#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 5.03 0.18 3.84 1.01 -1.25 -3.97 120.40 125.24 3kym s VAL 2 Ca 0.00 1.20 -0.13 0.00 0.00 0.00 0.00 61.98 63.06 3kym s VAL 2 Cb 0.00 -3.95 0.01 0.00 0.00 0.00 0.00 36.38 32.44 3kym s VAL 2 CO 0.00 0.14 0.39 0.00 0.00 0.00 0.00 175.10 175.63 3kym s GLN 3 N 1.70 1.24 -0.03 2.72 -2.07 -0.88 -5.02 119.66 117.33 3kym s GLN 3 Ca 0.30 -1.03 0.03 0.00 -1.82 0.00 0.00 55.36 52.84 3kym s GLN 3 Cb -0.16 0.44 -0.00 0.00 -1.09 0.00 0.00 33.01 32.20 3kym s GLN 3 CO 0.11 -0.49 -0.12 -0.51 -1.32 0.00 0.00 175.29 172.96 3kym s LEU 4 N -2.92 1.89 -0.34 2.60 1.43 -1.26 -2.67 118.68 117.40 3kym s LEU 4 Ca 0.13 -0.24 -0.01 0.00 -1.03 0.00 0.00 54.13 52.98 3kym s LEU 4 Cb 0.01 -0.69 0.12 0.00 0.03 0.00 0.00 46.19 45.67 3kym s LEU 4 CO -0.02 0.12 0.18 -0.22 0.23 0.00 0.00 176.35 176.64 3kym s LEU 5 N 0.00 1.28 0.46 1.79 0.20 -0.25 -4.00 118.68 118.16 3kym s LEU 5 Ca -0.01 -1.95 -0.17 0.00 0.69 0.00 0.00 54.13 52.69 3kym s LEU 5 Cb -0.08 -0.54 -0.09 0.00 -0.43 0.00 0.00 46.19 45.05 3kym s LEU 5 CO 0.01 -0.35 0.94 -1.83 -0.29 0.00 0.00 176.35 174.82 3kym s GLU 6 N 1.30 4.03 0.29 1.98 1.03 -1.26 -1.59 118.70 124.49 3kym s GLU 6 Ca 0.15 0.94 -0.13 0.00 0.03 0.00 0.00 54.97 55.95 3kym s GLU 6 Cb -0.21 -2.20 0.01 0.00 -0.80 0.00 0.00 34.13 30.94 3kym s GLU 6 CO -0.12 -0.14 0.58 -1.54 -1.33 0.00 0.00 175.26 172.71 3kym s SER 7 N -2.73 0.06 -0.09 0.83 1.04 0.20 -4.79 113.70 108.23 3kym s SER 7 Ca 0.59 -1.00 -0.00 0.00 0.48 0.00 0.00 55.95 56.02 3kym s SER 7 Cb -0.10 0.68 0.00 0.00 0.10 0.00 0.00 66.02 66.70 3kym s SER 7 CO 0.24 -1.31 0.08 0.61 0.98 0.00 0.00 173.24 173.84 3kym n GLY 8 N -0.46 0.77 3.90 7.32 0.00 -1.26 -2.81 105.19 112.65 3kym n GLY 8 Ca -0.03 -0.58 -0.31 0.00 0.00 0.00 0.00 46.02 45.09 3kym n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3kym s GLY 9 N -3.03 2.17 -0.01 -0.02 0.00 -1.26 -4.62 107.32 100.54 3kym s GLY 9 Ca 0.03 -0.85 -0.07 0.00 0.00 0.00 0.00 44.72 43.83 3kym s GLY 9 CO 0.05 -0.81 0.34 0.61 0.00 0.00 0.00 173.10 173.28 3kym n GLY 10 N 0.41 0.50 3.85 0.20 0.00 -1.20 -4.97 105.19 103.98 3kym n GLY 10 Ca -0.06 -0.88 -0.34 0.00 0.00 0.00 0.00 46.02 44.73 3kym n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3kym s LEU 11 N 0.00 4.17 -0.05 0.99 2.96 -1.26 -3.34 118.68 122.16 3kym s LEU 11 Ca 0.08 0.30 -0.08 0.00 -0.22 0.00 0.00 54.13 54.21 3kym s LEU 11 Cb -0.00 -2.33 0.01 0.00 0.50 0.00 0.00 46.19 44.37 3kym s LEU 11 CO -0.00 0.31 0.19 0.68 -1.32 0.00 0.00 176.35 176.21 3kym s VAL 12 N -1.19 0.03 0.08 1.68 -7.23 -0.71 -4.98 120.40 108.08 3kym s VAL 12 Ca 0.22 -0.22 -0.20 0.00 -1.81 0.00 0.00 61.98 59.97 3kym s VAL 12 Cb -0.12 -0.35 -0.07 0.00 0.56 0.00 0.00 36.38 36.40 3kym s VAL 12 CO 0.13 -0.12 0.59 -1.10 -0.31 0.00 0.00 175.10 174.29 3kym s GLN 13 N -0.40 4.25 0.64 4.82 -0.21 -1.26 -2.69 119.66 124.81 3kym s GLN 13 Ca -0.05 0.78 -0.17 0.00 0.02 0.00 0.00 55.36 55.94 3kym s GLN 13 Cb -0.03 -3.25 -0.06 0.00 1.00 0.00 0.00 33.01 30.66 3kym s GLN 13 CO 0.01 0.61 0.54 -2.30 -2.12 0.00 0.00 175.29 172.03 3kym n PRO 14 N 1.80 0.44 0.00 2.91 -0.02 -1.26 -3.01 135.00 135.86 3kym n PRO 14 Ca -0.10 0.18 0.00 0.00 -2.02 0.00 0.00 63.50 61.57 3kym n PRO 14 Cb 0.51 -1.78 0.00 0.00 -0.02 0.00 0.00 33.50 32.21 3kym n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3kym n GLY 15 N 1.71 2.36 0.00 -1.23 0.00 0.84 -4.92 105.19 103.95 3kym n GLY 15 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 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 0.06 3.17 -0.02 0.00 -1.16 -3.25 105.19 101.98 3kym n GLY 16 Ca 0.00 -1.62 -0.13 0.00 0.00 0.00 0.00 46.02 44.27 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 -1.00 -0.31 0.07 1.61 0.01 -1.25 -1.07 113.70 111.76 3kym s SER 17 Ca 0.00 0.59 -0.06 0.00 1.31 0.00 0.00 55.95 57.79 3kym s SER 17 Cb 0.00 0.59 -0.01 0.00 0.21 0.00 0.00 66.02 66.80 3kym s SER 17 CO 0.00 -0.11 0.12 -0.22 0.41 0.00 0.00 173.24 173.44 3kym s LEU 18 N 0.29 1.74 -0.10 2.44 0.20 -0.49 -4.99 118.68 117.76 3kym s LEU 18 Ca -0.01 -0.70 0.01 0.00 0.69 0.00 0.00 54.13 54.12 3kym s LEU 18 Cb -0.03 0.76 0.02 0.00 -0.43 0.00 0.00 46.19 46.51 3kym s LEU 18 CO -0.01 -0.66 -0.13 -0.60 -0.29 0.00 0.00 176.35 174.67 3kym s ARG 19 N -3.62 1.95 -0.25 1.98 3.52 -1.26 -0.48 118.95 120.79 3kym s ARG 19 Ca 0.03 -0.46 -0.04 0.00 -0.13 0.00 0.00 55.73 55.13 3kym s ARG 19 Cb 0.04 -1.71 -0.00 0.00 -1.56 0.00 0.00 34.95 31.72 3kym s ARG 19 CO -0.09 -0.09 -0.01 -0.51 -0.81 0.00 0.00 175.30 173.79 3kym s LEU 20 N 1.06 3.22 -0.14 -0.88 1.43 -0.28 -4.74 118.68 118.36 3kym s LEU 20 Ca -0.06 -0.53 -0.20 0.00 -1.03 0.00 0.00 54.13 52.31 3kym s LEU 20 Cb -0.15 -1.78 -0.04 0.00 0.03 0.00 0.00 46.19 44.26 3kym s LEU 20 CO -0.02 -0.08 0.58 -0.44 0.23 0.00 0.00 176.35 176.62 3kym s SER 21 N 1.47 6.74 -0.17 2.29 0.01 -1.12 -1.02 113.70 121.90 3kym s SER 21 Ca 0.04 0.89 -0.01 0.00 1.31 0.00 0.00 55.95 58.19 3kym s SER 21 Cb -0.15 -2.33 -0.00 0.00 0.21 0.00 0.00 66.02 63.74 3kym s SER 21 CO -0.02 -0.12 -0.12 0.00 0.41 0.00 0.00 173.24 173.39 3kym s ALA 23 N 0.89 3.79 0.28 0.00 0.00 -0.62 0.11 121.76 126.21 3kym s ALA 23 Ca -0.03 -0.75 0.11 0.00 0.00 0.00 0.00 51.96 51.29 3kym s ALA 23 Cb -0.15 -1.80 -0.05 0.00 0.00 0.00 0.00 23.12 21.12 3kym s ALA 23 CO -0.01 0.68 -0.16 0.00 0.00 0.00 0.00 175.76 176.28 3kym s ALA 24 N -1.16 2.84 -0.24 0.00 0.00 -0.98 -1.09 121.76 121.13 3kym s ALA 24 Ca 0.21 -1.85 -0.26 0.00 0.00 0.00 0.00 51.96 50.06 3kym s ALA 24 Cb -0.12 -0.34 0.08 0.00 0.00 0.00 0.00 23.12 22.74 3kym s ALA 24 CO 0.12 0.26 0.77 -1.54 0.00 0.00 0.00 175.76 175.37 3kym s SER 25 N -3.55 -0.69 0.00 0.00 1.04 -1.09 -4.88 113.70 104.54 3kym s SER 25 Ca 0.30 1.24 0.00 0.00 0.48 0.00 0.00 55.95 57.98 3kym s SER 25 Cb -0.05 1.23 0.00 0.00 0.10 0.00 0.00 66.02 67.31 3kym s SER 25 CO 0.16 -0.28 0.00 0.61 0.98 0.00 0.00 173.24 174.70 3kym n GLY 26 N 2.34 0.85 3.71 7.32 0.00 -1.25 -2.06 105.19 116.08 3kym n GLY 26 Ca -0.14 -0.04 -0.09 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.00 0.23 -0.75 1.61 -0.71 -1.26 -4.57 117.98 110.54 3kym s PHE 27 Ca 0.00 -0.67 -0.23 0.00 -1.04 0.00 0.00 56.93 54.99 3kym s PHE 27 Cb 0.00 0.45 0.07 0.00 -1.21 0.00 0.00 43.02 42.33 3kym s PHE 27 CO 0.00 -1.21 1.08 0.99 -1.34 0.00 0.00 175.22 174.74 3kym s THR 28 N -3.50 4.28 0.27 -4.49 2.01 -1.26 -4.86 115.64 108.09 3kym s THR 28 Ca 0.19 -0.50 -0.01 0.00 0.31 0.00 0.00 61.69 61.67 3kym s THR 28 Cb -0.03 -4.77 0.28 0.00 0.01 0.00 0.00 72.50 67.99 3kym s THR 28 CO 0.10 -1.56 1.88 0.15 -0.69 0.00 0.00 174.62 174.50 3kym h PHE 29 N 9.52 1.18 -0.94 4.92 3.04 -1.94 -3.02 116.94 129.70 3kym h PHE 29 Ca -0.17 0.03 0.26 0.00 3.98 0.00 0.00 57.97 62.08 3kym h PHE 29 Cb 1.05 -0.38 -0.14 0.00 2.56 0.00 0.00 35.95 39.04 3kym h PHE 29 CO 1.05 0.59 0.42 0.77 -2.02 0.00 0.00 178.31 179.13 3kym h SER 30 N 1.14 0.33 0.31 0.41 0.02 -1.89 -2.53 113.55 111.33 3kym h SER 30 Ca 0.43 0.18 -0.33 0.00 -0.84 0.00 0.00 61.79 61.23 3kym h SER 30 Cb 0.21 0.17 0.01 0.00 0.14 0.00 0.00 62.40 62.92 3kym h SER 30 CO -0.18 -0.08 -1.62 0.40 -1.14 0.00 0.00 176.83 174.21 3kym h ILE 31 N 0.33 1.08 -3.79 3.27 2.04 -1.92 -3.39 117.51 115.13 3kym h ILE 31 Ca 0.63 -2.66 -0.51 0.00 1.00 0.00 0.00 64.86 63.32 3kym h ILE 31 Cb 1.30 2.81 0.03 0.00 -0.74 0.00 0.00 36.82 40.22 3kym h ILE 31 CO -0.59 0.84 0.53 -0.31 0.00 0.00 0.00 178.15 178.61 3kym s TYR 32 N -2.60 3.42 0.39 1.37 1.51 -0.96 -4.42 117.35 116.07 3kym s TYR 32 Ca -0.12 1.59 -0.23 0.00 -1.01 0.00 0.00 57.07 57.30 3kym s TYR 32 Cb 0.06 -3.40 -0.10 0.00 -0.11 0.00 0.00 41.96 38.40 3kym s TYR 32 CO 0.87 -0.96 0.96 -2.14 -1.11 0.00 0.00 175.55 173.16 3kym s PRO 33 N -1.41 4.33 0.14 -1.71 0.02 -1.26 -4.23 135.00 130.88 3kym s PRO 33 Ca 0.47 1.24 0.09 0.00 0.02 0.00 0.00 61.00 62.81 3kym s PRO 33 Cb -0.34 -2.42 -0.04 0.00 0.02 0.00 0.00 34.50 31.72 3kym s PRO 33 CO 0.44 0.05 -0.20 -1.64 -0.33 0.00 0.00 177.00 175.32 3kym s MET 34 N -2.73 1.25 0.31 5.54 -1.94 -0.46 -1.64 119.30 119.64 3kym s MET 34 Ca 0.58 -1.33 0.10 0.00 -1.71 0.00 0.00 55.69 53.33 3kym s MET 34 Cb -0.14 -1.44 -0.06 0.00 2.01 0.00 0.00 34.83 35.20 3kym s MET 34 CO 0.18 0.31 -0.14 -0.06 -0.01 0.00 0.00 175.02 175.31 3kym s PHE 35 N -1.62 2.30 -0.07 -0.03 0.08 0.20 -1.64 117.98 117.21 3kym s PHE 35 Ca 0.13 -0.44 0.03 0.00 0.12 0.00 0.00 56.93 56.77 3kym s PHE 35 Cb -0.08 -1.18 0.01 0.00 -0.57 0.00 0.00 43.02 41.20 3kym s PHE 35 CO 0.06 0.61 -0.17 -1.58 -0.10 0.00 0.00 175.22 174.05 3kym s TRP 36 N -2.61 1.86 0.14 0.36 0.52 -0.63 -1.68 118.94 116.90 3kym s TRP 36 Ca 0.31 -0.69 0.11 0.00 0.02 0.00 0.00 56.10 55.84 3kym s TRP 36 Cb -0.01 -1.29 -0.04 0.00 -1.15 0.00 0.00 33.47 30.98 3kym s TRP 36 CO 0.15 -0.30 -0.25 0.08 0.02 0.00 0.00 176.95 176.65 3kym s VAL 37 N 0.44 2.17 0.11 4.03 1.01 0.14 -2.57 120.40 125.74 3kym s VAL 37 Ca -0.14 -1.78 0.03 0.00 0.00 0.00 0.00 61.98 60.09 3kym s VAL 37 Cb -0.16 -1.95 -0.04 0.00 0.00 0.00 0.00 36.38 34.23 3kym s VAL 37 CO 0.05 0.01 -0.08 0.00 0.00 0.00 0.00 175.10 175.08 3kym s ARG 38 N -2.18 0.91 -0.18 2.72 1.04 -0.55 0.47 118.95 121.19 3kym s ARG 38 Ca 0.14 -1.36 -0.02 0.00 -1.04 0.00 0.00 55.73 53.45 3kym s ARG 38 Cb -0.09 -0.37 0.05 0.00 -2.04 0.00 0.00 34.95 32.50 3kym s ARG 38 CO 0.06 0.02 0.01 -1.14 -0.04 0.00 0.00 175.30 174.21 3kym s GLN 39 N -3.72 0.88 0.22 3.89 0.74 -0.72 -1.03 119.66 119.91 3kym s GLN 39 Ca 0.13 -0.43 -0.30 0.00 0.05 0.00 0.00 55.36 54.81 3kym s GLN 39 Cb 0.04 -1.99 -0.09 0.00 1.10 0.00 0.00 33.01 32.06 3kym s GLN 39 CO -0.03 -0.56 1.37 0.00 -0.55 0.00 0.00 175.29 175.52 3kym s ALA 40 N 1.79 3.57 0.31 1.58 0.00 -1.26 -1.82 121.76 125.93 3kym s ALA 40 Ca -0.00 1.20 -0.28 0.00 0.00 0.00 0.00 51.96 52.88 3kym s ALA 40 Cb -0.16 -3.51 -0.13 0.00 0.00 0.00 0.00 23.12 19.31 3kym s ALA 40 CO -0.07 -0.62 1.18 -2.30 0.00 0.00 0.00 175.76 173.94 3kym n PRO 41 N 2.50 1.79 -1.23 0.00 -0.02 -1.26 -0.26 135.00 136.52 3kym n PRO 41 Ca 0.06 0.63 -0.08 0.00 -2.02 0.00 0.00 63.50 62.09 3kym n PRO 41 Cb 0.42 -2.13 -0.03 0.00 -0.02 0.00 0.00 33.50 31.74 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 1.04 0.78 3.58 -1.23 0.00 -1.26 -4.97 105.19 103.13 3kym n GLY 42 Ca 0.07 -0.03 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.54 0.66 0.00 1.61 4.76 0.65 -5.16 118.16 120.13 3kym n LYS 43 Ca -0.08 -3.66 0.00 0.00 -2.87 0.00 0.00 58.31 51.70 3kym n LYS 43 Cb 0.54 1.48 0.00 0.00 -1.84 0.00 0.00 35.03 35.20 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 -1.04 -1.21 2.84 0.72 0.00 -1.26 -4.62 105.19 100.62 3kym n GLY 44 Ca -0.14 -1.08 -0.26 0.00 0.00 0.00 0.00 46.02 44.54 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 1.05 -0.18 0.99 1.43 -1.26 -4.29 118.68 116.42 3kym s LEU 45 Ca 0.00 -0.35 -0.07 0.00 -1.03 0.00 0.00 54.13 52.68 3kym s LEU 45 Cb 0.00 -0.69 -0.04 0.00 0.03 0.00 0.00 46.19 45.50 3kym s LEU 45 CO 0.00 -0.18 0.05 -0.70 0.23 0.00 0.00 176.35 175.75 3kym s GLU 46 N 1.80 3.92 0.34 1.70 2.12 -0.20 -5.00 118.70 123.39 3kym s GLU 46 Ca 0.04 -0.37 -0.26 0.00 0.36 0.00 0.00 54.97 54.73 3kym s GLU 46 Cb -0.13 -3.19 -0.09 0.00 0.26 0.00 0.00 34.13 30.97 3kym s GLU 46 CO -0.07 0.24 1.03 -0.46 -0.54 0.00 0.00 175.26 175.45 3kym s TRP 47 N 0.45 3.50 0.02 5.30 -0.00 -1.26 -1.48 118.94 125.48 3kym s TRP 47 Ca 0.02 1.71 -0.01 0.00 -0.00 0.00 0.00 56.10 57.83 3kym s TRP 47 Cb -0.13 -3.10 -0.00 0.00 -0.00 0.00 0.00 33.47 30.24 3kym s TRP 47 CO 0.01 -0.31 -0.01 0.28 -0.00 0.00 0.00 176.95 176.91 3kym n VAL 48 N 0.49 0.43 -3.78 5.86 0.31 -1.06 -4.70 118.33 115.87 3kym n VAL 48 Ca 0.02 0.12 -0.13 0.00 -0.01 0.00 0.00 64.34 64.34 3kym n VAL 48 Cb 0.48 -1.55 -0.10 0.00 -0.91 0.00 0.00 33.84 31.77 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 -5.38 -0.22 -0.00 4.52 0.01 -1.07 -0.57 113.70 110.99 3kym s SER 49 Ca -0.01 0.30 -0.01 0.00 1.31 0.00 0.00 55.95 57.53 3kym s SER 49 Cb 0.00 0.44 -0.00 0.00 0.21 0.00 0.00 66.02 66.67 3kym s SER 49 CO 0.02 -0.26 0.02 0.86 0.41 0.00 0.00 173.24 174.29 3kym s TRP 50 N -0.57 0.05 -0.12 2.43 -0.00 -0.75 -1.60 118.94 118.38 3kym s TRP 50 Ca -0.07 -0.10 -0.08 0.00 -0.00 0.00 0.00 56.10 55.86 3kym s TRP 50 Cb -0.04 -0.05 0.04 0.00 -0.00 0.00 0.00 33.47 33.43 3kym s TRP 50 CO 0.02 -0.08 0.29 -1.50 -0.00 0.00 0.00 176.95 175.68 3kym s ILE 51 N -0.47 -0.02 1.00 5.86 2.07 -0.65 -1.36 121.20 127.63 3kym s ILE 51 Ca -0.05 0.08 -0.15 0.00 -1.41 0.00 0.00 60.65 59.12 3kym s ILE 51 Cb -0.03 -0.43 0.19 0.00 0.13 0.00 0.00 42.46 42.32 3kym s ILE 51 CO -0.00 0.03 1.18 -0.83 -1.91 0.00 0.00 174.94 173.41 3kym s GLY 52 N 0.87 1.63 -0.34 1.50 0.00 -1.19 -1.35 107.32 108.43 3kym s GLY 52 Ca -0.06 -0.81 -0.29 0.00 0.00 0.00 0.00 44.72 43.56 3kym s GLY 52 CO -0.06 -0.11 1.50 2.56 0.00 0.00 0.00 173.10 176.99 3kym s PRO 53 N -5.47 3.63 0.00 2.90 0.05 -1.26 -4.06 135.00 130.78 3kym s PRO 53 Ca 0.68 1.20 0.00 0.00 0.05 0.00 0.00 61.00 62.94 3kym s PRO 53 Cb -0.11 -4.03 0.00 0.00 0.05 0.00 0.00 34.50 30.41 3kym s PRO 53 CO 0.54 -1.50 0.00 0.45 0.05 0.00 0.00 177.00 176.54 3kym n SER 54 N 8.82 -1.82 -2.37 6.66 2.88 -1.26 -4.80 113.62 121.73 3kym n SER 54 Ca 0.18 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.62 3kym n SER 54 Cb 0.47 -0.91 -0.09 0.00 -0.75 0.00 0.00 64.21 62.93 3kym n SER 54 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3kym n GLY 55 N 0.26 2.34 0.19 0.46 0.00 -1.26 -4.40 105.19 102.78 3kym n GLY 55 Ca 0.00 -0.74 -0.06 0.00 0.00 0.00 0.00 46.02 45.22 3kym n GLY 55 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3kym h GLY 56 N 5.88 -0.43 -4.91 -0.02 0.00 -1.87 -3.45 103.07 98.28 3kym h GLY 56 Ca 0.18 0.16 -0.58 0.00 0.00 0.00 0.00 47.33 47.08 3kym h GLY 56 CO 0.53 -0.15 -0.09 -0.42 0.00 0.00 0.00 176.54 176.41 3kym s ILE 57 N -2.89 4.91 0.02 2.60 1.01 -1.26 -5.07 121.20 120.52 3kym s ILE 57 Ca -0.06 1.09 0.02 0.00 0.00 0.00 0.00 60.65 61.71 3kym s ILE 57 Cb 0.01 -3.85 -0.01 0.00 0.01 0.00 0.00 42.46 38.61 3kym s ILE 57 CO 0.18 0.50 -0.07 0.42 0.00 0.00 0.00 174.94 175.96 3kym s THR 58 N -0.65 0.56 0.14 2.92 -4.23 -1.26 -3.19 115.64 109.92 3kym s THR 58 Ca 0.28 -0.68 0.09 0.00 -1.18 0.00 0.00 61.69 60.20 3kym s THR 58 Cb -0.18 -0.55 -0.04 0.00 1.34 0.00 0.00 72.50 73.08 3kym s THR 58 CO 0.16 -0.10 -0.22 -0.54 -0.54 0.00 0.00 174.62 173.38 3kym s LYS 59 N -0.85 1.27 0.14 3.99 1.02 -0.46 -5.02 119.74 119.83 3kym s LYS 59 Ca -0.03 -1.31 0.00 0.00 0.02 0.00 0.00 55.97 54.65 3kym s LYS 59 Cb -0.06 -1.54 -0.04 0.00 -0.52 0.00 0.00 37.83 35.67 3kym s LYS 59 CO 0.00 0.34 0.01 0.71 -0.92 0.00 0.00 175.35 175.50 3kym s TYR 60 N -1.43 0.97 -0.08 3.18 2.02 -1.26 -1.81 117.35 118.94 3kym s TYR 60 Ca 0.12 -1.10 -0.30 0.00 -0.37 0.00 0.00 57.07 55.42 3kym s TYR 60 Cb -0.09 -0.56 -0.03 0.00 -0.40 0.00 0.00 41.96 40.88 3kym s TYR 60 CO 0.06 -0.35 1.17 0.00 -1.57 0.00 0.00 175.55 174.86 3kym s ALA 61 N -3.84 3.50 0.14 3.71 0.00 0.26 -4.81 121.76 120.73 3kym s ALA 61 Ca 0.21 0.56 0.04 0.00 0.00 0.00 0.00 51.96 52.77 3kym s ALA 61 Cb 0.07 -3.51 0.43 0.00 0.00 0.00 0.00 23.12 20.10 3kym s ALA 61 CO 0.01 -0.77 0.68 -0.25 0.00 0.00 0.00 175.76 175.42 3kym n ASP 62 N 5.30 0.03 0.17 0.00 10.43 -1.26 0.37 116.55 131.59 3kym n ASP 62 Ca 0.11 0.73 0.02 0.00 2.57 0.00 0.00 54.79 58.22 3kym n ASP 62 Cb 0.46 -0.30 0.30 0.00 1.84 0.00 0.00 41.12 43.43 3kym n ASP 62 CO 0.00 0.00 0.00 0.77 -1.07 0.00 0.00 177.20 176.90 3kym h SER 63 N 0.00 0.00 0.00 -2.24 4.64 -1.96 -3.36 113.55 110.63 3kym h SER 63 Ca 0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 3kym h SER 63 Cb 0.70 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.79 3kym h SER 63 CO -0.38 0.46 -0.55 0.55 -0.87 0.00 0.00 176.83 176.04 3kym n VAL 64 N -3.87 0.00 -1.86 0.95 3.14 1.17 -4.99 118.33 112.86 3kym n VAL 64 Ca -0.01 -0.29 -0.43 0.00 -2.96 0.00 0.00 64.34 60.65 3kym n VAL 64 Cb 0.50 0.88 -0.03 0.00 -1.06 0.00 0.00 33.84 34.13 3kym n VAL 64 CO 0.00 0.00 0.00 -1.59 -6.46 0.00 0.00 176.83 168.78 3kym s LYS 65 N -1.89 3.73 0.00 1.45 -2.85 0.20 -2.21 119.74 118.16 3kym s LYS 65 Ca 0.02 2.02 0.00 0.00 -1.00 0.00 0.00 55.97 57.01 3kym s LYS 65 Cb 0.06 -4.15 0.00 0.00 -2.06 0.00 0.00 37.83 31.67 3kym s LYS 65 CO 0.33 -1.40 0.00 0.41 0.10 0.00 0.00 175.35 174.79 3kym n GLY 66 N 4.90 1.83 0.00 0.59 0.00 -1.26 -4.95 105.19 106.30 3kym n GLY 66 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 3kym n GLY 66 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3kym n ARG 67 N 0.00 2.68 -4.91 1.61 1.85 -0.94 -5.05 116.66 111.90 3kym n ARG 67 Ca 0.00 0.00 -0.32 0.00 -1.00 0.00 0.00 57.85 56.53 3kym n ARG 67 Cb 0.00 -0.76 -0.13 0.00 -1.05 0.00 0.00 32.46 30.52 3kym n ARG 67 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 3kym s PHE 68 N -1.16 2.61 -0.08 2.89 2.99 -1.12 -0.87 117.98 123.25 3kym s PHE 68 Ca 0.00 -0.22 -0.00 0.00 0.00 0.00 0.00 56.93 56.70 3kym s PHE 68 Cb 0.00 -1.57 0.03 0.00 0.00 0.00 0.00 43.02 41.47 3kym s PHE 68 CO 0.00 0.16 -0.04 0.99 -0.00 0.00 0.00 175.22 176.33 3kym s THR 69 N -0.75 0.68 -0.01 0.64 2.01 0.73 -4.90 115.64 114.03 3kym s THR 69 Ca 0.12 -0.10 -0.11 0.00 0.31 0.00 0.00 61.69 61.91 3kym s THR 69 Cb -0.10 -0.75 -0.05 0.00 0.01 0.00 0.00 72.50 71.60 3kym s THR 69 CO 0.01 0.30 0.33 -0.51 -0.69 0.00 0.00 174.62 174.07 3kym s ILE 70 N 1.65 5.17 0.20 1.82 2.07 -1.26 -0.10 121.20 130.76 3kym s ILE 70 Ca 0.02 0.57 -0.10 0.00 -1.41 0.00 0.00 60.65 59.73 3kym s ILE 70 Cb -0.13 -3.62 -0.01 0.00 0.13 0.00 0.00 42.46 38.84 3kym s ILE 70 CO -0.05 0.52 0.35 -0.94 -1.91 0.00 0.00 174.94 172.91 3kym s SER 71 N -1.23 -0.01 0.03 4.50 1.04 -1.06 -5.01 113.70 111.95 3kym s SER 71 Ca 0.23 -0.95 -0.04 0.00 0.48 0.00 0.00 55.95 55.68 3kym s SER 71 Cb -0.15 0.49 -0.01 0.00 0.10 0.00 0.00 66.02 66.45 3kym s SER 71 CO 0.12 -0.99 0.05 0.00 0.98 0.00 0.00 173.24 173.40 3kym s ARG 72 N -4.01 0.48 -0.28 4.02 1.70 -1.26 -1.95 118.95 117.64 3kym s ARG 72 Ca 0.22 -0.69 0.00 0.00 -0.47 0.00 0.00 55.73 54.80 3kym s ARG 72 Cb 0.02 0.18 0.08 0.00 -0.57 0.00 0.00 34.95 34.67 3kym s ARG 72 CO 0.05 -0.10 0.04 0.34 -1.08 0.00 0.00 175.30 174.55 3kym s ASP 73 N -1.85 4.00 0.00 -2.89 3.68 -1.04 -4.85 116.67 113.72 3kym s ASP 73 Ca -0.09 -1.52 0.27 0.00 2.13 0.00 0.00 52.55 53.34 3kym s ASP 73 Cb -0.04 -1.06 1.64 0.00 -1.45 0.00 0.00 42.92 42.00 3kym s ASP 73 CO -0.03 -0.35 2.02 0.59 0.13 0.00 0.00 175.17 177.53 3kym n ASN 74 N 4.71 0.00 -0.02 -0.34 3.02 -1.26 -0.78 115.26 120.60 3kym n ASN 74 Ca -0.04 -1.01 -0.16 0.00 -0.03 0.00 0.00 54.58 53.34 3kym n ASN 74 Cb 0.43 0.00 -0.12 0.00 -0.61 0.00 0.00 39.78 39.49 3kym n ASN 74 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 3kym h SER 75 N 0.00 0.29 -0.01 6.41 0.02 -1.95 -3.35 113.55 114.95 3kym h SER 75 Ca 0.00 -0.80 0.00 0.00 -0.84 0.00 0.00 61.79 60.15 3kym h SER 75 Cb 0.00 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.45 3kym h SER 75 CO 0.00 1.05 -0.24 0.29 -1.14 0.00 0.00 176.83 176.78 3kym n LYS 76 N -4.43 1.70 -1.51 3.45 5.02 -1.16 -4.97 118.16 116.26 3kym n LYS 76 Ca -0.10 -1.38 -0.18 0.00 -2.02 0.00 0.00 58.31 54.63 3kym n LYS 76 Cb 0.56 -1.47 -0.08 0.00 -0.02 0.00 0.00 35.03 34.02 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 0.56 -4.79 -4.94 4.39 4.13 0.04 -4.80 115.26 109.86 3kym n ASN 77 Ca 0.12 0.44 -0.26 0.00 1.68 0.00 0.00 54.58 56.56 3kym n ASN 77 Cb 0.52 -4.26 -0.03 0.00 -1.54 0.00 0.00 39.78 34.46 3kym n ASN 77 CO 0.00 0.00 0.00 0.28 0.28 0.00 0.00 177.26 177.82 3kym s THR 78 N -2.51 5.29 0.05 3.41 -1.32 -1.09 -2.31 115.64 117.17 3kym s THR 78 Ca 0.00 -0.62 0.09 0.00 -1.21 0.00 0.00 61.69 59.95 3kym s THR 78 Cb 0.00 -3.75 -0.03 0.00 -1.51 0.00 0.00 72.50 67.21 3kym s THR 78 CO 0.00 -0.14 -0.26 -0.22 -2.21 0.00 0.00 174.62 171.80 3kym s LEU 79 N -3.33 2.19 0.05 9.08 2.96 0.29 -2.49 118.68 127.43 3kym s LEU 79 Ca 0.36 -0.60 0.06 0.00 -0.22 0.00 0.00 54.13 53.72 3kym s LEU 79 Cb -0.11 -1.23 -0.02 0.00 0.50 0.00 0.00 46.19 45.32 3kym s LEU 79 CO 0.29 0.24 -0.17 -0.31 -1.32 0.00 0.00 176.35 175.08 3kym s TYR 80 N -0.84 1.45 -0.09 5.38 1.51 -0.82 0.50 117.35 124.44 3kym s TYR 80 Ca 0.11 -0.38 -0.01 0.00 -1.01 0.00 0.00 57.07 55.79 3kym s TYR 80 Cb -0.10 -0.85 0.03 0.00 -0.11 0.00 0.00 41.96 40.93 3kym s TYR 80 CO 0.02 0.07 -0.04 -1.17 -1.11 0.00 0.00 175.55 173.33 3kym s LEU 81 N -1.31 0.96 -0.37 -1.29 2.96 -0.19 -2.57 118.68 116.87 3kym s LEU 81 Ca 0.03 -0.20 -0.20 0.00 -0.22 0.00 0.00 54.13 53.55 3kym s LEU 81 Cb -0.09 -0.64 0.01 0.00 0.50 0.00 0.00 46.19 45.97 3kym s LEU 81 CO 0.02 -0.14 0.60 -1.58 -1.32 0.00 0.00 176.35 173.93 3kym s GLN 82 N 1.72 3.57 -0.26 1.98 2.00 0.86 -1.12 119.66 128.40 3kym s GLN 82 Ca 0.03 -0.11 -0.06 0.00 -2.00 0.00 0.00 55.36 53.23 3kym s GLN 82 Cb -0.13 -3.84 -0.00 0.00 0.80 0.00 0.00 33.01 29.84 3kym s GLN 82 CO -0.06 -0.77 0.03 -1.64 -0.50 0.00 0.00 175.29 172.35 3kym s MET 83 N 2.64 3.29 0.18 1.67 -1.94 0.36 -0.19 119.30 125.32 3kym s MET 83 Ca 0.22 -0.70 0.09 0.00 -1.71 0.00 0.00 55.69 53.59 3kym s MET 83 Cb -0.15 -3.23 -0.04 0.00 2.01 0.00 0.00 34.83 33.42 3kym s MET 83 CO 0.15 -0.31 -0.19 -0.80 -0.01 0.00 0.00 175.02 173.87 3kym s ASN 84 N 1.51 2.87 -1.41 3.03 -0.87 -0.05 -1.40 114.94 118.62 3kym s ASN 84 Ca 0.04 -0.89 -0.05 0.00 -1.57 0.00 0.00 52.86 50.39 3kym s ASN 84 Cb -0.16 -0.18 0.03 0.00 -0.02 0.00 0.00 41.25 40.92 3kym s ASN 84 CO 0.01 -0.02 0.73 -1.20 -2.57 0.00 0.00 177.10 174.05 3kym n SER 85 N 0.15 -2.13 -4.75 -1.22 7.64 -0.24 -4.64 113.62 108.44 3kym n SER 85 Ca -0.12 -0.85 -0.36 0.00 1.01 0.00 0.00 58.87 58.55 3kym n SER 85 Cb 0.57 -3.76 0.04 0.00 -1.01 0.00 0.00 64.21 60.06 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 -6.93 3.64 0.44 -3.43 1.43 -1.05 -4.66 118.68 108.12 3kym s LEU 86 Ca 0.23 2.47 0.04 0.00 -1.03 0.00 0.00 54.13 55.84 3kym s LEU 86 Cb -0.11 -4.60 -0.05 0.00 0.03 0.00 0.00 46.19 41.46 3kym s LEU 86 CO 0.84 -1.72 0.02 -0.13 0.23 0.00 0.00 176.35 175.58 3kym s ARG 87 N -3.33 2.03 0.28 1.70 3.00 -1.26 -0.11 118.95 121.26 3kym s ARG 87 Ca 0.79 -2.22 0.03 0.00 0.00 0.00 0.00 55.73 54.33 3kym s ARG 87 Cb -0.33 -1.49 0.41 0.00 0.00 0.00 0.00 34.95 33.54 3kym s ARG 87 CO 0.35 -0.21 1.71 0.00 0.00 0.00 0.00 175.30 177.15 3kym h ALA 88 N 1.63 1.08 0.00 2.13 0.00 -1.99 -2.68 119.26 119.43 3kym h ALA 88 Ca -0.43 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.11 3kym h ALA 88 Cb 1.27 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.95 3kym h ALA 88 CO 0.76 0.57 0.00 -0.85 0.00 0.00 0.00 179.25 179.73 3kym n GLU 89 N -4.09 0.50 -0.58 0.00 0.00 -1.26 -1.80 120.64 113.40 3kym n GLU 89 Ca -0.01 0.00 0.10 0.00 0.00 0.00 0.00 57.16 57.25 3kym n GLU 89 Cb 0.43 -1.18 0.36 0.00 0.00 0.00 0.00 31.44 31.05 3kym n GLU 89 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 3kym n ASP 90 N -0.68 4.64 -4.67 -1.84 8.00 -1.01 -4.92 116.55 116.08 3kym n ASP 90 Ca 0.04 -2.36 -0.43 0.00 0.71 0.00 0.00 54.79 52.76 3kym n ASP 90 Cb 0.02 -0.57 -0.02 0.00 -0.02 0.00 0.00 41.12 40.53 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 -1.69 4.43 -0.06 -3.53 2.01 -0.75 -4.74 115.64 111.32 3kym s THR 91 Ca 0.51 1.73 -0.31 0.00 0.31 0.00 0.00 61.69 63.93 3kym s THR 91 Cb 0.32 -4.11 0.11 0.00 0.01 0.00 0.00 72.50 68.83 3kym s THR 91 CO 0.27 -0.12 1.08 0.00 -0.69 0.00 0.00 174.62 175.15 3kym s ALA 92 N 3.13 -1.96 -0.06 7.40 0.00 0.34 -4.48 121.76 126.13 3kym s ALA 92 Ca 0.51 1.09 -0.20 0.00 0.00 0.00 0.00 51.96 53.36 3kym s ALA 92 Cb -0.20 0.23 -0.04 0.00 0.00 0.00 0.00 23.12 23.11 3kym s ALA 92 CO 0.13 -0.75 0.58 0.95 0.00 0.00 0.00 175.76 176.68 3kym s THR 93 N -2.77 5.05 -0.17 0.00 -4.23 -0.75 -0.48 115.64 112.28 3kym s THR 93 Ca 0.09 1.19 -0.05 0.00 -1.18 0.00 0.00 61.69 61.73 3kym s THR 93 Cb -0.00 -3.92 -0.03 0.00 1.34 0.00 0.00 72.50 69.89 3kym s THR 93 CO -0.05 0.34 0.01 -0.31 -0.54 0.00 0.00 174.62 174.07 3kym s TYR 94 N 0.38 3.12 -0.10 3.99 1.51 -1.06 -1.76 117.35 123.42 3kym s TYR 94 Ca 0.31 -0.16 -0.01 0.00 -1.01 0.00 0.00 57.07 56.20 3kym s TYR 94 Cb -0.17 -2.02 -0.03 0.00 -0.11 0.00 0.00 41.96 39.63 3kym s TYR 94 CO 0.15 0.02 -0.05 0.71 -1.11 0.00 0.00 175.55 175.26 3kym s TYR 95 N 0.45 3.00 0.22 2.71 1.51 0.18 -3.14 117.35 122.27 3kym s TYR 95 Ca -0.01 -0.06 -0.19 0.00 -1.01 0.00 0.00 57.07 55.81 3kym s TYR 95 Cb -0.13 -1.80 -0.08 0.00 -0.11 0.00 0.00 41.96 39.84 3kym s TYR 95 CO 0.02 0.24 0.70 0.00 -1.11 0.00 0.00 175.55 175.39 3kym s ALA 97 N -1.54 0.22 0.25 0.00 0.00 -0.68 -1.78 121.76 118.23 3kym s ALA 97 Ca 0.43 -0.79 0.11 0.00 0.00 0.00 0.00 51.96 51.70 3kym s ALA 97 Cb -0.16 0.21 -0.05 0.00 0.00 0.00 0.00 23.12 23.12 3kym s ALA 97 CO 0.20 -0.26 -0.13 -0.98 0.00 0.00 0.00 175.76 174.60 3kym s ARG 98 N -2.50 1.91 0.19 0.00 1.04 -0.53 0.62 118.95 119.68 3kym s ARG 98 Ca -0.06 -1.54 -0.14 0.00 -1.04 0.00 0.00 55.73 52.95 3kym s ARG 98 Cb -0.02 -1.97 -0.07 0.00 -2.04 0.00 0.00 34.95 30.85 3kym s ARG 98 CO -0.05 0.37 0.58 -2.00 -0.04 0.00 0.00 175.30 174.16 3kym s GLU 99 N -3.34 3.97 0.07 3.89 2.12 -0.65 -1.43 118.70 123.33 3kym s GLU 99 Ca 0.28 0.50 -0.05 0.00 0.36 0.00 0.00 54.97 56.06 3kym s GLU 99 Cb -0.06 -2.82 -0.29 0.00 0.26 0.00 0.00 34.13 31.21 3kym s GLU 99 CO 0.16 0.41 1.11 0.78 -0.54 0.00 0.00 175.26 177.18 3kym h GLY 100 N 3.22 0.32 0.00 -1.50 0.00 -1.57 -3.45 103.07 100.09 3kym h GLY 100 Ca -0.48 -0.83 0.00 0.00 0.00 0.00 0.00 47.33 46.02 3kym h GLY 100 CO 0.66 0.73 0.00 1.42 0.00 0.00 0.00 176.54 179.35 3kym n HIS 101 N -3.53 0.00 -0.31 5.60 8.25 -1.26 -5.07 115.22 118.89 3kym n HIS 101 Ca -0.09 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.37 3kym n HIS 101 Cb 1.03 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.14 3kym n HIS 101 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 3kym n ASN 102 N 0.00 0.07 -1.80 0.41 5.15 -1.26 -4.69 115.26 113.15 3kym n ASN 102 Ca 0.00 -0.44 -0.14 0.00 -0.60 0.00 0.00 54.58 53.40 3kym n ASN 102 Cb 0.00 0.11 0.01 0.00 -0.53 0.00 0.00 39.78 39.37 3kym n ASN 102 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 3kym n ASP 103 N -0.11 -4.34 -3.62 1.20 10.43 -1.26 -5.01 116.55 113.83 3kym n ASP 103 Ca 0.00 -0.11 -0.41 0.00 2.57 0.00 0.00 54.79 56.85 3kym n ASP 103 Cb 0.08 -3.35 -0.02 0.00 1.84 0.00 0.00 41.12 39.66 3kym n ASP 103 CO 0.00 0.00 0.00 0.79 -1.07 0.00 0.00 177.20 176.92 3kym n TRP 104 N -4.04 2.79 -4.49 1.24 8.01 -1.26 -3.78 117.44 115.92 3kym n TRP 104 Ca -0.11 -2.58 -0.23 0.00 -1.31 0.00 0.00 57.50 53.27 3kym n TRP 104 Cb 0.60 -2.24 -0.11 0.00 -2.01 0.00 0.00 31.31 27.55 3kym n TRP 104 CO 0.00 0.00 0.00 1.52 -1.01 0.00 0.00 177.69 178.20 3kym s TYR 105 N 3.63 2.09 -0.33 -5.99 -0.85 -1.26 -5.02 117.35 109.62 3kym s TYR 105 Ca 0.52 -0.86 -0.08 0.00 -0.52 0.00 0.00 57.07 56.13 3kym s TYR 105 Cb 0.14 -1.37 0.02 0.00 0.38 0.00 0.00 41.96 41.13 3kym s TYR 105 CO -0.02 0.14 0.14 -0.06 -1.52 0.00 0.00 175.55 174.23 3kym s PHE 106 N -3.13 3.20 -2.66 -3.49 0.40 -1.26 -2.46 117.98 108.58 3kym s PHE 106 Ca 0.35 -0.98 0.22 0.00 -0.60 0.00 0.00 56.93 55.92 3kym s PHE 106 Cb 0.08 -2.33 0.22 0.00 0.51 0.00 0.00 43.02 41.50 3kym s PHE 106 CO 0.16 -0.60 1.23 -0.40 0.70 0.00 0.00 175.22 176.31 3kym n ASP 107 N 4.92 2.95 -3.68 1.36 5.75 -0.51 -4.92 116.55 122.40 3kym n ASP 107 Ca -0.13 -1.93 -0.14 0.00 -0.01 0.00 0.00 54.79 52.58 3kym n ASP 107 Cb 0.47 -0.05 -0.08 0.00 -1.03 0.00 0.00 41.12 40.43 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 -1.75 -0.15 -0.04 -2.12 2.96 -1.24 -4.98 118.68 111.36 3kym s LEU 108 Ca 0.28 1.10 0.02 0.00 -0.22 0.00 0.00 54.13 55.31 3kym s LEU 108 Cb 0.19 1.94 0.01 0.00 0.50 0.00 0.00 46.19 48.83 3kym s LEU 108 CO 0.28 -0.22 -0.09 0.26 -1.32 0.00 0.00 176.35 175.26 3kym s TRP 109 N 0.21 1.07 1.09 5.38 0.52 -1.26 -1.45 118.94 124.50 3kym s TRP 109 Ca -0.01 -0.31 -0.16 0.00 0.02 0.00 0.00 56.10 55.65 3kym s TRP 109 Cb -0.04 -0.79 0.24 0.00 -1.15 0.00 0.00 33.47 31.73 3kym s TRP 109 CO 0.01 -0.15 1.11 0.20 0.02 0.00 0.00 176.95 178.13 3kym s GLY 110 N 0.40 1.57 0.00 0.98 0.00 -0.73 -4.65 107.32 104.89 3kym s GLY 110 Ca -0.07 -0.66 0.26 0.00 0.00 0.00 0.00 44.72 44.25 3kym s GLY 110 CO 0.01 0.08 1.50 -0.96 0.00 0.00 0.00 173.10 173.74 3kym n ARG 111 N -4.44 1.12 -0.04 2.90 1.85 -1.26 -4.81 116.66 111.98 3kym n ARG 111 Ca 0.09 -0.73 0.01 0.00 -1.00 0.00 0.00 57.85 56.21 3kym n ARG 111 Cb 0.58 -1.48 -0.00 0.00 -1.05 0.00 0.00 32.46 30.51 3kym n ARG 111 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3kym n GLY 112 N 1.33 -2.63 3.00 2.89 0.00 -1.26 -5.02 105.19 103.49 3kym n GLY 112 Ca 0.13 -1.44 -0.11 0.00 0.00 0.00 0.00 46.02 44.60 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 -3.02 0.07 0.00 2.61 -4.23 -1.19 -4.88 115.64 105.00 3kym s THR 113 Ca 0.00 -0.57 -0.18 0.00 -1.18 0.00 0.00 61.69 59.76 3kym s THR 113 Cb 0.00 -0.25 -0.06 0.00 1.34 0.00 0.00 72.50 73.53 3kym s THR 113 CO 0.00 -0.31 0.50 -1.48 -0.54 0.00 0.00 174.62 172.78 3kym s LEU 114 N -0.97 4.45 -0.05 4.79 2.34 -1.26 -2.58 118.68 125.39 3kym s LEU 114 Ca -0.11 1.06 0.03 0.00 0.06 0.00 0.00 54.13 55.17 3kym s LEU 114 Cb -0.06 -2.75 0.00 0.00 -0.56 0.00 0.00 46.19 42.82 3kym s LEU 114 CO -0.00 0.22 -0.14 -0.69 -1.06 0.00 0.00 176.35 174.67 3kym s VAL 115 N -0.65 1.25 -0.15 1.48 1.01 0.36 -3.26 120.40 120.45 3kym s VAL 115 Ca 0.27 -0.59 -0.04 0.00 0.00 0.00 0.00 61.98 61.62 3kym s VAL 115 Cb -0.17 -1.10 0.05 0.00 0.00 0.00 0.00 36.38 35.16 3kym s VAL 115 CO 0.15 0.37 0.06 -0.89 0.00 0.00 0.00 175.10 174.79 3kym s THR 116 N 0.29 0.11 -0.62 3.92 2.01 -1.21 -0.51 115.64 119.64 3kym s THR 116 Ca -0.08 -0.15 -0.15 0.00 0.31 0.00 0.00 61.69 61.62 3kym s THR 116 Cb -0.13 -0.63 0.15 0.00 0.01 0.00 0.00 72.50 71.91 3kym s THR 116 CO 0.03 -0.14 0.57 -0.69 -0.69 0.00 0.00 174.62 173.69 3kym s VAL 117 N 2.05 5.26 -0.13 3.82 1.01 -1.26 -1.73 120.40 129.42 3kym s VAL 117 Ca 0.02 -1.79 -0.11 0.00 0.00 0.00 0.00 61.98 60.10 3kym s VAL 117 Cb -0.15 -4.34 0.04 0.00 0.00 0.00 0.00 36.38 31.92 3kym s VAL 117 CO -0.08 -0.91 0.35 -0.55 0.00 0.00 0.00 175.10 173.91 3kym s SER 118 N 3.14 -0.38 0.03 3.32 0.15 -1.09 -4.16 113.70 114.71 3kym s SER 118 Ca 0.07 0.71 -0.29 0.00 0.70 0.00 0.00 55.95 57.15 3kym s SER 118 Cb -0.24 0.68 -0.17 0.00 -1.71 0.00 0.00 66.02 64.58 3kym s SER 118 CO -0.00 -0.14 1.34 0.28 1.20 0.00 0.00 173.24 175.92 3kym h SER 119 N 6.05 -0.69 0.00 5.45 0.02 -1.96 -3.40 113.55 119.03 3kym h SER 119 Ca -0.30 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.62 3kym h SER 119 Cb 1.18 0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.90 3kym h SER 119 CO 0.30 -0.37 0.00 0.00 -1.14 0.00 0.00 176.83 175.62 3kym n ALA 120 N -2.57 0.00 0.00 3.77 0.00 -1.26 -4.95 120.51 115.50 3kym n ALA 120 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.32 3kym n ALA 120 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.80 3kym n ALA 120 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3kym n SER 121 N 0.00 0.00 -4.75 0.00 2.88 -1.26 -4.97 113.62 105.52 3kym n SER 121 Ca 0.00 0.00 -0.41 0.00 -1.33 0.00 0.00 58.87 57.13 3kym n SER 121 Cb 0.00 0.45 -0.05 0.00 -0.75 0.00 0.00 64.21 63.86 3kym n SER 121 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 3kym s THR 122 N -3.43 3.88 0.00 2.46 -4.23 -1.26 -4.68 115.64 108.39 3kym s THR 122 Ca 0.00 1.77 0.00 0.00 -1.18 0.00 0.00 61.69 62.28 3kym s THR 122 Cb 0.00 -4.13 0.00 0.00 1.34 0.00 0.00 72.50 69.71 3kym s THR 122 CO 0.00 0.37 0.00 1.17 -0.54 0.00 0.00 174.62 175.62 3kym n LYS 123 N 1.82 2.51 -3.55 3.99 4.81 -0.95 -4.89 118.16 121.89 3kym n LYS 123 Ca 0.00 0.00 -0.15 0.00 -0.87 0.00 0.00 58.31 57.30 3kym n LYS 123 Cb 0.46 0.00 -0.05 0.00 0.02 0.00 0.00 35.03 35.46 3kym n LYS 123 CO 0.00 0.00 0.00 0.20 1.17 0.00 0.00 177.40 178.77 3kym s GLY 124 N 0.00 -0.47 0.00 3.14 0.00 -1.26 -4.55 107.32 104.18 3kym s GLY 124 Ca 0.00 0.75 0.00 0.00 0.00 0.00 0.00 44.72 45.47 3kym s GLY 124 CO 0.00 0.43 0.57 -1.55 0.00 0.00 0.00 173.10 172.55 3kym n PRO 125 N 0.48 0.00 -2.08 2.90 -0.04 -1.26 -4.11 135.00 130.89 3kym n PRO 125 Ca -0.18 0.14 -0.01 0.00 -0.04 0.00 0.00 63.50 63.40 3kym n PRO 125 Cb 0.60 -1.08 0.00 0.00 -0.04 0.00 0.00 33.50 32.98 3kym n PRO 125 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3kym n SER 126 N -0.91 -4.76 -4.63 3.54 3.41 -1.26 -3.56 113.62 105.44 3kym n SER 126 Ca 0.00 0.50 -0.43 0.00 -0.26 0.00 0.00 58.87 58.68 3kym n SER 126 Cb 0.00 -3.01 -0.02 0.00 -0.26 0.00 0.00 64.21 60.92 3kym n SER 126 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3kym s VAL 127 N -1.14 4.25 -0.11 -3.33 1.01 -1.26 -3.55 120.40 116.27 3kym s VAL 127 Ca 0.04 1.42 -0.17 0.00 0.00 0.00 0.00 61.98 63.27 3kym s VAL 127 Cb -0.01 -4.22 -0.04 0.00 0.00 0.00 0.00 36.38 32.10 3kym s VAL 127 CO 0.36 -0.46 0.44 -0.36 0.00 0.00 0.00 175.10 175.08 3kym s PHE 128 N 4.12 3.53 -0.65 5.22 2.99 -0.17 -4.90 117.98 128.12 3kym s PHE 128 Ca 0.53 0.86 -0.11 0.00 0.00 0.00 0.00 56.93 58.21 3kym s PHE 128 Cb -0.16 -2.49 -0.19 0.00 0.00 0.00 0.00 43.02 40.19 3kym s PHE 128 CO 0.21 0.24 1.81 -0.35 -0.00 0.00 0.00 175.22 177.13 3kym n PRO 129 N 3.43 0.10 0.00 0.24 -0.04 -1.26 -3.07 135.00 134.40 3kym n PRO 129 Ca -0.09 -0.35 0.00 0.00 -0.04 0.00 0.00 63.50 63.02 3kym n PRO 129 Cb 0.52 -1.80 0.00 0.00 -0.04 0.00 0.00 33.50 32.18 3kym n PRO 129 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 3kym n LEU 130 N 9.12 0.00 -4.71 1.53 0.00 -1.26 -4.74 117.00 116.95 3kym n LEU 130 Ca 0.39 0.00 -0.30 0.00 0.00 0.00 0.00 56.01 56.10 3kym n LEU 130 Cb 0.34 0.00 0.14 0.00 0.00 0.00 0.00 43.42 43.90 3kym n LEU 130 CO 0.75 0.00 0.67 0.00 0.00 0.00 0.00 177.39 178.81 3kym s ALA 131 N 0.00 1.59 0.00 1.96 0.00 -1.18 -4.41 121.76 119.72 3kym s ALA 131 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 51.96 52.10 3kym s ALA 131 Cb 0.00 -3.26 0.00 0.00 0.00 0.00 0.00 23.12 19.86 3kym s ALA 131 CO 0.00 -2.36 0.00 -0.35 0.00 0.00 0.00 175.76 173.05 3kym n PRO 132 N -3.91 1.69 -0.61 0.00 -0.04 -1.26 -3.19 135.00 127.68 3kym n PRO 132 Ca 0.08 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.62 3kym n PRO 132 Cb 0.54 -0.65 -0.02 0.00 -0.04 0.00 0.00 33.50 33.32 3kym n PRO 132 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3kym n SER 134 N -4.39 0.00 0.07 0.00 7.64 -1.26 -4.80 113.62 110.88 3kym n SER 134 Ca 0.00 0.00 -0.23 0.00 1.01 0.00 0.00 58.87 59.66 3kym n SER 134 Cb 0.28 0.00 -0.15 0.00 -1.01 0.00 0.00 64.21 63.33 3kym n SER 134 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 3kym h ARG 135 N 0.00 0.38 0.00 1.43 2.43 -2.06 -3.45 114.38 113.11 3kym h ARG 135 Ca 0.00 -0.64 -0.22 0.00 -0.81 0.00 0.00 59.98 58.31 3kym h ARG 135 Cb 0.00 0.24 -0.15 0.00 -0.42 0.00 0.00 29.97 29.64 3kym h ARG 135 CO 0.00 1.31 -0.37 0.43 -1.51 0.00 0.00 179.97 179.83 3kym n SER 136 N -3.82 -2.14 -4.27 -3.80 7.64 -1.26 -5.14 113.62 100.84 3kym n SER 136 Ca -0.21 -3.23 -0.32 0.00 1.01 0.00 0.00 58.87 56.11 3kym n SER 136 Cb 0.99 1.65 -0.16 0.00 -1.01 0.00 0.00 64.21 65.68 3kym n SER 136 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3kym s THR 137 N 0.23 2.46 0.00 0.44 -4.23 -1.26 -4.92 115.64 108.36 3kym s THR 137 Ca 0.21 -0.87 0.00 0.00 -1.18 0.00 0.00 61.69 59.85 3kym s THR 137 Cb 0.31 -1.99 0.00 0.00 1.34 0.00 0.00 72.50 72.16 3kym s THR 137 CO -0.07 0.54 0.00 -0.24 -0.54 0.00 0.00 174.62 174.31 3kym n SER 138 N 3.59 0.00 -2.68 3.99 2.88 -1.26 -4.94 113.62 115.20 3kym n SER 138 Ca -0.19 0.00 -0.05 0.00 -1.33 0.00 0.00 58.87 57.30 3kym n SER 138 Cb 0.53 0.00 0.08 0.00 -0.75 0.00 0.00 64.21 64.06 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 0.00 0.46 0.00 -1.46 1.02 -1.26 -5.13 120.64 114.27 3kym n GLU 139 Ca 0.00 -1.08 0.00 0.00 -0.02 0.00 0.00 57.16 56.06 3kym n GLU 139 Cb 0.00 -0.27 0.00 0.00 -0.02 0.00 0.00 31.44 31.15 3kym n GLU 139 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 3kym n SER 140 N 0.07 0.00 -4.87 1.62 3.41 -1.26 -5.06 113.62 107.53 3kym n SER 140 Ca -0.09 0.00 -0.32 0.00 -0.26 0.00 0.00 58.87 58.20 3kym n SER 140 Cb 0.73 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.63 3kym n SER 140 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3kym s THR 141 N 2.36 4.92 0.00 6.66 -4.23 -1.26 -2.75 115.64 121.34 3kym s THR 141 Ca 0.00 0.49 0.00 0.00 -1.18 0.00 0.00 61.69 61.00 3kym s THR 141 Cb 0.00 -3.62 0.00 0.00 1.34 0.00 0.00 72.50 70.22 3kym s THR 141 CO 0.00 -0.07 0.00 0.00 -0.54 0.00 0.00 174.62 174.01 3kym n ALA 142 N -0.14 0.00 -0.80 3.99 0.00 -0.78 -4.92 120.51 117.86 3kym n ALA 142 Ca 0.01 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.37 3kym n ALA 142 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 3kym n ALA 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3kym n ALA 143 N -1.67 -2.94 -3.70 0.00 0.00 -1.19 -4.94 120.51 106.07 3kym n ALA 143 Ca 0.00 0.03 -0.20 0.00 0.00 0.00 0.00 53.44 53.27 3kym n ALA 143 Cb 0.00 -0.36 -0.17 0.00 0.00 0.00 0.00 19.45 18.92 3kym n ALA 143 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3kym s LEU 144 N -0.03 0.99 -0.27 0.00 1.02 -0.50 -4.79 118.68 115.09 3kym s LEU 144 Ca 0.00 -0.07 -0.04 0.00 0.02 0.00 0.00 54.13 54.04 3kym s LEU 144 Cb 0.00 -0.36 0.09 0.00 0.02 0.00 0.00 46.19 45.94 3kym s LEU 144 CO 0.00 -0.12 0.11 -0.83 0.02 0.00 0.00 176.35 175.53 3kym s GLY 145 N 1.35 0.55 -0.34 -3.19 0.00 -1.19 -0.42 107.32 104.08 3kym s GLY 145 Ca -0.05 -1.01 -0.29 0.00 0.00 0.00 0.00 44.72 43.37 3kym s GLY 145 CO -0.02 1.92 1.26 0.00 0.00 0.00 0.00 173.10 176.25 3kym s LEU 147 N 4.38 4.27 -0.37 0.00 2.96 -1.17 -2.00 118.68 126.74 3kym s LEU 147 Ca 0.54 1.73 0.02 0.00 -0.22 0.00 0.00 54.13 56.20 3kym s LEU 147 Cb -0.14 -3.56 0.11 0.00 0.50 0.00 0.00 46.19 43.09 3kym s LEU 147 CO 0.24 -0.55 0.10 -0.69 -1.32 0.00 0.00 176.35 174.13 3kym s VAL 148 N 2.19 2.57 0.17 1.68 1.01 0.36 -1.00 120.40 127.38 3kym s VAL 148 Ca 0.54 -2.34 0.08 0.00 0.00 0.00 0.00 61.98 60.26 3kym s VAL 148 Cb -0.23 -2.85 -0.04 0.00 0.00 0.00 0.00 36.38 33.26 3kym s VAL 148 CO 0.20 -0.64 -0.08 -0.54 0.00 0.00 0.00 175.10 174.05 3kym s LYS 149 N 0.88 2.12 0.00 2.72 1.02 -1.23 -0.82 119.74 124.43 3kym s LYS 149 Ca 0.11 -1.21 0.00 0.00 0.02 0.00 0.00 55.97 54.89 3kym s LYS 149 Cb -0.20 -2.21 0.00 0.00 -0.52 0.00 0.00 37.83 34.90 3kym s LYS 149 CO -0.07 0.45 0.00 -0.25 -0.92 0.00 0.00 175.35 174.56 3kym n ASP 150 N 0.11 -4.89 -3.58 2.83 8.00 0.42 -4.35 116.55 115.10 3kym n ASP 150 Ca -0.11 0.89 -0.09 0.00 0.71 0.00 0.00 54.79 56.19 3kym n ASP 150 Cb 0.55 -1.40 -0.05 0.00 -0.02 0.00 0.00 41.12 40.20 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 0.00 -0.33 -0.06 1.24 -0.85 -1.12 -4.01 117.35 112.22 3kym s TYR 151 Ca 0.00 0.53 -0.05 0.00 -0.52 0.00 0.00 57.07 57.03 3kym s TYR 151 Cb 0.00 0.46 0.02 0.00 0.38 0.00 0.00 41.96 42.82 3kym s TYR 151 CO 0.00 -0.33 0.15 0.12 -1.52 0.00 0.00 175.55 173.98 3kym s PHE 152 N -1.31 -0.17 0.00 -3.49 5.36 -1.26 0.34 117.98 117.44 3kym s PHE 152 Ca 0.00 0.42 0.00 0.00 -0.96 0.00 0.00 56.93 56.40 3kym s PHE 152 Cb -0.01 0.04 0.00 0.00 -0.34 0.00 0.00 43.02 42.71 3kym s PHE 152 CO -0.00 -0.09 0.00 -0.35 -1.46 0.00 0.00 175.22 173.31 3kym n PRO 153 N 3.17 2.63 -1.07 10.12 -0.04 -1.26 -2.25 135.00 146.30 3kym n PRO 153 Ca -0.14 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.00 3kym n PRO 153 Cb 0.58 0.00 0.12 0.00 -0.04 0.00 0.00 33.50 34.16 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 0.86 1.82 0.40 0.54 2.02 -1.26 -4.89 118.70 118.19 3kym s GLU 154 Ca 0.00 1.32 0.01 0.00 0.02 0.00 0.00 54.97 56.32 3kym s GLU 154 Cb 0.00 -1.84 0.01 0.00 0.10 0.00 0.00 34.13 32.40 3kym s GLU 154 CO 0.00 -1.99 0.09 -0.35 0.02 0.00 0.00 175.26 173.03 3kym n PRO 155 N -3.74 0.99 -3.92 0.39 -0.04 -1.26 -4.97 135.00 122.46 3kym n PRO 155 Ca 0.10 -2.81 -0.18 0.00 -0.04 0.00 0.00 63.50 60.57 3kym n PRO 155 Cb 0.53 0.63 -0.16 0.00 -0.04 0.00 0.00 33.50 34.45 3kym n PRO 155 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3kym s VAL 156 N -2.33 0.22 -0.21 0.52 1.01 -1.26 -4.51 120.40 113.82 3kym s VAL 156 Ca 0.07 0.09 -0.23 0.00 0.00 0.00 0.00 61.98 61.90 3kym s VAL 156 Cb -0.01 -0.32 -0.01 0.00 0.00 0.00 0.00 36.38 36.04 3kym s VAL 156 CO 0.04 0.17 0.76 -0.89 0.00 0.00 0.00 175.10 175.18 3kym s THR 157 N 1.16 4.91 -0.11 3.92 2.01 -1.14 -4.97 115.64 121.42 3kym s THR 157 Ca -0.08 1.45 0.03 0.00 0.31 0.00 0.00 61.69 63.39 3kym s THR 157 Cb -0.13 -4.06 0.01 0.00 0.01 0.00 0.00 72.50 68.32 3kym s THR 157 CO -0.02 0.01 -0.19 0.54 -0.69 0.00 0.00 174.62 174.27 3kym s VAL 158 N 2.41 1.75 0.46 3.82 0.11 -1.26 -1.61 120.40 126.08 3kym s VAL 158 Ca 0.33 -0.81 0.03 0.00 -2.93 0.00 0.00 61.98 58.60 3kym s VAL 158 Cb -0.16 -1.55 -0.01 0.00 -1.53 0.00 0.00 36.38 33.13 3kym s VAL 158 CO 0.09 0.49 0.10 -0.44 -3.33 0.00 0.00 175.10 172.02 3kym s SER 159 N 0.71 3.32 0.03 3.54 0.01 -0.74 -4.97 113.70 115.61 3kym s SER 159 Ca -0.11 -1.73 0.01 0.00 1.31 0.00 0.00 55.95 55.43 3kym s SER 159 Cb -0.16 0.63 -0.02 0.00 0.21 0.00 0.00 66.02 66.68 3kym s SER 159 CO 0.02 -0.97 -0.06 0.26 0.41 0.00 0.00 173.24 172.90 3kym s TRP 160 N -3.08 0.52 -0.25 2.43 0.52 -1.26 -2.34 118.94 115.47 3kym s TRP 160 Ca 0.15 -0.50 -0.05 0.00 0.02 0.00 0.00 56.10 55.73 3kym s TRP 160 Cb 0.01 -0.32 0.01 0.00 -1.15 0.00 0.00 33.47 32.01 3kym s TRP 160 CO 0.10 -0.12 0.16 0.09 0.02 0.00 0.00 176.95 177.20 3kym n ASN 161 N 1.55 -1.07 -2.57 2.95 4.13 -0.97 -2.95 115.26 116.34 3kym n ASN 161 Ca -0.23 -0.28 -0.04 0.00 1.68 0.00 0.00 54.58 55.71 3kym n ASN 161 Cb 0.55 -0.38 -0.04 0.00 -1.54 0.00 0.00 39.78 38.37 3kym n ASN 161 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 3kym n SER 162 N -0.02 -2.72 0.00 6.41 7.64 -1.26 -4.06 113.62 119.60 3kym n SER 162 Ca -0.05 1.45 0.00 0.00 1.01 0.00 0.00 58.87 61.28 3kym n SER 162 Cb 0.15 -5.02 0.00 0.00 -1.01 0.00 0.00 64.21 58.33 3kym n SER 162 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3kym n GLY 163 N 1.81 0.00 0.00 0.23 0.00 -1.24 -4.62 105.19 101.37 3kym n GLY 163 Ca -0.31 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.71 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 0.00 0.00 -2.67 4.61 0.00 -1.15 -5.00 120.51 116.30 3kym n ALA 164 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 3kym n ALA 164 Cb 0.00 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.51 3kym n ALA 164 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3kym n LEU 165 N 0.00 -1.44 -0.97 0.00 7.94 -1.23 -4.80 117.00 116.50 3kym n LEU 165 Ca 0.00 -1.60 0.12 0.00 -1.11 0.00 0.00 56.01 53.42 3kym n LEU 165 Cb 0.00 0.57 0.10 0.00 0.53 0.00 0.00 43.42 44.62 3kym n LEU 165 CO 0.00 1.48 0.63 0.41 -1.11 0.00 0.00 177.39 178.80 3kym n THR 166 N 1.87 0.02 -1.60 1.96 -1.04 -1.26 -4.59 114.28 109.64 3kym n THR 166 Ca 0.05 -0.51 -0.15 0.00 -2.04 0.00 0.00 64.05 61.40 3kym n THR 166 Cb 0.68 1.48 -0.12 0.00 -1.82 0.00 0.00 70.33 70.56 3kym n THR 166 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 3kym s SER 167 N -1.98 3.40 0.02 8.00 0.01 -1.26 -3.65 113.70 118.23 3kym s SER 167 Ca 0.28 -0.97 0.00 0.00 1.31 0.00 0.00 55.95 56.57 3kym s SER 167 Cb 0.20 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.83 3kym s SER 167 CO 0.30 -4.80 0.00 0.61 0.41 0.00 0.00 173.24 169.76 3kym n GLY 168 N 6.15 -3.76 3.61 3.44 0.00 -1.26 -4.75 105.19 108.62 3kym n GLY 168 Ca 0.41 -0.46 0.02 0.00 0.00 0.00 0.00 46.02 45.99 3kym n GLY 168 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kym s VAL 169 N -0.16 -0.01 -0.10 1.61 0.11 -1.24 -3.79 120.40 116.82 3kym s VAL 169 Ca 0.00 0.00 -0.02 0.00 -2.93 0.00 0.00 61.98 59.03 3kym s VAL 169 Cb 0.00 -1.00 0.04 0.00 -1.53 0.00 0.00 36.38 33.89 3kym s VAL 169 CO 0.00 0.00 0.03 -1.00 -3.33 0.00 0.00 175.10 170.80 3kym s HIS 170 N 1.15 0.58 -0.32 1.54 3.76 0.41 -4.98 115.29 117.42 3kym s HIS 170 Ca -0.08 -0.25 -0.07 0.00 -0.15 0.00 0.00 55.06 54.52 3kym s HIS 170 Cb -0.02 -0.78 0.03 0.00 1.11 0.00 0.00 32.58 32.91 3kym s HIS 170 CO -0.11 -0.38 0.10 0.99 -0.85 0.00 0.00 174.74 174.49 3kym s THR 171 N 2.00 3.92 0.54 1.30 2.01 -1.26 0.12 115.64 124.27 3kym s THR 171 Ca 0.03 -0.92 -0.19 0.00 0.31 0.00 0.00 61.69 60.93 3kym s THR 171 Cb -0.14 -3.13 -0.06 0.00 0.01 0.00 0.00 72.50 69.19 3kym s THR 171 CO -0.06 -0.07 1.07 -0.36 -0.69 0.00 0.00 174.62 174.51 3kym s PHE 172 N 1.46 2.89 0.34 4.92 0.40 -1.14 -5.00 117.98 121.85 3kym s PHE 172 Ca 0.00 1.55 -0.28 0.00 -0.60 0.00 0.00 56.93 57.60 3kym s PHE 172 Cb -0.18 -3.11 -0.10 0.00 0.51 0.00 0.00 43.02 40.13 3kym s PHE 172 CO 0.03 -1.14 1.34 -1.25 0.70 0.00 0.00 175.22 174.90 3kym s PRO 173 N -3.51 4.29 1.04 0.24 0.04 -1.26 -4.68 135.00 131.16 3kym s PRO 173 Ca 0.68 2.29 -0.11 0.00 0.04 0.00 0.00 61.00 63.89 3kym s PRO 173 Cb -0.18 -3.04 0.21 0.00 0.04 0.00 0.00 34.50 31.53 3kym s PRO 173 CO 0.27 -0.27 1.09 0.00 0.04 0.00 0.00 177.00 178.13 3kym s ALA 174 N -1.14 0.52 0.00 8.56 0.00 -1.26 -4.84 121.76 123.60 3kym s ALA 174 Ca 0.50 0.29 0.00 0.00 0.00 0.00 0.00 51.96 52.75 3kym s ALA 174 Cb -0.41 -3.37 0.00 0.00 0.00 0.00 0.00 23.12 19.34 3kym s ALA 174 CO 0.55 -3.32 0.00 0.28 0.00 0.00 0.00 175.76 173.27 3kym n VAL 175 N -4.60 0.00 -3.15 0.00 0.31 -0.49 -4.93 118.33 105.48 3kym n VAL 175 Ca 0.08 0.00 0.06 0.00 -0.01 0.00 0.00 64.34 64.47 3kym n VAL 175 Cb 0.53 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 33.44 3kym n VAL 175 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 3kym s LEU 176 N 0.00 -0.26 0.00 7.52 0.20 -1.26 -4.05 118.68 120.82 3kym s LEU 176 Ca 0.00 0.13 0.00 0.00 0.69 0.00 0.00 54.13 54.95 3kym s LEU 176 Cb 0.00 1.20 0.00 0.00 -0.43 0.00 0.00 46.19 46.96 3kym s LEU 176 CO 0.00 -0.05 0.00 0.00 -0.29 0.00 0.00 176.35 176.01 3kym n GLN 177 N 5.38 0.00 0.30 1.98 1.13 -1.26 -5.03 117.38 119.87 3kym n GLN 177 Ca -0.04 0.00 0.14 0.00 -1.94 0.00 0.00 57.00 55.16 3kym n GLN 177 Cb 0.55 0.00 0.74 0.00 0.11 0.00 0.00 30.24 31.64 3kym n GLN 177 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 3kym h SER 178 N 0.00 0.00 1.01 1.08 4.64 -1.99 -0.00 113.55 118.29 3kym h SER 178 Ca 0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 3kym h SER 178 Cb 0.00 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.10 3kym h SER 178 CO 0.00 0.00 -0.49 -1.28 -0.87 0.00 0.00 176.83 174.19 3kym h SER 179 N 0.00 -1.16 0.00 4.97 0.87 -2.03 -3.48 113.55 112.73 3kym h SER 179 Ca 0.00 0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.60 3kym h SER 179 Cb 0.60 0.30 0.00 0.00 -0.44 0.00 0.00 62.40 62.86 3kym h SER 179 CO 0.00 -0.82 0.00 0.61 -0.53 0.00 0.00 176.83 176.09 3kym n GLY 180 N -1.67 0.35 3.89 5.77 0.00 -0.01 -5.03 105.19 108.48 3kym n GLY 180 Ca -0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.57 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 0.00 2.52 0.11 0.99 1.43 -1.26 -4.81 118.68 117.65 3kym s LEU 181 Ca 0.00 -1.39 0.03 0.00 -1.03 0.00 0.00 54.13 51.74 3kym s LEU 181 Cb 0.00 -1.01 -0.04 0.00 0.03 0.00 0.00 46.19 45.17 3kym s LEU 181 CO 0.00 -1.14 0.13 -0.31 0.23 0.00 0.00 176.35 175.27 3kym s TYR 182 N -2.83 3.25 -0.16 0.29 4.12 0.15 -4.35 117.35 117.82 3kym s TYR 182 Ca 0.26 0.08 -0.13 0.00 0.02 0.00 0.00 57.07 57.29 3kym s TYR 182 Cb -0.02 -1.61 0.05 0.00 -1.52 0.00 0.00 41.96 38.86 3kym s TYR 182 CO 0.16 0.53 0.42 0.45 0.02 0.00 0.00 175.55 177.13 3kym s SER 183 N -2.71 -0.46 0.01 2.29 0.15 -1.26 -0.44 113.70 111.29 3kym s SER 183 Ca 0.31 0.86 -0.16 0.00 0.70 0.00 0.00 55.95 57.66 3kym s SER 183 Cb -0.12 0.83 0.03 0.00 -1.71 0.00 0.00 66.02 65.05 3kym s SER 183 CO 0.24 -0.16 0.34 -1.48 1.20 0.00 0.00 173.24 173.38 3kym s LEU 184 N 0.56 0.72 0.46 3.45 0.05 0.00 -1.40 118.68 122.54 3kym s LEU 184 Ca -0.03 0.01 0.07 0.00 0.05 0.00 0.00 54.13 54.23 3kym s LEU 184 Cb -0.04 1.43 -0.01 0.00 -2.05 0.00 0.00 46.19 45.52 3kym s LEU 184 CO -0.03 -0.54 0.36 -0.44 -0.55 0.00 0.00 176.35 175.14 3kym s SER 185 N -1.67 4.79 -0.15 1.48 0.01 -1.26 -0.49 113.70 116.41 3kym s SER 185 Ca -0.09 -0.98 -0.05 0.00 1.31 0.00 0.00 55.95 56.14 3kym s SER 185 Cb -0.03 -0.21 0.07 0.00 0.21 0.00 0.00 66.02 66.07 3kym s SER 185 CO 0.01 -0.80 0.28 -0.55 0.41 0.00 0.00 173.24 172.59 3kym s SER 186 N -4.15 0.44 0.11 2.44 0.15 -0.85 -2.89 113.70 108.95 3kym s SER 186 Ca 0.43 0.49 0.09 0.00 0.70 0.00 0.00 55.95 57.65 3kym s SER 186 Cb -0.01 0.73 -0.04 0.00 -1.71 0.00 0.00 66.02 64.99 3kym s SER 186 CO 0.25 -0.25 -0.18 0.68 1.20 0.00 0.00 173.24 174.94 3kym s VAL 187 N 2.43 2.85 0.02 4.45 -7.23 0.33 -0.65 120.40 122.61 3kym s VAL 187 Ca 0.03 -1.47 0.04 0.00 -1.81 0.00 0.00 61.98 58.77 3kym s VAL 187 Cb -0.13 -2.30 -0.02 0.00 0.56 0.00 0.00 36.38 34.50 3kym s VAL 187 CO -0.10 0.12 -0.13 0.54 -0.31 0.00 0.00 175.10 175.23 3kym s VAL 188 N -1.12 1.01 -0.10 1.32 0.11 0.43 0.16 120.40 122.20 3kym s VAL 188 Ca 0.18 -0.79 0.02 0.00 -2.93 0.00 0.00 61.98 58.45 3kym s VAL 188 Cb -0.11 -0.89 0.02 0.00 -1.53 0.00 0.00 36.38 33.87 3kym s VAL 188 CO 0.10 0.10 -0.14 0.42 -3.33 0.00 0.00 175.10 172.25 3kym s THR 189 N -0.63 1.39 -0.04 5.04 -4.23 -1.25 -1.41 115.64 114.51 3kym s THR 189 Ca 0.02 -0.58 -0.00 0.00 -1.18 0.00 0.00 61.69 59.95 3kym s THR 189 Cb -0.07 -1.28 0.03 0.00 1.34 0.00 0.00 72.50 72.52 3kym s THR 189 CO 0.00 0.42 0.00 0.68 -0.54 0.00 0.00 174.62 175.19 3kym s VAL 190 N 1.00 0.21 -0.70 2.29 -7.23 -1.26 -4.73 120.40 109.98 3kym s VAL 190 Ca -0.07 0.12 -0.26 0.00 -1.81 0.00 0.00 61.98 59.96 3kym s VAL 190 Cb -0.15 -0.33 -0.14 0.00 0.56 0.00 0.00 36.38 36.33 3kym s VAL 190 CO -0.01 0.18 2.46 -2.65 -0.31 0.00 0.00 175.10 174.76 3kym n PRO 191 N 4.46 0.64 0.00 4.82 -0.02 -1.26 -1.87 135.00 141.77 3kym n PRO 191 Ca -0.20 -0.16 0.00 0.00 -2.02 0.00 0.00 63.50 61.12 3kym n PRO 191 Cb 0.50 -2.88 0.00 0.00 -0.02 0.00 0.00 33.50 31.10 3kym n PRO 191 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3kym n SER 192 N 14.49 0.00 -3.92 2.55 3.41 -1.11 -4.70 113.62 124.33 3kym n SER 192 Ca 0.48 0.00 -0.32 0.00 -0.26 0.00 0.00 58.87 58.76 3kym n SER 192 Cb 0.38 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.26 3kym n SER 192 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3kym n SER 193 N -1.41 -1.02 0.00 4.04 7.64 -1.26 -4.51 113.62 117.10 3kym n SER 193 Ca 0.00 -1.00 0.00 0.00 1.01 0.00 0.00 58.87 58.88 3kym n SER 193 Cb 0.00 -1.27 0.00 0.00 -1.01 0.00 0.00 64.21 61.93 3kym n SER 193 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 3kym n ASN 194 N -1.87 -0.43 -0.04 6.43 3.02 -1.26 -4.67 115.26 116.43 3kym n ASN 194 Ca 0.02 0.00 0.01 0.00 -0.03 0.00 0.00 54.58 54.58 3kym n ASN 194 Cb 0.40 0.26 0.00 0.00 -0.61 0.00 0.00 39.78 39.82 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 1.83 0.00 -0.15 3.10 3.72 -1.23 -4.27 117.46 120.46 3kym n PHE 195 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 3kym n PHE 195 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 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 0.48 1.00 0.05 1.37 0.00 -1.26 -4.09 105.19 102.74 3kym n GLY 196 Ca 0.01 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 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 -0.00 0.44 -3.78 2.61 -1.04 -1.26 -4.74 114.28 106.50 3kym n THR 197 Ca 0.00 -0.57 -0.27 0.00 -2.04 0.00 0.00 64.05 61.16 3kym n THR 197 Cb 0.04 -0.22 -0.17 0.00 -1.82 0.00 0.00 70.33 68.17 3kym n THR 197 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 3kym s GLN 198 N -3.30 0.86 1.01 -2.82 2.00 -1.26 -5.06 119.66 111.08 3kym s GLN 198 Ca -0.06 -0.43 -0.13 0.00 -2.00 0.00 0.00 55.36 52.74 3kym s GLN 198 Cb 0.11 -2.00 0.19 0.00 0.80 0.00 0.00 33.01 32.12 3kym s GLN 198 CO 0.86 -0.56 1.11 0.99 -0.50 0.00 0.00 175.29 177.19 3kym s THR 199 N 1.79 1.95 -0.03 -0.34 2.01 -1.26 -3.48 115.64 116.29 3kym s THR 199 Ca -0.00 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.00 3kym s THR 199 Cb -0.16 -2.58 0.03 0.00 0.01 0.00 0.00 72.50 69.80 3kym s THR 199 CO -0.07 0.00 0.00 -0.31 -0.69 0.00 0.00 174.62 173.55 3kym s TYR 200 N -3.08 0.29 -0.02 4.92 1.51 -1.26 -4.97 117.35 114.74 3kym s TYR 200 Ca 0.66 0.01 0.01 0.00 -1.01 0.00 0.00 57.07 56.73 3kym s TYR 200 Cb -0.16 -0.40 0.01 0.00 -0.11 0.00 0.00 41.96 41.31 3kym s TYR 200 CO 0.56 -0.13 -0.02 0.95 -1.11 0.00 0.00 175.55 175.81 3kym s THR 201 N 1.02 0.26 0.62 -0.71 -4.23 -1.26 -2.50 115.64 108.83 3kym s THR 201 Ca -0.10 -0.04 -0.18 0.00 -1.18 0.00 0.00 61.69 60.19 3kym s THR 201 Cb -0.14 -0.30 -0.02 0.00 1.34 0.00 0.00 72.50 73.38 3kym s THR 201 CO -0.02 0.13 1.22 0.00 -0.54 0.00 0.00 174.62 175.41 3kym s ASN 203 N -1.61 3.05 -0.15 0.00 -0.87 -0.99 -2.46 114.94 111.91 3kym s ASN 203 Ca 0.78 -1.01 -0.00 0.00 -1.57 0.00 0.00 52.86 51.06 3kym s ASN 203 Cb -0.31 -0.38 -0.01 0.00 -0.02 0.00 0.00 41.25 40.53 3kym s ASN 203 CO 0.35 -0.39 -0.14 -0.69 -2.57 0.00 0.00 177.10 173.67 3kym s VAL 204 N 2.05 2.81 -0.04 1.60 1.01 -0.99 -1.79 120.40 125.05 3kym s VAL 204 Ca 0.05 -0.72 0.06 0.00 0.00 0.00 0.00 61.98 61.37 3kym s VAL 204 Cb -0.16 -2.19 -0.01 0.00 0.00 0.00 0.00 36.38 34.01 3kym s VAL 204 CO -0.22 0.51 -0.23 -0.62 0.00 0.00 0.00 175.10 174.54 3kym s ASP 205 N 0.75 2.80 -0.39 3.32 2.15 -0.63 -0.27 116.67 124.39 3kym s ASP 205 Ca -0.06 -0.46 0.03 0.00 0.43 0.00 0.00 52.55 52.50 3kym s ASP 205 Cb -0.15 -0.63 0.16 0.00 -0.30 0.00 0.00 42.92 41.99 3kym s ASP 205 CO 0.01 0.24 0.37 -2.28 -0.17 0.00 0.00 175.17 173.34 3kym s HIS 206 N -0.24 0.13 0.25 -5.34 5.65 -0.37 -2.89 115.29 112.48 3kym s HIS 206 Ca 0.00 -1.36 -0.09 0.00 0.25 0.00 0.00 55.06 53.87 3kym s HIS 206 Cb -0.12 -0.56 0.40 0.00 -1.18 0.00 0.00 32.58 31.12 3kym s HIS 206 CO 0.02 -0.94 1.61 0.87 -0.65 0.00 0.00 174.74 175.65 3kym h LYS 207 N 6.46 0.03 0.00 2.88 1.57 -1.83 -1.75 116.57 123.94 3kym h LYS 207 Ca 0.11 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 3kym h LYS 207 Cb 1.01 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.31 3kym h LYS 207 CO 0.23 0.02 0.07 -2.30 -0.57 0.00 0.00 179.45 176.91 3kym n PRO 208 N -5.46 0.00 -3.75 3.15 -0.02 -1.26 -3.77 135.00 123.89 3kym n PRO 208 Ca 0.13 0.23 -0.13 0.00 -2.02 0.00 0.00 63.50 61.71 3kym n PRO 208 Cb 0.45 -1.57 -0.14 0.00 -0.02 0.00 0.00 33.50 32.22 3kym n PRO 208 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3kym s SER 209 N -2.37 -0.12 0.00 2.55 1.04 -0.66 -4.94 113.70 109.20 3kym s SER 209 Ca 0.00 0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.74 3kym s SER 209 Cb 0.00 0.21 0.00 0.00 0.10 0.00 0.00 66.02 66.33 3kym s SER 209 CO 0.00 -0.14 0.00 -0.46 0.98 0.00 0.00 173.24 173.62 3kym n ASN 210 N 4.10 0.00 -4.42 7.02 6.94 -1.25 -4.54 115.26 123.11 3kym n ASN 210 Ca -0.25 -0.36 -0.44 0.00 -0.02 0.00 0.00 54.58 53.51 3kym n ASN 210 Cb 0.52 0.00 -0.05 0.00 -2.36 0.00 0.00 39.78 37.89 3kym n ASN 210 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 3kym s THR 211 N 1.11 4.78 -0.32 5.53 -4.23 -1.25 -4.99 115.64 116.26 3kym s THR 211 Ca 0.00 -0.63 0.02 0.00 -1.18 0.00 0.00 61.69 59.89 3kym s THR 211 Cb 0.00 -4.42 0.10 0.00 1.34 0.00 0.00 72.50 69.52 3kym s THR 211 CO 0.00 -1.01 0.07 -0.54 -0.54 0.00 0.00 174.62 172.61 3kym s LYS 212 N 2.86 1.09 0.00 3.99 3.01 -1.26 -1.23 119.74 128.19 3kym s LYS 212 Ca 0.15 -1.46 0.00 0.00 -1.01 0.00 0.00 55.97 53.65 3kym s LYS 212 Cb -0.21 -2.58 0.00 0.00 -1.01 0.00 0.00 37.83 34.04 3kym s LYS 212 CO 0.10 -0.96 0.00 1.55 0.51 0.00 0.00 175.35 176.55 3kym n VAL 213 N 4.56 0.00 -3.15 3.17 3.14 0.63 -4.98 118.33 121.69 3kym n VAL 213 Ca 0.01 0.00 0.06 0.00 -2.96 0.00 0.00 64.34 61.44 3kym n VAL 213 Cb 0.42 -0.24 -0.01 0.00 -1.06 0.00 0.00 33.84 32.95 3kym n VAL 213 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 3kym s ASP 214 N 0.40 -0.23 -0.34 6.55 -1.08 -1.26 -2.34 116.67 118.37 3kym s ASP 214 Ca 0.00 0.09 0.03 0.00 -0.52 0.00 0.00 52.55 52.15 3kym s ASP 214 Cb 0.00 1.17 0.10 0.00 -1.46 0.00 0.00 42.92 42.73 3kym s ASP 214 CO 0.00 -0.04 0.04 -0.75 0.52 0.00 0.00 175.17 174.94 3kym s LYS 215 N 2.98 1.61 -0.27 4.34 2.47 -1.03 -4.98 119.74 124.86 3kym s LYS 215 Ca 0.10 -1.81 -0.29 0.00 -1.56 0.00 0.00 55.97 52.41 3kym s LYS 215 Cb -0.05 -3.20 -0.00 0.00 -1.46 0.00 0.00 37.83 33.12 3kym s LYS 215 CO -0.15 -0.90 1.27 -0.08 0.16 0.00 0.00 175.35 175.65 3kym s THR 216 N 0.94 4.21 -0.25 3.43 -1.32 -1.26 -1.44 115.64 119.96 3kym s THR 216 Ca 0.08 1.40 -0.29 0.00 -1.21 0.00 0.00 61.69 61.67 3kym s THR 216 Cb -0.19 -4.15 0.00 0.00 -1.51 0.00 0.00 72.50 66.65 3kym s THR 216 CO -0.07 -0.40 1.19 0.54 -2.21 0.00 0.00 174.62 173.67 3kym s VAL 217 N 4.10 4.37 0.00 5.08 0.11 -1.04 -4.87 120.40 128.15 3kym s VAL 217 Ca 0.55 1.61 -0.02 0.00 -2.93 0.00 0.00 61.98 61.19 3kym s VAL 217 Cb -0.17 -4.20 -0.10 0.00 -1.53 0.00 0.00 36.38 30.37 3kym s VAL 217 CO 0.20 -0.32 1.80 -0.62 -3.33 0.00 0.00 175.10 172.83 3kym n GLU 218 N 6.81 0.87 -0.45 1.54 -0.58 -1.26 -4.72 120.64 122.85 3kym n GLU 218 Ca 0.13 -0.38 0.00 0.00 -0.42 0.00 0.00 57.16 56.49 3kym n GLU 218 Cb 0.46 -1.63 0.00 0.00 -0.57 0.00 0.00 31.44 29.70 3kym n GLU 218 CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52