -1.26 -5.01 135.00 136.12 2k2n n PRO 88 Ca 0.05 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.42 2k2n n PRO 88 Cb 0.50 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.93 2k2n n PRO 88 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2k2n n GLU 89 N -0.65 0.38 -0.16 0.54 -0.58 -1.26 -4.22 120.64 114.68 2k2n n GLU 89 Ca 0.00 0.15 -0.08 0.00 -0.42 0.00 0.00 57.16 56.82 2k2n n GLU 89 Cb 0.00 -1.16 0.01 0.00 -0.57 0.00 0.00 31.44 29.72 2k2n n GLU 89 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 2k2n h GLU 90 N -0.71 0.64 -0.55 3.49 5.08 -2.00 -2.26 114.58 118.27 2k2n h GLU 90 Ca -0.07 -0.07 -0.11 0.00 -1.00 0.00 0.00 59.36 58.12 2k2n h GLU 90 Cb 0.80 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.90 2k2n h GLU 90 CO -0.04 0.49 -0.09 0.00 -1.00 0.00 0.00 179.01 178.37 2k2n h ALA 91 N 1.12 0.75 -0.60 3.43 0.00 -2.00 -3.05 119.26 118.92 2k2n h ALA 91 Ca 0.17 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 2k2n h ALA 91 Cb 0.02 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 2k2n h ALA 91 CO -0.03 0.66 0.16 -0.09 0.00 0.00 0.00 179.25 179.95 2k2n h ARG 92 N 0.91 0.92 -0.57 0.00 2.43 -1.69 -2.18 114.38 114.19 2k2n h ARG 92 Ca 0.14 -0.19 -0.02 0.00 -0.81 0.00 0.00 59.98 59.10 2k2n h ARG 92 Cb 0.66 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 30.04 2k2n h ARG 92 CO 0.05 0.81 0.26 -0.09 -1.51 0.00 0.00 179.97 179.48 2k2n h ARG 93 N 0.89 0.81 -0.12 0.20 2.43 -1.31 -1.62 114.38 115.66 2k2n h ARG 93 Ca 0.19 -0.11 -0.12 0.00 -0.81 0.00 0.00 59.98 59.13 2k2n h ARG 93 Cb 0.29 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 2k2n h ARG 93 CO -0.00 0.64 -0.46 -0.07 -1.51 0.00 0.00 179.97 178.57 2k2n h LEU 94 N 0.81 0.31 -1.50 3.80 3.38 -1.35 -1.63 115.31 119.13 2k2n h LEU 94 Ca 0.20 -0.14 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 2k2n h LEU 94 Cb 0.12 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 2k2n h LEU 94 CO -0.02 0.73 -0.13 0.15 0.09 0.00 0.00 178.44 179.26 2k2n h PHE 95 N 0.24 0.17 0.00 1.13 3.04 -0.70 1.18 116.94 122.00 2k2n h PHE 95 Ca 0.02 -0.02 -0.16 0.00 3.98 0.00 0.00 57.97 61.79 2k2n h PHE 95 Cb 0.91 -0.05 -0.02 0.00 2.56 0.00 0.00 35.95 39.34 2k2n h PHE 95 CO 0.02 0.30 -0.86 -0.09 -2.02 0.00 0.00 178.31 175.66 2k2n h ARG 96 N 0.16 0.00 0.03 1.11 2.43 -1.04 -3.10 114.38 113.97 2k2n h ARG 96 Ca 0.03 0.00 -0.39 0.00 -0.81 0.00 0.00 59.98 58.82 2k2n h ARG 96 Cb 0.33 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 29.82 2k2n h ARG 96 CO 0.02 0.64 -2.28 1.28 -1.51 0.00 0.00 179.97 178.13 2k2n n LEU 97 N -3.22 2.62 -0.11 3.80 4.77 -0.65 -4.41 117.00 119.81 2k2n n LEU 97 Ca -0.01 0.08 0.04 0.00 -0.03 0.00 0.00 56.01 56.08 2k2n n LEU 97 Cb 0.84 -0.95 -0.02 0.00 -2.33 0.00 0.00 43.42 40.96 2k2n n LEU 97 CO 0.43 0.80 0.11 0.00 -1.33 0.00 0.00 177.39 177.40 2k2n n ALA 98 N -3.39 2.84 -3.56 -1.18 0.00 0.40 -5.04 120.51 110.57 2k2n n ALA 98 Ca -0.43 -0.33 -0.29 0.00 0.00 0.00 0.00 53.44 52.38 2k2n n ALA 98 Cb 0.96 -0.28 0.02 0.00 0.00 0.00 0.00 19.45 20.14 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 -0.64 -1.77 0.00 0.00 1.13 -1.13 -4.96 117.38 110.01 2k2n n GLN 99 Ca 0.03 1.20 0.00 0.00 -1.94 0.00 0.00 57.00 56.28 2k2n n GLN 99 Cb 0.15 -2.56 0.00 0.00 0.11 0.00 0.00 30.24 27.94 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 -1.29 0.00 -3.51 5.09 3.14 -1.26 -4.86 118.33 115.64 2k2n n VAL 100 Ca -0.17 0.00 -0.16 0.00 -2.96 0.00 0.00 64.34 61.05 2k2n n VAL 100 Cb 0.67 0.00 -0.05 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 1.10 -0.19 1.45 3.52 -1.24 -4.82 118.95 118.78 2k2n s ARG 101 Ca 0.00 -0.01 -0.29 0.00 -0.13 0.00 0.00 55.73 55.30 2k2n s ARG 101 Cb 0.00 0.51 0.13 0.00 -1.56 0.00 0.00 34.95 34.03 2k2n s ARG 101 CO 0.00 -0.39 1.02 0.54 -0.81 0.00 0.00 175.30 175.66 2k2n s VAL 102 N -2.03 0.00 -0.13 7.11 0.11 -1.26 -1.96 120.40 122.23 2k2n s VAL 102 Ca -0.07 0.00 -0.05 0.00 -2.93 0.00 0.00 61.98 58.93 2k2n s VAL 102 Cb -0.00 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.81 2k2n s VAL 102 CO 0.02 0.00 0.03 -0.63 -3.33 0.00 0.00 175.10 171.19 2k2n s ILE 103 N -0.85 4.55 0.44 7.04 1.01 0.24 -4.98 121.20 128.64 2k2n s ILE 103 Ca -0.01 -0.14 -0.05 0.00 0.00 0.00 0.00 60.65 60.46 2k2n s ILE 103 Cb -0.01 -2.98 -0.04 0.00 0.01 0.00 0.00 42.46 39.43 2k2n s ILE 103 CO -0.00 0.54 0.73 -0.69 0.00 0.00 0.00 174.94 175.52 2k2n s VAL 104 N -0.26 4.93 -0.22 2.92 1.01 -1.26 -2.91 120.40 124.62 2k2n s VAL 104 Ca 0.07 0.15 -0.39 0.00 0.00 0.00 0.00 61.98 61.81 2k2n s VAL 104 Cb -0.12 -3.84 -0.15 0.00 0.00 0.00 0.00 36.38 32.27 2k2n s VAL 104 CO 0.02 -0.73 1.74 -0.90 0.00 0.00 0.00 175.10 175.23 2k2n n ASP 105 N -1.97 2.51 0.28 3.32 5.68 -1.25 -4.62 116.55 120.51 2k2n n ASP 105 Ca -0.00 1.06 0.18 0.00 -0.50 0.00 0.00 54.79 55.53 2k2n n ASP 105 Cb 0.55 -1.18 0.92 0.00 -1.14 0.00 0.00 41.12 40.27 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 5.10 0.17 0.03 2.12 3.04 -1.80 -1.34 116.25 123.57 2k2n h VAL 106 Ca -0.47 0.00 -0.00 0.00 -1.01 0.00 0.00 66.70 65.22 2k2n h VAL 106 Cb 1.31 0.80 0.00 0.00 -2.01 0.00 0.00 31.29 31.40 2k2n h VAL 106 CO 0.94 0.00 -0.01 -0.08 -1.01 0.00 0.00 177.57 177.41 2k2n h GLU 107 N 0.00 -0.04 0.00 4.17 4.81 -1.88 0.00 114.58 121.65 2k2n h GLU 107 Ca 0.04 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 2k2n h GLU 107 Cb 0.46 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.85 2k2n h GLU 107 CO -0.00 0.06 0.00 0.00 -0.73 0.00 0.00 179.01 178.34 2k2n n ALA 108 N -2.15 1.29 -3.62 2.92 0.00 -0.51 -4.89 120.51 113.54 2k2n n ALA 108 Ca -0.08 -0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.16 2k2n n ALA 108 Cb 0.08 -1.13 0.00 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 -1.58 -1.54 -2.40 0.00 7.27 -0.01 -4.90 117.38 114.21 2k2n n GLN 109 Ca 0.01 0.96 -0.42 0.00 0.07 0.00 0.00 57.00 57.63 2k2n n GLN 109 Cb 0.08 -3.00 -0.03 0.00 2.41 0.00 0.00 30.24 29.70 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 -2.90 7.08 -0.06 1.69 0.01 -1.26 -5.02 113.70 113.25 2k2n s SER 110 Ca 0.03 2.11 0.06 0.00 1.31 0.00 0.00 55.95 59.45 2k2n s SER 110 Cb -0.00 -2.59 -0.01 0.00 0.21 0.00 0.00 66.02 63.63 2k2n s SER 110 CO 0.87 -0.43 -0.23 0.00 0.41 0.00 0.00 173.24 173.85 2k2n s ARG 111 N 0.56 2.44 0.14 12.44 1.70 -1.26 -4.16 118.95 130.81 2k2n s ARG 111 Ca 0.57 -0.85 0.06 0.00 -0.47 0.00 0.00 55.73 55.04 2k2n s ARG 111 Cb -0.31 -2.06 -0.04 0.00 -0.57 0.00 0.00 34.95 31.97 2k2n s ARG 111 CO 0.32 0.34 -0.14 0.45 -1.08 0.00 0.00 175.30 175.19 2k2n s SER 112 N -0.09 2.16 0.39 -2.89 0.15 -1.22 -4.66 113.70 107.54 2k2n s SER 112 Ca -0.05 -0.88 -0.11 0.00 0.70 0.00 0.00 55.95 55.61 2k2n s SER 112 Cb -0.14 -0.08 0.05 0.00 -1.71 0.00 0.00 66.02 64.13 2k2n s SER 112 CO 0.04 -0.16 0.71 2.30 1.20 0.00 0.00 173.24 177.33 2k2n n ILE 113 N 0.26 0.00 -1.30 6.45 -5.35 -1.26 -3.97 119.36 114.19 2k2n n ILE 113 Ca -0.13 -1.23 -0.35 0.00 -0.27 0.00 0.00 62.75 60.77 2k2n n ILE 113 Cb 0.58 1.03 0.11 0.00 -1.74 0.00 0.00 39.64 39.62 2k2n n ILE 113 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 2k2n n SER 114 N -1.56 1.37 -4.05 7.28 3.41 -1.26 -5.03 113.62 113.79 2k2n n SER 114 Ca -0.06 0.66 -0.11 0.00 -0.26 0.00 0.00 58.87 59.11 2k2n n SER 114 Cb 0.60 -1.52 -0.11 0.00 -0.26 0.00 0.00 64.21 62.91 2k2n n SER 114 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2k2n s GLN 115 N -3.87 0.49 0.43 4.33 -0.21 -1.26 -5.04 119.66 114.53 2k2n s GLN 115 Ca 0.76 -0.82 0.23 0.00 0.02 0.00 0.00 55.36 55.55 2k2n s GLN 115 Cb -0.32 -0.08 0.45 0.00 1.00 0.00 0.00 33.01 34.06 2k2n s GLN 115 CO 0.47 -0.01 1.64 -1.00 -2.12 0.00 0.00 175.29 174.27 2k2n h PRO 116 N 4.22 0.00 -6.09 2.91 0.13 -2.10 -3.45 132.00 127.62 2k2n h PRO 116 Ca -0.34 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.22 2k2n h PRO 116 Cb 1.19 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.17 2k2n h PRO 116 CO 0.46 0.08 -0.77 -1.21 -0.23 0.00 0.00 178.00 176.34 2k2n s GLU 117 N -3.25 1.51 0.10 0.86 0.41 -1.26 -5.15 118.70 111.92 2k2n s GLU 117 Ca 0.06 -1.63 0.10 0.00 -0.41 0.00 0.00 54.97 53.09 2k2n s GLU 117 Cb 0.06 -1.57 -0.04 0.00 -1.78 0.00 0.00 34.13 30.81 2k2n s GLU 117 CO 0.66 0.30 -0.26 -1.12 -0.49 0.00 0.00 175.26 174.36 2k2n s SER 118 N -3.18 3.13 0.00 -0.19 0.01 -1.26 -5.11 113.70 107.09 2k2n s SER 118 Ca 0.24 -0.70 0.00 0.00 1.31 0.00 0.00 55.95 56.81 2k2n s SER 118 Cb -0.05 -0.22 0.00 0.00 0.21 0.00 0.00 66.02 65.96 2k2n s SER 118 CO 0.11 0.18 0.00 0.79 0.41 0.00 0.00 173.24 174.72 2k2n n TRP 119 N 1.15 0.00 0.00 2.43 7.02 -1.26 -4.91 117.44 121.87 2k2n n TRP 119 Ca -0.18 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.30 2k2n n TRP 119 Cb 0.53 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.42 2k2n n TRP 119 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2k2n n GLY 120 N 3.93 -1.23 0.32 6.99 0.00 -1.26 -3.51 105.19 110.43 2k2n n GLY 120 Ca 0.00 -1.61 -0.03 0.00 0.00 0.00 0.00 46.02 44.38 2k2n n GLY 120 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2k2n h LEU 121 N 0.00 0.88 -1.62 0.99 5.85 -1.95 -1.91 115.31 117.56 2k2n h LEU 121 Ca 0.00 -0.12 0.07 0.00 0.84 0.00 0.00 57.88 58.66 2k2n h LEU 121 Cb 0.00 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 40.77 2k2n h LEU 121 CO 0.00 0.79 0.36 0.77 -0.34 0.00 0.00 178.44 180.02 2k2n h SER 122 N 0.95 0.41 0.52 1.25 4.64 -2.00 -0.03 113.55 119.28 2k2n h SER 122 Ca 0.22 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.41 2k2n h SER 122 Cb 0.19 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 62.17 2k2n h SER 122 CO -0.02 0.26 -0.59 0.00 -0.87 0.00 0.00 176.83 175.61 2k2n h ALA 123 N 1.71 0.98 -0.56 5.18 0.00 -1.39 -3.49 119.26 121.69 2k2n h ALA 123 Ca 0.24 -0.54 0.06 0.00 0.00 0.00 0.00 54.91 54.67 2k2n h ALA 123 Cb 0.34 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2k2n h ALA 123 CO -0.06 0.73 -0.08 0.54 0.00 0.00 0.00 179.25 180.38 2k2n n ARG 124 N -3.85 -0.44 -3.31 0.00 1.74 -0.03 -4.87 116.66 105.90 2k2n n ARG 124 Ca -0.02 0.29 -0.19 0.00 -0.77 0.00 0.00 57.85 57.17 2k2n n ARG 124 Cb 0.60 -0.54 -0.08 0.00 -1.02 0.00 0.00 32.46 31.42 2k2n n ARG 124 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2k2n s VAL 125 N -0.99 -0.22 0.00 1.55 1.01 -1.26 -4.90 120.40 115.59 2k2n s VAL 125 Ca 0.00 -1.42 0.00 0.00 0.00 0.00 0.00 61.98 60.56 2k2n s VAL 125 Cb 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 36.38 35.62 2k2n s VAL 125 CO 0.00 -0.70 0.00 -2.65 0.00 0.00 0.00 175.10 171.75 2k2n n PRO 126 N 3.76 0.62 0.02 2.72 -0.02 -1.26 -4.46 135.00 136.36 2k2n n PRO 126 Ca 0.16 0.00 0.13 0.00 -2.02 0.00 0.00 63.50 61.77 2k2n n PRO 126 Cb 0.46 0.00 0.58 0.00 -0.02 0.00 0.00 33.50 34.52 2k2n n PRO 126 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2k2n h LEU 127 N 0.00 0.20 0.00 2.45 3.38 -2.05 -3.47 115.31 115.83 2k2n h LEU 127 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2k2n h LEU 127 Cb 0.00 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.71 2k2n h LEU 127 CO 0.00 0.12 0.00 0.61 0.09 0.00 0.00 178.44 179.26 2k2n n GLY 128 N -1.55 3.63 3.78 0.83 0.00 -1.26 -5.09 105.19 105.53 2k2n n GLY 128 Ca 0.07 -1.30 -0.35 0.00 0.00 0.00 0.00 46.02 44.44 2k2n n GLY 128 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k2n s GLU 129 N -5.76 3.49 -0.00 1.61 0.41 -1.26 -4.93 118.70 112.27 2k2n s GLU 129 Ca 0.00 1.59 0.07 0.00 -0.41 0.00 0.00 54.97 56.22 2k2n s GLU 129 Cb 0.00 -2.08 0.20 0.00 -1.78 0.00 0.00 34.13 30.47 2k2n s GLU 129 CO 0.00 -0.73 1.16 -0.35 -0.49 0.00 0.00 175.26 174.85 2k2n n PRO 130 N -1.11 1.53 0.18 0.39 -0.04 -1.26 -3.77 135.00 130.93 2k2n n PRO 130 Ca 0.11 -0.81 0.13 0.00 -0.04 0.00 0.00 63.50 62.89 2k2n n PRO 130 Cb 0.51 -1.19 0.42 0.00 -0.04 0.00 0.00 33.50 33.20 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 1.30 0.00 0.00 1.53 4.07 -2.04 -3.46 115.31 116.71 2k2n h LEU 131 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 2k2n h LEU 131 Cb 0.32 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.06 2k2n h LEU 131 CO 0.00 0.00 0.00 0.00 -1.08 0.00 0.00 178.44 177.36 2k2n n GLN 132 N -2.68 -0.91 -3.02 1.13 1.13 -1.25 -3.37 117.38 108.41 2k2n n GLN 132 Ca 0.03 0.23 -0.01 0.00 -1.94 0.00 0.00 57.00 55.31 2k2n n GLN 132 Cb 0.39 -4.32 0.00 0.00 0.11 0.00 0.00 30.24 26.42 2k2n n GLN 132 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2k2n n ARG 133 N -0.77 -1.48 -1.62 -1.09 1.74 -1.26 -4.97 116.66 107.21 2k2n n ARG 133 Ca 0.00 1.59 -0.33 0.00 -0.77 0.00 0.00 57.85 58.34 2k2n n ARG 133 Cb 0.23 -5.73 0.06 0.00 -1.02 0.00 0.00 32.46 26.00 2k2n n ARG 133 CO 0.00 0.00 0.00 -2.14 -1.52 0.00 0.00 177.63 173.97 2k2n s PRO 134 N -2.94 2.55 -0.21 5.56 0.02 -1.22 -4.91 135.00 133.86 2k2n s PRO 134 Ca 0.04 1.47 -0.07 0.00 0.02 0.00 0.00 61.00 62.46 2k2n s PRO 134 Cb -0.01 -1.91 -0.03 0.00 0.02 0.00 0.00 34.50 32.56 2k2n s PRO 134 CO 0.75 -1.46 0.05 0.14 -0.33 0.00 0.00 177.00 176.15 2k2n s VAL 135 N -2.29 4.45 0.05 3.83 -7.23 -1.26 -4.49 120.40 113.45 2k2n s VAL 135 Ca 0.68 -0.14 -0.38 0.00 -1.81 0.00 0.00 61.98 60.33 2k2n s VAL 135 Cb -0.22 -3.03 -0.18 0.00 0.56 0.00 0.00 36.38 33.50 2k2n s VAL 135 CO 0.44 0.41 1.17 -0.67 -0.31 0.00 0.00 175.10 176.14 2k2n n ASP 136 N 4.15 0.70 -0.34 4.85 -0.08 -1.26 -3.43 116.55 121.15 2k2n n ASP 136 Ca -0.16 1.14 0.15 0.00 -1.51 0.00 0.00 54.79 54.41 2k2n n ASP 136 Cb 0.52 -1.04 0.30 0.00 2.34 0.00 0.00 41.12 43.24 2k2n n ASP 136 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2k2n h PRO 137 N 3.62 0.01 -0.94 -0.67 0.11 -1.86 -1.31 132.00 130.95 2k2n h PRO 137 Ca -0.49 -0.00 0.29 0.00 0.11 0.00 0.00 66.00 65.91 2k2n h PRO 137 Cb 1.39 -0.00 -0.17 0.00 0.11 0.00 0.00 31.00 32.32 2k2n h PRO 137 CO 0.70 0.00 0.12 0.00 -0.21 0.00 0.00 178.00 178.62 2k2n h HIS 139 N 0.00 0.00 0.38 0.00 -0.00 -1.56 -3.02 115.15 110.95 2k2n h HIS 139 Ca 0.62 0.00 -0.02 0.00 -0.00 0.00 0.00 60.37 60.97 2k2n h HIS 139 Cb 1.37 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.78 2k2n h HIS 139 CO -0.38 0.87 -0.18 0.28 -0.00 0.00 0.00 177.93 178.51 2k2n h VAL 140 N 0.00 0.60 0.00 5.26 2.07 0.54 -1.82 116.25 122.90 2k2n h VAL 140 Ca -0.04 -0.41 -0.05 0.00 0.82 0.00 0.00 66.70 67.03 2k2n h VAL 140 Cb 1.69 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 32.26 2k2n h VAL 140 CO 0.11 0.07 -0.22 0.45 0.02 0.00 0.00 177.57 178.00 2k2n h HIS 141 N -0.76 0.00 -0.54 1.57 3.86 -1.40 -0.56 115.15 117.33 2k2n h HIS 141 Ca -0.05 0.00 0.01 0.00 -1.16 0.00 0.00 60.37 59.17 2k2n h HIS 141 Cb 0.52 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.96 2k2n h HIS 141 CO 0.00 0.22 0.35 -0.92 0.86 0.00 0.00 177.93 178.45 2k2n h TYR 142 N 0.00 0.67 -0.15 2.45 3.20 -1.37 0.01 116.97 121.78 2k2n h TYR 142 Ca -0.00 0.02 -0.20 0.00 3.14 0.00 0.00 58.73 61.68 2k2n h TYR 142 Cb 0.43 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 38.48 2k2n h TYR 142 CO 0.00 0.41 -0.71 -0.07 -1.64 0.00 0.00 178.16 176.15 2k2n h LEU 143 N 0.72 0.78 -1.08 2.82 3.38 -0.72 -2.58 115.31 118.63 2k2n h LEU 143 Ca 0.20 -0.49 0.21 0.00 0.09 0.00 0.00 57.88 57.89 2k2n h LEU 143 Cb -0.07 -0.23 -0.11 0.00 0.09 0.00 0.00 40.66 40.35 2k2n h LEU 143 CO -0.05 1.26 0.61 0.50 0.09 0.00 0.00 178.44 180.86 2k2n h LYS 144 N 0.47 0.66 0.00 1.13 1.63 -0.53 2.76 116.57 122.68 2k2n h LYS 144 Ca -0.03 -0.04 -0.03 0.00 -0.85 0.00 0.00 60.65 59.70 2k2n h LYS 144 Cb 1.32 -0.15 -0.00 0.00 -0.60 0.00 0.00 32.23 32.79 2k2n h LYS 144 CO 0.14 0.43 -0.13 0.77 -3.45 0.00 0.00 179.45 177.21 2k2n h SER 145 N 0.68 0.00 0.06 4.20 0.02 -0.61 0.05 113.55 117.95 2k2n h SER 145 Ca 0.58 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.53 2k2n h SER 145 Cb 1.03 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.57 2k2n h SER 145 CO -0.37 0.13 -0.06 0.23 -1.14 0.00 0.00 176.83 175.62 2k2n n MET 146 N -3.93 1.38 -1.34 3.45 2.81 0.91 -4.91 117.12 115.49 2k2n n MET 146 Ca -0.02 -0.74 -0.05 0.00 -1.81 0.00 0.00 57.70 55.08 2k2n n MET 146 Cb 0.22 -1.48 -0.02 0.00 -0.71 0.00 0.00 33.22 31.23 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 1.20 0.66 3.55 3.03 0.00 0.02 -5.02 105.19 108.63 2k2n n GLY 147 Ca 0.18 -0.79 -0.33 0.00 0.00 0.00 0.00 46.02 45.07 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 3.51 -0.14 1.61 1.01 -0.89 -4.73 120.40 118.56 2k2n s VAL 148 Ca 0.00 -0.60 0.01 0.00 0.00 0.00 0.00 61.98 61.38 2k2n s VAL 148 Cb 0.00 -2.43 -0.09 0.00 0.00 0.00 0.00 36.38 33.86 2k2n s VAL 148 CO 0.00 0.56 -0.12 0.00 0.00 0.00 0.00 175.10 175.54 2k2n n ALA 149 N 2.13 1.72 -3.76 5.51 0.00 -1.25 -3.68 120.51 121.19 2k2n n ALA 149 Ca -0.17 -0.58 -0.23 0.00 0.00 0.00 0.00 53.44 52.45 2k2n n ALA 149 Cb 0.53 0.19 -0.17 0.00 0.00 0.00 0.00 19.45 20.00 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 -5.38 1.61 -0.09 0.00 0.01 -1.19 -2.23 113.70 106.43 2k2n s SER 150 Ca -0.19 -0.16 0.03 0.00 1.31 0.00 0.00 55.95 56.95 2k2n s SER 150 Cb 0.05 -0.56 -0.01 0.00 0.21 0.00 0.00 66.02 65.70 2k2n s SER 150 CO 0.31 -0.13 -0.19 -0.55 0.41 0.00 0.00 173.24 173.09 2k2n s SER 151 N 1.62 3.60 -0.08 2.44 0.15 -1.15 -2.29 113.70 117.98 2k2n s SER 151 Ca 0.01 -0.39 0.01 0.00 0.70 0.00 0.00 55.95 56.28 2k2n s SER 151 Cb -0.13 -1.19 -0.03 0.00 -1.71 0.00 0.00 66.02 62.96 2k2n s SER 151 CO -0.04 0.23 -0.10 -0.22 1.20 0.00 0.00 173.24 174.30 2k2n s LEU 152 N -0.03 2.95 -0.16 3.45 0.20 -0.56 0.80 118.68 125.33 2k2n s LEU 152 Ca -0.05 -0.14 0.01 0.00 0.69 0.00 0.00 54.13 54.63 2k2n s LEU 152 Cb -0.14 -1.64 0.02 0.00 -0.43 0.00 0.00 46.19 44.00 2k2n s LEU 152 CO 0.05 0.30 -0.17 -0.69 -0.29 0.00 0.00 176.35 175.55 2k2n s VAL 153 N -0.46 1.81 -0.32 1.68 1.01 -0.83 -0.40 120.40 122.90 2k2n s VAL 153 Ca 0.06 -0.78 0.03 0.00 0.00 0.00 0.00 61.98 61.29 2k2n s VAL 153 Cb -0.12 -1.66 0.09 0.00 0.00 0.00 0.00 36.38 34.68 2k2n s VAL 153 CO 0.02 0.50 0.01 0.54 0.00 0.00 0.00 175.10 176.17 2k2n s VAL 154 N 1.39 2.38 -0.20 2.92 0.11 -1.12 -3.62 120.40 122.26 2k2n s VAL 154 Ca 0.05 -2.04 -0.43 0.00 -2.93 0.00 0.00 61.98 56.63 2k2n s VAL 154 Cb -0.13 -2.62 -0.20 0.00 -1.53 0.00 0.00 36.38 31.91 2k2n s VAL 154 CO -0.12 -0.40 1.30 -2.65 -3.33 0.00 0.00 175.10 169.90 2k2n n PRO 155 N 4.36 0.05 -2.18 1.54 -0.02 -1.26 -4.39 135.00 133.10 2k2n n PRO 155 Ca -0.03 0.02 -0.30 0.00 -2.02 0.00 0.00 63.50 61.16 2k2n n PRO 155 Cb 0.42 -1.53 0.02 0.00 -0.02 0.00 0.00 33.50 32.39 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 2.58 5.67 0.00 2.45 7.94 -1.26 -4.84 117.00 129.53 2k2n n LEU 156 Ca 0.24 -4.98 -0.07 0.00 -1.11 0.00 0.00 56.01 50.10 2k2n n LEU 156 Cb 0.03 -0.63 -0.02 0.00 0.53 0.00 0.00 43.42 43.34 2k2n n LEU 156 CO 0.73 2.04 0.08 1.15 -1.11 0.00 0.00 177.39 180.28 2k2n n MET 157 N -0.57 0.35 -1.42 1.96 0.00 -1.26 -4.59 117.12 111.58 2k2n n MET 157 Ca 0.45 -1.38 -0.28 0.00 0.00 0.00 0.00 57.70 56.49 2k2n n MET 157 Cb 0.61 1.33 0.22 0.00 0.00 0.00 0.00 33.22 35.38 2k2n n MET 157 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 175.97 177.55 2k2n n HIS 158 N -0.29 -3.93 0.03 3.17 -0.00 -0.92 -4.94 115.22 108.35 2k2n n HIS 158 Ca 0.00 -1.04 -0.09 0.00 0.46 0.00 0.00 57.72 57.06 2k2n n HIS 158 Cb 0.29 -1.03 -0.06 0.00 -0.12 0.00 0.00 29.99 29.07 2k2n n HIS 158 CO 0.00 0.00 0.00 1.25 0.46 0.00 0.00 176.34 178.05 2k2n h HIS 159 N -2.18 -0.17 -0.55 1.57 2.76 -1.97 -3.37 115.15 111.24 2k2n h HIS 159 Ca -0.40 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.76 2k2n h HIS 159 Cb 1.16 0.06 0.00 0.00 1.55 0.00 0.00 27.41 30.18 2k2n h HIS 159 CO 0.00 0.22 0.00 0.94 -1.30 0.00 0.00 177.93 177.79 2k2n n GLN 160 N -4.88 2.73 -3.86 5.26 -0.06 -1.26 -4.58 117.38 110.73 2k2n n GLN 160 Ca -0.06 -2.37 -0.13 0.00 -2.00 0.00 0.00 57.00 52.43 2k2n n GLN 160 Cb 0.24 -1.44 -0.15 0.00 -4.06 0.00 0.00 30.24 24.83 2k2n n GLN 160 CO 0.00 0.00 0.00 -1.21 -0.20 0.00 0.00 177.06 175.65 2k2n s GLU 161 N -1.03 0.02 -0.29 3.69 0.41 -1.26 -5.04 118.70 115.20 2k2n s GLU 161 Ca 0.38 0.04 -0.05 0.00 -0.41 0.00 0.00 54.97 54.93 2k2n s GLU 161 Cb 0.20 -0.10 0.02 0.00 -1.78 0.00 0.00 34.13 32.47 2k2n s GLU 161 CO 0.26 -0.04 0.04 -1.17 -0.49 0.00 0.00 175.26 173.86 2k2n s LEU 162 N 0.30 3.75 -0.09 1.80 0.20 -1.26 -2.17 118.68 121.21 2k2n s LEU 162 Ca -0.03 -0.84 0.02 0.00 0.69 0.00 0.00 54.13 53.97 2k2n s LEU 162 Cb -0.04 -1.81 -0.25 0.00 -0.43 0.00 0.00 46.19 43.66 2k2n s LEU 162 CO -0.01 -0.20 0.47 0.79 -0.29 0.00 0.00 176.35 177.11 2k2n n TRP 163 N 4.79 1.08 -3.35 5.38 5.03 -1.26 -4.86 117.44 124.25 2k2n n TRP 163 Ca -0.15 0.29 -0.02 0.00 3.03 0.00 0.00 57.50 60.66 2k2n n TRP 163 Cb 0.47 -1.16 0.01 0.00 -1.03 0.00 0.00 31.31 29.59 2k2n n TRP 163 CO 0.00 0.00 0.00 0.41 -0.03 0.00 0.00 177.69 178.07 2k2n n GLY 164 N 1.81 1.48 2.80 6.99 0.00 -1.26 0.14 105.19 117.15 2k2n n GLY 164 Ca -0.26 -1.05 -0.17 0.00 0.00 0.00 0.00 46.02 44.54 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 1.07 -0.19 0.99 1.02 0.24 -4.58 118.68 117.23 2k2n s LEU 165 Ca 0.05 -0.01 -0.08 0.00 0.02 0.00 0.00 54.13 54.12 2k2n s LEU 165 Cb -0.01 -0.18 -0.04 0.00 0.02 0.00 0.00 46.19 45.97 2k2n s LEU 165 CO 0.03 -0.12 0.07 -0.22 0.02 0.00 0.00 176.35 176.13 2k2n s LEU 166 N 1.13 3.82 -0.00 1.79 2.96 -1.26 -0.06 118.68 127.05 2k2n s LEU 166 Ca -0.08 0.07 0.00 0.00 -0.22 0.00 0.00 54.13 53.90 2k2n s LEU 166 Cb -0.13 -1.97 0.00 0.00 0.50 0.00 0.00 46.19 44.58 2k2n s LEU 166 CO -0.02 0.16 -0.01 0.54 -1.32 0.00 0.00 176.35 175.69 2k2n s VAL 167 N 0.48 0.09 -0.06 1.68 0.11 -1.10 -2.81 120.40 118.78 2k2n s VAL 167 Ca 0.04 -0.04 0.01 0.00 -2.93 0.00 0.00 61.98 59.06 2k2n s VAL 167 Cb -0.13 -0.09 -0.03 0.00 -1.53 0.00 0.00 36.38 34.61 2k2n s VAL 167 CO 0.01 0.03 -0.08 -0.94 -3.33 0.00 0.00 175.10 170.79 2k2n s SER 168 N 0.01 4.58 -0.12 3.54 1.04 0.47 -2.51 113.70 120.70 2k2n s SER 168 Ca 0.00 -0.05 -0.01 0.00 0.48 0.00 0.00 55.95 56.37 2k2n s SER 168 Cb -0.01 -1.13 -0.02 0.00 0.10 0.00 0.00 66.02 64.96 2k2n s SER 168 CO -0.00 0.36 -0.09 -1.00 0.98 0.00 0.00 173.24 173.49 2k2n s HIS 169 N -0.82 2.90 -0.10 5.02 3.76 0.30 -1.49 115.29 124.86 2k2n s HIS 169 Ca 0.13 -0.38 -0.00 0.00 -0.15 0.00 0.00 55.06 54.66 2k2n s HIS 169 Cb -0.11 -1.85 0.02 0.00 1.11 0.00 0.00 32.58 31.76 2k2n s HIS 169 CO 0.02 -0.03 -0.07 -1.58 -0.85 0.00 0.00 174.74 172.22 2k2n s HIS 170 N 0.09 1.39 -0.95 1.40 2.46 -0.97 -2.38 115.29 116.33 2k2n s HIS 170 Ca -0.03 -0.66 -0.08 0.00 0.47 0.00 0.00 55.06 54.76 2k2n s HIS 170 Cb -0.14 -1.17 -0.12 0.00 -0.13 0.00 0.00 32.58 31.02 2k2n s HIS 170 CO 0.04 -0.47 3.14 0.00 -2.47 0.00 0.00 174.74 174.98 2k2n n ALA 171 N 4.83 7.01 -3.44 1.58 0.00 -1.26 -3.19 120.51 126.05 2k2n n ALA 171 Ca -0.13 -2.95 -0.16 0.00 0.00 0.00 0.00 53.44 50.20 2k2n n ALA 171 Cb 0.50 -2.87 -0.07 0.00 0.00 0.00 0.00 19.45 17.02 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 1.19 0.93 0.09 0.00 2.02 -1.26 -4.95 118.70 116.72 2k2n s GLU 172 Ca 0.67 0.15 0.17 0.00 0.02 0.00 0.00 54.97 55.98 2k2n s GLU 172 Cb 0.24 0.43 0.73 0.00 0.10 0.00 0.00 34.13 35.64 2k2n s GLU 172 CO -0.05 -0.28 1.54 -0.35 0.02 0.00 0.00 175.26 176.14 2k2n n PRO 173 N 1.09 0.06 -1.35 0.39 -0.04 -1.26 -4.27 135.00 129.62 2k2n n PRO 173 Ca -0.20 0.31 -0.47 0.00 -0.04 0.00 0.00 63.50 63.10 2k2n n PRO 173 Cb 0.57 -1.62 -0.13 0.00 -0.04 0.00 0.00 33.50 32.27 2k2n n PRO 173 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 2k2n n ARG 174 N -1.75 0.00 -0.78 0.54 0.63 -1.26 -4.70 116.66 109.34 2k2n n ARG 174 Ca 0.03 0.00 -0.34 0.00 -0.92 0.00 0.00 57.85 56.62 2k2n n ARG 174 Cb 0.19 -1.45 0.13 0.00 0.45 0.00 0.00 32.46 31.77 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 7.81 -0.95 -2.71 -0.14 -0.02 -1.26 -4.89 135.00 132.84 2k2n n PRO 175 Ca 0.59 -0.26 -0.42 0.00 -2.02 0.00 0.00 63.50 61.39 2k2n n PRO 175 Cb 0.00 -1.53 -0.03 0.00 -0.02 0.00 0.00 33.50 31.92 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 -2.20 3.65 -0.01 6.00 -0.85 -1.26 -5.04 117.35 117.64 2k2n s TYR 176 Ca 0.51 1.69 0.03 0.00 -0.52 0.00 0.00 57.07 58.78 2k2n s TYR 176 Cb -0.09 -3.12 -0.03 0.00 0.38 0.00 0.00 41.96 39.10 2k2n s TYR 176 CO 0.68 -0.02 -0.09 0.45 -1.52 0.00 0.00 175.55 175.04 2k2n s SER 177 N 1.01 4.44 0.56 -0.18 0.15 -1.26 -5.00 113.70 113.42 2k2n s SER 177 Ca 0.52 -0.17 0.24 0.00 0.70 0.00 0.00 55.95 57.24 2k2n s SER 177 Cb -0.21 -1.00 1.52 0.00 -1.71 0.00 0.00 66.02 64.62 2k2n s SER 177 CO 0.27 0.30 2.13 1.56 1.20 0.00 0.00 173.24 178.70 2k2n h GLN 178 N 4.77 0.00 -0.89 5.44 4.20 -2.01 -1.28 115.11 125.33 2k2n h GLN 178 Ca -0.48 0.00 0.06 0.00 0.06 0.00 0.00 58.65 58.29 2k2n h GLN 178 Cb 1.16 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.89 2k2n h GLN 178 CO 0.52 0.00 0.58 0.93 -0.67 0.00 0.00 178.83 180.19 2k2n h GLU 179 N 0.00 0.99 -0.62 1.46 4.39 -2.00 -1.06 114.58 117.74 2k2n h GLU 179 Ca 0.07 -0.06 -0.05 0.00 0.34 0.00 0.00 59.36 59.66 2k2n h GLU 179 Cb 0.33 -0.22 -0.03 0.00 -0.10 0.00 0.00 28.75 28.73 2k2n h GLU 179 CO -0.00 0.65 0.17 0.93 -1.16 0.00 0.00 179.01 179.60 2k2n h GLU 180 N 1.02 0.95 -0.68 2.33 5.08 -1.65 -2.63 114.58 118.99 2k2n h GLU 180 Ca 0.38 -0.20 -0.06 0.00 -1.00 0.00 0.00 59.36 58.48 2k2n h GLU 180 Cb 0.19 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 2k2n h GLU 180 CO -0.14 0.84 0.20 -0.07 -1.00 0.00 0.00 179.01 178.84 2k2n h LEU 181 N 0.92 1.01 -1.18 1.33 3.38 -1.27 -2.73 115.31 116.75 2k2n h LEU 181 Ca 0.20 -0.22 0.15 0.00 0.09 0.00 0.00 57.88 58.10 2k2n h LEU 181 Cb 0.30 -0.26 -0.08 0.00 0.09 0.00 0.00 40.66 40.71 2k2n h LEU 181 CO -0.00 0.96 0.60 1.56 0.09 0.00 0.00 178.44 181.64 2k2n h GLN 182 N 1.01 0.74 0.31 1.13 1.08 -1.00 0.54 115.11 118.91 2k2n h GLN 182 Ca 0.22 -0.04 -0.01 0.00 -1.45 0.00 0.00 58.65 57.36 2k2n h GLN 182 Cb 0.32 -0.17 0.00 0.00 -0.05 0.00 0.00 27.48 27.58 2k2n h GLN 182 CO -0.00 0.49 -0.15 0.28 -0.95 0.00 0.00 178.83 178.50 2k2n h VAL 183 N 0.77 0.68 0.00 -0.54 2.07 -1.41 -3.28 116.25 114.54 2k2n h VAL 183 Ca 0.48 -0.62 -0.18 0.00 0.82 0.00 0.00 66.70 67.20 2k2n h VAL 183 Cb 0.72 0.99 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 2k2n h VAL 183 CO -0.25 0.12 -0.85 -0.37 0.02 0.00 0.00 177.57 176.24 2k2n h VAL 184 N -0.77 1.59 -0.46 2.57 -1.51 -1.44 -3.09 116.25 113.15 2k2n h VAL 184 Ca -0.04 -2.93 0.09 0.00 -1.23 0.00 0.00 66.70 62.59 2k2n h VAL 184 Cb 0.51 2.59 -0.09 0.00 -2.13 0.00 0.00 31.29 32.17 2k2n h VAL 184 CO 0.07 0.83 -0.11 -0.61 -1.23 0.00 0.00 177.57 176.53 2k2n h GLN 185 N 0.00 0.01 0.05 5.19 5.75 -0.01 2.63 115.11 128.72 2k2n h GLN 185 Ca -0.01 -0.00 -0.25 0.00 -0.15 0.00 0.00 58.65 58.24 2k2n h GLN 185 Cb 1.52 -0.00 0.02 0.00 1.07 0.00 0.00 27.48 30.09 2k2n h GLN 185 CO 0.11 0.01 -1.00 1.25 -2.65 0.00 0.00 178.83 176.55 2k2n h LEU 186 N 0.01 0.79 0.04 -2.39 5.85 -1.66 -3.07 115.31 114.87 2k2n h LEU 186 Ca 0.22 -0.79 -0.19 0.00 0.84 0.00 0.00 57.88 57.97 2k2n h LEU 186 Cb 0.34 -0.24 0.02 0.00 0.37 0.00 0.00 40.66 41.14 2k2n h LEU 186 CO -0.46 1.48 -0.75 0.25 -0.34 0.00 0.00 178.44 178.62 2k2n h LEU 187 N 0.19 0.60 -0.96 2.25 5.85 -1.38 -3.21 115.31 118.64 2k2n h LEU 187 Ca -0.14 -0.80 0.01 0.00 0.84 0.00 0.00 57.88 57.79 2k2n h LEU 187 Cb 1.68 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 42.48 2k2n h LEU 187 CO 0.19 1.32 0.63 0.00 -0.34 0.00 0.00 178.44 180.25 2k2n h ALA 188 N 0.28 1.22 -0.90 1.25 0.00 0.44 -1.19 119.26 120.37 2k2n h ALA 188 Ca -0.10 -0.07 0.08 0.00 0.00 0.00 0.00 54.91 54.82 2k2n h ALA 188 Cb 1.47 -0.39 -0.06 0.00 0.00 0.00 0.00 17.79 18.81 2k2n h ALA 188 CO 0.15 0.62 0.58 -0.44 0.00 0.00 0.00 179.25 180.16 2k2n h ASP 189 N 1.31 0.85 0.85 0.00 3.32 -1.61 0.77 116.42 121.91 2k2n h ASP 189 Ca 0.35 0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.36 2k2n h ASP 189 Cb -0.14 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.24 2k2n h ASP 189 CO -0.08 0.52 -0.28 -0.61 -1.72 0.00 0.00 179.24 177.08 2k2n h GLN 190 N 0.95 0.00 0.02 3.56 4.15 -1.25 -2.65 115.11 119.89 2k2n h GLN 190 Ca 0.41 0.00 -0.09 0.00 0.77 0.00 0.00 58.65 59.73 2k2n h GLN 190 Cb 0.33 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.01 2k2n h GLN 190 CO -0.17 0.28 -0.49 0.28 -1.93 0.00 0.00 178.83 176.80 2k2n h VAL 191 N 0.00 1.50 -0.85 2.39 2.07 0.30 -2.77 116.25 118.89 2k2n h VAL 191 Ca -0.00 -2.33 0.25 0.00 0.82 0.00 0.00 66.70 65.43 2k2n h VAL 191 Cb 0.77 3.04 -0.03 0.00 -1.52 0.00 0.00 31.29 33.55 2k2n h VAL 191 CO 0.04 0.55 0.62 0.28 0.02 0.00 0.00 177.57 179.08 2k2n h SER 192 N -0.89 0.00 0.53 0.57 0.02 0.36 1.38 113.55 115.53 2k2n h SER 192 Ca -0.12 0.00 -0.20 0.00 -0.84 0.00 0.00 61.79 60.63 2k2n h SER 192 Cb 1.19 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.72 2k2n h SER 192 CO -0.03 0.00 -0.88 0.40 -1.14 0.00 0.00 176.83 175.18 2k2n h ILE 193 N 0.00 1.48 -0.26 3.27 2.04 -1.51 -2.85 117.51 119.68 2k2n h ILE 193 Ca 0.40 -2.57 -0.05 0.00 1.00 0.00 0.00 64.86 63.64 2k2n h ILE 193 Cb 1.64 2.44 -0.01 0.00 -0.74 0.00 0.00 36.82 40.15 2k2n h ILE 193 CO -0.00 0.75 -0.04 0.00 0.00 0.00 0.00 178.15 178.86 2k2n h ALA 194 N 0.94 0.35 -0.42 1.87 0.00 0.21 -0.15 119.26 122.06 2k2n h ALA 194 Ca -0.05 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.55 2k2n h ALA 194 Cb 1.50 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.18 2k2n h ALA 194 CO 0.14 0.14 0.05 -0.84 0.00 0.00 0.00 179.25 178.73 2k2n h ILE 195 N 0.24 1.21 -0.30 0.00 3.07 -1.16 0.18 117.51 120.75 2k2n h ILE 195 Ca 0.07 -0.80 -0.10 0.00 1.55 0.00 0.00 64.86 65.58 2k2n h ILE 195 Cb 0.50 0.84 -0.01 0.00 -0.27 0.00 0.00 36.82 37.88 2k2n h ILE 195 CO 0.02 0.29 -0.18 0.00 -1.05 0.00 0.00 178.15 177.22 2k2n h ALA 196 N 1.43 0.43 -0.25 0.16 0.00 -1.25 -2.36 119.26 117.41 2k2n h ALA 196 Ca 0.14 -0.35 -0.17 0.00 0.00 0.00 0.00 54.91 54.53 2k2n h ALA 196 Cb 0.32 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 2k2n h ALA 196 CO 0.01 0.36 -0.52 1.96 0.00 0.00 0.00 179.25 181.05 2k2n h GLN 197 N 0.41 0.73 -0.13 0.00 4.20 -0.68 -3.14 115.11 116.50 2k2n h GLN 197 Ca 0.06 -0.44 -0.07 0.00 0.06 0.00 0.00 58.65 58.26 2k2n h GLN 197 Cb 0.72 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.54 2k2n h GLN 197 CO 0.05 1.07 -0.25 0.00 -0.67 0.00 0.00 178.83 179.03 2k2n h ALA 198 N 0.85 1.35 -0.75 3.87 0.00 -0.65 -2.95 119.26 120.98 2k2n h ALA 198 Ca 0.02 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 2k2n h ALA 198 Cb 1.09 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.76 2k2n h ALA 198 CO 0.11 0.45 0.31 1.49 0.00 0.00 0.00 179.25 181.61 2k2n h GLU 199 N 0.21 1.11 -0.47 0.00 4.81 -1.37 -2.66 114.58 116.21 2k2n h GLU 199 Ca 0.03 -0.19 -0.04 0.00 -0.13 0.00 0.00 59.36 59.04 2k2n h GLU 199 Cb 0.55 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.72 2k2n h GLU 199 CO 0.04 0.89 0.14 1.25 -0.73 0.00 0.00 179.01 180.60 2k2n h LEU 200 N 1.09 0.63 0.02 1.64 5.85 -1.56 -2.94 115.31 120.04 2k2n h LEU 200 Ca 0.25 -0.09 0.03 0.00 0.84 0.00 0.00 57.88 58.91 2k2n h LEU 200 Cb 0.19 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 2k2n h LEU 200 CO -0.02 0.61 -0.23 -1.28 -0.34 0.00 0.00 178.44 177.18 2k2n h SER 201 N 0.68 -0.68 0.00 1.25 0.87 -1.50 -3.53 113.55 110.64 2k2n h SER 201 Ca 0.16 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.81 2k2n h SER 201 Cb 0.22 0.28 0.00 0.00 -0.44 0.00 0.00 62.40 62.45 2k2n h SER 201 CO -0.01 -0.30 0.00 -0.11 -0.53 0.00 0.00 176.83 175.88