#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 -0.31 1.96 5.19 -1.98 -2.10 116.42 119.17 2k2n h ASP 32 Ca 0.00 -0.75 0.04 0.00 -0.62 0.00 0.00 57.03 55.70 2k2n h ASP 32 Cb 0.00 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 39.47 2k2n h ASP 32 CO 0.00 0.75 0.09 1.56 -3.12 0.00 0.00 179.24 178.52 2k2n h GLN 33 N -0.75 0.21 -0.42 3.56 4.20 -1.99 0.14 115.11 120.06 2k2n h GLN 33 Ca -0.00 -0.01 -0.06 0.00 0.06 0.00 0.00 58.65 58.63 2k2n h GLN 33 Cb 0.75 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.46 2k2n h GLN 33 CO 0.00 0.14 0.02 0.97 -0.67 0.00 0.00 178.83 179.29 2k2n h ILE 34 N 0.22 1.26 -0.30 2.54 2.10 -1.97 -2.24 117.51 119.10 2k2n h ILE 34 Ca 0.14 -0.99 -0.00 0.00 1.08 0.00 0.00 64.86 65.09 2k2n h ILE 34 Cb 0.13 1.06 -0.01 0.00 -1.09 0.00 0.00 36.82 36.91 2k2n h ILE 34 CO -0.16 0.34 0.17 -0.07 -1.08 0.00 0.00 178.15 177.35 2k2n h LEU 35 N 0.58 0.37 -1.26 2.19 3.38 -0.99 0.98 115.31 120.56 2k2n h LEU 35 Ca 0.12 -0.08 0.02 0.00 0.09 0.00 0.00 57.88 58.04 2k2n h LEU 35 Cb 0.46 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.07 2k2n h LEU 35 CO 0.02 0.34 0.51 0.03 0.09 0.00 0.00 178.44 179.43 2k2n h ARG 36 N 0.38 0.97 0.00 1.13 3.08 -0.68 0.97 114.38 120.23 2k2n h ARG 36 Ca 0.11 -0.06 -0.10 0.00 0.07 0.00 0.00 59.98 60.00 2k2n h ARG 36 Cb 0.05 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 29.86 2k2n h ARG 36 CO -0.02 0.64 -0.46 0.00 -1.07 0.00 0.00 179.97 179.06 2k2n h ALA 37 N 1.53 1.20 -0.03 0.04 0.00 -0.84 -2.89 119.26 118.27 2k2n h ALA 37 Ca 0.29 -0.42 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 2k2n h ALA 37 Cb -0.05 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.67 2k2n h ALA 37 CO -0.07 0.58 -0.16 1.15 0.00 0.00 0.00 179.25 180.75 2k2n h THR 38 N 0.00 1.49 -0.23 0.00 2.02 0.15 -3.13 112.91 113.20 2k2n h THR 38 Ca -0.00 -1.66 -0.06 0.00 0.77 0.00 0.00 66.41 65.45 2k2n h THR 38 Cb 0.84 2.49 -0.01 0.00 -1.74 0.00 0.00 68.15 69.73 2k2n h THR 38 CO 0.06 0.46 -0.13 1.62 0.37 0.00 0.00 175.52 177.90 2k2n h VAL 39 N -0.43 1.21 -0.06 3.16 3.04 -0.99 -2.62 116.25 119.56 2k2n h VAL 39 Ca -0.01 -0.94 -0.01 0.00 -1.01 0.00 0.00 66.70 64.73 2k2n h VAL 39 Cb 0.82 1.18 -0.00 0.00 -2.01 0.00 0.00 31.29 31.28 2k2n h VAL 39 CO 0.03 0.30 0.00 -0.08 -1.01 0.00 0.00 177.57 176.82 2k2n h GLU 40 N 0.36 0.09 -0.76 4.17 4.57 -1.59 -2.81 114.58 118.61 2k2n h GLU 40 Ca 0.07 -0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 58.20 2k2n h GLU 40 Cb 0.45 -0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 28.99 2k2n h GLU 40 CO 0.03 0.35 0.39 0.93 -1.18 0.00 0.00 179.01 179.52 2k2n h GLU 41 N -0.17 1.08 -0.49 1.92 5.08 -1.47 -2.86 114.58 117.66 2k2n h GLU 41 Ca 0.02 -0.14 -0.00 0.00 -1.00 0.00 0.00 59.36 58.23 2k2n h GLU 41 Cb 0.31 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 2k2n h GLU 41 CO 0.00 0.82 0.29 0.28 -1.00 0.00 0.00 179.01 179.40 2k2n h VAL 42 N 1.08 1.16 -0.98 3.13 2.07 -1.42 -2.48 116.25 118.80 2k2n h VAL 42 Ca 0.27 -0.36 0.14 0.00 0.82 0.00 0.00 66.70 67.56 2k2n h VAL 42 Cb 0.08 0.51 -0.09 0.00 -1.52 0.00 0.00 31.29 30.27 2k2n h VAL 42 CO -0.04 0.16 0.62 -0.09 0.02 0.00 0.00 177.57 178.24 2k2n h ARG 43 N 0.65 0.86 -0.80 1.57 2.43 -1.26 0.14 114.38 117.97 2k2n h ARG 43 Ca 0.18 -0.05 0.02 0.00 -0.81 0.00 0.00 59.98 59.31 2k2n h ARG 43 Cb 0.01 -0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 29.32 2k2n h ARG 43 CO -0.03 0.57 0.53 0.00 -1.51 0.00 0.00 179.97 179.53 2k2n h ALA 44 N 1.57 1.46 0.13 2.80 0.00 -1.40 3.34 119.26 127.17 2k2n h ALA 44 Ca 0.51 -0.05 -0.20 0.00 0.00 0.00 0.00 54.91 55.17 2k2n h ALA 44 Cb 0.63 -0.31 0.02 0.00 0.00 0.00 0.00 17.79 18.14 2k2n h ALA 44 CO -0.28 0.49 -0.86 0.35 0.00 0.00 0.00 179.25 178.95 2k2n h PHE 45 N 1.05 0.60 0.07 0.00 3.57 -0.86 -3.36 116.94 118.01 2k2n h PHE 45 Ca 0.30 -0.43 -0.29 0.00 3.53 0.00 0.00 57.97 61.09 2k2n h PHE 45 Cb -0.07 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 38.62 2k2n h PHE 45 CO -0.00 1.32 -1.49 -0.07 -2.23 0.00 0.00 178.31 175.83 2k2n h LEU 46 N -0.28 0.23 0.93 0.59 3.38 -0.67 -3.47 115.31 116.02 2k2n h LEU 46 Ca -0.15 -0.34 -0.40 0.00 0.09 0.00 0.00 57.88 57.09 2k2n h LEU 46 Cb 1.66 -0.07 -0.16 0.00 0.09 0.00 0.00 40.66 42.18 2k2n h LEU 46 CO 0.16 1.28 -0.36 0.61 0.09 0.00 0.00 178.44 180.22 2k2n n GLY 47 N 1.60 1.87 3.77 0.83 0.00 1.11 -4.93 105.19 109.44 2k2n n GLY 47 Ca -0.14 -0.02 -0.39 0.00 0.00 0.00 0.00 46.02 45.46 2k2n n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k2n s THR 48 N -2.68 3.31 0.31 2.61 2.01 -1.26 -4.90 115.64 115.04 2k2n s THR 48 Ca 0.00 1.20 0.05 0.00 0.31 0.00 0.00 61.69 63.25 2k2n s THR 48 Cb 0.00 -3.71 0.40 0.00 0.01 0.00 0.00 72.50 69.19 2k2n s THR 48 CO 0.00 0.19 1.52 0.47 -0.69 0.00 0.00 174.62 176.11 2k2n n ASP 49 N 0.57 -0.04 -3.64 3.53 8.00 -1.19 -4.52 116.55 119.26 2k2n n ASP 49 Ca 0.02 1.64 -0.06 0.00 0.71 0.00 0.00 54.79 57.10 2k2n n ASP 49 Cb 0.46 -0.63 -0.07 0.00 -0.02 0.00 0.00 41.12 40.86 2k2n n ASP 49 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 2k2n s ARG 50 N -5.88 0.59 -0.03 -1.24 3.52 -1.22 -3.02 118.95 111.67 2k2n s ARG 50 Ca -0.12 0.98 0.00 0.00 -0.13 0.00 0.00 55.73 56.47 2k2n s ARG 50 Cb 0.29 0.13 0.03 0.00 -1.56 0.00 0.00 34.95 33.84 2k2n s ARG 50 CO 0.75 -0.12 0.01 0.54 -0.81 0.00 0.00 175.30 175.68 2k2n s VAL 51 N 1.41 0.10 0.04 7.11 0.11 -1.21 0.58 120.40 128.53 2k2n s VAL 51 Ca -0.09 0.15 -0.01 0.00 -2.93 0.00 0.00 61.98 59.11 2k2n s VAL 51 Cb -0.04 -0.22 -0.03 0.00 -1.53 0.00 0.00 36.38 34.56 2k2n s VAL 51 CO -0.17 0.14 -0.02 -1.59 -3.33 0.00 0.00 175.10 170.13 2k2n s LYS 52 N 1.17 0.48 -0.15 1.54 -2.85 -1.08 -2.74 119.74 116.11 2k2n s LYS 52 Ca -0.08 -0.91 -0.08 0.00 -1.00 0.00 0.00 55.97 53.90 2k2n s LYS 52 Cb -0.13 0.17 -0.04 0.00 -2.06 0.00 0.00 37.83 35.76 2k2n s LYS 52 CO -0.02 -0.09 0.14 0.08 0.10 0.00 0.00 175.35 175.55 2k2n s VAL 53 N -2.73 5.47 -0.09 1.79 1.01 0.14 -2.72 120.40 123.26 2k2n s VAL 53 Ca -0.04 0.20 0.02 0.00 0.00 0.00 0.00 61.98 62.16 2k2n s VAL 53 Cb -0.01 -3.42 0.01 0.00 0.00 0.00 0.00 36.38 32.97 2k2n s VAL 53 CO -0.06 0.56 -0.14 -0.47 0.00 0.00 0.00 175.10 174.99 2k2n s TYR 54 N -0.55 1.77 -0.16 5.22 5.04 0.12 -3.41 117.35 125.38 2k2n s TYR 54 Ca 0.13 -0.76 -0.18 0.00 -2.44 0.00 0.00 57.07 53.82 2k2n s TYR 54 Cb -0.12 -1.28 -0.04 0.00 0.35 0.00 0.00 41.96 40.87 2k2n s TYR 54 CO 0.02 -0.39 0.47 1.03 -1.34 0.00 0.00 175.55 175.34 2k2n s ARG 55 N 0.85 4.27 -0.28 4.97 0.52 -1.23 0.22 118.95 128.27 2k2n s ARG 55 Ca -0.10 0.39 -0.20 0.00 -0.52 0.00 0.00 55.73 55.29 2k2n s ARG 55 Cb -0.15 -3.49 -0.01 0.00 0.52 0.00 0.00 34.95 31.82 2k2n s ARG 55 CO 0.01 0.04 0.64 0.12 0.02 0.00 0.00 175.30 176.13 2k2n s PHE 56 N 1.02 3.24 0.29 -0.53 5.36 -0.54 -3.51 117.98 123.30 2k2n s PHE 56 Ca 0.24 0.70 -0.09 0.00 -0.96 0.00 0.00 56.93 56.82 2k2n s PHE 56 Cb -0.15 -2.94 -0.07 0.00 -0.34 0.00 0.00 43.02 39.53 2k2n s PHE 56 CO 0.09 -0.42 0.61 0.16 -1.46 0.00 0.00 175.22 174.20 2k2n s ASP 57 N 1.57 6.56 0.62 6.13 -4.77 -1.26 -4.85 116.67 120.66 2k2n s ASP 57 Ca 0.26 0.92 0.40 0.00 -3.30 0.00 0.00 52.55 50.84 2k2n s ASP 57 Cb -0.15 -2.23 2.20 0.00 -1.09 0.00 0.00 42.92 41.65 2k2n s ASP 57 CO 0.10 -0.18 2.24 1.55 0.70 0.00 0.00 175.17 179.58 2k2n h PRO 58 N 2.01 0.00 0.00 2.11 0.13 -1.98 0.56 132.00 134.82 2k2n h PRO 58 Ca -0.47 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.63 2k2n h PRO 58 Cb 1.18 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 2k2n h PRO 58 CO 0.67 0.00 -0.37 0.93 -0.23 0.00 0.00 178.00 179.00 2k2n h GLU 59 N 0.00 0.00 0.00 0.86 5.08 -2.03 -3.47 114.58 115.02 2k2n h GLU 59 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2k2n h GLU 59 Cb 0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.31 2k2n h GLU 59 CO 0.00 0.11 0.00 0.41 -1.00 0.00 0.00 179.01 178.53 2k2n n GLY 60 N 1.16 2.33 0.00 -3.84 0.00 0.19 -4.53 105.19 100.48 2k2n n GLY 60 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2k2n n GLY 60 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2k2n n HIS 61 N -1.19 0.00 0.00 1.61 8.25 -1.26 -3.70 115.22 118.93 2k2n n HIS 61 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2k2n n HIS 61 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 2k2n n HIS 61 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2k2n n GLY 62 N 0.68 2.34 3.25 -1.41 0.00 -1.26 -4.61 105.19 104.18 2k2n n GLY 62 Ca 0.00 -1.82 -0.22 0.00 0.00 0.00 0.00 46.02 43.97 2k2n n GLY 62 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2k2n s THR 63 N -2.48 1.53 -0.43 2.61 -4.23 -1.23 -3.41 115.64 108.00 2k2n s THR 63 Ca 0.00 -1.44 -0.29 0.00 -1.18 0.00 0.00 61.69 58.78 2k2n s THR 63 Cb 0.00 -1.40 0.02 0.00 1.34 0.00 0.00 72.50 72.46 2k2n s THR 63 CO 0.00 -0.09 1.22 -0.69 -0.54 0.00 0.00 174.62 174.53 2k2n s VAL 64 N -1.16 4.14 -1.79 2.29 1.01 -1.24 -3.47 120.40 120.19 2k2n s VAL 64 Ca 0.04 1.20 0.15 0.00 0.00 0.00 0.00 61.98 63.37 2k2n s VAL 64 Cb -0.10 -4.43 0.09 0.00 0.00 0.00 0.00 36.38 31.94 2k2n s VAL 64 CO 0.03 -0.84 0.94 0.52 0.00 0.00 0.00 175.10 175.76 2k2n n VAL 65 N 6.76 0.00 -3.33 2.92 0.31 -1.22 -3.59 118.33 120.18 2k2n n VAL 65 Ca 0.14 -0.47 0.01 0.00 -0.01 0.00 0.00 64.34 64.01 2k2n n VAL 65 Cb 0.48 1.29 -0.03 0.00 -0.91 0.00 0.00 33.84 34.67 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 -1.39 -2.08 -0.05 3.52 0.00 -1.24 -3.82 121.76 116.70 2k2n s ALA 66 Ca 0.17 1.92 -0.03 0.00 0.00 0.00 0.00 51.96 54.01 2k2n s ALA 66 Cb 0.13 -1.99 0.03 0.00 0.00 0.00 0.00 23.12 21.28 2k2n s ALA 66 CO 0.23 -1.19 0.12 -2.00 0.00 0.00 0.00 175.76 172.93 2k2n s GLU 67 N 2.84 0.10 -0.01 0.00 2.12 -1.26 -0.69 118.70 121.80 2k2n s GLU 67 Ca 0.12 0.27 0.05 0.00 0.36 0.00 0.00 54.97 55.77 2k2n s GLU 67 Cb -0.14 -0.09 -0.01 0.00 0.26 0.00 0.00 34.13 34.15 2k2n s GLU 67 CO -0.20 -0.10 -0.15 0.00 -0.54 0.00 0.00 175.26 174.27 2k2n s ALA 68 N 0.71 1.24 0.03 6.30 0.00 -1.11 -4.77 121.76 124.16 2k2n s ALA 68 Ca -0.05 -0.63 0.02 0.00 0.00 0.00 0.00 51.96 51.30 2k2n s ALA 68 Cb -0.07 -0.32 -0.02 0.00 0.00 0.00 0.00 23.12 22.71 2k2n s ALA 68 CO -0.03 0.30 -0.08 -0.98 0.00 0.00 0.00 175.76 174.96 2k2n s ARG 69 N -0.32 0.56 0.38 0.00 1.70 -1.26 -3.34 118.95 116.66 2k2n s ARG 69 Ca 0.05 -0.66 0.14 0.00 -0.47 0.00 0.00 55.73 54.79 2k2n s ARG 69 Cb -0.06 -0.40 0.97 0.00 -0.57 0.00 0.00 34.95 34.89 2k2n s ARG 69 CO -0.00 0.08 1.82 0.78 -1.08 0.00 0.00 175.30 176.90 2k2n h GLY 70 N 4.81 1.23 0.00 3.88 0.00 -1.79 -3.47 103.07 107.73 2k2n h GLY 70 Ca -0.35 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 46.73 2k2n h GLY 70 CO 0.43 -0.04 0.00 0.61 0.00 0.00 0.00 176.54 177.54 2k2n n GLY 71 N -1.45 -0.54 0.00 4.60 0.00 -1.26 -4.92 105.19 101.62 2k2n n GLY 71 Ca 0.22 -0.89 0.02 0.00 0.00 0.00 0.00 46.02 45.37 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 0.25 -0.06 1.61 0.28 -1.26 -2.69 120.64 118.77 2k2n n GLU 72 Ca 0.00 0.00 -0.12 0.00 -0.16 0.00 0.00 57.16 56.88 2k2n n GLU 72 Cb 0.00 -1.28 -0.06 0.00 1.43 0.00 0.00 31.44 31.53 2k2n n GLU 72 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 177.13 176.88 2k2n h ARG 73 N 0.00 0.34 -4.98 3.44 2.43 -1.97 -3.41 114.38 110.23 2k2n h ARG 73 Ca 0.00 -0.12 -0.67 0.00 -0.81 0.00 0.00 59.98 58.38 2k2n h ARG 73 Cb 0.00 -0.03 -0.34 0.00 -0.42 0.00 0.00 29.97 29.18 2k2n h ARG 73 CO 0.00 0.57 -0.81 -0.51 -1.51 0.00 0.00 179.97 177.71 2k2n s LEU 74 N -9.44 2.69 0.85 3.80 1.43 -1.09 -5.11 118.68 111.79 2k2n s LEU 74 Ca -0.14 -0.84 -0.15 0.00 -1.03 0.00 0.00 54.13 51.97 2k2n s LEU 74 Cb 0.06 -1.55 -0.05 0.00 0.03 0.00 0.00 46.19 44.69 2k2n s LEU 74 CO 0.73 -0.07 0.14 -2.65 0.23 0.00 0.00 176.35 174.73 2k2n n PRO 75 N 4.60 -0.00 -3.56 1.29 -0.02 -1.26 -4.80 135.00 131.25 2k2n n PRO 75 Ca -0.18 0.03 -0.36 0.00 -2.02 0.00 0.00 63.50 60.97 2k2n n PRO 75 Cb 0.48 -1.59 -0.07 0.00 -0.02 0.00 0.00 33.50 32.29 2k2n n PRO 75 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2k2n s SER 76 N -1.53 6.41 -0.05 2.55 1.04 -1.26 -4.96 113.70 115.91 2k2n s SER 76 Ca 0.56 0.48 0.11 0.00 0.48 0.00 0.00 55.95 57.58 2k2n s SER 76 Cb -0.27 -2.17 0.41 0.00 0.10 0.00 0.00 66.02 64.08 2k2n s SER 76 CO 0.68 0.11 1.27 0.18 0.98 0.00 0.00 173.24 176.46 2k2n n LEU 77 N 3.55 2.78 -4.72 2.42 4.77 -1.26 -4.94 117.00 119.59 2k2n n LEU 77 Ca -0.12 -1.40 -0.42 0.00 -0.03 0.00 0.00 56.01 54.04 2k2n n LEU 77 Cb 0.52 -0.40 -0.03 0.00 -2.33 0.00 0.00 43.42 41.18 2k2n n LEU 77 CO 0.39 0.53 1.18 -0.22 -1.33 0.00 0.00 177.39 177.94 2k2n s LEU 78 N -1.20 4.37 0.00 2.23 2.96 -1.26 -2.21 118.68 123.56 2k2n s LEU 78 Ca 0.29 2.55 0.00 0.00 -0.22 0.00 0.00 54.13 56.75 2k2n s LEU 78 Cb 0.18 -3.59 0.00 0.00 0.50 0.00 0.00 46.19 43.28 2k2n s LEU 78 CO 0.16 -0.77 0.00 0.61 -1.32 0.00 0.00 176.35 175.02 2k2n n GLY 79 N 3.57 1.69 3.83 7.98 0.00 -1.24 -5.03 105.19 115.99 2k2n n GLY 79 Ca 0.13 0.00 -0.33 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 4.09 -0.13 0.99 1.43 -0.94 -4.88 118.68 119.23 2k2n s LEU 80 Ca 0.00 1.45 -0.04 0.00 -1.03 0.00 0.00 54.13 54.50 2k2n s LEU 80 Cb 0.00 -4.14 -0.04 0.00 0.03 0.00 0.00 46.19 42.05 2k2n s LEU 80 CO 0.00 -0.21 0.03 0.42 0.23 0.00 0.00 176.35 176.83 2k2n s THR 81 N -1.95 4.56 0.30 5.49 -4.23 -1.26 -3.61 115.64 114.94 2k2n s THR 81 Ca 0.55 -0.14 -0.11 0.00 -1.18 0.00 0.00 61.69 60.81 2k2n s THR 81 Cb -0.11 -2.98 -0.07 0.00 1.34 0.00 0.00 72.50 70.67 2k2n s THR 81 CO 0.17 0.55 0.65 -0.36 -0.54 0.00 0.00 174.62 175.09 2k2n s PHE 82 N -0.36 3.42 0.33 3.99 0.40 -1.22 -5.03 117.98 119.51 2k2n s PHE 82 Ca 0.08 0.98 -0.29 0.00 -0.60 0.00 0.00 56.93 57.10 2k2n s PHE 82 Cb -0.12 -2.36 -0.11 0.00 0.51 0.00 0.00 43.02 40.94 2k2n s PHE 82 CO 0.02 0.13 1.44 -1.25 0.70 0.00 0.00 175.22 176.25 2k2n s PRO 83 N -3.16 4.22 0.11 0.24 0.04 -1.26 -4.48 135.00 130.70 2k2n s PRO 83 Ca 0.50 2.41 -0.31 0.00 0.04 0.00 0.00 61.00 63.64 2k2n s PRO 83 Cb -0.11 -3.03 -0.09 0.00 0.04 0.00 0.00 34.50 31.31 2k2n s PRO 83 CO 0.23 -0.42 1.52 0.00 0.04 0.00 0.00 177.00 178.38 2k2n s ALA 84 N -0.76 3.68 0.00 8.56 0.00 -1.26 -2.25 121.76 129.73 2k2n s ALA 84 Ca 0.54 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.71 2k2n s ALA 84 Cb -0.44 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.07 2k2n s ALA 84 CO 0.54 -0.83 0.00 0.41 0.00 0.00 0.00 175.76 175.88 2k2n n GLY 85 N 3.73 0.57 0.37 0.00 0.00 -1.24 -4.89 105.19 103.72 2k2n n GLY 85 Ca 0.14 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.25 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 0.72 -3.35 1.61 3.58 -1.68 -3.37 116.42 113.93 2k2n h ASP 86 Ca 0.00 0.03 -0.57 0.00 0.42 0.00 0.00 57.03 56.91 2k2n h ASP 86 Cb 0.00 -0.12 -0.06 0.00 1.72 0.00 0.00 39.33 40.87 2k2n h ASP 86 CO 0.00 0.41 0.94 -0.63 -2.88 0.00 0.00 179.24 177.08 2k2n s ILE 87 N -5.74 4.21 0.54 2.25 -1.09 -1.26 -5.01 121.20 115.10 2k2n s ILE 87 Ca -0.10 1.33 -0.05 0.00 -2.23 0.00 0.00 60.65 59.60 2k2n s ILE 87 Cb 0.21 -4.34 0.08 0.00 -1.58 0.00 0.00 42.46 36.83 2k2n s ILE 87 CO 0.79 -0.65 0.19 -2.65 -1.23 0.00 0.00 174.94 171.39 2k2n n PRO 88 N 7.45 -0.01 -0.11 2.79 -0.02 -1.26 -4.91 135.00 138.93 2k2n n PRO 88 Ca 0.14 -0.32 -0.24 0.00 -2.02 0.00 0.00 63.50 61.05 2k2n n PRO 88 Cb 0.47 -0.84 -0.08 0.00 -0.02 0.00 0.00 33.50 33.03 2k2n n PRO 88 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2k2n n GLU 89 N -0.26 0.49 -0.17 -0.52 1.02 -1.26 -4.11 120.64 115.82 2k2n n GLU 89 Ca 0.03 0.21 -0.09 0.00 -0.02 0.00 0.00 57.16 57.29 2k2n n GLU 89 Cb 0.13 -1.32 0.04 0.00 -0.02 0.00 0.00 31.44 30.27 2k2n n GLU 89 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 2k2n h GLU 90 N -0.77 0.99 0.10 3.49 4.81 -2.00 -3.04 114.58 118.17 2k2n h GLU 90 Ca -0.58 -0.35 -0.01 0.00 -0.13 0.00 0.00 59.36 58.30 2k2n h GLU 90 Cb 1.53 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.83 2k2n h GLU 90 CO -0.34 1.02 -0.05 0.00 -0.73 0.00 0.00 179.01 178.92 2k2n h ALA 91 N 1.00 -0.14 -0.99 2.92 0.00 -1.97 -3.09 119.26 116.99 2k2n h ALA 91 Ca 0.14 -0.20 0.15 0.00 0.00 0.00 0.00 54.91 55.01 2k2n h ALA 91 Cb 0.63 0.05 -0.09 0.00 0.00 0.00 0.00 17.79 18.39 2k2n h ALA 91 CO 0.04 -0.38 0.62 -0.09 0.00 0.00 0.00 179.25 179.44 2k2n h ARG 92 N -0.54 0.85 -0.26 0.00 2.43 -1.71 0.13 114.38 115.28 2k2n h ARG 92 Ca -0.01 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.07 2k2n h ARG 92 Cb 0.44 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 2k2n h ARG 92 CO 0.02 0.56 0.02 0.00 -1.51 0.00 0.00 179.97 179.06 2k2n h ARG 93 N 0.88 0.37 -0.23 0.20 3.08 -1.53 -2.02 114.38 115.13 2k2n h ARG 93 Ca 0.52 -0.06 -0.15 0.00 0.07 0.00 0.00 59.98 60.37 2k2n h ARG 93 Cb 0.67 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.65 2k2n h ARG 93 CO -0.30 0.39 -0.46 -0.07 -1.07 0.00 0.00 179.97 178.47 2k2n h LEU 94 N 0.37 0.65 -2.01 3.04 3.38 -0.69 -2.19 115.31 117.86 2k2n h LEU 94 Ca 0.09 -0.31 0.01 0.00 0.09 0.00 0.00 57.88 57.76 2k2n h LEU 94 Cb 0.22 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 2k2n h LEU 94 CO 0.00 1.01 0.03 -0.26 0.09 0.00 0.00 178.44 179.31 2k2n h PHE 95 N 0.48 0.00 0.00 1.13 -1.00 -0.69 1.08 116.94 117.95 2k2n h PHE 95 Ca 0.03 0.00 -0.14 0.00 2.81 0.00 0.00 57.97 60.67 2k2n h PHE 95 Cb 0.98 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.52 2k2n h PHE 95 CO 0.04 0.00 -0.85 -0.09 -1.61 0.00 0.00 178.31 175.80 2k2n h ARG 96 N 0.00 0.00 0.02 1.51 2.43 -1.25 -3.16 114.38 113.92 2k2n h ARG 96 Ca 0.02 0.00 -0.40 0.00 -0.81 0.00 0.00 59.98 58.79 2k2n h ARG 96 Cb 0.07 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.56 2k2n h ARG 96 CO -0.00 0.49 -2.29 1.28 -1.51 0.00 0.00 179.97 177.94 2k2n n LEU 97 N -3.13 2.37 -0.08 3.80 4.77 -0.18 -4.45 117.00 120.10 2k2n n LEU 97 Ca -0.02 0.17 0.03 0.00 -0.03 0.00 0.00 56.01 56.16 2k2n n LEU 97 Cb 0.79 -0.91 -0.01 0.00 -2.33 0.00 0.00 43.42 40.96 2k2n n LEU 97 CO 0.42 0.69 0.11 0.00 -1.33 0.00 0.00 177.39 177.28 2k2n n ALA 98 N -3.65 2.64 -3.53 -1.18 0.00 0.36 -5.05 120.51 110.10 2k2n n ALA 98 Ca -0.46 -0.29 -0.36 0.00 0.00 0.00 0.00 53.44 52.34 2k2n n ALA 98 Cb 0.91 -0.20 0.03 0.00 0.00 0.00 0.00 19.45 20.19 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 -1.89 0.00 0.00 1.13 -1.12 -4.96 117.38 109.91 2k2n n GLN 99 Ca 0.02 1.35 0.00 0.00 -1.94 0.00 0.00 57.00 56.43 2k2n n GLN 99 Cb 0.11 -2.26 0.00 0.00 0.11 0.00 0.00 30.24 28.20 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 -0.60 0.00 -3.64 5.09 3.14 -1.26 -4.95 118.33 116.10 2k2n n VAL 100 Ca -0.12 0.00 -0.02 0.00 -2.96 0.00 0.00 64.34 61.24 2k2n n VAL 100 Cb 0.68 0.00 -0.07 0.00 -1.06 0.00 0.00 33.84 33.39 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 0.36 0.07 1.45 1.81 -1.25 -4.86 118.95 116.53 2k2n s ARG 101 Ca 0.00 0.62 -0.09 0.00 -1.72 0.00 0.00 55.73 54.53 2k2n s ARG 101 Cb 0.00 0.08 0.00 0.00 -0.45 0.00 0.00 34.95 34.58 2k2n s ARG 101 CO 0.00 -0.07 0.20 0.14 -0.68 0.00 0.00 175.30 174.88 2k2n s VAL 102 N 1.26 0.13 -0.13 3.52 -7.23 -1.26 -2.19 120.40 114.48 2k2n s VAL 102 Ca -0.08 -1.03 -0.03 0.00 -1.81 0.00 0.00 61.98 59.03 2k2n s VAL 102 Cb -0.04 -1.14 -0.03 0.00 0.56 0.00 0.00 36.38 35.74 2k2n s VAL 102 CO -0.14 -0.57 -0.03 -0.63 -0.31 0.00 0.00 175.10 173.42 2k2n s ILE 103 N -3.25 4.00 0.38 -0.62 1.01 0.24 -4.97 121.20 117.99 2k2n s ILE 103 Ca 0.00 -0.33 -0.01 0.00 0.00 0.00 0.00 60.65 60.31 2k2n s ILE 103 Cb 0.02 -2.73 -0.03 0.00 0.01 0.00 0.00 42.46 39.73 2k2n s ILE 103 CO -0.08 0.52 0.61 0.54 0.00 0.00 0.00 174.94 176.54 2k2n s VAL 104 N -0.01 5.05 -0.36 2.92 0.11 -1.26 -2.42 120.40 124.43 2k2n s VAL 104 Ca 0.01 -0.29 -0.42 0.00 -2.93 0.00 0.00 61.98 58.35 2k2n s VAL 104 Cb -0.13 -3.86 -0.17 0.00 -1.53 0.00 0.00 36.38 30.69 2k2n s VAL 104 CO 0.02 -0.63 1.72 -0.90 -3.33 0.00 0.00 175.10 171.98 2k2n n ASP 105 N -1.90 1.97 0.33 3.54 5.68 -1.25 -4.56 116.55 120.35 2k2n n ASP 105 Ca -0.03 1.09 0.15 0.00 -0.50 0.00 0.00 54.79 55.50 2k2n n ASP 105 Cb 0.56 -1.05 0.80 0.00 -1.14 0.00 0.00 41.12 40.29 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 5.23 0.00 -0.27 2.12 3.04 -1.75 0.27 116.25 124.89 2k2n h VAL 106 Ca -0.45 0.00 -0.02 0.00 -1.01 0.00 0.00 66.70 65.22 2k2n h VAL 106 Cb 1.34 0.65 -0.01 0.00 -2.01 0.00 0.00 31.29 31.26 2k2n h VAL 106 CO 0.97 0.00 0.08 -0.08 -1.01 0.00 0.00 177.57 177.53 2k2n h GLU 107 N 0.00 0.43 0.00 4.17 4.81 -1.88 -0.61 114.58 121.50 2k2n h GLU 107 Ca 0.00 -0.10 0.00 0.00 -0.13 0.00 0.00 59.36 59.13 2k2n h GLU 107 Cb 0.66 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.98 2k2n h GLU 107 CO 0.00 0.50 0.00 0.00 -0.73 0.00 0.00 179.01 178.78 2k2n n ALA 108 N -2.29 1.32 -3.63 2.92 0.00 0.08 -4.90 120.51 114.01 2k2n n ALA 108 Ca -0.03 0.10 -0.20 0.00 0.00 0.00 0.00 53.44 53.32 2k2n n ALA 108 Cb 0.17 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.33 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 -2.06 -1.52 -2.47 0.00 -0.06 -0.24 -4.90 117.38 106.13 2k2n n GLN 109 Ca 0.01 0.94 -0.42 0.00 -2.00 0.00 0.00 57.00 55.52 2k2n n GLN 109 Cb 0.11 -3.00 -0.03 0.00 -4.06 0.00 0.00 30.24 23.26 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 -2.95 7.14 -0.07 1.69 0.15 -1.26 -5.02 113.70 113.39 2k2n s SER 110 Ca 0.01 2.00 0.05 0.00 0.70 0.00 0.00 55.95 58.71 2k2n s SER 110 Cb -0.00 -2.58 -0.01 0.00 -1.71 0.00 0.00 66.02 61.71 2k2n s SER 110 CO 0.87 -0.40 -0.23 -0.60 1.20 0.00 0.00 173.24 174.08 2k2n s ARG 111 N 0.76 2.70 0.07 5.44 3.52 -1.26 -3.88 118.95 126.31 2k2n s ARG 111 Ca 0.56 -0.86 0.07 0.00 -0.13 0.00 0.00 55.73 55.37 2k2n s ARG 111 Cb -0.29 -2.25 -0.03 0.00 -1.56 0.00 0.00 34.95 30.83 2k2n s ARG 111 CO 0.30 0.36 -0.18 -1.12 -0.81 0.00 0.00 175.30 173.85 2k2n s SER 112 N -0.09 2.20 0.20 -2.12 0.01 -1.25 -4.66 113.70 107.97 2k2n s SER 112 Ca -0.05 -0.60 -0.09 0.00 1.31 0.00 0.00 55.95 56.51 2k2n s SER 112 Cb -0.14 -0.13 -0.01 0.00 0.21 0.00 0.00 66.02 65.95 2k2n s SER 112 CO 0.04 0.04 0.33 -0.63 0.41 0.00 0.00 173.24 173.43 2k2n s ILE 113 N -1.07 0.04 0.88 1.44 1.01 -1.26 -3.97 121.20 118.27 2k2n s ILE 113 Ca 0.04 -1.47 -0.10 0.00 0.00 0.00 0.00 60.65 59.12 2k2n s ILE 113 Cb -0.09 -2.04 0.12 0.00 0.01 0.00 0.00 42.46 40.46 2k2n s ILE 113 CO 0.03 -0.16 1.12 -0.94 0.00 0.00 0.00 174.94 174.99 2k2n s SER 114 N -3.01 3.35 0.05 3.58 1.04 -1.26 -5.06 113.70 112.40 2k2n s SER 114 Ca 0.22 1.97 0.02 0.00 0.48 0.00 0.00 55.95 58.64 2k2n s SER 114 Cb 0.03 -2.50 -0.03 0.00 0.10 0.00 0.00 66.02 63.61 2k2n s SER 114 CO 0.04 -2.79 -0.08 -1.10 0.98 0.00 0.00 173.24 170.29 2k2n s GLN 115 N -4.74 0.61 0.50 4.02 1.11 -1.26 -5.00 119.66 114.89 2k2n s GLN 115 Ca 0.65 -0.88 0.21 0.00 0.01 0.00 0.00 55.36 55.35 2k2n s GLN 115 Cb -0.21 -0.30 0.73 0.00 -1.01 0.00 0.00 33.01 32.21 2k2n s GLN 115 CO 0.58 0.04 1.06 -2.30 0.01 0.00 0.00 175.29 174.68 2k2n n PRO 116 N 1.15 0.01 -4.23 2.91 -0.02 -1.26 -4.21 135.00 129.36 2k2n n PRO 116 Ca -0.21 0.84 -0.20 0.00 -2.02 0.00 0.00 63.50 61.91 2k2n n PRO 116 Cb 0.56 -2.09 -0.12 0.00 -0.02 0.00 0.00 33.50 31.83 2k2n n PRO 116 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2k2n s GLU 117 N -3.99 0.97 0.00 -0.52 0.41 -1.26 -5.12 118.70 109.18 2k2n s GLU 117 Ca -0.02 -1.10 0.00 0.00 -0.41 0.00 0.00 54.97 53.44 2k2n s GLU 117 Cb 0.11 -1.01 0.00 0.00 -1.78 0.00 0.00 34.13 31.45 2k2n s GLU 117 CO 0.37 0.22 0.00 -1.13 -0.49 0.00 0.00 175.26 174.23 2k2n n SER 118 N 0.99 0.00 -4.60 -0.19 3.41 -1.26 -4.78 113.62 107.19 2k2n n SER 118 Ca -0.19 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 57.99 2k2n n SER 118 Cb 0.55 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.49 2k2n n SER 118 CO 0.00 0.00 0.00 1.87 -0.16 0.00 0.00 175.04 176.75 2k2n n TRP 119 N 0.00 1.27 -4.15 7.33 -0.00 -1.26 -3.93 117.44 116.69 2k2n n TRP 119 Ca 0.00 0.63 0.00 0.00 -0.00 0.00 0.00 57.50 58.13 2k2n n TRP 119 Cb 0.00 -2.25 0.00 0.00 -0.00 0.00 0.00 31.31 29.06 2k2n n TRP 119 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 2k2n n GLY 120 N 1.18 -1.92 6.55 5.87 0.00 -1.26 -4.79 105.19 110.81 2k2n n GLY 120 Ca 0.09 -1.36 0.00 0.00 0.00 0.00 0.00 46.02 44.75 2k2n n GLY 120 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2k2n n LEU 121 N 0.00 0.00 -0.36 0.99 4.77 -1.19 0.14 117.00 121.34 2k2n n LEU 121 Ca 0.00 0.00 0.04 0.00 -0.03 0.00 0.00 56.01 56.02 2k2n n LEU 121 Cb 0.00 0.00 0.20 0.00 -2.33 0.00 0.00 43.42 41.29 2k2n n LEU 121 CO 0.00 0.00 1.26 -1.28 -1.33 0.00 0.00 177.39 176.04 2k2n h SER 122 N 0.00 1.00 0.28 -1.43 0.87 -1.86 2.16 113.55 114.56 2k2n h SER 122 Ca 0.00 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 2k2n h SER 122 Cb 0.00 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 61.77 2k2n h SER 122 CO 0.00 0.61 0.00 0.00 -0.53 0.00 0.00 176.83 176.91 2k2n n ALA 123 N -2.37 2.57 0.00 6.23 0.00 0.37 -4.48 120.51 122.83 2k2n n ALA 123 Ca 0.16 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2k2n n ALA 123 Cb 0.23 -1.50 0.00 0.00 0.00 0.00 0.00 19.45 18.18 2k2n n ALA 123 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2k2n n ARG 124 N -1.14 0.00 -2.09 0.00 0.63 0.12 -4.72 116.66 109.45 2k2n n ARG 124 Ca 0.19 0.00 -0.36 0.00 -0.92 0.00 0.00 57.85 56.76 2k2n n ARG 124 Cb 0.17 0.00 0.02 0.00 0.45 0.00 0.00 32.46 33.10 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 0.00 2.78 0.36 5.15 -7.23 0.69 -3.20 120.40 118.95 2k2n s VAL 125 Ca 0.00 0.51 -0.18 0.00 -1.81 0.00 0.00 61.98 60.50 2k2n s VAL 125 Cb 0.00 -3.22 -0.14 0.00 0.56 0.00 0.00 36.38 33.58 2k2n s VAL 125 CO 0.00 -0.08 0.06 -2.65 -0.31 0.00 0.00 175.10 172.12 2k2n n PRO 126 N -1.29 0.00 0.00 4.82 -0.02 -1.26 -3.00 135.00 134.25 2k2n n PRO 126 Ca 0.12 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.60 2k2n n PRO 126 Cb 0.49 -0.87 0.00 0.00 -0.02 0.00 0.00 33.50 33.10 2k2n n PRO 126 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2k2n n LEU 127 N 2.05 0.00 -0.44 2.45 4.77 -1.26 -4.87 117.00 119.70 2k2n n LEU 127 Ca 0.10 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 56.13 2k2n n LEU 127 Cb 0.35 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.41 2k2n n LEU 127 CO 0.48 0.00 -0.19 0.61 -1.33 0.00 0.00 177.39 176.95 2k2n n GLY 128 N 0.00 -2.77 0.00 -0.72 0.00 -1.16 -5.06 105.19 95.47 2k2n n GLY 128 Ca 0.00 -1.33 0.00 0.00 0.00 0.00 0.00 46.02 44.69 2k2n n GLY 128 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2k2n n GLU 129 N -2.76 0.00 -3.38 1.61 4.07 -1.26 -5.14 120.64 113.78 2k2n n GLU 129 Ca -0.03 0.00 -0.34 0.00 -0.06 0.00 0.00 57.16 56.74 2k2n n GLU 129 Cb 0.21 0.00 -0.06 0.00 -0.06 0.00 0.00 31.44 31.53 2k2n n GLU 129 CO 0.00 0.00 0.00 -1.25 -0.06 0.00 0.00 177.13 175.82 2k2n s PRO 130 N 0.00 3.90 -0.00 5.31 0.04 -1.26 -4.98 135.00 138.01 2k2n s PRO 130 Ca 0.00 0.40 0.16 0.00 0.04 0.00 0.00 61.00 61.60 2k2n s PRO 130 Cb 0.00 -2.80 0.46 0.00 0.04 0.00 0.00 34.50 32.20 2k2n s PRO 130 CO 0.00 0.40 1.38 1.28 0.04 0.00 0.00 177.00 180.11 2k2n n LEU 131 N 0.38 2.82 -4.54 -3.56 4.77 -1.26 -4.87 117.00 110.74 2k2n n LEU 131 Ca -0.03 -1.41 -0.14 0.00 -0.03 0.00 0.00 56.01 54.40 2k2n n LEU 131 Cb 0.52 -0.35 -0.10 0.00 -2.33 0.00 0.00 43.42 41.16 2k2n n LEU 131 CO 0.44 0.69 1.32 0.00 -1.33 0.00 0.00 177.39 178.51 2k2n n GLN 132 N 1.01 0.41 -3.67 3.23 1.13 -1.26 -4.79 117.38 113.44 2k2n n GLN 132 Ca 0.17 -0.80 -0.28 0.00 -1.94 0.00 0.00 57.00 54.16 2k2n n GLN 132 Cb 0.45 -3.27 -0.11 0.00 0.11 0.00 0.00 30.24 27.42 2k2n n GLN 132 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 2k2n s ARG 133 N 8.52 1.65 0.52 -1.09 0.52 -1.26 -5.12 118.95 122.69 2k2n s ARG 133 Ca 0.96 -2.61 -0.19 0.00 -0.52 0.00 0.00 55.73 53.36 2k2n s ARG 133 Cb -0.23 -2.46 -0.11 0.00 0.52 0.00 0.00 34.95 32.68 2k2n s ARG 133 CO 0.16 -1.30 0.43 -2.30 0.02 0.00 0.00 175.30 172.32 2k2n n PRO 134 N 2.62 0.46 -3.47 3.54 -0.02 -1.26 -4.94 135.00 131.93 2k2n n PRO 134 Ca 0.21 0.17 -0.41 0.00 -2.02 0.00 0.00 63.50 61.46 2k2n n PRO 134 Cb 0.40 -1.55 -0.10 0.00 -0.02 0.00 0.00 33.50 32.23 2k2n n PRO 134 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2k2n s VAL 135 N -1.70 5.23 0.21 -1.45 -7.23 -1.25 -4.28 120.40 109.93 2k2n s VAL 135 Ca 0.65 -0.11 -0.29 0.00 -1.81 0.00 0.00 61.98 60.43 2k2n s VAL 135 Cb -0.49 -3.77 -0.16 0.00 0.56 0.00 0.00 36.38 32.51 2k2n s VAL 135 CO 0.57 -0.06 0.74 0.47 -0.31 0.00 0.00 175.10 176.52 2k2n n ASP 136 N 5.24 -0.23 -0.33 4.85 8.00 -1.25 -3.93 116.55 128.89 2k2n n ASP 136 Ca -0.11 1.15 0.19 0.00 0.71 0.00 0.00 54.79 56.73 2k2n n ASP 136 Cb 0.49 -1.07 0.38 0.00 -0.02 0.00 0.00 41.12 40.90 2k2n n ASP 136 CO 0.00 0.00 0.00 -0.65 -0.39 0.00 0.00 177.20 176.16 2k2n h PRO 137 N 1.58 0.02 -0.97 -0.24 0.11 -1.88 -1.64 132.00 128.98 2k2n h PRO 137 Ca -0.34 -0.00 0.22 0.00 0.11 0.00 0.00 66.00 65.99 2k2n h PRO 137 Cb 1.40 -0.00 -0.18 0.00 0.11 0.00 0.00 31.00 32.33 2k2n h PRO 137 CO 0.59 0.01 -0.13 0.00 -0.21 0.00 0.00 178.00 178.27 2k2n h HIS 139 N 0.01 0.00 0.26 0.00 -0.00 -1.61 -3.02 115.15 110.78 2k2n h HIS 139 Ca 0.51 0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 60.87 2k2n h HIS 139 Cb 0.91 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.32 2k2n h HIS 139 CO -0.64 0.72 -0.12 0.28 -0.00 0.00 0.00 177.93 178.16 2k2n h VAL 140 N 0.00 0.79 0.00 5.26 2.07 -0.22 -1.46 116.25 122.69 2k2n h VAL 140 Ca -0.03 -0.41 -0.05 0.00 0.82 0.00 0.00 66.70 67.03 2k2n h VAL 140 Cb 1.57 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 32.36 2k2n h VAL 140 CO 0.09 0.09 -0.26 -0.74 0.02 0.00 0.00 177.57 176.77 2k2n h HIS 141 N -0.56 0.00 -0.66 1.57 6.17 -1.34 -0.68 115.15 119.65 2k2n h HIS 141 Ca -0.04 0.00 0.01 0.00 0.71 0.00 0.00 60.37 61.06 2k2n h HIS 141 Cb 0.41 0.00 -0.03 0.00 2.52 0.00 0.00 27.41 30.30 2k2n h HIS 141 CO -0.00 0.26 0.44 -0.92 0.71 0.00 0.00 177.93 178.41 2k2n h TYR 142 N 0.00 0.82 -0.19 5.26 3.20 -1.35 0.09 116.97 124.81 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 0.48 -0.28 0.01 0.00 1.54 0.00 0.00 36.73 38.48 2k2n h TYR 142 CO 0.00 0.51 -0.70 -0.07 -1.64 0.00 0.00 178.16 176.26 2k2n h LEU 143 N 0.88 0.89 -1.12 2.82 3.38 -0.67 -2.62 115.31 118.87 2k2n h LEU 143 Ca 0.25 -0.55 0.21 0.00 0.09 0.00 0.00 57.88 57.88 2k2n h LEU 143 Cb -0.08 -0.26 -0.10 0.00 0.09 0.00 0.00 40.66 40.31 2k2n h LEU 143 CO -0.06 1.34 0.62 0.50 0.09 0.00 0.00 178.44 180.92 2k2n h LYS 144 N 0.55 0.63 0.00 1.13 1.63 -0.52 2.84 116.57 122.83 2k2n h LYS 144 Ca -0.03 -0.04 -0.03 0.00 -0.85 0.00 0.00 60.65 59.71 2k2n h LYS 144 Cb 1.31 -0.14 -0.00 0.00 -0.60 0.00 0.00 32.23 32.79 2k2n h LYS 144 CO 0.14 0.42 -0.13 0.77 -3.45 0.00 0.00 179.45 177.20 2k2n h SER 145 N 0.65 0.00 0.06 4.20 0.02 -0.63 -0.65 113.55 117.20 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 1.04 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.58 2k2n h SER 145 CO -0.35 0.13 -0.13 0.23 -1.14 0.00 0.00 176.83 175.58 2k2n n MET 146 N -3.59 1.46 -1.23 3.45 2.81 0.92 -4.92 117.12 116.01 2k2n n MET 146 Ca -0.01 -0.95 -0.08 0.00 -1.81 0.00 0.00 57.70 54.84 2k2n n MET 146 Cb 0.27 -1.48 -0.03 0.00 -0.71 0.00 0.00 33.22 31.26 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 1.27 0.99 3.70 3.03 0.00 0.46 -5.01 105.19 109.64 2k2n n GLY 147 Ca 0.15 -0.64 -0.33 0.00 0.00 0.00 0.00 46.02 45.20 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 -2.28 4.32 -0.14 1.61 1.01 -0.90 -4.40 120.40 119.62 2k2n s VAL 148 Ca 0.00 -0.49 -0.02 0.00 0.00 0.00 0.00 61.98 61.47 2k2n s VAL 148 Cb 0.00 -2.91 -0.08 0.00 0.00 0.00 0.00 36.38 33.39 2k2n s VAL 148 CO 0.00 0.42 -0.14 0.00 0.00 0.00 0.00 175.10 175.37 2k2n n ALA 149 N 1.50 1.85 -3.78 5.51 0.00 -0.76 -3.95 120.51 120.88 2k2n n ALA 149 Ca -0.15 -0.57 -0.23 0.00 0.00 0.00 0.00 53.44 52.48 2k2n n ALA 149 Cb 0.53 0.24 -0.17 0.00 0.00 0.00 0.00 19.45 20.04 2k2n n ALA 149 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2k2n s SER 150 N -5.69 1.62 -0.01 0.00 0.15 -0.98 -2.09 113.70 106.71 2k2n s SER 150 Ca -0.19 -0.13 0.03 0.00 0.70 0.00 0.00 55.95 56.37 2k2n s SER 150 Cb 0.06 -0.51 -0.03 0.00 -1.71 0.00 0.00 66.02 63.83 2k2n s SER 150 CO 0.29 -0.17 -0.09 -0.55 1.20 0.00 0.00 173.24 173.92 2k2n s SER 151 N 1.82 4.43 -0.04 5.45 0.15 -1.02 -2.47 113.70 122.02 2k2n s SER 151 Ca 0.03 -0.17 0.05 0.00 0.70 0.00 0.00 55.95 56.57 2k2n s SER 151 Cb -0.12 -1.00 -0.02 0.00 -1.71 0.00 0.00 66.02 63.16 2k2n s SER 151 CO -0.05 0.30 -0.19 -0.22 1.20 0.00 0.00 173.24 174.28 2k2n s LEU 152 N -1.21 2.47 -0.12 3.45 2.96 -1.04 0.80 118.68 125.99 2k2n s LEU 152 Ca 0.15 -0.31 -0.00 0.00 -0.22 0.00 0.00 54.13 53.75 2k2n s LEU 152 Cb -0.11 -1.47 0.02 0.00 0.50 0.00 0.00 46.19 45.13 2k2n s LEU 152 CO 0.05 0.33 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.63 2k2n s VAL 153 N -0.64 1.11 -0.14 1.68 1.01 -0.93 -1.12 120.40 121.37 2k2n s VAL 153 Ca 0.10 -0.34 0.00 0.00 0.00 0.00 0.00 61.98 61.74 2k2n s VAL 153 Cb -0.11 -1.10 0.02 0.00 0.00 0.00 0.00 36.38 35.19 2k2n s VAL 153 CO 0.00 0.38 -0.12 -0.69 0.00 0.00 0.00 175.10 174.67 2k2n s VAL 154 N 1.64 1.40 -0.04 2.92 1.01 -1.16 -3.82 120.40 122.35 2k2n s VAL 154 Ca 0.04 -0.52 -0.30 0.00 0.00 0.00 0.00 61.98 61.20 2k2n s VAL 154 Cb -0.13 -1.34 -0.04 0.00 0.00 0.00 0.00 36.38 34.87 2k2n s VAL 154 CO -0.08 0.43 1.33 -2.16 0.00 0.00 0.00 175.10 174.62 2k2n s PRO 155 N 1.56 4.30 -0.96 2.72 0.04 -1.26 -3.70 135.00 137.69 2k2n s PRO 155 Ca 0.05 1.84 -0.00 0.00 0.04 0.00 0.00 61.00 62.93 2k2n s PRO 155 Cb -0.13 -3.61 0.33 0.00 0.04 0.00 0.00 34.50 31.13 2k2n s PRO 155 CO -0.10 -0.56 1.75 1.28 0.04 0.00 0.00 177.00 179.41 2k2n n LEU 156 N 5.54 7.05 0.00 -3.56 4.32 -1.26 -4.89 117.00 124.19 2k2n n LEU 156 Ca 0.13 -5.37 -0.00 0.00 -0.02 0.00 0.00 56.01 50.74 2k2n n LEU 156 Cb 0.45 -1.09 -0.00 0.00 -1.62 0.00 0.00 43.42 41.16 2k2n n LEU 156 CO 0.57 2.06 0.00 1.15 -1.22 0.00 0.00 177.39 179.95 2k2n n MET 157 N -0.13 0.01 -1.88 3.23 0.00 -1.26 -4.47 117.12 112.62 2k2n n MET 157 Ca 0.46 -0.04 -0.28 0.00 0.00 0.00 0.00 57.70 57.83 2k2n n MET 157 Cb 0.28 0.04 0.20 0.00 0.00 0.00 0.00 33.22 33.74 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 -0.01 -3.96 0.02 3.17 -0.00 -0.84 -5.00 115.22 108.61 2k2n n HIS 158 Ca 0.00 -1.17 -0.10 0.00 0.46 0.00 0.00 57.72 56.91 2k2n n HIS 158 Cb 0.01 -0.99 -0.08 0.00 -0.12 0.00 0.00 29.99 28.81 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 -1.71 -0.13 -0.57 1.57 2.76 -1.96 -3.36 115.15 111.75 2k2n h HIS 159 Ca -0.42 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.75 2k2n h HIS 159 Cb 1.16 0.04 0.00 0.00 1.55 0.00 0.00 27.41 30.16 2k2n h HIS 159 CO 0.00 0.36 0.00 1.04 -1.30 0.00 0.00 177.93 178.03 2k2n n GLN 160 N -4.85 3.28 -3.79 5.26 6.02 -1.26 -4.56 117.38 117.47 2k2n n GLN 160 Ca -0.07 -2.67 -0.13 0.00 -0.01 0.00 0.00 57.00 54.12 2k2n n GLN 160 Cb 0.27 -1.70 -0.12 0.00 1.02 0.00 0.00 30.24 29.72 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 -1.60 0.27 -0.22 -1.09 2.56 -1.26 -5.06 118.70 112.31 2k2n s GLU 161 Ca 0.44 0.31 -0.03 0.00 0.00 0.00 0.00 54.97 55.68 2k2n s GLU 161 Cb 0.27 0.13 -0.00 0.00 2.00 0.00 0.00 34.13 36.53 2k2n s GLU 161 CO 0.23 -0.03 -0.05 -0.51 -0.56 0.00 0.00 175.26 174.33 2k2n s LEU 162 N 0.09 2.87 -0.12 2.70 1.02 -1.26 -1.99 118.68 121.99 2k2n s LEU 162 Ca -0.00 -0.44 0.04 0.00 0.02 0.00 0.00 54.13 53.74 2k2n s LEU 162 Cb -0.02 -1.72 -0.24 0.00 0.02 0.00 0.00 46.19 44.24 2k2n s LEU 162 CO 0.00 -0.03 0.37 0.79 0.02 0.00 0.00 176.35 177.50 2k2n n TRP 163 N 4.78 0.89 -3.72 0.29 7.02 -1.26 -4.79 117.44 120.65 2k2n n TRP 163 Ca -0.18 0.24 -0.05 0.00 -1.02 0.00 0.00 57.50 56.49 2k2n n TRP 163 Cb 0.51 -1.14 0.02 0.00 -2.42 0.00 0.00 31.31 28.28 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 1.85 0.97 2.84 6.99 0.00 -1.26 -1.47 105.19 115.12 2k2n n GLY 164 Ca -0.29 -1.16 -0.15 0.00 0.00 0.00 0.00 46.02 44.42 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 1.44 -0.16 0.99 1.43 0.58 -4.41 118.68 118.56 2k2n s LEU 165 Ca 0.15 -0.02 -0.07 0.00 -1.03 0.00 0.00 54.13 53.17 2k2n s LEU 165 Cb -0.03 -0.15 -0.04 0.00 0.03 0.00 0.00 46.19 45.99 2k2n s LEU 165 CO 0.07 -0.06 0.09 -0.22 0.23 0.00 0.00 176.35 176.46 2k2n s LEU 166 N 0.66 4.02 -0.01 1.79 2.96 -1.24 -0.70 118.68 126.15 2k2n s LEU 166 Ca -0.06 0.23 0.00 0.00 -0.22 0.00 0.00 54.13 54.08 2k2n s LEU 166 Cb -0.09 -2.00 0.01 0.00 0.50 0.00 0.00 46.19 44.61 2k2n s LEU 166 CO -0.01 0.27 -0.00 0.54 -1.32 0.00 0.00 176.35 175.82 2k2n s VAL 167 N -0.17 0.09 -0.08 1.68 0.11 -1.10 -2.96 120.40 117.96 2k2n s VAL 167 Ca 0.09 0.04 -0.00 0.00 -2.93 0.00 0.00 61.98 59.18 2k2n s VAL 167 Cb -0.12 -0.14 -0.03 0.00 -1.53 0.00 0.00 36.38 34.56 2k2n s VAL 167 CO 0.01 0.07 -0.05 -0.44 -3.33 0.00 0.00 175.10 171.36 2k2n s SER 168 N 0.49 4.79 -0.25 3.54 0.01 -0.27 -2.65 113.70 119.36 2k2n s SER 168 Ca -0.04 0.01 -0.06 0.00 1.31 0.00 0.00 55.95 57.16 2k2n s SER 168 Cb -0.07 -1.29 -0.02 0.00 0.21 0.00 0.00 66.02 64.86 2k2n s SER 168 CO -0.01 0.35 0.04 -1.00 0.41 0.00 0.00 173.24 173.03 2k2n s HIS 169 N -0.73 3.05 -0.23 2.43 3.76 0.20 -2.49 115.29 121.29 2k2n s HIS 169 Ca 0.11 -0.66 0.02 0.00 -0.15 0.00 0.00 55.06 54.39 2k2n s HIS 169 Cb -0.11 -2.20 0.04 0.00 1.11 0.00 0.00 32.58 31.42 2k2n s HIS 169 CO 0.02 -0.45 -0.14 -1.01 -0.85 0.00 0.00 174.74 172.31 2k2n s HIS 170 N 1.56 3.00 -0.40 1.40 3.76 -1.03 -3.15 115.29 120.42 2k2n s HIS 170 Ca 0.06 -2.01 0.26 0.00 -0.15 0.00 0.00 55.06 53.22 2k2n s HIS 170 Cb -0.15 -1.89 1.00 0.00 1.11 0.00 0.00 32.58 32.66 2k2n s HIS 170 CO 0.01 -0.84 1.78 0.00 -0.85 0.00 0.00 174.74 174.84 2k2n h ALA 171 N 7.85 1.00 -2.74 -1.40 0.00 -1.86 -1.93 119.26 120.19 2k2n h ALA 171 Ca -0.29 0.00 -0.51 0.00 0.00 0.00 0.00 54.91 54.11 2k2n h ALA 171 Cb 1.08 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.88 2k2n h ALA 171 CO 0.52 0.00 0.47 -1.21 0.00 0.00 0.00 179.25 179.04 2k2n s GLU 172 N -3.35 4.62 0.00 0.00 2.02 -1.26 -4.32 118.70 116.41 2k2n s GLU 172 Ca 0.05 1.76 0.00 0.00 0.02 0.00 0.00 54.97 56.80 2k2n s GLU 172 Cb 0.09 -3.23 0.00 0.00 0.10 0.00 0.00 34.13 31.09 2k2n s GLU 172 CO 0.47 0.15 0.81 -0.35 0.02 0.00 0.00 175.26 176.37 2k2n n PRO 173 N 1.76 0.85 -2.21 0.39 -0.04 -1.26 -4.16 135.00 130.32 2k2n n PRO 173 Ca 0.01 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 63.11 2k2n n PRO 173 Cb 0.45 -1.03 0.00 0.00 -0.04 0.00 0.00 33.50 32.88 2k2n n PRO 173 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2k2n s ARG 174 N -1.92 3.46 0.77 0.54 0.52 -1.26 -4.66 118.95 116.39 2k2n s ARG 174 Ca 0.00 1.73 -0.11 0.00 -0.52 0.00 0.00 55.73 56.83 2k2n s ARG 174 Cb 0.00 -2.16 0.05 0.00 0.52 0.00 0.00 34.95 33.36 2k2n s ARG 174 CO 0.00 -0.79 1.08 -1.25 0.02 0.00 0.00 175.30 174.36 2k2n s PRO 175 N -3.04 2.35 0.13 3.54 0.04 -1.26 -4.58 135.00 132.18 2k2n s PRO 175 Ca 0.70 0.90 -0.30 0.00 0.04 0.00 0.00 61.00 62.33 2k2n s PRO 175 Cb -0.27 -1.93 -0.07 0.00 0.04 0.00 0.00 34.50 32.27 2k2n s PRO 175 CO 0.32 -1.50 1.14 1.52 0.04 0.00 0.00 177.00 178.51 2k2n s TYR 176 N -3.03 3.52 0.07 0.56 1.13 -1.26 -5.04 117.35 113.30 2k2n s TYR 176 Ca 0.60 1.48 0.06 0.00 -1.41 0.00 0.00 57.07 57.80 2k2n s TYR 176 Cb -0.15 -3.34 -0.04 0.00 -1.10 0.00 0.00 41.96 37.33 2k2n s TYR 176 CO 0.55 -0.88 -0.09 -1.12 -2.51 0.00 0.00 175.55 171.50 2k2n s SER 177 N 0.35 4.43 0.54 -0.18 0.01 -1.26 -5.00 113.70 112.58 2k2n s SER 177 Ca 0.53 -0.32 0.21 0.00 1.31 0.00 0.00 55.95 57.68 2k2n s SER 177 Cb -0.30 -0.90 1.46 0.00 0.21 0.00 0.00 66.02 66.50 2k2n s SER 177 CO 0.33 0.21 2.18 -0.61 0.41 0.00 0.00 173.24 175.77 2k2n h GLN 178 N 3.94 0.00 -0.68 12.44 4.15 -2.00 -2.13 115.11 130.82 2k2n h GLN 178 Ca -0.48 0.00 0.08 0.00 0.77 0.00 0.00 58.65 59.01 2k2n h GLN 178 Cb 1.17 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 28.79 2k2n h GLN 178 CO 0.52 0.00 0.35 1.49 -1.93 0.00 0.00 178.83 179.27 2k2n h GLU 179 N 0.00 0.61 -0.52 1.69 4.22 -2.00 -0.50 114.58 118.08 2k2n h GLU 179 Ca 0.00 -0.04 -0.04 0.00 0.08 0.00 0.00 59.36 59.37 2k2n h GLU 179 Cb 0.02 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 2k2n h GLU 179 CO -0.00 0.40 0.14 0.93 -2.18 0.00 0.00 179.01 178.31 2k2n h GLU 180 N 0.62 0.78 -0.68 1.92 5.08 -1.80 -2.53 114.58 117.97 2k2n h GLU 180 Ca 0.33 -0.14 -0.02 0.00 -1.00 0.00 0.00 59.36 58.52 2k2n h GLU 180 Cb 0.29 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.39 2k2n h GLU 180 CO -0.23 0.69 0.34 1.25 -1.00 0.00 0.00 179.01 180.05 2k2n h LEU 181 N 0.76 0.88 -1.63 1.33 5.85 -1.14 -2.33 115.31 119.03 2k2n h LEU 181 Ca 0.17 -0.13 0.11 0.00 0.84 0.00 0.00 57.88 58.88 2k2n h LEU 181 Cb 0.25 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.01 2k2n h LEU 181 CO -0.01 0.76 0.43 1.56 -0.34 0.00 0.00 178.44 180.84 2k2n h GLN 182 N 0.94 0.39 0.44 1.25 1.08 -0.85 0.23 115.11 118.61 2k2n h GLN 182 Ca 0.24 -0.02 -0.02 0.00 -1.45 0.00 0.00 58.65 57.39 2k2n h GLN 182 Cb 0.10 -0.09 0.00 0.00 -0.05 0.00 0.00 27.48 27.45 2k2n h GLN 182 CO -0.03 0.26 -0.21 0.28 -0.95 0.00 0.00 178.83 178.18 2k2n h VAL 183 N 0.41 0.41 0.01 -0.54 2.07 -1.33 -3.27 116.25 114.00 2k2n h VAL 183 Ca 0.30 -0.52 -0.20 0.00 0.82 0.00 0.00 66.70 67.09 2k2n h VAL 183 Cb 0.63 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 2k2n h VAL 183 CO -0.08 0.07 -0.96 -0.37 0.02 0.00 0.00 177.57 176.25 2k2n h VAL 184 N -0.96 1.65 -0.21 2.57 -1.51 -1.46 -3.07 116.25 113.25 2k2n h VAL 184 Ca -0.06 -3.17 0.06 0.00 -1.23 0.00 0.00 66.70 62.30 2k2n h VAL 184 Cb 0.57 2.74 -0.07 0.00 -2.13 0.00 0.00 31.29 32.40 2k2n h VAL 184 CO 0.10 0.91 -0.29 -0.61 -1.23 0.00 0.00 177.57 176.45 2k2n h GLN 185 N 0.01 -0.31 -0.04 5.19 -0.00 -0.65 2.50 115.11 121.82 2k2n h GLN 185 Ca -0.02 0.02 -0.25 0.00 -0.00 0.00 0.00 58.65 58.40 2k2n h GLN 185 Cb 1.68 0.07 0.02 0.00 0.00 0.00 0.00 27.48 29.24 2k2n h GLN 185 CO 0.13 -0.20 -0.95 1.25 0.00 0.00 0.00 178.83 179.06 2k2n h LEU 186 N -0.32 0.86 0.03 -2.39 5.85 -1.68 -3.15 115.31 114.51 2k2n h LEU 186 Ca 0.12 -0.65 -0.24 0.00 0.84 0.00 0.00 57.88 57.95 2k2n h LEU 186 Cb 0.51 -0.26 0.02 0.00 0.37 0.00 0.00 40.66 41.30 2k2n h LEU 186 CO -0.39 1.45 -0.95 0.25 -0.34 0.00 0.00 178.44 178.46 2k2n h LEU 187 N 0.41 0.78 -1.03 2.25 5.85 -1.38 -3.22 115.31 118.97 2k2n h LEU 187 Ca -0.10 -0.77 0.07 0.00 0.84 0.00 0.00 57.88 57.92 2k2n h LEU 187 Cb 1.59 -0.24 -0.07 0.00 0.37 0.00 0.00 40.66 42.31 2k2n h LEU 187 CO 0.19 1.46 0.64 0.00 -0.34 0.00 0.00 178.44 180.38 2k2n h ALA 188 N 0.34 1.42 -0.94 1.25 0.00 0.42 -0.40 119.26 121.35 2k2n h ALA 188 Ca -0.13 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 54.81 2k2n h ALA 188 Cb 1.63 -0.30 -0.06 0.00 0.00 0.00 0.00 17.79 19.06 2k2n h ALA 188 CO 0.18 0.42 0.62 -0.44 0.00 0.00 0.00 179.25 180.04 2k2n h ASP 189 N 1.15 1.00 0.36 0.00 3.32 -1.59 0.72 116.42 121.39 2k2n h ASP 189 Ca 0.43 -0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.42 2k2n h ASP 189 Cb 0.19 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 2k2n h ASP 189 CO -0.17 0.67 -0.26 1.56 -1.72 0.00 0.00 179.24 179.32 2k2n h GLN 190 N 1.15 0.00 0.12 3.56 4.20 -1.11 -1.57 115.11 121.47 2k2n h GLN 190 Ca 0.39 0.00 -0.22 0.00 0.06 0.00 0.00 58.65 58.87 2k2n h GLN 190 Cb 0.07 0.00 0.01 0.00 0.30 0.00 0.00 27.48 27.86 2k2n h GLN 190 CO -0.13 0.26 -1.06 0.28 -0.67 0.00 0.00 178.83 177.51 2k2n h VAL 191 N 0.00 1.29 -0.61 -0.54 2.07 -0.19 -2.55 116.25 115.73 2k2n h VAL 191 Ca -0.00 -2.46 0.18 0.00 0.82 0.00 0.00 66.70 65.23 2k2n h VAL 191 Cb 0.51 2.96 -0.02 0.00 -1.52 0.00 0.00 31.29 33.22 2k2n h VAL 191 CO 0.03 0.69 0.45 -1.28 0.02 0.00 0.00 177.57 177.48 2k2n h SER 192 N -0.39 0.00 0.59 0.57 0.87 0.50 0.82 113.55 116.51 2k2n h SER 192 Ca -0.22 0.00 -0.22 0.00 -1.23 0.00 0.00 61.79 60.13 2k2n h SER 192 Cb 1.66 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.61 2k2n h SER 192 CO 0.09 0.00 -0.97 0.40 -0.53 0.00 0.00 176.83 175.82 2k2n h ILE 193 N 0.00 1.50 -0.04 2.23 1.08 -1.29 -2.42 117.51 118.57 2k2n h ILE 193 Ca 0.29 -2.75 -0.05 0.00 -0.39 0.00 0.00 64.86 61.96 2k2n h ILE 193 Cb 1.18 2.59 0.00 0.00 -3.07 0.00 0.00 36.82 37.52 2k2n h ILE 193 CO -0.00 0.80 -0.15 0.00 -0.69 0.00 0.00 178.15 178.11 2k2n h ALA 194 N 0.86 0.08 -0.47 1.87 0.00 0.89 0.23 119.26 122.71 2k2n h ALA 194 Ca -0.06 -0.37 -0.08 0.00 0.00 0.00 0.00 54.91 54.39 2k2n h ALA 194 Cb 1.64 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.40 2k2n h ALA 194 CO 0.15 0.01 -0.03 -0.84 0.00 0.00 0.00 179.25 178.54 2k2n h ILE 195 N -0.36 1.25 -0.07 0.00 -0.00 -0.56 0.90 117.51 118.65 2k2n h ILE 195 Ca -0.01 -1.05 -0.06 0.00 -0.00 0.00 0.00 64.86 63.75 2k2n h ILE 195 Cb 0.79 0.91 0.00 0.00 -0.00 0.00 0.00 36.82 38.52 2k2n h ILE 195 CO 0.03 0.37 -0.19 0.00 -0.00 0.00 0.00 178.15 178.36 2k2n h ALA 196 N 1.23 0.12 -0.17 0.16 0.00 -1.43 -2.84 119.26 116.33 2k2n h ALA 196 Ca 0.14 -0.37 -0.16 0.00 0.00 0.00 0.00 54.91 54.51 2k2n h ALA 196 Cb 0.49 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2k2n h ALA 196 CO 0.02 0.06 -0.58 1.96 0.00 0.00 0.00 179.25 180.72 2k2n h GLN 197 N -0.23 0.53 -0.19 0.00 1.08 -0.41 -3.14 115.11 112.75 2k2n h GLN 197 Ca -0.00 -0.35 -0.05 0.00 -1.45 0.00 0.00 58.65 56.80 2k2n h GLN 197 Cb 0.79 0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 28.26 2k2n h GLN 197 CO 0.04 0.96 -0.10 0.00 -0.95 0.00 0.00 178.83 178.77 2k2n h ALA 198 N 0.97 1.47 -0.30 3.87 0.00 0.77 -2.60 119.26 123.45 2k2n h ALA 198 Ca 0.00 -0.21 0.02 0.00 0.00 0.00 0.00 54.91 54.73 2k2n h ALA 198 Cb 1.12 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 2k2n h ALA 198 CO 0.11 0.37 0.20 1.49 0.00 0.00 0.00 179.25 181.42 2k2n h GLU 199 N 0.29 0.32 -0.34 0.00 4.81 -1.45 -1.60 114.58 116.61 2k2n h GLU 199 Ca 0.06 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.26 2k2n h GLU 199 Cb 0.37 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.66 2k2n h GLU 199 CO 0.02 0.21 0.15 -0.07 -0.73 0.00 0.00 179.01 178.59 2k2n h LEU 200 N 0.33 0.42 -0.21 1.64 4.07 -1.58 -2.83 115.31 117.15 2k2n h LEU 200 Ca 0.12 -0.03 0.06 0.00 0.08 0.00 0.00 57.88 58.10 2k2n h LEU 200 Cb 0.07 -0.11 -0.07 0.00 1.08 0.00 0.00 40.66 41.64 2k2n h LEU 200 CO -0.03 0.37 -0.26 0.28 -1.08 0.00 0.00 178.44 177.72 2k2n h SER 201 N 0.47 -0.83 0.00 -0.43 0.02 -1.41 -3.53 113.55 107.84 2k2n h SER 201 Ca 0.12 0.14 0.00 0.00 -0.84 0.00 0.00 61.79 61.21 2k2n h SER 201 Cb 0.07 0.38 0.00 0.00 0.14 0.00 0.00 62.40 62.99 2k2n h SER 201 CO -0.02 -0.30 0.00 0.18 -1.14 0.00 0.00 176.83 175.56