#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kym s VAL 2 N 0.00 4.62 0.01 2.62 1.01 -1.26 -3.68 120.40 123.72 3kym s VAL 2 Ca 0.00 1.25 -0.08 0.00 0.00 0.00 0.00 61.98 63.15 3kym s VAL 2 Cb 0.00 -4.30 0.00 0.00 0.00 0.00 0.00 36.38 32.08 3kym s VAL 2 CO 0.00 -0.47 0.16 -1.10 0.00 0.00 0.00 175.10 173.69 3kym s GLN 3 N 3.38 0.54 -0.21 2.72 -1.52 -1.09 -5.03 119.66 118.45 3kym s GLN 3 Ca 0.38 -0.44 -0.00 0.00 -1.95 0.00 0.00 55.36 53.35 3kym s GLN 3 Cb -0.12 0.22 0.06 0.00 -0.22 0.00 0.00 33.01 32.95 3kym s GLN 3 CO 0.17 -0.14 -0.03 -0.51 -0.25 0.00 0.00 175.29 174.53 3kym s LEU 4 N -1.53 2.03 -0.24 2.90 1.43 -1.26 -2.04 118.68 119.97 3kym s LEU 4 Ca -0.13 -0.98 -0.01 0.00 -1.03 0.00 0.00 54.13 51.98 3kym s LEU 4 Cb -0.06 -0.98 0.03 0.00 0.03 0.00 0.00 46.19 45.20 3kym s LEU 4 CO 0.01 -0.24 -0.07 -0.76 0.23 0.00 0.00 176.35 175.51 3kym s LEU 5 N 1.56 3.14 0.34 1.79 1.43 0.26 -3.58 118.68 123.62 3kym s LEU 5 Ca -0.03 -0.90 0.04 0.00 -1.03 0.00 0.00 54.13 52.21 3kym s LEU 5 Cb -0.18 -1.64 -0.01 0.00 0.03 0.00 0.00 46.19 44.39 3kym s LEU 5 CO -0.07 -0.12 0.50 -1.83 0.23 0.00 0.00 176.35 175.05 3kym s GLU 6 N 1.31 3.20 0.30 1.70 1.03 -1.26 -1.10 118.70 123.87 3kym s GLU 6 Ca -0.00 -0.80 -0.20 0.00 0.03 0.00 0.00 54.97 54.01 3kym s GLU 6 Cb -0.17 -2.77 0.03 0.00 -0.80 0.00 0.00 34.13 30.42 3kym s GLU 6 CO -0.05 0.07 0.72 -1.54 -1.33 0.00 0.00 175.26 173.14 3kym s SER 7 N -4.13 -0.20 0.00 0.83 1.04 -0.84 -4.96 113.70 105.44 3kym s SER 7 Ca 0.43 -0.73 0.00 0.00 0.48 0.00 0.00 55.95 56.13 3kym s SER 7 Cb -0.10 0.75 0.00 0.00 0.10 0.00 0.00 66.02 66.77 3kym s SER 7 CO 0.32 -1.41 0.00 0.61 0.98 0.00 0.00 173.24 173.75 3kym n GLY 8 N -0.47 0.56 0.00 7.32 0.00 -1.26 -2.57 105.19 108.77 3kym n GLY 8 Ca -0.05 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.93 3kym n GLY 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kym n GLY 9 N -2.87 -1.97 0.89 -0.02 0.00 -1.26 -4.67 105.19 95.28 3kym n GLY 9 Ca 0.00 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 45.00 3kym n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kym n GLY 10 N 1.87 -2.19 3.84 -0.02 0.00 0.80 -4.96 105.19 104.53 3kym n GLY 10 Ca 0.00 -1.97 -0.37 0.00 0.00 0.00 0.00 46.02 43.68 3kym n GLY 10 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 3kym s LEU 11 N 0.00 4.44 0.07 0.99 0.05 -1.26 -2.10 118.68 120.87 3kym s LEU 11 Ca 0.00 0.94 -0.05 0.00 0.05 0.00 0.00 54.13 55.07 3kym s LEU 11 Cb 0.00 -2.74 -0.02 0.00 -2.05 0.00 0.00 46.19 41.38 3kym s LEU 11 CO 0.00 0.27 0.09 0.68 -0.55 0.00 0.00 176.35 176.84 3kym s VAL 12 N -1.19 0.18 0.10 1.48 -7.23 -0.51 -4.94 120.40 108.29 3kym s VAL 12 Ca 0.27 -1.49 -0.15 0.00 -1.81 0.00 0.00 61.98 58.80 3kym s VAL 12 Cb -0.16 -1.44 -0.07 0.00 0.56 0.00 0.00 36.38 35.27 3kym s VAL 12 CO 0.15 -0.81 0.52 -1.10 -0.31 0.00 0.00 175.10 173.55 3kym s GLN 13 N -3.89 4.01 0.29 4.82 -1.52 -1.26 -0.74 119.66 121.37 3kym s GLN 13 Ca 0.06 0.52 -0.29 0.00 -1.95 0.00 0.00 55.36 53.70 3kym s GLN 13 Cb 0.06 -3.07 -0.10 0.00 -0.22 0.00 0.00 33.01 29.68 3kym s GLN 13 CO -0.10 0.57 1.45 -2.14 -0.25 0.00 0.00 175.29 174.81 3kym s PRO 14 N -1.57 4.24 0.00 2.91 0.02 -1.26 -1.26 135.00 138.08 3kym s PRO 14 Ca 0.33 2.37 0.00 0.00 0.02 0.00 0.00 61.00 63.71 3kym s PRO 14 Cb -0.16 -3.07 0.00 0.00 0.02 0.00 0.00 34.50 31.29 3kym s PRO 14 CO 0.18 -0.43 0.00 0.41 -0.33 0.00 0.00 177.00 176.83 3kym n GLY 15 N 1.69 2.63 0.00 0.52 0.00 0.25 -4.88 105.19 105.41 3kym n GLY 15 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3kym n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kym n GLY 16 N -2.00 -2.47 3.08 -0.02 0.00 -0.39 -3.31 105.19 100.08 3kym n GLY 16 Ca 0.00 -1.35 -0.08 0.00 0.00 0.00 0.00 46.02 44.59 3kym n GLY 16 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3kym s SER 17 N -1.62 0.36 -0.14 1.61 0.01 -1.26 -2.33 113.70 110.32 3kym s SER 17 Ca 0.00 -0.79 -0.25 0.00 1.31 0.00 0.00 55.95 56.23 3kym s SER 17 Cb 0.00 0.19 0.06 0.00 0.21 0.00 0.00 66.02 66.48 3kym s SER 17 CO 0.00 -0.53 0.61 -0.22 0.41 0.00 0.00 173.24 173.51 3kym s LEU 18 N -2.47 -0.37 -0.13 2.44 0.20 0.08 -5.01 118.68 113.43 3kym s LEU 18 Ca 0.00 0.93 0.03 0.00 0.69 0.00 0.00 54.13 55.78 3kym s LEU 18 Cb 0.02 2.21 0.01 0.00 -0.43 0.00 0.00 46.19 48.00 3kym s LEU 18 CO -0.07 -0.39 -0.23 -0.60 -0.29 0.00 0.00 176.35 174.77 3kym s ARG 19 N -0.43 3.02 0.20 1.98 3.52 -1.26 0.42 118.95 126.40 3kym s ARG 19 Ca -0.06 -0.86 -0.01 0.00 -0.13 0.00 0.00 55.73 54.67 3kym s ARG 19 Cb -0.03 -2.38 -0.04 0.00 -1.56 0.00 0.00 34.95 30.93 3kym s ARG 19 CO 0.05 0.05 0.40 -0.51 -0.81 0.00 0.00 175.30 174.48 3kym s LEU 20 N 0.66 4.22 0.09 -0.88 1.43 -0.41 -4.74 118.68 119.05 3kym s LEU 20 Ca -0.11 0.44 0.05 0.00 -1.03 0.00 0.00 54.13 53.48 3kym s LEU 20 Cb -0.16 -3.21 -0.03 0.00 0.03 0.00 0.00 46.19 42.81 3kym s LEU 20 CO 0.02 -0.04 -0.13 -0.44 0.23 0.00 0.00 176.35 175.98 3kym s SER 21 N -3.09 1.69 -0.24 2.29 0.01 -1.06 -2.81 113.70 110.49 3kym s SER 21 Ca 0.39 -0.72 -0.04 0.00 1.31 0.00 0.00 55.95 56.89 3kym s SER 21 Cb -0.11 -0.04 0.08 0.00 0.21 0.00 0.00 66.02 66.16 3kym s SER 21 CO 0.29 -0.15 0.11 0.00 0.41 0.00 0.00 173.24 173.90 3kym s ALA 23 N 2.09 3.22 -0.07 0.00 0.00 -0.26 -0.70 121.76 126.03 3kym s ALA 23 Ca 0.06 0.57 0.02 0.00 0.00 0.00 0.00 51.96 52.61 3kym s ALA 23 Cb -0.16 -3.30 -0.02 0.00 0.00 0.00 0.00 23.12 19.63 3kym s ALA 23 CO -0.24 -0.11 -0.13 0.00 0.00 0.00 0.00 175.76 175.28 3kym s ALA 24 N 0.37 2.68 0.17 0.00 0.00 -1.13 -0.58 121.76 123.27 3kym s ALA 24 Ca 0.49 -0.94 0.01 0.00 0.00 0.00 0.00 51.96 51.51 3kym s ALA 24 Cb -0.23 -1.06 -0.04 0.00 0.00 0.00 0.00 23.12 21.79 3kym s ALA 24 CO 0.29 0.47 0.02 -1.54 0.00 0.00 0.00 175.76 175.00 3kym s SER 25 N -0.42 0.97 0.00 0.00 1.04 -0.86 -4.88 113.70 109.54 3kym s SER 25 Ca 0.05 -1.19 0.00 0.00 0.48 0.00 0.00 55.95 55.29 3kym s SER 25 Cb -0.12 0.17 0.00 0.00 0.10 0.00 0.00 66.02 66.17 3kym s SER 25 CO 0.02 -0.62 0.00 0.61 0.98 0.00 0.00 173.24 174.23 3kym n GLY 26 N -0.21 1.03 3.68 7.32 0.00 -1.24 -2.66 105.19 113.10 3kym n GLY 26 Ca -0.06 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.86 3kym n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3kym s PHE 27 N -3.02 0.33 -1.32 1.61 -0.71 -1.26 -4.77 117.98 108.83 3kym s PHE 27 Ca 0.00 -0.75 -0.17 0.00 -1.04 0.00 0.00 56.93 54.97 3kym s PHE 27 Cb 0.00 0.39 0.07 0.00 -1.21 0.00 0.00 43.02 42.28 3kym s PHE 27 CO 0.00 -1.20 1.81 2.41 -1.34 0.00 0.00 175.22 176.89 3kym n THR 28 N -0.47 3.89 -0.32 -4.49 -1.04 -1.26 -4.78 114.28 105.82 3kym n THR 28 Ca -0.03 -3.97 0.31 0.00 -2.04 0.00 0.00 64.05 58.32 3kym n THR 28 Cb 0.61 -2.41 0.67 0.00 -1.82 0.00 0.00 70.33 67.38 3kym n THR 28 CO 0.00 0.00 0.00 0.15 -0.64 0.00 0.00 175.07 174.58 3kym h PHE 29 N 7.22 0.23 0.00 -1.42 3.04 -1.94 0.36 116.94 124.44 3kym h PHE 29 Ca 0.46 0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.42 3kym h PHE 29 Cb 0.82 -0.07 0.00 0.00 2.56 0.00 0.00 35.95 39.27 3kym h PHE 29 CO 1.41 0.01 0.00 -1.13 -2.02 0.00 0.00 178.31 176.58 3kym n SER 30 N -4.35 0.59 -0.02 0.41 3.41 -1.26 -3.24 113.62 109.16 3kym n SER 30 Ca 0.25 0.63 0.04 0.00 -0.26 0.00 0.00 58.87 59.54 3kym n SER 30 Cb 1.12 -0.76 -0.14 0.00 -0.26 0.00 0.00 64.21 64.16 3kym n SER 30 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 3kym n ILE 31 N -2.14 0.58 -3.83 -1.33 5.41 0.13 -4.50 119.36 113.68 3kym n ILE 31 Ca 0.03 -0.63 -0.35 0.00 1.00 0.00 0.00 62.75 62.80 3kym n ILE 31 Cb 0.24 -0.25 -0.05 0.00 -0.71 0.00 0.00 39.64 38.86 3kym n ILE 31 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 3kym s TYR 32 N -3.15 3.58 0.48 1.39 1.51 -1.20 -4.61 117.35 115.35 3kym s TYR 32 Ca -0.07 0.51 -0.19 0.00 -1.01 0.00 0.00 57.07 56.31 3kym s TYR 32 Cb 0.11 -1.94 -0.09 0.00 -0.11 0.00 0.00 41.96 39.93 3kym s TYR 32 CO 0.86 0.67 0.99 -2.14 -1.11 0.00 0.00 175.55 174.83 3kym s PRO 33 N -1.54 3.94 0.15 -1.71 0.02 -1.26 -4.13 135.00 130.46 3kym s PRO 33 Ca 0.23 1.15 0.07 0.00 0.02 0.00 0.00 61.00 62.47 3kym s PRO 33 Cb -0.13 -2.13 -0.04 0.00 0.02 0.00 0.00 34.50 32.22 3kym s PRO 33 CO 0.13 -0.29 -0.15 -1.64 -0.33 0.00 0.00 177.00 174.72 3kym s MET 34 N -3.52 1.13 0.23 5.54 -1.94 -0.19 -2.58 119.30 117.97 3kym s MET 34 Ca 0.63 -1.35 0.08 0.00 -1.71 0.00 0.00 55.69 53.34 3kym s MET 34 Cb -0.12 -1.02 -0.05 0.00 2.01 0.00 0.00 34.83 35.65 3kym s MET 34 CO 0.22 0.19 -0.12 -0.06 -0.01 0.00 0.00 175.02 175.24 3kym s PHE 35 N -2.34 1.82 -0.21 -0.03 0.08 0.16 -2.51 117.98 114.95 3kym s PHE 35 Ca 0.13 -0.59 -0.02 0.00 0.12 0.00 0.00 56.93 56.57 3kym s PHE 35 Cb -0.04 -0.90 0.06 0.00 -0.57 0.00 0.00 43.02 41.58 3kym s PHE 35 CO 0.04 0.36 0.02 -1.58 -0.10 0.00 0.00 175.22 173.96 3kym s TRP 36 N -2.95 1.43 0.27 0.36 0.52 -1.20 -1.55 118.94 115.81 3kym s TRP 36 Ca 0.25 -1.15 0.07 0.00 0.02 0.00 0.00 56.10 55.29 3kym s TRP 36 Cb 0.00 -1.21 -0.04 0.00 -1.15 0.00 0.00 33.47 31.07 3kym s TRP 36 CO 0.09 -0.67 0.19 0.08 0.02 0.00 0.00 176.95 176.66 3kym s VAL 37 N 1.72 4.19 0.17 4.03 1.01 0.10 -1.38 120.40 130.25 3kym s VAL 37 Ca -0.02 -1.46 -0.03 0.00 0.00 0.00 0.00 61.98 60.47 3kym s VAL 37 Cb -0.18 -3.31 -0.03 0.00 0.00 0.00 0.00 36.38 32.86 3kym s VAL 37 CO -0.08 -0.33 0.16 0.00 0.00 0.00 0.00 175.10 174.85 3kym s ARG 38 N -3.85 1.13 -0.25 2.72 1.70 -0.76 0.98 118.95 120.62 3kym s ARG 38 Ca 0.34 -1.46 -0.05 0.00 -0.47 0.00 0.00 55.73 54.09 3kym s ARG 38 Cb -0.07 0.29 0.13 0.00 -0.57 0.00 0.00 34.95 34.73 3kym s ARG 38 CO 0.25 -0.37 0.48 -1.14 -1.08 0.00 0.00 175.30 173.44 3kym s GLN 39 N -4.08 0.43 0.51 3.89 0.74 -0.09 -0.36 119.66 120.70 3kym s GLN 39 Ca 0.29 0.93 -0.20 0.00 0.05 0.00 0.00 55.36 56.43 3kym s GLN 39 Cb 0.06 0.21 -0.07 0.00 1.10 0.00 0.00 33.01 34.30 3kym s GLN 39 CO 0.06 -0.46 1.08 0.00 -0.55 0.00 0.00 175.29 175.42 3kym s ALA 40 N 2.69 2.80 0.02 1.58 0.00 -1.25 -1.40 121.76 126.20 3kym s ALA 40 Ca 0.08 0.71 -0.36 0.00 0.00 0.00 0.00 51.96 52.39 3kym s ALA 40 Cb -0.14 -3.30 -0.15 0.00 0.00 0.00 0.00 23.12 19.53 3kym s ALA 40 CO -0.17 -0.51 1.58 -2.30 0.00 0.00 0.00 175.76 174.37 3kym n PRO 41 N -1.10 1.68 -2.28 0.00 -0.02 -1.26 -0.39 135.00 131.63 3kym n PRO 41 Ca 0.10 0.61 -0.21 0.00 -2.02 0.00 0.00 63.50 61.98 3kym n PRO 41 Cb 0.52 -2.34 -0.02 0.00 -0.02 0.00 0.00 33.50 31.64 3kym n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3kym n GLY 42 N 3.43 -0.13 0.00 -1.23 0.00 -1.26 -4.99 105.19 101.01 3kym n GLY 42 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 3kym n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3kym n LYS 43 N -2.92 1.78 -0.11 1.61 4.76 0.47 -5.18 118.16 118.59 3kym n LYS 43 Ca -0.24 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.20 3kym n LYS 43 Cb 0.69 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.88 3kym n LYS 43 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3kym n GLY 44 N 3.64 -0.20 3.45 0.72 0.00 -1.26 -4.72 105.19 106.81 3kym n GLY 44 Ca 0.00 -1.75 -0.34 0.00 0.00 0.00 0.00 46.02 43.93 3kym n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kym s LEU 45 N 0.00 3.11 -0.24 0.99 1.43 -1.26 -3.94 118.68 118.77 3kym s LEU 45 Ca 0.00 -0.20 0.01 0.00 -1.03 0.00 0.00 54.13 52.92 3kym s LEU 45 Cb 0.00 -1.75 0.06 0.00 0.03 0.00 0.00 46.19 44.53 3kym s LEU 45 CO 0.00 0.14 -0.06 -0.70 0.23 0.00 0.00 176.35 175.96 3kym s GLU 46 N 0.51 1.74 0.35 1.70 2.12 0.51 -4.99 118.70 120.64 3kym s GLU 46 Ca -0.04 -1.09 -0.28 0.00 0.36 0.00 0.00 54.97 53.91 3kym s GLU 46 Cb -0.15 -2.66 -0.12 0.00 0.26 0.00 0.00 34.13 31.47 3kym s GLU 46 CO 0.03 -0.61 1.46 1.87 -0.54 0.00 0.00 175.26 177.47 3kym n TRP 47 N 4.61 2.78 0.01 5.30 -0.00 -1.26 -1.82 117.44 127.05 3kym n TRP 47 Ca -0.12 0.44 -0.02 0.00 -0.00 0.00 0.00 57.50 57.80 3kym n TRP 47 Cb 0.43 -2.51 -0.01 0.00 -0.00 0.00 0.00 31.31 29.23 3kym n TRP 47 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 177.69 177.97 3kym n VAL 48 N 0.75 0.62 -4.19 5.87 0.31 -0.48 -4.58 118.33 116.62 3kym n VAL 48 Ca 0.04 0.15 -0.12 0.00 -0.01 0.00 0.00 64.34 64.40 3kym n VAL 48 Cb 0.38 -1.58 -0.10 0.00 -0.91 0.00 0.00 33.84 31.62 3kym n VAL 48 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 3kym s SER 49 N -5.54 0.71 0.07 4.52 0.01 -1.14 -0.06 113.70 112.28 3kym s SER 49 Ca -0.03 -1.21 -0.13 0.00 1.31 0.00 0.00 55.95 55.90 3kym s SER 49 Cb 0.01 0.22 0.02 0.00 0.21 0.00 0.00 66.02 66.47 3kym s SER 49 CO 0.04 -0.67 0.29 0.86 0.41 0.00 0.00 173.24 174.17 3kym s TRP 50 N -3.88 -0.06 -0.28 2.43 -0.00 -1.03 -3.25 118.94 112.87 3kym s TRP 50 Ca 0.25 -0.20 -0.17 0.00 -0.00 0.00 0.00 56.10 55.97 3kym s TRP 50 Cb 0.07 0.09 0.08 0.00 -0.00 0.00 0.00 33.47 33.71 3kym s TRP 50 CO 0.03 -0.56 0.71 -1.50 -0.00 0.00 0.00 176.95 175.63 3kym s ILE 51 N -3.20 0.00 0.68 5.86 2.07 -1.04 -2.82 121.20 122.74 3kym s ILE 51 Ca -0.00 0.00 -0.06 0.00 -1.41 0.00 0.00 60.65 59.18 3kym s ILE 51 Cb 0.01 -1.00 0.06 0.00 0.13 0.00 0.00 42.46 41.66 3kym s ILE 51 CO -0.07 0.00 0.99 -0.83 -1.91 0.00 0.00 174.94 173.11 3kym s GLY 52 N 1.42 1.69 -0.92 1.50 0.00 -1.20 -1.03 107.32 108.79 3kym s GLY 52 Ca -0.08 -0.94 -0.23 0.00 0.00 0.00 0.00 44.72 43.46 3kym s GLY 52 CO -0.16 -0.56 1.91 -1.55 0.00 0.00 0.00 173.10 172.74 3kym n PRO 53 N -2.85 1.39 0.00 2.90 -0.04 -1.26 -0.93 135.00 134.21 3kym n PRO 53 Ca 0.08 -2.06 0.00 0.00 -0.04 0.00 0.00 63.50 61.47 3kym n PRO 53 Cb 0.60 -3.29 0.00 0.00 -0.04 0.00 0.00 33.50 30.77 3kym n PRO 53 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3kym n SER 54 N 11.14 0.00 0.00 3.54 3.41 -1.26 -4.89 113.62 125.56 3kym n SER 54 Ca 0.47 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.08 3kym n SER 54 Cb 0.44 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 3kym n SER 54 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3kym n GLY 55 N 0.00 1.17 4.68 5.00 0.00 -0.11 -4.92 105.19 111.02 3kym n GLY 55 Ca 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.26 3kym n GLY 55 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kym n GLY 56 N 0.00 1.33 2.94 -0.02 0.00 -1.26 -4.48 105.19 103.71 3kym n GLY 56 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 3kym n GLY 56 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kym s ILE 57 N 0.00 1.47 -0.06 -0.61 1.01 -1.26 -5.11 121.20 116.64 3kym s ILE 57 Ca 0.00 -1.08 0.02 0.00 0.00 0.00 0.00 60.65 59.60 3kym s ILE 57 Cb 0.00 -1.69 0.01 0.00 0.01 0.00 0.00 42.46 40.79 3kym s ILE 57 CO 0.00 -0.01 -0.13 0.42 0.00 0.00 0.00 174.94 175.22 3kym s THR 58 N 1.44 1.16 0.33 2.92 -4.23 -1.26 -3.27 115.64 112.72 3kym s THR 58 Ca -0.04 -0.50 0.08 0.00 -1.18 0.00 0.00 61.69 60.06 3kym s THR 58 Cb -0.18 -1.05 -0.04 0.00 1.34 0.00 0.00 72.50 72.57 3kym s THR 58 CO -0.07 0.36 0.19 -0.54 -0.54 0.00 0.00 174.62 174.02 3kym s LYS 59 N 0.63 2.52 0.07 3.99 1.02 -1.13 -5.00 119.74 121.85 3kym s LYS 59 Ca -0.14 -1.43 -0.13 0.00 0.02 0.00 0.00 55.97 54.29 3kym s LYS 59 Cb -0.16 -2.30 0.02 0.00 -0.52 0.00 0.00 37.83 34.87 3kym s LYS 59 CO 0.04 0.13 0.30 0.71 -0.92 0.00 0.00 175.35 175.61 3kym s TYR 60 N -2.36 -0.08 0.40 3.18 2.02 -1.26 -2.47 117.35 116.78 3kym s TYR 60 Ca 0.38 -0.14 -0.25 0.00 -0.37 0.00 0.00 57.07 56.70 3kym s TYR 60 Cb -0.04 0.10 -0.08 0.00 -0.40 0.00 0.00 41.96 41.54 3kym s TYR 60 CO 0.24 -0.55 1.15 0.00 -1.57 0.00 0.00 175.55 174.82 3kym s ALA 61 N -3.01 3.13 0.28 3.71 0.00 0.92 -4.85 121.76 121.93 3kym s ALA 61 Ca -0.02 0.92 -0.04 0.00 0.00 0.00 0.00 51.96 52.83 3kym s ALA 61 Cb 0.01 -3.36 0.36 0.00 0.00 0.00 0.00 23.12 20.13 3kym s ALA 61 CO -0.06 -0.48 1.94 0.22 0.00 0.00 0.00 175.76 177.37 3kym h ASP 62 N 2.59 1.03 0.16 0.00 -0.00 -1.93 0.20 116.42 118.47 3kym h ASP 62 Ca -0.49 -0.04 0.00 0.00 -0.00 0.00 0.00 57.03 56.51 3kym h ASP 62 Cb 1.23 -0.26 0.00 0.00 -0.00 0.00 0.00 39.33 40.30 3kym h ASP 62 CO 0.62 0.76 0.00 -1.54 -0.00 0.00 0.00 179.24 179.08 3kym n SER 63 N -4.39 0.00 -0.01 2.28 3.41 -1.26 -3.41 113.62 110.25 3kym n SER 63 Ca 0.10 0.12 -0.01 0.00 -0.26 0.00 0.00 58.87 58.82 3kym n SER 63 Cb 0.03 -0.27 -0.01 0.00 -0.26 0.00 0.00 64.21 63.71 3kym n SER 63 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 3kym n VAL 64 N -1.27 0.12 -1.63 -3.33 0.31 -0.15 -4.97 118.33 107.42 3kym n VAL 64 Ca 0.05 -0.05 -0.64 0.00 -0.01 0.00 0.00 64.34 63.68 3kym n VAL 64 Cb 0.07 -0.66 -0.10 0.00 -0.91 0.00 0.00 33.84 32.24 3kym n VAL 64 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 3kym n LYS 65 N -2.45 0.00 0.00 5.55 4.81 0.53 -0.57 118.16 126.03 3kym n LYS 65 Ca -0.04 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.40 3kym n LYS 65 Cb 0.54 -1.42 0.00 0.00 0.02 0.00 0.00 35.03 34.17 3kym n LYS 65 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3kym n GLY 66 N 4.04 2.69 0.10 3.14 0.00 -1.26 -4.85 105.19 109.04 3kym n GLY 66 Ca 0.31 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.23 3kym n GLY 66 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kym n ARG 67 N -0.31 0.67 -4.80 1.61 1.74 0.27 -5.00 116.66 110.83 3kym n ARG 67 Ca 0.00 0.15 -0.33 0.00 -0.77 0.00 0.00 57.85 56.90 3kym n ARG 67 Cb 0.00 -1.65 -0.14 0.00 -1.02 0.00 0.00 32.46 29.65 3kym n ARG 67 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3kym s PHE 68 N -2.54 2.80 -0.30 -1.55 0.40 -1.20 -2.34 117.98 113.25 3kym s PHE 68 Ca -0.10 -0.66 -0.06 0.00 -0.60 0.00 0.00 56.93 55.51 3kym s PHE 68 Cb 0.07 -1.83 0.02 0.00 0.51 0.00 0.00 43.02 41.78 3kym s PHE 68 CO 0.81 -0.22 0.07 0.99 0.70 0.00 0.00 175.22 177.57 3kym s THR 69 N 0.33 3.82 0.05 0.64 2.01 0.46 -4.93 115.64 118.01 3kym s THR 69 Ca -0.11 -0.79 -0.16 0.00 0.31 0.00 0.00 61.69 60.94 3kym s THR 69 Cb -0.16 -2.99 -0.06 0.00 0.01 0.00 0.00 72.50 69.29 3kym s THR 69 CO 0.06 0.06 0.48 -0.51 -0.69 0.00 0.00 174.62 174.01 3kym s ILE 70 N 1.47 4.91 0.02 1.82 2.07 -1.26 0.12 121.20 130.34 3kym s ILE 70 Ca 0.02 0.94 -0.14 0.00 -1.41 0.00 0.00 60.65 60.06 3kym s ILE 70 Cb -0.17 -3.77 0.02 0.00 0.13 0.00 0.00 42.46 38.66 3kym s ILE 70 CO 0.02 0.51 0.29 -0.94 -1.91 0.00 0.00 174.94 172.91 3kym s SER 71 N -1.22 -0.14 0.08 4.50 1.04 -1.00 -4.99 113.70 111.97 3kym s SER 71 Ca 0.28 -0.09 0.09 0.00 0.48 0.00 0.00 55.95 56.71 3kym s SER 71 Cb -0.17 0.33 -0.03 0.00 0.10 0.00 0.00 66.02 66.24 3kym s SER 71 CO 0.16 -0.53 -0.25 0.00 0.98 0.00 0.00 173.24 173.60 3kym s ARG 72 N -2.01 1.54 -0.33 4.02 1.70 -1.26 -0.78 118.95 121.82 3kym s ARG 72 Ca -0.09 -1.16 0.03 0.00 -0.47 0.00 0.00 55.73 54.04 3kym s ARG 72 Cb -0.03 -1.81 0.09 0.00 -0.57 0.00 0.00 34.95 32.63 3kym s ARG 72 CO -0.00 0.45 0.04 0.34 -1.08 0.00 0.00 175.30 175.05 3kym s ASP 73 N -1.54 4.78 0.51 -2.89 -1.08 -0.99 -4.97 116.67 110.49 3kym s ASP 73 Ca 0.11 -1.96 0.29 0.00 -0.52 0.00 0.00 52.55 50.47 3kym s ASP 73 Cb -0.10 -1.64 1.31 0.00 -1.46 0.00 0.00 42.92 41.03 3kym s ASP 73 CO 0.03 -0.36 1.98 0.78 0.52 0.00 0.00 175.17 178.12 3kym h ASN 74 N 7.71 0.00 0.72 -0.34 2.35 -1.95 -1.49 115.58 122.58 3kym h ASN 74 Ca -0.09 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.63 3kym h ASN 74 Cb 1.03 0.00 0.01 0.00 0.05 0.00 0.00 38.32 39.41 3kym h ASN 74 CO 0.53 0.11 -0.34 0.28 -1.65 0.00 0.00 177.43 176.36 3kym h SER 75 N 0.00 -0.82 0.40 5.81 0.02 -1.97 -3.25 113.55 113.74 3kym h SER 75 Ca -0.00 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 3kym h SER 75 Cb 0.51 0.21 0.00 0.00 0.14 0.00 0.00 62.40 63.26 3kym h SER 75 CO 0.01 -0.51 0.00 0.29 -1.14 0.00 0.00 176.83 175.49 3kym n LYS 76 N -5.02 0.29 -1.57 3.45 5.02 -1.12 -4.87 118.16 114.34 3kym n LYS 76 Ca -0.12 0.09 -0.19 0.00 -2.02 0.00 0.00 58.31 56.07 3kym n LYS 76 Cb 0.38 -1.50 -0.08 0.00 -0.02 0.00 0.00 35.03 33.81 3kym n LYS 76 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3kym n ASN 77 N -1.29 -5.33 -4.78 4.39 4.13 -0.58 -4.82 115.26 106.98 3kym n ASN 77 Ca 0.10 0.47 -0.22 0.00 1.68 0.00 0.00 54.58 56.61 3kym n ASN 77 Cb 0.17 -4.53 -0.05 0.00 -1.54 0.00 0.00 39.78 33.82 3kym n ASN 77 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 3kym s THR 78 N -2.72 3.34 -0.01 3.41 -4.23 -1.12 -2.83 115.64 111.49 3kym s THR 78 Ca 0.00 -1.56 0.05 0.00 -1.18 0.00 0.00 61.69 59.00 3kym s THR 78 Cb 0.00 -3.08 -0.01 0.00 1.34 0.00 0.00 72.50 70.75 3kym s THR 78 CO 0.00 -0.20 -0.17 -0.22 -0.54 0.00 0.00 174.62 173.49 3kym s LEU 79 N -3.89 2.05 0.11 4.79 2.96 0.12 -2.36 118.68 122.45 3kym s LEU 79 Ca 0.38 -0.33 0.09 0.00 -0.22 0.00 0.00 54.13 54.05 3kym s LEU 79 Cb -0.04 -0.87 -0.04 0.00 0.50 0.00 0.00 46.19 45.74 3kym s LEU 79 CO 0.24 0.20 -0.22 -0.31 -1.32 0.00 0.00 176.35 174.94 3kym s TYR 80 N -0.45 1.85 -0.19 5.38 1.51 0.04 -1.35 117.35 124.14 3kym s TYR 80 Ca 0.06 -0.41 -0.02 0.00 -1.01 0.00 0.00 57.07 55.69 3kym s TYR 80 Cb -0.07 -1.01 0.06 0.00 -0.11 0.00 0.00 41.96 40.83 3kym s TYR 80 CO -0.00 0.22 0.00 -1.17 -1.11 0.00 0.00 175.55 173.49 3kym s LEU 81 N -1.93 1.50 -0.24 -1.29 2.96 -1.12 -2.39 118.68 116.17 3kym s LEU 81 Ca 0.07 -0.84 -0.28 0.00 -0.22 0.00 0.00 54.13 52.86 3kym s LEU 81 Cb -0.10 -0.75 0.01 0.00 0.50 0.00 0.00 46.19 45.85 3kym s LEU 81 CO 0.04 -0.27 0.99 -1.58 -1.32 0.00 0.00 176.35 174.21 3kym s GLN 82 N 1.74 4.22 -0.32 1.98 2.00 0.31 -1.29 119.66 128.31 3kym s GLN 82 Ca -0.02 1.23 -0.07 0.00 -2.00 0.00 0.00 55.36 54.50 3kym s GLN 82 Cb -0.17 -3.65 0.02 0.00 0.80 0.00 0.00 33.01 30.01 3kym s GLN 82 CO -0.07 -0.62 0.11 -1.64 -0.50 0.00 0.00 175.29 172.57 3kym s MET 83 N 3.13 2.96 0.28 1.67 -1.94 0.17 -0.40 119.30 125.17 3kym s MET 83 Ca 0.42 -0.96 0.08 0.00 -1.71 0.00 0.00 55.69 53.52 3kym s MET 83 Cb -0.15 -3.46 -0.04 0.00 2.01 0.00 0.00 34.83 33.20 3kym s MET 83 CO 0.07 -0.53 0.17 -0.80 -0.01 0.00 0.00 175.02 173.92 3kym s ASN 84 N 1.49 5.16 -0.83 3.03 0.01 -0.99 -0.74 114.94 122.08 3kym s ASN 84 Ca 0.02 -0.45 -0.14 0.00 -0.71 0.00 0.00 52.86 51.57 3kym s ASN 84 Cb -0.18 -1.11 0.02 0.00 0.41 0.00 0.00 41.25 40.39 3kym s ASN 84 CO 0.03 -0.13 0.52 -1.20 -1.51 0.00 0.00 177.10 174.81 3kym n SER 85 N -1.16 -3.64 -4.74 -1.22 7.64 -0.98 -4.77 113.62 104.75 3kym n SER 85 Ca -0.06 -0.94 -0.41 0.00 1.01 0.00 0.00 58.87 58.48 3kym n SER 85 Cb 0.59 -1.30 -0.04 0.00 -1.01 0.00 0.00 64.21 62.45 3kym n SER 85 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3kym s LEU 86 N -5.72 4.53 -0.06 -3.43 1.43 -1.19 -4.67 118.68 109.56 3kym s LEU 86 Ca 0.20 1.98 0.04 0.00 -1.03 0.00 0.00 54.13 55.32 3kym s LEU 86 Cb -0.11 -3.60 -0.02 0.00 0.03 0.00 0.00 46.19 42.49 3kym s LEU 86 CO 0.77 -0.10 -0.17 -0.13 0.23 0.00 0.00 176.35 176.95 3kym s ARG 87 N -0.47 2.57 0.30 1.70 0.52 -1.26 0.88 118.95 123.18 3kym s ARG 87 Ca 0.47 -0.75 0.18 0.00 -0.52 0.00 0.00 55.73 55.11 3kym s ARG 87 Cb -0.27 -2.34 1.05 0.00 0.52 0.00 0.00 34.95 33.91 3kym s ARG 87 CO 0.33 0.54 1.19 0.00 0.02 0.00 0.00 175.30 177.38 3kym n ALA 88 N 2.55 0.85 0.21 2.13 0.00 -1.26 0.43 120.51 125.42 3kym n ALA 88 Ca -0.17 0.74 0.02 0.00 0.00 0.00 0.00 53.44 54.03 3kym n ALA 88 Cb 0.52 -0.78 0.09 0.00 0.00 0.00 0.00 19.45 19.28 3kym n ALA 88 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3kym h GLU 89 N 0.00 0.00 -0.00 0.00 4.81 -1.95 -1.86 114.58 115.58 3kym h GLU 89 Ca 0.65 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.88 3kym h GLU 89 Cb 1.83 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.21 3kym h GLU 89 CO -0.52 0.00 -0.45 -0.25 -0.73 0.00 0.00 179.01 177.06 3kym n ASP 90 N -2.01 1.04 -4.65 1.04 8.00 1.49 -4.94 116.55 116.52 3kym n ASP 90 Ca -0.00 -1.02 -0.42 0.00 0.71 0.00 0.00 54.79 54.05 3kym n ASP 90 Cb 0.73 0.73 -0.03 0.00 -0.02 0.00 0.00 41.12 42.53 3kym n ASP 90 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3kym s THR 91 N -1.96 3.22 -0.00 -3.53 2.01 -0.70 -4.86 115.64 109.82 3kym s THR 91 Ca 0.08 0.27 -0.30 0.00 0.31 0.00 0.00 61.69 62.05 3kym s THR 91 Cb 0.10 -3.19 0.11 0.00 0.01 0.00 0.00 72.50 69.54 3kym s THR 91 CO 0.44 -0.04 1.27 0.00 -0.69 0.00 0.00 174.62 175.59 3kym s ALA 92 N 4.81 -2.23 -0.13 7.40 0.00 -0.72 -4.40 121.76 126.49 3kym s ALA 92 Ca 0.84 0.53 -0.13 0.00 0.00 0.00 0.00 51.96 53.20 3kym s ALA 92 Cb -0.38 0.47 -0.05 0.00 0.00 0.00 0.00 23.12 23.16 3kym s ALA 92 CO 0.37 -1.07 0.29 0.95 0.00 0.00 0.00 175.76 176.30 3kym s THR 93 N -2.39 5.29 -0.17 0.00 -4.23 -0.50 -1.46 115.64 112.18 3kym s THR 93 Ca 0.17 0.55 -0.05 0.00 -1.18 0.00 0.00 61.69 61.18 3kym s THR 93 Cb 0.04 -3.62 -0.03 0.00 1.34 0.00 0.00 72.50 70.23 3kym s THR 93 CO -0.03 0.44 -0.00 -0.31 -0.54 0.00 0.00 174.62 174.18 3kym s TYR 94 N 0.08 3.09 -0.04 3.99 1.51 -1.00 -0.91 117.35 124.07 3kym s TYR 94 Ca 0.17 -0.22 0.06 0.00 -1.01 0.00 0.00 57.07 56.07 3kym s TYR 94 Cb -0.13 -2.01 -0.02 0.00 -0.11 0.00 0.00 41.96 39.68 3kym s TYR 94 CO 0.05 -0.02 -0.21 0.71 -1.11 0.00 0.00 175.55 174.97 3kym s TYR 95 N 0.48 2.49 0.33 2.71 1.51 0.28 -2.19 117.35 122.95 3kym s TYR 95 Ca -0.01 -0.37 -0.07 0.00 -1.01 0.00 0.00 57.07 55.61 3kym s TYR 95 Cb -0.14 -1.56 -0.06 0.00 -0.11 0.00 0.00 41.96 40.09 3kym s TYR 95 CO 0.02 0.02 0.63 0.00 -1.11 0.00 0.00 175.55 175.12 3kym s ALA 97 N -2.18 -1.47 -0.00 0.00 0.00 -0.60 -2.02 121.76 115.48 3kym s ALA 97 Ca 0.47 0.79 -0.02 0.00 0.00 0.00 0.00 51.96 53.19 3kym s ALA 97 Cb -0.11 0.33 -0.04 0.00 0.00 0.00 0.00 23.12 23.30 3kym s ALA 97 CO 0.30 -0.49 0.15 0.50 0.00 0.00 0.00 175.76 176.22 3kym s ARG 98 N -2.21 3.32 0.46 0.00 3.52 0.40 0.36 118.95 124.79 3kym s ARG 98 Ca -0.06 -0.38 -0.22 0.00 -0.13 0.00 0.00 55.73 54.93 3kym s ARG 98 Cb -0.01 -3.02 -0.08 0.00 -1.56 0.00 0.00 34.95 30.29 3kym s ARG 98 CO 0.00 0.66 1.11 -2.00 -0.81 0.00 0.00 175.30 174.26 3kym s GLU 99 N -1.94 3.83 0.00 5.12 2.12 -1.06 -1.67 118.70 125.10 3kym s GLU 99 Ca 0.27 1.62 0.00 0.00 0.36 0.00 0.00 54.97 57.21 3kym s GLU 99 Cb -0.12 -2.35 0.00 0.00 0.26 0.00 0.00 34.13 31.92 3kym s GLU 99 CO 0.18 -0.45 0.00 0.41 -0.54 0.00 0.00 175.26 174.86 3kym n GLY 100 N 0.28 -1.75 2.37 -1.50 0.00 0.47 -4.42 105.19 100.63 3kym n GLY 100 Ca 0.07 -0.23 -0.32 0.00 0.00 0.00 0.00 46.02 45.54 3kym n GLY 100 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3kym n HIS 101 N 0.00 1.90 0.00 1.61 -0.00 -1.26 -4.74 115.22 112.73 3kym n HIS 101 Ca 0.00 -2.46 0.00 0.00 -0.00 0.00 0.00 57.72 55.26 3kym n HIS 101 Cb 0.00 -1.84 0.00 0.00 -0.00 0.00 0.00 29.99 28.15 3kym n HIS 101 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.34 176.43 3kym n ASN 102 N 2.06 0.00 -4.79 0.26 4.13 -1.26 -5.00 115.26 110.66 3kym n ASN 102 Ca 0.60 0.00 -0.38 0.00 1.68 0.00 0.00 54.58 56.47 3kym n ASN 102 Cb 0.42 -0.01 -0.06 0.00 -1.54 0.00 0.00 39.78 38.59 3kym n ASN 102 CO 0.00 0.00 0.00 -1.81 0.28 0.00 0.00 177.26 175.73 3kym s ASP 103 N -1.70 7.32 0.00 6.41 1.01 -1.26 -4.85 116.67 123.60 3kym s ASP 103 Ca 0.00 1.61 0.00 0.00 0.71 0.00 0.00 52.55 54.87 3kym s ASP 103 Cb 0.00 -2.49 0.00 0.00 1.01 0.00 0.00 42.92 41.44 3kym s ASP 103 CO 0.00 0.15 0.00 0.79 0.21 0.00 0.00 175.17 176.32 3kym n TRP 104 N 1.32 0.00 -4.48 4.23 5.03 -1.26 -3.62 117.44 118.66 3kym n TRP 104 Ca -0.04 0.00 -0.26 0.00 3.03 0.00 0.00 57.50 60.22 3kym n TRP 104 Cb 0.49 -0.01 -0.10 0.00 -1.03 0.00 0.00 31.31 30.66 3kym n TRP 104 CO 0.00 0.00 0.00 1.52 -0.03 0.00 0.00 177.69 179.18 3kym s TYR 105 N 0.06 2.50 -0.44 -5.99 -0.85 -1.26 -4.98 117.35 106.38 3kym s TYR 105 Ca 0.00 -0.55 -0.11 0.00 -0.52 0.00 0.00 57.07 55.89 3kym s TYR 105 Cb 0.00 -1.60 0.09 0.00 0.38 0.00 0.00 41.96 40.82 3kym s TYR 105 CO 0.00 0.47 0.31 -0.06 -1.52 0.00 0.00 175.55 174.75 3kym s PHE 106 N -2.62 3.33 -0.62 -3.49 0.08 -1.26 -0.39 117.98 113.01 3kym s PHE 106 Ca 0.35 -1.46 0.23 0.00 0.12 0.00 0.00 56.93 56.17 3kym s PHE 106 Cb 0.05 -3.12 0.16 0.00 -0.57 0.00 0.00 43.02 39.53 3kym s PHE 106 CO 0.18 -0.87 1.13 -0.40 -0.10 0.00 0.00 175.22 175.17 3kym n ASP 107 N 4.98 0.64 -3.70 1.36 5.75 -0.67 -4.88 116.55 120.03 3kym n ASP 107 Ca -0.10 -0.08 -0.11 0.00 -0.01 0.00 0.00 54.79 54.48 3kym n ASP 107 Cb 0.43 0.56 -0.12 0.00 -1.03 0.00 0.00 41.12 40.96 3kym n ASP 107 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 3kym s LEU 108 N -4.04 0.01 -0.04 -2.12 2.96 -1.25 -5.01 118.68 109.19 3kym s LEU 108 Ca 0.05 0.76 0.05 0.00 -0.22 0.00 0.00 54.13 54.76 3kym s LEU 108 Cb 0.14 1.09 -0.01 0.00 0.50 0.00 0.00 46.19 47.92 3kym s LEU 108 CO 0.77 -0.19 -0.18 0.26 -1.32 0.00 0.00 176.35 175.69 3kym s TRP 109 N 1.55 1.80 0.14 5.38 0.52 -1.26 -0.45 118.94 126.61 3kym s TRP 109 Ca -0.08 -0.49 -0.02 0.00 0.02 0.00 0.00 56.10 55.52 3kym s TRP 109 Cb -0.10 -1.20 0.03 0.00 -1.15 0.00 0.00 33.47 31.06 3kym s TRP 109 CO -0.11 -0.15 0.19 0.41 0.02 0.00 0.00 176.95 177.31 3kym n GLY 110 N 3.04 -1.18 0.09 0.98 0.00 -0.86 -4.80 105.19 102.47 3kym n GLY 110 Ca -0.18 -1.68 -0.04 0.00 0.00 0.00 0.00 46.02 44.13 3kym n GLY 110 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3kym h ARG 111 N 0.00 0.00 0.00 1.61 1.12 -1.89 -3.46 114.38 111.77 3kym h ARG 111 Ca -0.06 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.81 3kym h ARG 111 Cb 0.17 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.13 3kym h ARG 111 CO 0.04 0.69 0.00 0.41 -3.11 0.00 0.00 179.97 178.00 3kym n GLY 112 N 1.35 2.28 2.87 2.80 0.00 -1.26 -5.03 105.19 108.20 3kym n GLY 112 Ca -0.03 -1.75 -0.19 0.00 0.00 0.00 0.00 46.02 44.05 3kym n GLY 112 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3kym s THR 113 N -2.04 0.45 0.14 2.61 -4.23 -0.93 -4.87 115.64 106.77 3kym s THR 113 Ca 0.00 -0.07 -0.30 0.00 -1.18 0.00 0.00 61.69 60.14 3kym s THR 113 Cb 0.00 -0.49 -0.07 0.00 1.34 0.00 0.00 72.50 73.28 3kym s THR 113 CO 0.00 0.21 1.17 -0.22 -0.54 0.00 0.00 174.62 175.23 3kym s LEU 114 N 0.95 4.44 -0.16 4.79 2.96 -1.26 -2.38 118.68 128.01 3kym s LEU 114 Ca -0.11 2.12 -0.00 0.00 -0.22 0.00 0.00 54.13 55.92 3kym s LEU 114 Cb -0.14 -3.60 0.04 0.00 0.50 0.00 0.00 46.19 42.99 3kym s LEU 114 CO -0.00 -0.36 -0.08 -0.69 -1.32 0.00 0.00 176.35 173.90 3kym s VAL 115 N 0.24 1.29 -0.38 1.68 1.01 -0.54 -0.14 120.40 123.56 3kym s VAL 115 Ca 0.54 -0.68 -0.01 0.00 0.00 0.00 0.00 61.98 61.83 3kym s VAL 115 Cb -0.31 -1.39 0.10 0.00 0.00 0.00 0.00 36.38 34.79 3kym s VAL 115 CO 0.34 0.22 0.15 -0.89 0.00 0.00 0.00 175.10 174.91 3kym s THR 116 N 1.56 2.95 -0.87 3.92 2.01 -0.89 -1.75 115.64 122.57 3kym s THR 116 Ca 0.01 -2.12 -0.22 0.00 0.31 0.00 0.00 61.69 59.67 3kym s THR 116 Cb -0.15 -3.05 0.08 0.00 0.01 0.00 0.00 72.50 69.39 3kym s THR 116 CO -0.08 -0.64 1.20 -0.69 -0.69 0.00 0.00 174.62 173.72 3kym s VAL 117 N 1.07 4.28 0.02 3.82 1.01 -1.26 -1.42 120.40 127.92 3kym s VAL 117 Ca 0.09 -0.82 -0.17 0.00 0.00 0.00 0.00 61.98 61.08 3kym s VAL 117 Cb -0.21 -4.85 0.03 0.00 0.00 0.00 0.00 36.38 31.34 3kym s VAL 117 CO -0.05 -1.66 0.38 -0.55 0.00 0.00 0.00 175.10 173.21 3kym s SER 118 N 4.04 -0.25 0.00 3.32 0.15 0.08 -4.35 113.70 116.69 3kym s SER 118 Ca 0.34 0.03 0.24 0.00 0.70 0.00 0.00 55.95 57.27 3kym s SER 118 Cb -0.07 0.38 0.32 0.00 -1.71 0.00 0.00 66.02 64.94 3kym s SER 118 CO -0.02 -0.59 1.33 -1.54 1.20 0.00 0.00 173.24 173.62 3kym n SER 119 N 0.78 2.82 -4.78 5.45 3.41 -1.26 -4.11 113.62 115.92 3kym n SER 119 Ca -0.19 -1.93 -0.37 0.00 -0.26 0.00 0.00 58.87 56.11 3kym n SER 119 Cb 0.58 -0.01 -0.04 0.00 -0.26 0.00 0.00 64.21 64.48 3kym n SER 119 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3kym s ALA 120 N -1.98 3.16 0.41 7.33 0.00 -1.26 -5.05 121.76 124.38 3kym s ALA 120 Ca 0.30 0.73 -0.17 0.00 0.00 0.00 0.00 51.96 52.82 3kym s ALA 120 Cb 0.20 -3.28 -0.09 0.00 0.00 0.00 0.00 23.12 19.95 3kym s ALA 120 CO 0.31 -0.17 0.87 -1.12 0.00 0.00 0.00 175.76 175.64 3kym s SER 121 N -1.42 6.77 0.26 0.00 0.01 -1.26 -5.03 113.70 113.02 3kym s SER 121 Ca 0.54 1.47 -0.31 0.00 1.31 0.00 0.00 55.95 58.97 3kym s SER 121 Cb -0.24 -2.45 -0.13 0.00 0.21 0.00 0.00 66.02 63.41 3kym s SER 121 CO 0.30 -0.36 1.41 0.41 0.41 0.00 0.00 173.24 175.41 3kym n THR 122 N -0.82 1.09 -3.72 1.44 -1.04 -1.26 -4.82 114.28 105.15 3kym n THR 122 Ca 0.05 -0.27 -0.12 0.00 -2.04 0.00 0.00 64.05 61.67 3kym n THR 122 Cb 0.54 -1.54 -0.13 0.00 -1.82 0.00 0.00 70.33 67.38 3kym n THR 122 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 3kym s LYS 123 N -0.61 0.21 0.33 -2.82 2.20 0.49 -4.97 119.74 114.58 3kym s LYS 123 Ca 0.66 0.55 -0.28 0.00 -0.36 0.00 0.00 55.97 56.54 3kym s LYS 123 Cb -0.62 -0.11 -0.10 0.00 -1.51 0.00 0.00 37.83 35.49 3kym s LYS 123 CO 0.51 -0.17 1.24 0.20 -0.36 0.00 0.00 175.35 176.77 3kym s GLY 124 N 1.32 2.99 1.10 5.54 0.00 -1.26 -1.65 107.32 115.35 3kym s GLY 124 Ca -0.09 1.14 -0.17 0.00 0.00 0.00 0.00 44.72 45.60 3kym s GLY 124 CO -0.09 1.75 1.14 2.56 0.00 0.00 0.00 173.10 178.46 3kym s PRO 125 N -1.82 -0.41 -0.07 2.90 0.05 -1.26 -4.74 135.00 129.65 3kym s PRO 125 Ca 0.50 0.03 0.03 0.00 0.05 0.00 0.00 61.00 61.61 3kym s PRO 125 Cb -0.37 -1.68 0.01 0.00 0.05 0.00 0.00 34.50 32.51 3kym s PRO 125 CO 0.48 -3.19 -0.15 -1.12 0.05 0.00 0.00 177.00 173.07 3kym s SER 126 N -3.96 2.04 -0.26 6.66 0.01 0.12 -4.90 113.70 113.42 3kym s SER 126 Ca 0.69 -0.35 -0.09 0.00 1.31 0.00 0.00 55.95 57.51 3kym s SER 126 Cb -0.11 -0.94 -0.04 0.00 0.21 0.00 0.00 66.02 65.14 3kym s SER 126 CO 0.56 0.06 0.12 -0.69 0.41 0.00 0.00 173.24 173.69 3kym s VAL 127 N 0.60 4.78 -0.03 3.43 1.01 -1.26 -0.97 120.40 127.97 3kym s VAL 127 Ca -0.15 -0.01 0.06 0.00 0.00 0.00 0.00 61.98 61.88 3kym s VAL 127 Cb -0.16 -3.25 -0.01 0.00 0.00 0.00 0.00 36.38 32.96 3kym s VAL 127 CO 0.05 0.31 -0.22 -0.36 0.00 0.00 0.00 175.10 174.88 3kym s PHE 128 N 1.56 2.08 0.56 5.22 0.08 -0.83 -4.96 117.98 121.70 3kym s PHE 128 Ca 0.06 -0.48 -0.21 0.00 0.12 0.00 0.00 56.93 56.42 3kym s PHE 128 Cb -0.15 -1.35 -0.04 0.00 -0.57 0.00 0.00 43.02 40.90 3kym s PHE 128 CO 0.06 -0.10 1.36 -1.25 -0.10 0.00 0.00 175.22 175.20 3kym s PRO 129 N -0.35 3.04 -0.19 0.24 0.04 -1.26 -0.44 135.00 136.08 3kym s PRO 129 Ca 0.04 2.24 0.01 0.00 0.04 0.00 0.00 61.00 63.33 3kym s PRO 129 Cb -0.10 -2.20 0.03 0.00 0.04 0.00 0.00 34.50 32.26 3kym s PRO 129 CO 0.01 -1.27 -0.16 -0.51 0.04 0.00 0.00 177.00 175.11 3kym s LEU 130 N -3.65 2.24 -0.04 -3.56 1.02 -0.37 -4.77 118.68 109.55 3kym s LEU 130 Ca 0.73 -0.75 -0.13 0.00 0.02 0.00 0.00 54.13 53.99 3kym s LEU 130 Cb -0.41 -1.39 0.02 0.00 0.02 0.00 0.00 46.19 44.44 3kym s LEU 130 CO 0.47 -0.06 0.30 0.00 0.02 0.00 0.00 176.35 177.08 3kym s ALA 131 N 1.32 -0.75 0.12 4.21 0.00 -1.26 -0.92 121.76 124.48 3kym s ALA 131 Ca 0.02 0.42 -0.30 0.00 0.00 0.00 0.00 51.96 52.10 3kym s ALA 131 Cb -0.14 -0.06 -0.07 0.00 0.00 0.00 0.00 23.12 22.85 3kym s ALA 131 CO -0.11 -0.23 1.20 -1.25 0.00 0.00 0.00 175.76 175.37 3kym s PRO 132 N -0.98 4.47 -1.09 0.00 0.04 -1.26 -4.95 135.00 131.22 3kym s PRO 132 Ca -0.11 1.82 -0.19 0.00 0.04 0.00 0.00 61.00 62.56 3kym s PRO 132 Cb -0.05 -3.30 0.09 0.00 0.04 0.00 0.00 34.50 31.29 3kym s PRO 132 CO 0.03 -0.17 1.42 0.00 0.04 0.00 0.00 177.00 178.33 3kym s SER 134 N 4.12 4.21 -0.16 0.00 0.01 -1.26 -5.03 113.70 115.59 3kym s SER 134 Ca 0.44 -0.21 -0.05 0.00 1.31 0.00 0.00 55.95 57.44 3kym s SER 134 Cb -0.01 -0.90 -0.08 0.00 0.21 0.00 0.00 66.02 65.24 3kym s SER 134 CO -0.04 0.31 -0.19 -2.11 0.41 0.00 0.00 173.24 171.62 3kym n ARG 135 N 1.96 0.36 -4.27 12.44 1.85 -1.26 -5.04 116.66 122.70 3kym n ARG 135 Ca -0.17 0.13 -0.25 0.00 -1.00 0.00 0.00 57.85 56.57 3kym n ARG 135 Cb 0.52 -1.16 -0.08 0.00 -1.05 0.00 0.00 32.46 30.70 3kym n ARG 135 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 3kym s SER 136 N -6.19 4.50 0.01 2.89 0.15 -1.26 -5.05 113.70 108.74 3kym s SER 136 Ca -0.22 -0.55 0.00 0.00 0.70 0.00 0.00 55.95 55.87 3kym s SER 136 Cb 0.08 -0.84 0.00 0.00 -1.71 0.00 0.00 66.02 63.54 3kym s SER 136 CO 0.31 0.06 0.00 0.35 1.20 0.00 0.00 173.24 175.16 3kym n THR 137 N -0.35 -1.08 -1.86 6.45 -2.24 -1.26 -5.03 114.28 108.92 3kym n THR 137 Ca -0.09 0.05 -0.02 0.00 -2.27 0.00 0.00 64.05 61.72 3kym n THR 137 Cb 0.57 -0.86 0.01 0.00 -2.10 0.00 0.00 70.33 67.94 3kym n THR 137 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 3kym n SER 138 N -0.58 -3.14 0.00 3.42 2.88 -1.26 -5.02 113.62 109.92 3kym n SER 138 Ca 0.00 -0.08 0.00 0.00 -1.33 0.00 0.00 58.87 57.46 3kym n SER 138 Cb 0.00 -1.74 0.00 0.00 -0.75 0.00 0.00 64.21 61.72 3kym n SER 138 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 3kym n GLU 139 N -1.50 0.00 0.00 -1.46 1.02 -1.26 -5.19 120.64 112.25 3kym n GLU 139 Ca -0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 3kym n GLU 139 Cb 0.51 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.93 3kym n GLU 139 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 3kym n SER 140 N 0.00 0.00 -4.59 1.62 2.88 -1.26 -4.76 113.62 107.51 3kym n SER 140 Ca 0.00 0.00 -0.45 0.00 -1.33 0.00 0.00 58.87 57.09 3kym n SER 140 Cb 0.00 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.44 3kym n SER 140 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 3kym n THR 141 N 0.00 1.95 -4.05 2.46 5.66 -1.26 -4.61 114.28 114.43 3kym n THR 141 Ca 0.00 -0.49 -0.11 0.00 -3.05 0.00 0.00 64.05 60.40 3kym n THR 141 Cb 0.00 -0.99 -0.11 0.00 -1.55 0.00 0.00 70.33 67.68 3kym n THR 141 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3kym s ALA 142 N -1.02 0.47 0.01 1.79 0.00 -1.23 -4.93 121.76 116.85 3kym s ALA 142 Ca 0.59 -0.81 0.00 0.00 0.00 0.00 0.00 51.96 51.74 3kym s ALA 142 Cb -0.71 0.11 -0.01 0.00 0.00 0.00 0.00 23.12 22.51 3kym s ALA 142 CO 0.60 -0.11 -0.01 0.00 0.00 0.00 0.00 175.76 176.23 3kym s ALA 143 N -1.85 0.04 0.25 0.00 0.00 -1.26 -3.17 121.76 115.77 3kym s ALA 143 Ca -0.08 -0.19 0.01 0.00 0.00 0.00 0.00 51.96 51.70 3kym s ALA 143 Cb -0.07 0.05 -0.04 0.00 0.00 0.00 0.00 23.12 23.06 3kym s ALA 143 CO -0.01 -0.05 0.14 -0.48 0.00 0.00 0.00 175.76 175.35 3kym s LEU 144 N -0.48 1.46 0.00 0.00 0.05 -0.82 -4.48 118.68 114.41 3kym s LEU 144 Ca -0.05 -1.45 0.00 0.00 0.05 0.00 0.00 54.13 52.67 3kym s LEU 144 Cb -0.03 0.25 0.00 0.00 -2.05 0.00 0.00 46.19 44.35 3kym s LEU 144 CO -0.00 -0.84 0.00 0.61 -0.55 0.00 0.00 176.35 175.57 3kym n GLY 145 N -0.43 2.02 2.89 -3.48 0.00 -0.10 0.17 105.19 106.25 3kym n GLY 145 Ca 0.02 -0.89 -0.15 0.00 0.00 0.00 0.00 46.02 45.00 3kym n GLY 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kym s LEU 147 N 0.23 4.69 -0.69 0.00 2.96 0.42 -1.26 118.68 125.03 3kym s LEU 147 Ca -0.02 -0.73 -0.17 0.00 -0.22 0.00 0.00 54.13 52.99 3kym s LEU 147 Cb -0.04 -2.10 0.14 0.00 0.50 0.00 0.00 46.19 44.69 3kym s LEU 147 CO -0.01 -0.33 0.74 -0.69 -1.32 0.00 0.00 176.35 174.75 3kym s VAL 148 N 1.65 5.07 0.01 1.68 1.01 -0.29 -1.97 120.40 127.56 3kym s VAL 148 Ca 0.05 -1.53 0.02 0.00 0.00 0.00 0.00 61.98 60.52 3kym s VAL 148 Cb -0.18 -4.50 -0.04 0.00 0.00 0.00 0.00 36.38 31.66 3kym s VAL 148 CO 0.09 -1.11 -0.00 -0.75 0.00 0.00 0.00 175.10 173.32 3kym s LYS 149 N 1.88 2.75 -1.00 2.72 2.20 -0.14 -2.34 119.74 125.81 3kym s LYS 149 Ca 0.15 -0.64 -0.07 0.00 -0.36 0.00 0.00 55.97 55.05 3kym s LYS 149 Cb -0.19 -2.65 -0.05 0.00 -1.51 0.00 0.00 37.83 33.43 3kym s LYS 149 CO -0.00 0.61 0.87 -0.25 -0.36 0.00 0.00 175.35 176.22 3kym n ASP 150 N 1.29 -6.68 -4.56 1.43 8.00 -0.90 0.16 116.55 115.28 3kym n ASP 150 Ca -0.14 -0.64 -0.24 0.00 0.71 0.00 0.00 54.79 54.48 3kym n ASP 150 Cb 0.53 -4.99 -0.09 0.00 -0.02 0.00 0.00 41.12 36.55 3kym n ASP 150 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 3kym s TYR 151 N -3.33 2.46 -0.27 1.24 -0.85 -0.03 -4.09 117.35 112.49 3kym s TYR 151 Ca 0.38 -0.34 -0.26 0.00 -0.52 0.00 0.00 57.07 56.33 3kym s TYR 151 Cb -0.06 -1.18 0.13 0.00 0.38 0.00 0.00 41.96 41.23 3kym s TYR 151 CO 0.76 0.63 1.06 0.12 -1.52 0.00 0.00 175.55 176.61 3kym s PHE 152 N -2.47 -0.42 0.50 -3.49 5.36 -0.66 -0.34 117.98 116.45 3kym s PHE 152 Ca 0.32 0.99 -0.07 0.00 -0.96 0.00 0.00 56.93 57.21 3kym s PHE 152 Cb -0.04 0.39 0.11 0.00 -0.34 0.00 0.00 43.02 43.14 3kym s PHE 152 CO 0.17 -0.23 0.67 -0.35 -1.46 0.00 0.00 175.22 174.03 3kym n PRO 153 N 1.94 -0.45 -2.00 10.12 -0.04 -1.26 -0.38 135.00 142.93 3kym n PRO 153 Ca -0.12 -1.22 -0.34 0.00 -0.04 0.00 0.00 63.50 61.78 3kym n PRO 153 Cb 0.56 -0.64 0.02 0.00 -0.04 0.00 0.00 33.50 33.41 3kym n PRO 153 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3kym s GLU 154 N -4.38 3.12 0.47 0.54 0.41 -1.26 -4.66 118.70 112.94 3kym s GLU 154 Ca 0.40 1.41 0.07 0.00 -0.41 0.00 0.00 54.97 56.44 3kym s GLU 154 Cb -0.01 -1.99 0.00 0.00 -1.78 0.00 0.00 34.13 30.35 3kym s GLU 154 CO 0.27 -1.00 0.37 -1.25 -0.49 0.00 0.00 175.26 173.17 3kym s PRO 155 N -3.81 2.35 0.42 0.39 0.04 -1.26 -4.99 135.00 128.14 3kym s PRO 155 Ca 0.68 -1.80 0.08 0.00 0.04 0.00 0.00 61.00 60.00 3kym s PRO 155 Cb -0.20 -2.20 -0.01 0.00 0.04 0.00 0.00 34.50 32.12 3kym s PRO 155 CO 0.35 -0.38 0.41 0.54 0.04 0.00 0.00 177.00 177.96 3kym s VAL 156 N -2.63 2.74 -0.05 -0.36 0.11 -1.26 -4.51 120.40 114.43 3kym s VAL 156 Ca 0.41 -1.28 -0.02 0.00 -2.93 0.00 0.00 61.98 58.17 3kym s VAL 156 Cb -0.02 -3.00 0.03 0.00 -1.53 0.00 0.00 36.38 31.86 3kym s VAL 156 CO 0.24 -0.00 0.11 0.28 -3.33 0.00 0.00 175.10 172.40 3kym s THR 157 N -2.45 -0.04 0.00 5.04 -1.32 0.27 -4.98 115.64 112.15 3kym s THR 157 Ca 0.49 0.16 0.00 0.00 -1.21 0.00 0.00 61.69 61.14 3kym s THR 157 Cb -0.05 -0.19 0.00 0.00 -1.51 0.00 0.00 72.50 70.76 3kym s THR 157 CO 0.29 0.07 0.00 0.55 -2.21 0.00 0.00 174.62 173.32 3kym n VAL 158 N 4.03 0.00 -0.34 5.08 3.14 -1.26 -1.15 118.33 127.83 3kym n VAL 158 Ca -0.25 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.13 3kym n VAL 158 Cb 0.52 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.30 3kym n VAL 158 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 3kym n SER 159 N 0.00 -2.09 -4.37 6.55 3.41 -1.26 -4.13 113.62 111.73 3kym n SER 159 Ca 0.00 0.36 -0.28 0.00 -0.26 0.00 0.00 58.87 58.70 3kym n SER 159 Cb 0.00 -0.30 -0.13 0.00 -0.26 0.00 0.00 64.21 63.52 3kym n SER 159 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 3kym s TRP 160 N -3.69 2.19 -1.05 7.33 0.52 -1.26 -1.49 118.94 121.49 3kym s TRP 160 Ca 0.00 -0.39 -0.23 0.00 0.02 0.00 0.00 56.10 55.50 3kym s TRP 160 Cb 0.00 -1.19 0.03 0.00 -1.15 0.00 0.00 33.47 31.16 3kym s TRP 160 CO 0.00 0.31 0.43 0.09 0.02 0.00 0.00 176.95 177.80 3kym n ASN 161 N 0.94 -2.41 0.00 2.95 3.02 -0.29 -3.11 115.26 116.35 3kym n ASN 161 Ca -0.18 -1.07 0.00 0.00 -0.03 0.00 0.00 54.58 53.30 3kym n ASN 161 Cb 0.53 -1.29 0.00 0.00 -0.61 0.00 0.00 39.78 38.42 3kym n ASN 161 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3kym n SER 162 N -1.71 0.00 -2.33 6.41 3.41 -1.26 -4.22 113.62 113.92 3kym n SER 162 Ca -0.13 0.00 -0.16 0.00 -0.26 0.00 0.00 58.87 58.32 3kym n SER 162 Cb 0.48 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.33 3kym n SER 162 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3kym n GLY 163 N 0.00 -0.26 0.00 5.00 0.00 -1.26 -4.34 105.19 104.34 3kym n GLY 163 Ca 0.00 0.28 0.00 0.00 0.00 0.00 0.00 46.02 46.30 3kym n GLY 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kym n ALA 164 N 4.09 0.00 -2.30 4.61 0.00 -1.26 -4.69 120.51 120.96 3kym n ALA 164 Ca 0.35 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.40 3kym n ALA 164 Cb 0.05 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.52 3kym n ALA 164 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3kym n LEU 165 N 0.00 7.17 0.00 0.00 4.32 -1.18 -4.95 117.00 122.36 3kym n LEU 165 Ca 0.00 -5.13 0.00 0.00 -0.02 0.00 0.00 56.01 50.86 3kym n LEU 165 Cb 0.00 -1.05 0.00 0.00 -1.62 0.00 0.00 43.42 40.75 3kym n LEU 165 CO 0.00 1.94 0.00 1.07 -1.22 0.00 0.00 177.39 179.18 3kym n THR 166 N -0.32 0.00 -2.15 -5.08 5.66 -1.26 -4.77 114.28 106.36 3kym n THR 166 Ca 0.49 0.00 -0.04 0.00 -3.05 0.00 0.00 64.05 61.46 3kym n THR 166 Cb 0.27 0.00 0.02 0.00 -1.55 0.00 0.00 70.33 69.07 3kym n THR 166 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 3kym n SER 167 N 0.00 -3.96 -3.23 1.09 2.88 -1.26 -4.71 113.62 104.43 3kym n SER 167 Ca 0.00 -0.18 -0.17 0.00 -1.33 0.00 0.00 58.87 57.19 3kym n SER 167 Cb 0.00 -2.44 0.02 0.00 -0.75 0.00 0.00 64.21 61.03 3kym n SER 167 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3kym n GLY 168 N -1.36 -0.53 2.83 0.46 0.00 -1.26 -4.87 105.19 100.46 3kym n GLY 168 Ca -0.02 0.66 -0.04 0.00 0.00 0.00 0.00 46.02 46.63 3kym n GLY 168 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3kym n VAL 169 N 0.47-10.58 -5.02 1.61 0.31 -1.23 -2.96 118.33 100.93 3kym n VAL 169 Ca -0.02 1.42 -0.29 0.00 -0.01 0.00 0.00 64.34 65.44 3kym n VAL 169 Cb 0.52 -6.53 -0.17 0.00 -0.91 0.00 0.00 33.84 26.75 3kym n VAL 169 CO 0.00 0.00 0.00 -1.00 -1.32 0.00 0.00 176.83 174.51 3kym s HIS 170 N -1.81 2.17 -0.20 3.52 3.76 -0.28 -5.01 115.29 117.44 3kym s HIS 170 Ca 0.08 -0.83 0.01 0.00 -0.15 0.00 0.00 55.06 54.17 3kym s HIS 170 Cb -0.02 -1.48 0.04 0.00 1.11 0.00 0.00 32.58 32.23 3kym s HIS 170 CO 0.71 -0.34 -0.13 0.99 -0.85 0.00 0.00 174.74 175.13 3kym s THR 171 N 0.34 1.82 0.40 1.30 2.01 -1.26 -1.22 115.64 119.02 3kym s THR 171 Ca -0.15 -1.06 -0.25 0.00 0.31 0.00 0.00 61.69 60.54 3kym s THR 171 Cb -0.16 -1.82 -0.09 0.00 0.01 0.00 0.00 72.50 70.44 3kym s THR 171 CO 0.06 0.25 1.11 -0.36 -0.69 0.00 0.00 174.62 174.99 3kym s PHE 172 N 1.33 3.18 0.54 4.92 0.40 -0.58 -5.02 117.98 122.75 3kym s PHE 172 Ca -0.01 1.60 -0.22 0.00 -0.60 0.00 0.00 56.93 57.71 3kym s PHE 172 Cb -0.16 -3.27 -0.05 0.00 0.51 0.00 0.00 43.02 40.05 3kym s PHE 172 CO -0.09 -0.98 1.34 -1.25 0.70 0.00 0.00 175.22 174.94 3kym s PRO 173 N -2.35 3.20 0.49 0.24 0.04 -1.26 -4.60 135.00 130.76 3kym s PRO 173 Ca 0.57 2.18 -0.21 0.00 0.04 0.00 0.00 61.00 63.58 3kym s PRO 173 Cb -0.27 -2.27 -0.07 0.00 0.04 0.00 0.00 34.50 31.93 3kym s PRO 173 CO 0.34 -1.13 1.11 0.00 0.04 0.00 0.00 177.00 177.36 3kym s ALA 174 N -1.33 2.85 -0.09 8.56 0.00 -1.26 -4.83 121.76 125.65 3kym s ALA 174 Ca 0.71 0.80 0.00 0.00 0.00 0.00 0.00 51.96 53.47 3kym s ALA 174 Cb -0.39 -3.34 -0.03 0.00 0.00 0.00 0.00 23.12 19.37 3kym s ALA 174 CO 0.46 -0.59 -0.09 0.08 0.00 0.00 0.00 175.76 175.63 3kym s VAL 175 N -1.74 3.53 -0.38 0.00 1.01 0.17 -4.92 120.40 118.08 3kym s VAL 175 Ca 0.68 -0.53 -0.26 0.00 0.00 0.00 0.00 61.98 61.87 3kym s VAL 175 Cb -0.23 -2.46 0.02 0.00 0.00 0.00 0.00 36.38 33.70 3kym s VAL 175 CO 0.28 0.57 0.94 -0.22 0.00 0.00 0.00 175.10 176.67 3kym s LEU 176 N -0.44 3.98 0.00 3.92 2.96 -1.26 -1.89 118.68 125.95 3kym s LEU 176 Ca 0.06 0.56 -0.18 0.00 -0.22 0.00 0.00 54.13 54.35 3kym s LEU 176 Cb -0.12 -3.28 0.25 0.00 0.50 0.00 0.00 46.19 43.54 3kym s LEU 176 CO 0.02 -0.89 1.14 0.00 -1.32 0.00 0.00 176.35 175.30 3kym n GLN 177 N 6.85 -2.14 0.02 1.98 6.02 0.17 -4.99 117.38 125.29 3kym n GLN 177 Ca 0.07 -1.79 -0.08 0.00 -0.01 0.00 0.00 57.00 55.19 3kym n GLN 177 Cb 0.48 -1.42 0.07 0.00 1.02 0.00 0.00 30.24 30.40 3kym n GLN 177 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 3kym h SER 178 N -2.14 0.56 -4.40 1.08 4.64 -1.96 -3.40 113.55 107.92 3kym h SER 178 Ca -0.40 -0.30 -0.50 0.00 -0.47 0.00 0.00 61.79 60.13 3kym h SER 178 Cb 1.15 -0.16 0.08 0.00 -0.31 0.00 0.00 62.40 63.15 3kym h SER 178 CO 0.27 0.99 0.41 -0.94 -0.87 0.00 0.00 176.83 176.69 3kym s SER 179 N -6.91 5.67 0.00 4.97 1.04 -1.26 -4.94 113.70 112.27 3kym s SER 179 Ca -0.07 1.31 0.04 0.00 0.48 0.00 0.00 55.95 57.71 3kym s SER 179 Cb 0.12 -2.21 0.25 0.00 0.10 0.00 0.00 66.02 64.28 3kym s SER 179 CO 0.83 -1.22 0.61 0.61 0.98 0.00 0.00 173.24 175.05 3kym n GLY 180 N -2.73 -0.24 3.92 7.32 0.00 -1.26 -4.83 105.19 107.36 3kym n GLY 180 Ca 0.07 -0.03 -0.30 0.00 0.00 0.00 0.00 46.02 45.76 3kym n GLY 180 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kym s LEU 181 N -1.54 4.28 0.44 0.99 1.43 -1.26 -4.75 118.68 118.26 3kym s LEU 181 Ca 0.06 0.43 -0.09 0.00 -1.03 0.00 0.00 54.13 53.51 3kym s LEU 181 Cb 0.03 -3.17 -0.05 0.00 0.03 0.00 0.00 46.19 43.03 3kym s LEU 181 CO 0.05 0.04 0.79 -0.31 0.23 0.00 0.00 176.35 177.15 3kym s TYR 182 N -1.71 3.51 -0.13 0.29 1.51 0.53 -0.65 117.35 120.71 3kym s TYR 182 Ca 0.38 0.98 -0.22 0.00 -1.01 0.00 0.00 57.07 57.20 3kym s TYR 182 Cb -0.12 -2.41 0.05 0.00 -0.11 0.00 0.00 41.96 39.38 3kym s TYR 182 CO 0.27 -0.19 0.56 0.45 -1.11 0.00 0.00 175.55 175.53 3kym s SER 183 N -3.51 -0.54 0.24 2.29 0.15 -0.79 -0.85 113.70 110.68 3kym s SER 183 Ca 0.50 0.83 -0.13 0.00 0.70 0.00 0.00 55.95 57.85 3kym s SER 183 Cb -0.10 0.82 -0.00 0.00 -1.71 0.00 0.00 66.02 65.03 3kym s SER 183 CO 0.37 -0.37 0.46 -1.48 1.20 0.00 0.00 173.24 173.42 3kym s LEU 184 N -0.44 0.37 0.11 3.45 0.05 -0.99 -0.65 118.68 120.58 3kym s LEU 184 Ca -0.06 -0.90 0.08 0.00 0.05 0.00 0.00 54.13 53.30 3kym s LEU 184 Cb -0.03 1.71 -0.04 0.00 -2.05 0.00 0.00 46.19 45.78 3kym s LEU 184 CO 0.04 -1.11 -0.16 -0.44 -0.55 0.00 0.00 176.35 174.14 3kym s SER 185 N -3.01 4.02 -0.08 1.48 0.01 -1.26 -1.14 113.70 113.72 3kym s SER 185 Ca 0.21 -0.50 0.02 0.00 1.31 0.00 0.00 55.95 57.00 3kym s SER 185 Cb -0.00 -0.63 0.01 0.00 0.21 0.00 0.00 66.02 65.61 3kym s SER 185 CO 0.08 0.18 -0.15 -0.55 0.41 0.00 0.00 173.24 173.21 3kym s SER 186 N -2.10 2.14 0.22 2.44 0.15 -0.39 -1.52 113.70 114.63 3kym s SER 186 Ca 0.19 -0.37 0.10 0.00 0.70 0.00 0.00 55.95 56.57 3kym s SER 186 Cb -0.11 -0.98 -0.05 0.00 -1.71 0.00 0.00 66.02 63.18 3kym s SER 186 CO 0.11 0.05 -0.19 0.68 1.20 0.00 0.00 173.24 175.08 3kym s VAL 187 N 0.69 2.12 -0.15 4.45 -7.23 -0.36 -0.31 120.40 119.61 3kym s VAL 187 Ca -0.13 -2.17 -0.01 0.00 -1.81 0.00 0.00 61.98 57.86 3kym s VAL 187 Cb -0.16 -2.09 0.04 0.00 0.56 0.00 0.00 36.38 34.73 3kym s VAL 187 CO 0.03 -0.37 -0.05 0.54 -0.31 0.00 0.00 175.10 174.94 3kym s VAL 188 N -2.33 1.04 0.19 1.32 0.11 0.13 -1.13 120.40 119.72 3kym s VAL 188 Ca 0.23 -0.52 -0.01 0.00 -2.93 0.00 0.00 61.98 58.75 3kym s VAL 188 Cb -0.05 -1.19 -0.04 0.00 -1.53 0.00 0.00 36.38 33.57 3kym s VAL 188 CO 0.10 0.18 0.38 0.28 -3.33 0.00 0.00 175.10 172.71 3kym s THR 189 N 1.67 5.21 -0.25 5.04 -1.32 -1.16 -1.94 115.64 122.90 3kym s THR 189 Ca 0.02 -0.33 -0.29 0.00 -1.21 0.00 0.00 61.69 59.88 3kym s THR 189 Cb -0.15 -3.72 0.17 0.00 -1.51 0.00 0.00 72.50 67.29 3kym s THR 189 CO -0.08 -0.14 1.22 0.68 -2.21 0.00 0.00 174.62 174.10 3kym s VAL 190 N -1.83 0.00 -0.35 5.08 -7.23 -1.19 -3.91 120.40 110.97 3kym s VAL 190 Ca 0.38 0.00 -0.33 0.00 -1.81 0.00 0.00 61.98 60.23 3kym s VAL 190 Cb -0.11 -1.00 -0.14 0.00 0.56 0.00 0.00 36.38 35.69 3kym s VAL 190 CO 0.28 0.00 1.12 -2.65 -0.31 0.00 0.00 175.10 173.54 3kym n PRO 191 N 0.85 0.00 0.00 4.82 -0.02 -1.26 -3.55 135.00 135.84 3kym n PRO 191 Ca -0.06 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.42 3kym n PRO 191 Cb 0.58 -1.05 0.00 0.00 -0.02 0.00 0.00 33.50 33.02 3kym n PRO 191 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3kym n SER 192 N 2.79 0.00 0.00 2.55 2.88 -1.26 -2.85 113.62 117.73 3kym n SER 192 Ca 0.22 0.79 0.01 0.00 -1.33 0.00 0.00 58.87 58.56 3kym n SER 192 Cb -0.04 -0.29 0.06 0.00 -0.75 0.00 0.00 64.21 63.20 3kym n SER 192 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 3kym n SER 193 N -1.58 0.00 -3.40 -3.46 2.88 -1.26 -2.68 113.62 104.12 3kym n SER 193 Ca 0.00 0.33 -0.38 0.00 -1.33 0.00 0.00 58.87 57.49 3kym n SER 193 Cb 0.00 -0.35 0.01 0.00 -0.75 0.00 0.00 64.21 63.12 3kym n SER 193 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 3kym n ASN 194 N -1.35 6.75 -3.19 -3.46 3.02 -1.13 -4.72 115.26 111.18 3kym n ASN 194 Ca 0.01 -3.71 -0.36 0.00 -0.03 0.00 0.00 54.58 50.49 3kym n ASN 194 Cb 0.02 -1.02 0.01 0.00 -0.61 0.00 0.00 39.78 38.18 3kym n ASN 194 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 3kym n PHE 195 N -0.15 3.17 0.00 3.10 3.72 -1.09 -4.84 117.46 121.36 3kym n PHE 195 Ca 0.44 -2.87 0.00 0.00 -0.05 0.00 0.00 57.45 54.97 3kym n PHE 195 Cb 0.29 -0.92 0.00 0.00 -0.94 0.00 0.00 39.48 37.92 3kym n PHE 195 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3kym n GLY 196 N -0.26 -3.22 0.00 1.37 0.00 -1.26 -4.90 105.19 96.92 3kym n GLY 196 Ca 0.44 0.41 0.00 0.00 0.00 0.00 0.00 46.02 46.88 3kym n GLY 196 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3kym n THR 197 N -1.28 0.00 -0.21 2.61 -1.04 -1.26 -5.00 114.28 108.10 3kym n THR 197 Ca 0.00 0.00 -0.00 0.00 -2.04 0.00 0.00 64.05 62.01 3kym n THR 197 Cb 0.00 -0.05 -0.00 0.00 -1.82 0.00 0.00 70.33 68.46 3kym n THR 197 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3kym n GLN 198 N -0.87 -1.97 0.00 -2.82 1.13 -1.26 -4.57 117.38 107.02 3kym n GLN 198 Ca 0.00 0.09 0.00 0.00 -1.94 0.00 0.00 57.00 55.15 3kym n GLN 198 Cb 0.00 -2.98 0.00 0.00 0.11 0.00 0.00 30.24 27.37 3kym n GLN 198 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 3kym n THR 199 N -0.38 0.00 -2.92 5.09 -2.24 -1.26 -4.67 114.28 107.90 3kym n THR 199 Ca -0.00 0.00 -0.44 0.00 -2.27 0.00 0.00 64.05 61.34 3kym n THR 199 Cb 0.09 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.28 3kym n THR 199 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 3kym s TYR 200 N 0.00 2.87 0.04 4.78 1.51 -1.26 -4.83 117.35 120.46 3kym s TYR 200 Ca 0.00 -0.90 0.04 0.00 -1.01 0.00 0.00 57.07 55.19 3kym s TYR 200 Cb 0.00 -4.25 -0.04 0.00 -0.11 0.00 0.00 41.96 37.56 3kym s TYR 200 CO 0.00 -1.55 -0.03 0.95 -1.11 0.00 0.00 175.55 173.81 3kym s THR 201 N 3.39 3.87 -0.11 -0.71 -4.23 -1.26 -1.13 115.64 115.45 3kym s THR 201 Ca 0.24 -0.85 0.02 0.00 -1.18 0.00 0.00 61.69 59.92 3kym s THR 201 Cb -0.14 -2.76 -0.01 0.00 1.34 0.00 0.00 72.50 70.93 3kym s THR 201 CO 0.03 0.27 -0.17 0.00 -0.54 0.00 0.00 174.62 174.21 3kym s ASN 203 N 0.21 6.16 -0.01 0.00 -0.87 -0.56 -1.45 114.94 118.42 3kym s ASN 203 Ca -0.10 -1.01 -0.08 0.00 -1.57 0.00 0.00 52.86 50.10 3kym s ASN 203 Cb -0.16 -2.21 -0.05 0.00 -0.02 0.00 0.00 41.25 38.82 3kym s ASN 203 CO 0.06 -0.63 0.27 -0.69 -2.57 0.00 0.00 177.10 173.53 3kym s VAL 204 N 1.94 5.30 -0.12 1.60 1.01 0.12 -4.06 120.40 126.18 3kym s VAL 204 Ca 0.08 0.27 -0.08 0.00 0.00 0.00 0.00 61.98 62.25 3kym s VAL 204 Cb -0.21 -3.56 0.04 0.00 0.00 0.00 0.00 36.38 32.66 3kym s VAL 204 CO 0.10 0.43 0.29 -0.62 0.00 0.00 0.00 175.10 175.31 3kym s ASP 205 N -1.51 -0.32 -0.29 3.32 2.15 -0.30 -1.32 116.67 118.40 3kym s ASP 205 Ca 0.25 0.61 -0.04 0.00 0.43 0.00 0.00 52.55 53.81 3kym s ASP 205 Cb -0.13 0.55 0.10 0.00 -0.30 0.00 0.00 42.92 43.13 3kym s ASP 205 CO 0.14 -0.14 0.13 -2.28 -0.17 0.00 0.00 175.17 172.84 3kym s HIS 206 N 0.85 0.43 0.27 -5.34 5.65 -0.74 -0.57 115.29 115.84 3kym s HIS 206 Ca -0.06 -0.92 -0.02 0.00 0.25 0.00 0.00 55.06 54.31 3kym s HIS 206 Cb -0.07 -0.96 0.36 0.00 -1.18 0.00 0.00 32.58 30.73 3kym s HIS 206 CO -0.06 -0.82 1.81 0.87 -0.65 0.00 0.00 174.74 175.89 3kym h LYS 207 N 8.38 0.88 0.00 2.88 6.56 -1.86 -0.44 116.57 132.97 3kym h LYS 207 Ca -0.19 -0.18 -0.04 0.00 -1.06 0.00 0.00 60.65 59.17 3kym h LYS 207 Cb 1.02 -0.13 -0.01 0.00 -0.57 0.00 0.00 32.23 32.54 3kym h LYS 207 CO 0.44 0.79 -0.19 -1.35 -2.06 0.00 0.00 179.45 177.07 3kym h PRO 208 N 0.84 0.00 0.01 3.15 0.11 -1.92 -2.52 132.00 131.66 3kym h PRO 208 Ca 0.18 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 66.11 3kym h PRO 208 Cb 0.31 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.40 3kym h PRO 208 CO -0.00 0.19 -0.87 0.77 -0.21 0.00 0.00 178.00 177.88 3kym h SER 209 N 0.00 0.11 -3.85 -2.05 0.02 -1.62 -3.48 113.55 102.68 3kym h SER 209 Ca -0.00 -0.10 -0.36 0.00 -0.84 0.00 0.00 61.79 60.50 3kym h SER 209 Cb 0.53 -0.03 0.05 0.00 0.14 0.00 0.00 62.40 63.09 3kym h SER 209 CO 0.02 0.92 -0.53 -3.20 -1.14 0.00 0.00 176.83 172.91 3kym n ASN 210 N -3.58 -5.56 -4.50 3.07 2.85 -0.27 -4.92 115.26 102.34 3kym n ASN 210 Ca -0.02 -0.23 -0.34 0.00 -0.11 0.00 0.00 54.58 53.88 3kym n ASN 210 Cb 0.81 -4.41 -0.12 0.00 1.24 0.00 0.00 39.78 37.30 3kym n ASN 210 CO 0.00 0.00 0.00 0.42 -2.11 0.00 0.00 177.26 175.57 3kym s THR 211 N -3.09 3.67 -0.24 -0.44 -4.23 -1.05 -5.00 115.64 105.27 3kym s THR 211 Ca 0.24 -0.45 -0.01 0.00 -1.18 0.00 0.00 61.69 60.29 3kym s THR 211 Cb -0.11 -2.57 0.07 0.00 1.34 0.00 0.00 72.50 71.24 3kym s THR 211 CO 0.30 0.53 0.02 -0.54 -0.54 0.00 0.00 174.62 174.39 3kym s LYS 212 N 0.02 1.06 -0.16 3.99 3.01 -1.26 -1.79 119.74 124.61 3kym s LYS 212 Ca -0.01 -0.82 0.02 0.00 -1.01 0.00 0.00 55.97 54.14 3kym s LYS 212 Cb -0.14 -2.31 0.02 0.00 -1.01 0.00 0.00 37.83 34.39 3kym s LYS 212 CO 0.03 -0.71 -0.20 0.08 0.51 0.00 0.00 175.35 175.06 3kym s VAL 213 N 1.60 2.00 -0.21 3.17 1.01 -0.44 -5.01 120.40 122.53 3kym s VAL 213 Ca -0.00 -0.92 -0.05 0.00 0.00 0.00 0.00 61.98 61.01 3kym s VAL 213 Cb -0.18 -1.79 -0.02 0.00 0.00 0.00 0.00 36.38 34.39 3kym s VAL 213 CO -0.11 0.53 -0.01 -1.81 0.00 0.00 0.00 175.10 173.71 3kym s ASP 214 N 1.07 4.69 -0.09 3.32 1.01 -1.26 0.11 116.67 125.52 3kym s ASP 214 Ca -0.01 -0.26 0.04 0.00 0.71 0.00 0.00 52.55 53.03 3kym s ASP 214 Cb -0.14 -1.80 0.00 0.00 1.01 0.00 0.00 42.92 41.98 3kym s ASP 214 CO -0.07 0.03 -0.22 -0.75 0.21 0.00 0.00 175.17 174.37 3kym s LYS 215 N 1.18 2.75 -0.30 8.23 2.47 -0.53 -4.96 119.74 128.58 3kym s LYS 215 Ca 0.03 -0.81 -0.08 0.00 -1.56 0.00 0.00 55.97 53.55 3kym s LYS 215 Cb -0.14 -2.13 0.01 0.00 -1.46 0.00 0.00 37.83 34.10 3kym s LYS 215 CO 0.01 0.19 0.10 0.95 0.16 0.00 0.00 175.35 176.76 3kym s THR 216 N 0.30 4.14 0.31 3.43 -4.23 -1.26 -0.07 115.64 118.26 3kym s THR 216 Ca -0.16 -0.64 -0.26 0.00 -1.18 0.00 0.00 61.69 59.45 3kym s THR 216 Cb -0.17 -3.14 -0.10 0.00 1.34 0.00 0.00 72.50 70.44 3kym s THR 216 CO 0.07 0.06 0.93 0.54 -0.54 0.00 0.00 174.62 175.69 3kym s VAL 217 N 1.53 4.22 0.00 2.29 0.11 -0.28 -4.94 120.40 123.32 3kym s VAL 217 Ca 0.03 1.82 0.02 0.00 -2.93 0.00 0.00 61.98 60.92 3kym s VAL 217 Cb -0.17 -4.03 -0.04 0.00 -1.53 0.00 0.00 36.38 30.61 3kym s VAL 217 CO 0.03 0.17 0.00 -1.61 -3.33 0.00 0.00 175.10 170.37 3kym s GLU 218 N -1.99 2.77 0.00 1.54 2.02 -1.26 -4.36 118.70 117.42 3kym s GLU 218 Ca 0.49 -0.62 0.16 0.00 0.02 0.00 0.00 54.97 55.02 3kym s GLU 218 Cb -0.19 -2.66 0.13 0.00 0.10 0.00 0.00 34.13 31.51 3kym s GLU 218 CO 0.24 0.62 1.02 -2.13 0.02 0.00 0.00 175.26 175.03