#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r0k s VAL 2 N 0.00 3.07 -0.29 2.62 1.01 -1.26 -3.84 120.40 121.72 2r0k s VAL 2 Ca 0.00 0.88 -0.25 0.00 0.00 0.00 0.00 61.98 62.61 2r0k s VAL 2 Cb 0.00 -3.56 0.17 0.00 0.00 0.00 0.00 36.38 32.99 2r0k s VAL 2 CO 0.00 0.13 1.30 0.00 0.00 0.00 0.00 175.10 176.53 2r0k s GLN 3 N -0.11 0.21 -0.14 2.72 -2.07 0.03 -4.96 119.66 115.34 2r0k s GLN 3 Ca 0.58 0.23 -0.06 0.00 -1.82 0.00 0.00 55.36 54.29 2r0k s GLN 3 Cb -0.38 0.10 -0.04 0.00 -1.09 0.00 0.00 33.01 31.60 2r0k s GLN 3 CO 0.39 -0.03 0.09 -0.51 -1.32 0.00 0.00 175.29 173.91 2r0k s LEU 4 N 0.02 4.06 -0.12 2.60 2.01 -1.26 -2.59 118.68 123.40 2r0k s LEU 4 Ca 0.06 0.28 0.00 0.00 0.01 0.00 0.00 54.13 54.49 2r0k s LEU 4 Cb -0.05 -1.99 0.02 0.00 0.01 0.00 0.00 46.19 44.18 2r0k s LEU 4 CO -0.12 0.32 -0.11 -0.69 1.01 0.00 0.00 176.35 176.77 2r0k s VAL 5 N -0.52 1.23 0.16 -1.59 1.01 -1.17 -4.16 120.40 115.36 2r0k s VAL 5 Ca 0.11 -0.43 0.04 0.00 0.00 0.00 0.00 61.98 61.70 2r0k s VAL 5 Cb -0.12 -1.19 -0.04 0.00 0.00 0.00 0.00 36.38 35.04 2r0k s VAL 5 CO 0.02 0.40 0.18 -1.61 0.00 0.00 0.00 175.10 174.08 2r0k s GLU 6 N 1.47 3.04 -0.22 2.72 2.02 -1.26 -1.37 118.70 125.10 2r0k s GLU 6 Ca 0.02 -0.81 -0.27 0.00 0.02 0.00 0.00 54.97 53.93 2r0k s GLU 6 Cb -0.13 -2.72 0.11 0.00 0.10 0.00 0.00 34.13 31.48 2r0k s GLU 6 CO -0.07 0.49 0.92 -1.12 0.02 0.00 0.00 175.26 175.50 2r0k s SER 7 N -3.17 -0.51 0.00 -0.19 0.01 -0.70 -4.94 113.70 104.19 2r0k s SER 7 Ca 0.32 0.85 0.00 0.00 1.31 0.00 0.00 55.95 58.43 2r0k s SER 7 Cb -0.10 0.81 0.00 0.00 0.21 0.00 0.00 66.02 66.94 2r0k s SER 7 CO 0.25 -0.27 0.00 0.61 0.41 0.00 0.00 173.24 174.24 2r0k n GLY 8 N 1.79 1.68 3.85 3.44 0.00 -1.26 0.17 105.19 114.86 2r0k n GLY 8 Ca -0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.58 2r0k n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2r0k s GLY 9 N -1.40 1.80 0.00 -0.02 0.00 -1.26 -4.72 107.32 101.72 2r0k s GLY 9 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 44.72 44.76 2r0k s GLY 9 CO 0.00 0.32 0.00 0.61 0.00 0.00 0.00 173.10 174.03 2r0k n GLY 10 N -2.20 -0.59 3.79 0.20 0.00 -0.35 -4.80 105.19 101.23 2r0k n GLY 10 Ca 0.07 -0.50 -0.39 0.00 0.00 0.00 0.00 46.02 45.20 2r0k n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2r0k s LEU 11 N 0.00 4.49 -0.04 0.99 2.96 -1.26 0.13 118.68 125.95 2r0k s LEU 11 Ca 0.00 1.27 -0.25 0.00 -0.22 0.00 0.00 54.13 54.93 2r0k s LEU 11 Cb 0.00 -2.95 0.05 0.00 0.50 0.00 0.00 46.19 43.79 2r0k s LEU 11 CO 0.00 0.20 0.55 0.54 -1.32 0.00 0.00 176.35 176.32 2r0k s VAL 12 N -0.77 0.02 0.19 1.68 0.11 -0.22 -4.93 120.40 116.48 2r0k s VAL 12 Ca 0.30 -0.17 -0.27 0.00 -2.93 0.00 0.00 61.98 58.92 2r0k s VAL 12 Cb -0.19 -0.86 -0.08 0.00 -1.53 0.00 0.00 36.38 33.72 2r0k s VAL 12 CO 0.19 -0.09 0.84 -1.10 -3.33 0.00 0.00 175.10 171.61 2r0k s GLN 13 N -1.20 4.68 0.08 1.54 1.11 -1.25 -2.29 119.66 122.32 2r0k s GLN 13 Ca -0.12 1.28 -0.31 0.00 0.01 0.00 0.00 55.36 56.23 2r0k s GLN 13 Cb -0.02 -3.27 -0.10 0.00 -1.01 0.00 0.00 33.01 28.60 2r0k s GLN 13 CO 0.08 0.54 1.88 -2.30 0.01 0.00 0.00 175.29 175.49 2r0k n PRO 14 N 1.61 2.74 -0.23 2.91 -0.02 -1.26 0.08 135.00 140.84 2r0k n PRO 14 Ca -0.04 1.00 0.00 0.00 -2.02 0.00 0.00 63.50 62.44 2r0k n PRO 14 Cb 0.48 -2.91 0.00 0.00 -0.02 0.00 0.00 33.50 31.06 2r0k n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2r0k n GLY 15 N 4.32 0.88 0.00 -1.23 0.00 0.90 -4.91 105.19 105.14 2r0k n GLY 15 Ca 0.19 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.16 2r0k n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r0k n GLY 16 N -2.23 0.67 3.19 -0.02 0.00 0.11 -4.54 105.19 102.36 2r0k n GLY 16 Ca 0.00 -1.85 -0.12 0.00 0.00 0.00 0.00 46.02 44.05 2r0k n GLY 16 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2r0k s SER 17 N -1.00 -0.36 0.01 1.61 0.15 -1.26 -2.26 113.70 110.58 2r0k s SER 17 Ca 0.00 0.67 0.01 0.00 0.70 0.00 0.00 55.95 57.33 2r0k s SER 17 Cb 0.00 0.62 -0.01 0.00 -1.71 0.00 0.00 66.02 64.92 2r0k s SER 17 CO 0.00 -0.14 -0.03 -0.76 1.20 0.00 0.00 173.24 173.50 2r0k s LEU 18 N 0.73 2.06 -0.12 3.45 1.43 0.26 -4.98 118.68 121.50 2r0k s LEU 18 Ca -0.05 -0.16 -0.03 0.00 -1.03 0.00 0.00 54.13 52.87 2r0k s LEU 18 Cb -0.06 -0.11 -0.03 0.00 0.03 0.00 0.00 46.19 46.02 2r0k s LEU 18 CO -0.05 -0.03 -0.02 -0.60 0.23 0.00 0.00 176.35 175.88 2r0k s ARG 19 N -0.40 3.36 0.13 1.70 3.52 -1.26 0.15 118.95 126.15 2r0k s ARG 19 Ca -0.02 -0.46 0.10 0.00 -0.13 0.00 0.00 55.73 55.21 2r0k s ARG 19 Cb -0.03 -2.87 -0.04 0.00 -1.56 0.00 0.00 34.95 30.45 2r0k s ARG 19 CO -0.00 0.46 -0.20 -0.51 -0.81 0.00 0.00 175.30 174.24 2r0k s LEU 20 N -0.22 2.61 -0.05 -0.88 1.02 -0.98 -4.50 118.68 115.69 2r0k s LEU 20 Ca 0.05 -0.63 0.04 0.00 0.02 0.00 0.00 54.13 53.61 2r0k s LEU 20 Cb -0.13 -1.45 -0.00 0.00 0.02 0.00 0.00 46.19 44.63 2r0k s LEU 20 CO 0.02 0.17 -0.17 -0.44 0.02 0.00 0.00 176.35 175.95 2r0k s SER 21 N -2.22 2.18 -0.44 2.29 0.01 0.13 -2.17 113.70 113.47 2r0k s SER 21 Ca 0.18 -0.36 0.04 0.00 1.31 0.00 0.00 55.95 57.11 2r0k s SER 21 Cb -0.10 -0.70 0.12 0.00 0.21 0.00 0.00 66.02 65.54 2r0k s SER 21 CO 0.10 0.14 0.18 0.00 0.41 0.00 0.00 173.24 174.06 2r0k s ALA 23 N 0.26 3.35 0.69 0.00 0.00 -0.47 -1.35 121.76 124.24 2r0k s ALA 23 Ca 0.15 -2.13 -0.15 0.00 0.00 0.00 0.00 51.96 49.82 2r0k s ALA 23 Cb -0.23 -3.58 0.02 0.00 0.00 0.00 0.00 23.12 19.32 2r0k s ALA 23 CO -0.04 -2.42 1.15 0.00 0.00 0.00 0.00 175.76 174.46 2r0k s ALA 24 N 2.95 2.32 -0.28 0.00 0.00 -0.55 -3.07 121.76 123.13 2r0k s ALA 24 Ca 0.14 0.71 -0.17 0.00 0.00 0.00 0.00 51.96 52.63 2r0k s ALA 24 Cb -0.23 -3.39 0.11 0.00 0.00 0.00 0.00 23.12 19.62 2r0k s ALA 24 CO 0.07 -1.53 0.85 0.45 0.00 0.00 0.00 175.76 175.60 2r0k s SER 25 N -2.30 -0.70 0.00 0.00 0.15 -1.07 -4.83 113.70 104.96 2r0k s SER 25 Ca 0.70 1.14 0.00 0.00 0.70 0.00 0.00 55.95 58.50 2r0k s SER 25 Cb -0.24 1.27 0.00 0.00 -1.71 0.00 0.00 66.02 65.34 2r0k s SER 25 CO 0.43 -0.18 0.00 0.61 1.20 0.00 0.00 173.24 175.29 2r0k n GLY 26 N 3.81 2.53 3.27 9.45 0.00 -1.25 -0.79 105.19 122.20 2r0k n GLY 26 Ca -0.19 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.73 2r0k n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2r0k s PHE 27 N -2.67 0.81 0.08 1.61 -0.71 -1.26 -4.54 117.98 111.29 2r0k s PHE 27 Ca 0.00 -1.12 -0.17 0.00 -1.04 0.00 0.00 56.93 54.61 2r0k s PHE 27 Cb 0.00 -0.33 -0.06 0.00 -1.21 0.00 0.00 43.02 41.42 2r0k s PHE 27 CO 0.00 -0.67 0.52 0.95 -1.34 0.00 0.00 175.22 174.68 2r0k s THR 28 N -4.07 4.84 0.29 -4.49 -4.23 -1.26 -4.99 115.64 101.73 2r0k s THR 28 Ca 0.28 1.01 -0.01 0.00 -1.18 0.00 0.00 61.69 61.79 2r0k s THR 28 Cb 0.05 -3.81 0.18 0.00 1.34 0.00 0.00 72.50 70.27 2r0k s THR 28 CO 0.06 0.47 1.86 0.40 -0.54 0.00 0.00 174.62 176.87 2r0k h ILE 29 N 3.36 1.22 -0.49 2.99 2.04 -1.92 -3.31 117.51 121.41 2r0k h ILE 29 Ca -0.50 -0.71 -0.06 0.00 1.00 0.00 0.00 64.86 64.59 2r0k h ILE 29 Cb 1.21 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 37.79 2r0k h ILE 29 CO 0.64 0.28 0.05 0.74 0.00 0.00 0.00 178.15 179.85 2r0k h THR 30 N 0.86 1.23 -1.53 -0.27 2.02 -1.94 -2.86 112.91 110.42 2r0k h THR 30 Ca 0.20 -0.92 -0.65 0.00 0.77 0.00 0.00 66.41 65.81 2r0k h THR 30 Cb 0.20 0.81 -0.23 0.00 -1.74 0.00 0.00 68.15 67.19 2r0k h THR 30 CO -0.02 0.33 0.78 0.61 0.37 0.00 0.00 175.52 177.60 2r0k n GLY 31 N -0.74 5.06 0.00 2.16 0.00 -1.24 -4.20 105.19 106.23 2r0k n GLY 31 Ca 0.03 -2.20 0.00 0.00 0.00 0.00 0.00 46.02 43.85 2r0k n GLY 31 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2r0k n SER 32 N -0.02 0.00 -4.75 1.61 2.88 -1.08 -4.98 113.62 107.28 2r0k n SER 32 Ca 0.52 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.72 2r0k n SER 32 Cb 0.39 0.00 0.05 0.00 -0.75 0.00 0.00 64.21 63.90 2r0k n SER 32 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2r0k s ALA 33 N 0.00 2.42 -0.09 -1.46 0.00 -1.05 -4.63 121.76 116.95 2r0k s ALA 33 Ca 0.00 0.76 0.04 0.00 0.00 0.00 0.00 51.96 52.76 2r0k s ALA 33 Cb 0.00 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 19.73 2r0k s ALA 33 CO 0.00 -1.35 -0.22 0.42 0.00 0.00 0.00 175.76 174.61 2r0k s ILE 34 N -2.03 1.88 0.28 0.00 -1.09 -0.51 -2.50 121.20 117.22 2r0k s ILE 34 Ca 0.72 -0.92 0.11 0.00 -2.23 0.00 0.00 60.65 58.32 2r0k s ILE 34 Cb -0.25 -1.63 -0.05 0.00 -1.58 0.00 0.00 42.46 38.95 2r0k s ILE 34 CO 0.39 0.52 -0.11 -1.00 -1.23 0.00 0.00 174.94 173.51 2r0k s HIS 35 N 0.33 2.47 -0.18 3.97 3.76 0.26 -0.37 115.29 125.53 2r0k s HIS 35 Ca -0.16 -0.29 0.01 0.00 -0.15 0.00 0.00 55.06 54.47 2r0k s HIS 35 Cb -0.17 -1.09 0.02 0.00 1.11 0.00 0.00 32.58 32.45 2r0k s HIS 35 CO 0.07 0.67 -0.20 -1.58 -0.85 0.00 0.00 174.74 172.85 2r0k s TRP 36 N -2.43 2.75 -0.18 1.40 0.52 -0.30 -0.97 118.94 119.73 2r0k s TRP 36 Ca 0.31 -1.61 -0.04 0.00 0.02 0.00 0.00 56.10 54.78 2r0k s TRP 36 Cb -0.05 -1.90 -0.02 0.00 -1.15 0.00 0.00 33.47 30.35 2r0k s TRP 36 CO 0.17 -0.79 -0.03 0.08 0.02 0.00 0.00 176.95 176.40 2r0k s VAL 37 N 1.25 3.77 0.35 4.03 1.01 0.25 -1.26 120.40 129.81 2r0k s VAL 37 Ca 0.04 -0.39 0.07 0.00 0.00 0.00 0.00 61.98 61.70 2r0k s VAL 37 Cb -0.13 -2.67 -0.02 0.00 0.00 0.00 0.00 36.38 33.56 2r0k s VAL 37 CO -0.12 0.46 0.39 0.00 0.00 0.00 0.00 175.10 175.83 2r0k s ARG 38 N 0.73 2.85 -0.22 2.72 1.70 0.71 0.12 118.95 127.57 2r0k s ARG 38 Ca -0.02 -1.22 -0.08 0.00 -0.47 0.00 0.00 55.73 53.94 2r0k s ARG 38 Cb -0.14 -2.61 0.09 0.00 -0.57 0.00 0.00 34.95 31.72 2r0k s ARG 38 CO 0.02 0.02 0.48 -1.14 -1.08 0.00 0.00 175.30 173.60 2r0k s GLN 39 N -4.10 0.41 0.54 3.89 0.74 -0.37 -0.35 119.66 120.41 2r0k s GLN 39 Ca 0.44 1.11 -0.11 0.00 0.05 0.00 0.00 55.36 56.85 2r0k s GLN 39 Cb -0.07 0.39 -0.05 0.00 1.10 0.00 0.00 33.01 34.38 2r0k s GLN 39 CO 0.29 -0.22 0.93 0.00 -0.55 0.00 0.00 175.29 175.73 2r0k s ALA 40 N 2.47 3.20 0.18 1.58 0.00 -1.26 -0.62 121.76 127.31 2r0k s ALA 40 Ca -0.04 -0.15 -0.24 0.00 0.00 0.00 0.00 51.96 51.53 2r0k s ALA 40 Cb -0.11 -2.92 0.07 0.00 0.00 0.00 0.00 23.12 20.15 2r0k s ALA 40 CO -0.14 -0.43 1.48 -2.30 0.00 0.00 0.00 175.76 174.37 2r0k n PRO 41 N -2.21 -0.33 0.00 0.00 -0.02 -1.26 -1.06 135.00 130.12 2r0k n PRO 41 Ca 0.04 1.46 0.12 0.00 -2.02 0.00 0.00 63.50 63.10 2r0k n PRO 41 Cb 0.54 -2.16 0.17 0.00 -0.02 0.00 0.00 33.50 32.03 2r0k n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2r0k n GLY 42 N -1.34 -0.45 4.00 -1.23 0.00 -1.26 -5.01 105.19 99.91 2r0k n GLY 42 Ca 0.05 -0.51 -0.21 0.00 0.00 0.00 0.00 46.02 45.35 2r0k n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2r0k s LYS 43 N -2.58 2.25 0.00 1.61 3.01 -0.22 -5.12 119.74 118.69 2r0k s LYS 43 Ca 0.19 -1.23 0.00 0.00 -1.01 0.00 0.00 55.97 53.92 2r0k s LYS 43 Cb 0.18 -2.54 0.00 0.00 -1.01 0.00 0.00 37.83 34.47 2r0k s LYS 43 CO 0.59 -0.91 0.00 0.41 0.51 0.00 0.00 175.35 175.95 2r0k n GLY 44 N -2.38 -0.37 3.64 -3.33 0.00 -1.26 -4.55 105.19 96.94 2r0k n GLY 44 Ca 0.13 -1.71 -0.36 0.00 0.00 0.00 0.00 46.02 44.08 2r0k n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2r0k s LEU 45 N 0.00 4.06 -0.25 0.99 1.43 -1.26 -4.18 118.68 119.46 2r0k s LEU 45 Ca 0.00 0.09 -0.01 0.00 -1.03 0.00 0.00 54.13 53.18 2r0k s LEU 45 Cb 0.00 -2.09 0.04 0.00 0.03 0.00 0.00 46.19 44.17 2r0k s LEU 45 CO 0.00 0.06 -0.07 -0.70 0.23 0.00 0.00 176.35 175.87 2r0k s GLU 46 N 1.09 2.67 0.23 1.70 2.12 0.53 -4.99 118.70 122.04 2r0k s GLU 46 Ca 0.07 -1.08 -0.30 0.00 0.36 0.00 0.00 54.97 54.02 2r0k s GLU 46 Cb -0.14 -2.97 -0.09 0.00 0.26 0.00 0.00 34.13 31.20 2r0k s GLU 46 CO 0.05 -0.45 1.31 -0.46 -0.54 0.00 0.00 175.26 175.17 2r0k s TRP 47 N 1.27 3.22 0.00 5.30 -0.00 -1.26 -0.21 118.94 127.26 2r0k s TRP 47 Ca -0.02 1.25 0.00 0.00 -0.00 0.00 0.00 56.10 57.33 2r0k s TRP 47 Cb -0.17 -3.62 0.00 0.00 -0.00 0.00 0.00 33.47 29.68 2r0k s TRP 47 CO -0.05 -1.89 0.00 1.33 -0.00 0.00 0.00 176.95 176.34 2r0k n VAL 48 N 2.29 0.00 -3.76 5.86 0.24 -0.39 -4.70 118.33 117.87 2r0k n VAL 48 Ca 0.05 0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 62.22 2r0k n VAL 48 Cb 0.42 -0.59 -0.11 0.00 -1.47 0.00 0.00 33.84 32.10 2r0k n VAL 48 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2r0k s ALA 49 N -1.96 -0.79 -0.01 2.33 0.00 -1.19 0.15 121.76 120.30 2r0k s ALA 49 Ca 0.00 0.82 0.07 0.00 0.00 0.00 0.00 51.96 52.85 2r0k s ALA 49 Cb 0.00 -0.45 -0.02 0.00 0.00 0.00 0.00 23.12 22.65 2r0k s ALA 49 CO 0.00 -0.17 -0.22 -1.50 0.00 0.00 0.00 175.76 173.88 2r0k s ILE 50 N -0.02 1.71 0.02 0.00 2.07 -0.07 -1.15 121.20 123.75 2r0k s ILE 50 Ca -0.02 -0.95 0.08 0.00 -1.41 0.00 0.00 60.65 58.36 2r0k s ILE 50 Cb -0.03 -1.43 -0.02 0.00 0.13 0.00 0.00 42.46 41.11 2r0k s ILE 50 CO 0.01 0.47 -0.25 -0.51 -1.91 0.00 0.00 174.94 172.75 2r0k s ILE 51 N -0.53 1.97 -0.61 2.00 2.07 0.50 -2.16 121.20 124.45 2r0k s ILE 51 Ca 0.08 -1.20 -0.11 0.00 -1.41 0.00 0.00 60.65 58.01 2r0k s ILE 51 Cb -0.08 -1.67 0.15 0.00 0.13 0.00 0.00 42.46 40.99 2r0k s ILE 51 CO -0.01 0.43 0.51 0.20 -1.91 0.00 0.00 174.94 174.16 2r0k s ASN 52 N -0.92 6.04 0.00 4.50 0.02 -0.20 -1.43 114.94 122.96 2r0k s ASN 52 Ca 0.10 -2.23 0.00 0.00 -1.02 0.00 0.00 52.86 49.71 2r0k s ASN 52 Cb -0.10 -2.09 0.00 0.00 0.02 0.00 0.00 41.25 39.08 2r0k s ASN 52 CO 0.01 -0.66 0.71 -2.65 0.02 0.00 0.00 177.10 174.53 2r0k n PRO 52 N 4.54 0.77 -0.10 -0.60 -0.02 -1.26 0.16 135.00 138.48 2r0k n PRO 52 Ca -0.01 0.00 -0.17 0.00 -2.02 0.00 0.00 63.50 61.30 2r0k n PRO 52 Cb 0.42 -1.06 -0.07 0.00 -0.02 0.00 0.00 33.50 32.77 2r0k n PRO 52 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2r0k n ASN 53 N -0.40 1.90 0.10 2.55 0.23 -1.26 -4.60 115.26 113.78 2r0k n ASN 53 Ca 0.00 0.42 0.12 0.00 -0.53 0.00 0.00 54.58 54.58 2r0k n ASN 53 Cb 0.03 -0.84 0.04 0.00 -2.08 0.00 0.00 39.78 36.93 2r0k n ASN 53 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 2r0k h GLY 54 N -1.00 0.00 0.00 4.83 0.00 -1.76 -3.48 103.07 101.66 2r0k h GLY 54 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.04 2r0k h GLY 54 CO -0.17 0.00 0.00 0.61 0.00 0.00 0.00 176.54 176.98 2r0k n GLY 55 N 1.21 0.53 3.72 4.60 0.00 0.42 -5.02 105.19 110.65 2r0k n GLY 55 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 2r0k n GLY 55 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2r0k s TYR 56 N -2.22 3.40 -0.07 1.61 5.04 -1.23 -4.80 117.35 119.08 2r0k s TYR 56 Ca 0.00 1.29 -0.02 0.00 -2.44 0.00 0.00 57.07 55.91 2r0k s TYR 56 Cb 0.00 -3.47 0.03 0.00 0.35 0.00 0.00 41.96 38.87 2r0k s TYR 56 CO 0.00 -1.44 0.03 0.95 -1.34 0.00 0.00 175.55 173.75 2r0k s THR 57 N 0.59 0.17 -0.03 4.34 -4.23 -1.26 -1.03 115.64 114.19 2r0k s THR 57 Ca 0.57 0.20 0.01 0.00 -1.18 0.00 0.00 61.69 61.29 2r0k s THR 57 Cb -0.32 -0.40 -0.03 0.00 1.34 0.00 0.00 72.50 73.08 2r0k s THR 57 CO 0.33 0.19 -0.01 -0.47 -0.54 0.00 0.00 174.62 174.11 2r0k s TYR 58 N 2.05 3.06 0.37 3.99 5.04 -0.92 -4.98 117.35 125.97 2r0k s TYR 58 Ca 0.05 0.09 0.08 0.00 -2.44 0.00 0.00 57.07 54.85 2r0k s TYR 58 Cb -0.12 -1.70 -0.07 0.00 0.35 0.00 0.00 41.96 40.41 2r0k s TYR 58 CO -0.05 0.44 -0.03 0.71 -1.34 0.00 0.00 175.55 175.28 2r0k s TYR 59 N -0.99 2.43 0.59 4.97 2.02 -1.26 -0.89 117.35 124.21 2r0k s TYR 59 Ca 0.17 -0.61 -0.09 0.00 -0.37 0.00 0.00 57.07 56.17 2r0k s TYR 59 Cb -0.11 -1.57 -0.03 0.00 -0.40 0.00 0.00 41.96 39.85 2r0k s TYR 59 CO 0.07 0.48 0.95 0.00 -1.57 0.00 0.00 175.55 175.48 2r0k s ALA 60 N -2.70 3.19 0.07 3.71 0.00 0.12 -4.90 121.76 121.24 2r0k s ALA 60 Ca 0.34 -0.31 -0.23 0.00 0.00 0.00 0.00 51.96 51.75 2r0k s ALA 60 Cb 0.07 -2.87 -0.16 0.00 0.00 0.00 0.00 23.12 20.16 2r0k s ALA 60 CO 0.17 -0.66 1.64 -0.44 0.00 0.00 0.00 175.76 176.47 2r0k h ASP 61 N -0.18 0.02 -0.06 0.00 3.32 -1.93 0.72 116.42 118.30 2r0k h ASP 61 Ca -0.45 -0.11 0.02 0.00 0.02 0.00 0.00 57.03 56.51 2r0k h ASP 61 Cb 1.21 -0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.75 2r0k h ASP 61 CO 0.62 0.12 0.12 0.77 -1.72 0.00 0.00 179.24 179.15 2r0k h SER 62 N -0.08 0.00 0.00 6.45 4.64 -1.98 -2.85 113.55 119.73 2r0k h SER 62 Ca 0.00 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.16 2r0k h SER 62 Cb 0.11 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.17 2r0k h SER 62 CO -0.00 0.00 -1.83 0.55 -0.87 0.00 0.00 176.83 174.68 2r0k n VAL 63 N -3.42 0.62 -1.68 0.95 3.14 -1.08 -4.96 118.33 111.91 2r0k n VAL 63 Ca -0.01 -0.49 -0.48 0.00 -2.96 0.00 0.00 64.34 60.40 2r0k n VAL 63 Cb 0.21 -0.39 -0.05 0.00 -1.06 0.00 0.00 33.84 32.55 2r0k n VAL 63 CO 0.00 0.00 0.00 1.17 -6.46 0.00 0.00 176.83 171.54 2r0k n LYS 64 N -2.33 2.10 -1.09 1.45 4.81 0.22 -1.49 118.16 121.82 2r0k n LYS 64 Ca -0.16 0.77 0.00 0.00 -0.87 0.00 0.00 58.31 58.05 2r0k n LYS 64 Cb 0.75 -2.57 0.00 0.00 0.02 0.00 0.00 35.03 33.23 2r0k n LYS 64 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2r0k n GLY 65 N 3.99 0.46 0.57 3.14 0.00 -1.26 -4.82 105.19 107.27 2r0k n GLY 65 Ca 0.21 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 45.27 2r0k n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2r0k n ARG 66 N -2.51 0.00 -3.37 1.61 1.74 -0.56 -5.06 116.66 108.51 2r0k n ARG 66 Ca 0.00 0.00 -0.22 0.00 -0.77 0.00 0.00 57.85 56.86 2r0k n ARG 66 Cb 0.09 -0.41 -0.00 0.00 -1.02 0.00 0.00 32.46 31.12 2r0k n ARG 66 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2r0k s PHE 67 N -1.39 3.32 -0.24 -1.55 0.40 -0.88 -1.66 117.98 115.98 2r0k s PHE 67 Ca 0.00 0.13 -0.03 0.00 -0.60 0.00 0.00 56.93 56.43 2r0k s PHE 67 Cb 0.00 -1.99 0.13 0.00 0.51 0.00 0.00 43.02 41.67 2r0k s PHE 67 CO 0.00 -0.00 0.40 0.99 0.70 0.00 0.00 175.22 177.30 2r0k s THR 68 N -2.30 -0.64 -0.06 0.64 2.01 -0.16 -4.91 115.64 110.22 2r0k s THR 68 Ca 0.43 -0.03 -0.14 0.00 0.31 0.00 0.00 61.69 62.26 2r0k s THR 68 Cb -0.10 -0.80 -0.05 0.00 0.01 0.00 0.00 72.50 71.56 2r0k s THR 68 CO 0.34 -0.08 0.36 -0.51 -0.69 0.00 0.00 174.62 174.04 2r0k s ILE 69 N 2.58 5.16 0.32 1.82 2.07 -1.26 -0.89 121.20 131.00 2r0k s ILE 69 Ca 0.11 0.71 -0.06 0.00 -1.41 0.00 0.00 60.65 60.00 2r0k s ILE 69 Cb -0.15 -3.67 0.00 0.00 0.13 0.00 0.00 42.46 38.78 2r0k s ILE 69 CO -0.16 0.52 0.49 -0.94 -1.91 0.00 0.00 174.94 172.95 2r0k s SER 70 N -0.59 0.58 -0.09 4.50 1.04 -1.01 -4.98 113.70 113.15 2r0k s SER 70 Ca 0.21 -1.33 -0.17 0.00 0.48 0.00 0.00 55.95 55.15 2r0k s SER 70 Cb -0.15 0.65 0.04 0.00 0.10 0.00 0.00 66.02 66.66 2r0k s SER 70 CO 0.10 -1.28 0.41 0.00 0.98 0.00 0.00 173.24 173.44 2r0k s ALA 71 N -3.24 -1.03 -0.44 5.32 0.00 -1.26 0.06 121.76 121.17 2r0k s ALA 71 Ca 0.28 0.87 -0.04 0.00 0.00 0.00 0.00 51.96 53.07 2r0k s ALA 71 Cb -0.01 -0.32 0.12 0.00 0.00 0.00 0.00 23.12 22.91 2r0k s ALA 71 CO 0.17 -0.24 0.25 0.34 0.00 0.00 0.00 175.76 176.28 2r0k s ASP 72 N -0.53 5.32 0.47 0.00 -1.08 0.69 -4.99 116.67 116.55 2r0k s ASP 72 Ca -0.06 -2.12 0.12 0.00 -0.52 0.00 0.00 52.55 49.97 2r0k s ASP 72 Cb -0.04 -1.86 1.10 0.00 -1.46 0.00 0.00 42.92 40.67 2r0k s ASP 72 CO 0.03 -0.54 2.11 0.00 0.52 0.00 0.00 175.17 177.29 2r0k h THR 73 N 6.20 1.04 0.07 1.71 1.03 -1.92 -0.26 112.91 120.78 2r0k h THR 73 Ca -0.13 -0.08 -0.00 0.00 -0.01 0.00 0.00 66.41 66.19 2r0k h THR 73 Cb 1.04 0.79 0.00 0.00 -1.07 0.00 0.00 68.15 68.91 2r0k h THR 73 CO 0.72 0.04 -0.04 0.77 -0.01 0.00 0.00 175.52 177.01 2r0k h SER 74 N 0.24 -0.08 0.75 0.00 4.64 -1.94 -3.06 113.55 114.08 2r0k h SER 74 Ca 0.07 -0.41 0.00 0.00 -0.47 0.00 0.00 61.79 60.98 2r0k h SER 74 Cb -0.01 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 2r0k h SER 74 CO -0.01 0.38 0.00 0.11 -0.87 0.00 0.00 176.83 176.44 2r0k h LYS 75 N -0.57 0.00 -5.49 4.77 1.57 -1.92 -3.47 116.57 111.46 2r0k h LYS 75 Ca -0.01 0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.48 2r0k h LYS 75 Cb 0.49 0.00 0.18 0.00 0.08 0.00 0.00 32.23 32.97 2r0k h LYS 75 CO 0.02 0.00 -0.78 -1.71 -0.57 0.00 0.00 179.45 176.40 2r0k n ASN 76 N -2.95 -3.73 -4.09 0.86 5.15 -0.14 -4.87 115.26 105.49 2r0k n ASN 76 Ca -0.00 -0.64 -0.17 0.00 -0.60 0.00 0.00 54.58 53.17 2r0k n ASN 76 Cb 0.24 -5.04 -0.13 0.00 -0.53 0.00 0.00 39.78 34.32 2r0k n ASN 76 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2r0k s THR 77 N -3.36 0.83 0.28 -0.44 2.01 -1.02 -1.48 115.64 112.46 2r0k s THR 77 Ca 0.17 -0.87 0.09 0.00 0.31 0.00 0.00 61.69 61.39 2r0k s THR 77 Cb -0.02 -0.78 -0.04 0.00 0.01 0.00 0.00 72.50 71.67 2r0k s THR 77 CO 0.71 -0.07 0.04 0.00 -0.69 0.00 0.00 174.62 174.62 2r0k s ALA 78 N -0.84 3.27 0.19 7.40 0.00 -0.45 -0.22 121.76 131.10 2r0k s ALA 78 Ca -0.01 -1.67 0.02 0.00 0.00 0.00 0.00 51.96 50.29 2r0k s ALA 78 Cb -0.07 -0.81 -0.05 0.00 0.00 0.00 0.00 23.12 22.19 2r0k s ALA 78 CO 0.01 0.22 0.02 0.71 0.00 0.00 0.00 175.76 176.71 2r0k s TYR 79 N -2.33 1.28 -0.32 0.00 2.02 0.11 -1.18 117.35 116.94 2r0k s TYR 79 Ca 0.33 -1.05 -0.00 0.00 -0.37 0.00 0.00 57.07 55.98 2r0k s TYR 79 Cb -0.06 -0.73 0.13 0.00 -0.40 0.00 0.00 41.96 40.90 2r0k s TYR 79 CO 0.21 -0.23 0.27 -1.17 -1.57 0.00 0.00 175.55 173.05 2r0k s LEU 80 N -3.20 0.14 0.19 -1.29 2.96 -0.92 -2.40 118.68 114.16 2r0k s LEU 80 Ca 0.27 -1.26 -0.30 0.00 -0.22 0.00 0.00 54.13 52.61 2r0k s LEU 80 Cb 0.06 0.20 -0.09 0.00 0.50 0.00 0.00 46.19 46.87 2r0k s LEU 80 CO 0.06 -0.36 1.32 -1.58 -1.32 0.00 0.00 176.35 174.47 2r0k s GLN 81 N 1.91 4.38 -0.25 1.98 2.00 -0.07 -2.31 119.66 127.30 2r0k s GLN 81 Ca 0.12 2.06 0.01 0.00 -2.00 0.00 0.00 55.36 55.55 2r0k s GLN 81 Cb -0.16 -3.20 0.07 0.00 0.80 0.00 0.00 33.01 30.52 2r0k s GLN 81 CO -0.22 -0.27 -0.04 -1.64 -0.50 0.00 0.00 175.29 172.61 2r0k s MET 82 N 0.01 1.66 0.26 1.67 -1.94 0.40 -0.99 119.30 120.36 2r0k s MET 82 Ca 0.57 -1.15 0.09 0.00 -1.71 0.00 0.00 55.69 53.50 2r0k s MET 82 Cb -0.36 -2.67 -0.04 0.00 2.01 0.00 0.00 34.83 33.77 2r0k s MET 82 CO 0.37 -0.65 -0.00 -0.80 -0.01 0.00 0.00 175.02 173.93 2r0k s ASN 82 N 1.31 4.55 -0.97 3.03 0.01 -0.67 -0.58 114.94 121.63 2r0k s ASN 82 Ca -0.04 -0.64 -0.12 0.00 -0.71 0.00 0.00 52.86 51.36 2r0k s ASN 82 Cb -0.19 -0.85 0.00 0.00 0.41 0.00 0.00 41.25 40.62 2r0k s ASN 82 CO -0.07 0.00 0.70 -1.20 -1.51 0.00 0.00 177.10 175.02 2r0k n SER 82 N -0.88 -5.44 -4.64 -1.22 7.64 -0.96 -4.63 113.62 103.49 2r0k n SER 82 Ca -0.07 -0.88 -0.43 0.00 1.01 0.00 0.00 58.87 58.51 2r0k n SER 82 Cb 0.59 -2.87 -0.02 0.00 -1.01 0.00 0.00 64.21 60.89 2r0k n SER 82 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2r0k s LEU 82 N -5.66 3.99 0.67 -3.43 1.43 -1.15 -4.73 118.68 109.80 2r0k s LEU 82 Ca 0.23 1.25 -0.13 0.00 -1.03 0.00 0.00 54.13 54.45 2r0k s LEU 82 Cb -0.10 -3.54 0.00 0.00 0.03 0.00 0.00 46.19 42.58 2r0k s LEU 82 CO 0.87 -0.88 1.07 -0.60 0.23 0.00 0.00 176.35 177.04 2r0k s ARG 83 N 3.70 2.91 0.18 1.70 6.06 -1.26 -0.07 118.95 132.17 2r0k s ARG 83 Ca 0.50 1.14 -0.12 0.00 -2.50 0.00 0.00 55.73 54.74 2r0k s ARG 83 Cb -0.15 -1.98 0.16 0.00 0.06 0.00 0.00 34.95 33.04 2r0k s ARG 83 CO 0.16 -1.13 1.78 0.00 -2.50 0.00 0.00 175.30 173.61 2r0k h ALA 84 N -0.31 0.67 -0.22 6.12 0.00 -1.96 -2.76 119.26 120.81 2r0k h ALA 84 Ca -0.45 0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.55 2r0k h ALA 84 Cb 1.22 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 2r0k h ALA 84 CO 0.56 -0.11 0.40 0.93 0.00 0.00 0.00 179.25 181.03 2r0k h GLU 85 N 0.49 0.00 0.00 0.00 3.07 -1.93 -2.43 114.58 113.77 2r0k h GLU 85 Ca 0.24 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.10 2r0k h GLU 85 Cb 0.17 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.08 2r0k h GLU 85 CO -0.18 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 177.18 2r0k n ASP 86 N -3.32 0.06 -4.68 1.42 8.00 -1.04 -4.75 116.55 112.23 2r0k n ASP 86 Ca 0.03 0.52 -0.50 0.00 0.71 0.00 0.00 54.79 55.54 2r0k n ASP 86 Cb 0.51 -0.53 -0.05 0.00 -0.02 0.00 0.00 41.12 41.03 2r0k n ASP 86 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 2r0k n THR 87 N -1.57 0.42 -3.72 -3.53 -1.04 -0.92 -4.89 114.28 99.04 2r0k n THR 87 Ca 0.03 -0.08 0.01 0.00 -2.04 0.00 0.00 64.05 61.97 2r0k n THR 87 Cb 0.15 -1.63 -0.00 0.00 -1.82 0.00 0.00 70.33 67.04 2r0k n THR 87 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2r0k s ALA 88 N 3.40 -2.17 -0.10 2.41 0.00 -0.67 -4.58 121.76 120.04 2r0k s ALA 88 Ca 0.92 0.44 -0.13 0.00 0.00 0.00 0.00 51.96 53.19 2r0k s ALA 88 Cb -0.79 0.51 -0.05 0.00 0.00 0.00 0.00 23.12 22.79 2r0k s ALA 88 CO 0.53 -1.07 0.31 0.08 0.00 0.00 0.00 175.76 175.61 2r0k s VAL 89 N -2.43 5.25 -0.30 0.00 1.01 0.21 -0.45 120.40 123.69 2r0k s VAL 89 Ca 0.17 0.60 -0.04 0.00 0.00 0.00 0.00 61.98 62.71 2r0k s VAL 89 Cb 0.03 -3.63 0.04 0.00 0.00 0.00 0.00 36.38 32.82 2r0k s VAL 89 CO -0.02 0.48 0.03 -0.31 0.00 0.00 0.00 175.10 175.28 2r0k s TYR 90 N -0.25 3.21 -0.06 5.22 1.51 0.42 -1.24 117.35 126.16 2r0k s TYR 90 Ca 0.19 -1.56 -0.06 0.00 -1.01 0.00 0.00 57.07 54.62 2r0k s TYR 90 Cb -0.14 -2.16 -0.04 0.00 -0.11 0.00 0.00 41.96 39.50 2r0k s TYR 90 CO 0.07 -0.74 0.19 0.71 -1.11 0.00 0.00 175.55 174.68 2r0k s TYR 91 N 1.34 3.59 0.08 2.71 2.02 0.12 -1.52 117.35 125.69 2r0k s TYR 91 Ca -0.02 0.53 0.06 0.00 -0.37 0.00 0.00 57.07 57.27 2r0k s TYR 91 Cb -0.19 -1.95 -0.04 0.00 -0.40 0.00 0.00 41.96 39.39 2r0k s TYR 91 CO -0.00 0.69 -0.09 0.00 -1.57 0.00 0.00 175.55 174.57 2r0k s ALA 93 N -1.15 1.26 0.03 0.00 0.00 -0.15 -1.98 121.76 119.77 2r0k s ALA 93 Ca 0.20 -1.75 0.07 0.00 0.00 0.00 0.00 51.96 50.48 2r0k s ALA 93 Cb -0.11 1.39 -0.02 0.00 0.00 0.00 0.00 23.12 24.38 2r0k s ALA 93 CO 0.12 -0.63 -0.19 -0.98 0.00 0.00 0.00 175.76 174.08 2r0k s ARG 94 N -3.93 1.31 -0.08 0.00 1.04 -0.90 -0.58 118.95 115.81 2r0k s ARG 94 Ca 0.38 -0.86 0.03 0.00 -1.04 0.00 0.00 55.73 54.24 2r0k s ARG 94 Cb 0.05 -1.38 0.01 0.00 -2.04 0.00 0.00 34.95 31.60 2r0k s ARG 94 CO 0.16 0.35 -0.16 -1.12 -0.04 0.00 0.00 175.30 174.50 2r0k s SER 95 N -1.05 2.18 0.00 -2.89 0.01 -1.04 -2.32 113.70 108.59 2r0k s SER 95 Ca 0.06 -0.38 0.00 0.00 1.31 0.00 0.00 55.95 56.94 2r0k s SER 95 Cb -0.08 -1.01 0.00 0.00 0.21 0.00 0.00 66.02 65.14 2r0k s SER 95 CO 0.01 0.07 0.00 0.00 0.41 0.00 0.00 173.24 173.73 2r0k n ALA 96 N 3.74 1.88 -2.24 1.44 0.00 -1.24 -2.54 120.51 121.55 2r0k n ALA 96 Ca -0.22 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 52.90 2r0k n ALA 96 Cb 0.52 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.93 2r0k n ALA 96 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2r0k s ARG 97 N -0.57 2.96 0.00 0.00 1.70 -1.26 -4.55 118.95 117.23 2r0k s ARG 97 Ca 0.00 -0.95 0.00 0.00 -0.47 0.00 0.00 55.73 54.31 2r0k s ARG 97 Cb 0.00 -5.24 0.00 0.00 -0.57 0.00 0.00 34.95 29.14 2r0k s ARG 97 CO 0.00 -3.14 0.00 1.19 -1.08 0.00 0.00 175.30 172.27 2r0k n PHE 98 N 12.23 0.00 -3.70 5.89 3.01 -1.26 -4.78 117.46 128.85 2r0k n PHE 98 Ca 0.41 0.00 -0.03 0.00 1.01 0.00 0.00 57.45 58.84 2r0k n PHE 98 Cb 0.48 -0.78 -0.01 0.00 -0.01 0.00 0.00 39.48 39.15 2r0k n PHE 98 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 2r0k s SER 99 N -0.44 -0.18 -0.74 4.37 0.01 -1.26 -5.08 113.70 110.38 2r0k s SER 99 Ca 0.00 -0.32 -0.26 0.00 1.31 0.00 0.00 55.95 56.69 2r0k s SER 99 Cb 0.00 0.43 -0.11 0.00 0.21 0.00 0.00 66.02 66.55 2r0k s SER 99 CO 0.00 -0.78 2.33 -0.36 0.41 0.00 0.00 173.24 174.84 2r0k s PHE 100 N -3.15 1.23 -0.21 2.43 0.40 -1.25 -3.69 117.98 113.75 2r0k s PHE 100 Ca 0.12 1.69 0.22 0.00 -0.60 0.00 0.00 56.93 58.36 2r0k s PHE 100 Cb -0.01 -3.57 -0.18 0.00 0.51 0.00 0.00 43.02 39.78 2r0k s PHE 100 CO 0.00 -1.82 0.74 -0.40 0.70 0.00 0.00 175.22 174.45 2r0k n ASP 101 N 17.30 0.39 -3.98 1.36 5.75 -0.98 -4.83 116.55 131.55 2r0k n ASP 101 Ca 0.43 0.04 -0.26 0.00 -0.01 0.00 0.00 54.79 54.98 2r0k n ASP 101 Cb 0.46 1.32 -0.17 0.00 -1.03 0.00 0.00 41.12 41.70 2r0k n ASP 101 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 2r0k s TYR 102 N -3.41 1.57 0.16 2.11 2.02 -1.26 -5.06 117.35 113.48 2r0k s TYR 102 Ca -0.04 -0.70 0.10 0.00 -0.37 0.00 0.00 57.07 56.07 2r0k s TYR 102 Cb 0.13 -1.20 -0.04 0.00 -0.40 0.00 0.00 41.96 40.44 2r0k s TYR 102 CO 0.86 -0.42 -0.21 -1.58 -1.57 0.00 0.00 175.55 172.63 2r0k s TRP 103 N 1.16 2.42 0.88 2.71 0.52 -1.26 -2.11 118.94 123.26 2r0k s TRP 103 Ca -0.05 -0.32 -0.12 0.00 0.02 0.00 0.00 56.10 55.64 2r0k s TRP 103 Cb -0.14 -1.24 0.16 0.00 -1.15 0.00 0.00 33.47 31.10 2r0k s TRP 103 CO -0.03 0.44 1.22 0.20 0.02 0.00 0.00 176.95 178.80 2r0k s GLY 104 N -2.43 1.75 0.24 0.98 0.00 -0.84 -4.31 107.32 102.71 2r0k s GLY 104 Ca 0.19 -1.20 0.11 0.00 0.00 0.00 0.00 44.72 43.82 2r0k s GLY 104 CO 0.10 -0.53 1.48 0.06 0.00 0.00 0.00 173.10 174.21 2r0k h GLN 105 N -1.29 0.00 0.00 2.90 -0.00 -1.91 -3.46 115.11 111.35 2r0k h GLN 105 Ca -0.43 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.22 2r0k h GLN 105 Cb 1.26 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.74 2r0k h GLN 105 CO 0.44 0.70 0.00 0.41 -0.00 0.00 0.00 178.83 180.37 2r0k n GLY 106 N 0.82 1.68 3.55 0.06 0.00 -1.26 -4.99 105.19 105.05 2r0k n GLY 106 Ca -0.00 -1.45 -0.30 0.00 0.00 0.00 0.00 46.02 44.27 2r0k n GLY 106 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2r0k s THR 107 N -0.50 3.20 -0.28 2.61 -1.32 -0.57 -4.85 115.64 113.94 2r0k s THR 107 Ca 0.00 -1.29 -0.10 0.00 -1.21 0.00 0.00 61.69 59.09 2r0k s THR 107 Cb 0.00 -2.47 -0.04 0.00 -1.51 0.00 0.00 72.50 68.48 2r0k s THR 107 CO 0.00 0.15 0.16 -0.22 -2.21 0.00 0.00 174.62 172.49 2r0k s LEU 108 N -2.07 3.87 -0.28 9.08 2.96 -1.26 0.16 118.68 131.14 2r0k s LEU 108 Ca 0.20 -0.11 -0.08 0.00 -0.22 0.00 0.00 54.13 53.92 2r0k s LEU 108 Cb -0.11 -2.06 -0.01 0.00 0.50 0.00 0.00 46.19 44.51 2r0k s LEU 108 CO 0.12 -0.06 0.09 -0.69 -1.32 0.00 0.00 176.35 174.49 2r0k s VAL 109 N 1.71 4.31 -0.32 1.68 1.01 0.40 -1.21 120.40 127.98 2r0k s VAL 109 Ca 0.07 -0.35 -0.07 0.00 0.00 0.00 0.00 61.98 61.63 2r0k s VAL 109 Cb -0.16 -3.11 0.02 0.00 0.00 0.00 0.00 36.38 33.13 2r0k s VAL 109 CO 0.09 0.21 0.09 -0.89 0.00 0.00 0.00 175.10 174.60 2r0k s THR 110 N 1.59 3.87 -0.40 3.92 2.01 0.34 -1.66 115.64 125.31 2r0k s THR 110 Ca 0.05 -0.92 -0.01 0.00 0.31 0.00 0.00 61.69 61.12 2r0k s THR 110 Cb -0.16 -3.10 0.11 0.00 0.01 0.00 0.00 72.50 69.36 2r0k s THR 110 CO 0.04 -0.05 0.18 0.54 -0.69 0.00 0.00 174.62 174.64 2r0k s VAL 111 N 1.45 3.08 0.00 3.82 0.11 -1.26 -1.05 120.40 126.55 2r0k s VAL 111 Ca 0.00 -2.15 0.00 0.00 -2.93 0.00 0.00 61.98 56.90 2r0k s VAL 111 Cb -0.18 -3.14 0.00 0.00 -1.53 0.00 0.00 36.38 31.53 2r0k s VAL 111 CO 0.03 -0.68 0.00 -1.54 -3.33 0.00 0.00 175.10 169.58 2r0k n SER 112 N 4.48 0.00 -1.14 3.54 3.41 -0.97 -4.54 113.62 118.40 2r0k n SER 112 Ca -0.01 -0.05 0.08 0.00 -0.26 0.00 0.00 58.87 58.64 2r0k n SER 112 Cb 0.41 0.00 0.28 0.00 -0.26 0.00 0.00 64.21 64.65 2r0k n SER 112 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2r0k n SER 113 N -0.08 4.20 -4.83 4.04 2.88 -1.26 -3.87 113.62 114.69 2r0k n SER 113 Ca 0.00 -2.75 -0.24 0.00 -1.33 0.00 0.00 58.87 54.56 2r0k n SER 113 Cb 0.00 -0.52 0.08 0.00 -0.75 0.00 0.00 64.21 63.01 2r0k n SER 113 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2r0k s ALA 114 N -2.36 3.49 -0.17 -1.46 0.00 -1.26 -5.09 121.76 114.90 2r0k s ALA 114 Ca 0.43 -1.28 -0.02 0.00 0.00 0.00 0.00 51.96 51.08 2r0k s ALA 114 Cb 0.32 -2.29 -0.02 0.00 0.00 0.00 0.00 23.12 21.14 2r0k s ALA 114 CO 0.14 -1.23 -0.08 -1.12 0.00 0.00 0.00 175.76 173.47 2r0k s SER 115 N -4.57 4.30 -0.43 0.00 0.01 -1.26 -5.02 113.70 106.73 2r0k s SER 115 Ca 0.62 -0.31 -0.44 0.00 1.31 0.00 0.00 55.95 57.13 2r0k s SER 115 Cb -0.09 -1.70 -0.18 0.00 0.21 0.00 0.00 66.02 64.26 2r0k s SER 115 CO 0.43 0.10 1.76 0.41 0.41 0.00 0.00 173.24 176.34 2r0k n THR 116 N 4.00 0.10 -4.61 1.44 -1.04 -1.26 -4.69 114.28 108.22 2r0k n THR 116 Ca -0.18 -0.03 -0.23 0.00 -2.04 0.00 0.00 64.05 61.57 2r0k n THR 116 Cb 0.52 -0.77 -0.16 0.00 -1.82 0.00 0.00 70.33 68.10 2r0k n THR 116 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 2r0k s LYS 117 N 3.79 1.28 0.58 -2.82 2.20 0.04 -4.95 119.74 119.86 2r0k s LYS 117 Ca 1.06 -0.46 -0.14 0.00 -0.36 0.00 0.00 55.97 56.06 2r0k s LYS 117 Cb -1.34 -1.17 -0.05 0.00 -1.51 0.00 0.00 37.83 33.76 2r0k s LYS 117 CO 0.73 0.21 1.02 0.20 -0.36 0.00 0.00 175.35 177.16 2r0k s GLY 118 N -0.01 1.94 0.09 5.54 0.00 -1.26 -2.61 107.32 111.01 2r0k s GLY 118 Ca -0.01 0.17 -0.16 0.00 0.00 0.00 0.00 44.72 44.72 2r0k s GLY 118 CO 0.01 0.46 0.53 2.56 0.00 0.00 0.00 173.10 176.65 2r0k s PRO 119 N -4.43 4.04 -0.00 2.90 0.04 -1.26 -4.48 135.00 131.81 2r0k s PRO 119 Ca 0.59 0.55 -0.26 0.00 0.04 0.00 0.00 61.00 61.92 2r0k s PRO 119 Cb -0.12 -3.10 -0.04 0.00 0.04 0.00 0.00 34.50 31.28 2r0k s PRO 119 CO 0.41 0.58 0.82 -1.12 0.04 0.00 0.00 177.00 177.73 2r0k s SER 120 N -1.39 7.20 -0.26 6.66 0.01 -0.21 -4.83 113.70 120.88 2r0k s SER 120 Ca 0.32 1.45 -0.05 0.00 1.31 0.00 0.00 55.95 58.98 2r0k s SER 120 Cb -0.17 -2.49 0.01 0.00 0.21 0.00 0.00 66.02 63.58 2r0k s SER 120 CO 0.18 -0.12 0.01 -0.69 0.41 0.00 0.00 173.24 173.03 2r0k s VAL 121 N 0.56 3.50 0.08 3.43 1.01 -1.26 0.82 120.40 128.54 2r0k s VAL 121 Ca 0.43 -0.75 0.06 0.00 0.00 0.00 0.00 61.98 61.72 2r0k s VAL 121 Cb -0.20 -2.75 -0.04 0.00 0.00 0.00 0.00 36.38 33.39 2r0k s VAL 121 CO 0.23 0.19 -0.08 -0.36 0.00 0.00 0.00 175.10 175.08 2r0k s PHE 122 N 1.44 2.79 0.06 5.22 0.08 -1.22 -4.89 117.98 121.47 2r0k s PHE 122 Ca 0.02 -0.12 -0.22 0.00 0.12 0.00 0.00 56.93 56.73 2r0k s PHE 122 Cb -0.16 -1.48 -0.06 0.00 -0.57 0.00 0.00 43.02 40.74 2r0k s PHE 122 CO -0.01 0.42 0.67 -1.25 -0.10 0.00 0.00 175.22 174.95 2r0k s PRO 123 N -2.05 4.39 -0.74 0.24 0.04 -1.26 0.03 135.00 135.65 2r0k s PRO 123 Ca 0.21 0.91 -0.16 0.00 0.04 0.00 0.00 61.00 62.00 2r0k s PRO 123 Cb -0.11 -3.30 0.16 0.00 0.04 0.00 0.00 34.50 31.29 2r0k s PRO 123 CO 0.13 0.46 0.76 -0.51 0.04 0.00 0.00 177.00 177.88 2r0k s LEU 124 N -0.60 6.08 0.22 -3.56 1.43 0.45 -4.88 118.68 117.83 2r0k s LEU 124 Ca 0.33 -2.14 -0.29 0.00 -1.03 0.00 0.00 54.13 51.00 2r0k s LEU 124 Cb -0.20 -2.26 -0.09 0.00 0.03 0.00 0.00 46.19 43.67 2r0k s LEU 124 CO 0.21 -0.83 0.90 0.00 0.23 0.00 0.00 176.35 176.87 2r0k s ALA 125 N 1.40 3.36 1.10 4.21 0.00 -1.26 -2.40 121.76 128.16 2r0k s ALA 125 Ca 0.16 0.56 -0.05 0.00 0.00 0.00 0.00 51.96 52.63 2r0k s ALA 125 Cb -0.16 -3.15 0.08 0.00 0.00 0.00 0.00 23.12 19.88 2r0k s ALA 125 CO -0.03 0.22 0.20 -2.30 0.00 0.00 0.00 175.76 173.84 2r0k n PRO 126 N 1.54 -2.44 -0.07 0.00 -0.02 -1.26 -4.92 135.00 127.84 2r0k n PRO 126 Ca -0.03 -0.33 0.01 0.00 -2.02 0.00 0.00 63.50 61.13 2r0k n PRO 126 Cb 0.47 -0.40 0.02 0.00 -0.02 0.00 0.00 33.50 33.57 2r0k n PRO 126 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2r0k n GLY 134 N -0.90 -0.33 3.71 -1.23 0.00 -1.26 -4.72 105.19 100.46 2r0k n GLY 134 Ca 0.03 0.20 -0.29 0.00 0.00 0.00 0.00 46.02 45.96 2r0k n GLY 134 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2r0k s THR 135 N -5.21 4.09 -0.07 2.61 -1.32 -1.26 -3.66 115.64 110.83 2r0k s THR 135 Ca -0.03 -1.08 0.01 0.00 -1.21 0.00 0.00 61.69 59.38 2r0k s THR 135 Cb 0.04 -3.00 0.02 0.00 -1.51 0.00 0.00 72.50 68.05 2r0k s THR 135 CO 0.14 0.02 -0.07 0.00 -2.21 0.00 0.00 174.62 172.50 2r0k s ALA 136 N -1.50 0.98 0.46 11.08 0.00 -0.21 -4.90 121.76 127.68 2r0k s ALA 136 Ca 0.27 -0.26 -0.08 0.00 0.00 0.00 0.00 51.96 51.89 2r0k s ALA 136 Cb -0.11 -0.59 -0.05 0.00 0.00 0.00 0.00 23.12 22.38 2r0k s ALA 136 CO 0.20 -0.09 0.80 0.00 0.00 0.00 0.00 175.76 176.67 2r0k s ALA 137 N 1.09 3.35 0.07 0.00 0.00 -1.26 -1.93 121.76 123.07 2r0k s ALA 137 Ca -0.08 -0.34 -0.23 0.00 0.00 0.00 0.00 51.96 51.31 2r0k s ALA 137 Cb -0.14 -2.68 0.06 0.00 0.00 0.00 0.00 23.12 20.35 2r0k s ALA 137 CO -0.01 -0.25 0.55 -0.48 0.00 0.00 0.00 175.76 175.57 2r0k s LEU 138 N -4.43 -0.22 0.00 0.00 0.05 0.08 -4.22 118.68 109.95 2r0k s LEU 138 Ca 0.50 0.16 0.00 0.00 0.05 0.00 0.00 54.13 54.84 2r0k s LEU 138 Cb -0.10 2.26 0.00 0.00 -2.05 0.00 0.00 46.19 46.30 2r0k s LEU 138 CO 0.40 -0.77 0.00 0.61 -0.55 0.00 0.00 176.35 176.04 2r0k n GLY 139 N 0.24 1.76 3.25 -3.48 0.00 -1.01 0.16 105.19 106.11 2r0k n GLY 139 Ca -0.18 -0.79 -0.18 0.00 0.00 0.00 0.00 46.02 44.87 2r0k n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r0k n LEU 141 N 0.42 3.18 -4.60 0.00 7.94 0.10 -2.75 117.00 121.29 2r0k n LEU 141 Ca -0.15 -5.34 -0.43 0.00 -1.11 0.00 0.00 56.01 48.98 2r0k n LEU 141 Cb 0.57 -0.38 -0.03 0.00 0.53 0.00 0.00 43.42 44.12 2r0k n LEU 141 CO 0.28 2.12 1.64 -0.69 -1.11 0.00 0.00 177.39 179.62 2r0k s VAL 142 N -2.59 3.33 0.07 1.96 1.01 -1.03 -3.39 120.40 119.76 2r0k s VAL 142 Ca 0.41 0.33 0.04 0.00 0.00 0.00 0.00 61.98 62.75 2r0k s VAL 142 Cb 0.18 -3.45 -0.03 0.00 0.00 0.00 0.00 36.38 33.08 2r0k s VAL 142 CO -0.05 -0.29 -0.10 -0.75 0.00 0.00 0.00 175.10 173.90 2r0k s LYS 143 N 5.92 0.75 -0.61 2.72 2.20 0.24 -1.79 119.74 129.17 2r0k s LYS 143 Ca 0.86 -1.00 -0.12 0.00 -0.36 0.00 0.00 55.97 55.35 2r0k s LYS 143 Cb -0.25 -0.53 0.02 0.00 -1.51 0.00 0.00 37.83 35.55 2r0k s LYS 143 CO 0.34 0.10 0.65 -0.25 -0.36 0.00 0.00 175.35 175.82 2r0k n ASP 144 N 0.98 -6.83 -3.95 1.43 8.00 0.28 -1.05 116.55 115.41 2r0k n ASP 144 Ca -0.19 -0.09 -0.10 0.00 0.71 0.00 0.00 54.79 55.12 2r0k n ASP 144 Cb 0.56 -3.93 -0.11 0.00 -0.02 0.00 0.00 41.12 37.62 2r0k n ASP 144 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2r0k s TYR 145 N -2.60 0.20 -0.08 1.24 1.13 -0.70 -4.36 117.35 112.18 2r0k s TYR 145 Ca 0.15 -0.41 -0.07 0.00 -1.41 0.00 0.00 57.07 55.32 2r0k s TYR 145 Cb -0.03 -0.15 0.02 0.00 -1.10 0.00 0.00 41.96 40.71 2r0k s TYR 145 CO 0.81 -0.18 0.22 0.12 -2.51 0.00 0.00 175.55 174.01 2r0k s PHE 146 N -1.26 -0.25 0.23 -3.49 2.19 -1.07 -0.15 117.98 114.18 2r0k s PHE 146 Ca -0.14 0.60 0.04 0.00 0.33 0.00 0.00 56.93 57.76 2r0k s PHE 146 Cb -0.08 0.08 0.04 0.00 -1.31 0.00 0.00 43.02 41.74 2r0k s PHE 146 CO -0.01 -0.12 0.32 -0.35 1.83 0.00 0.00 175.22 176.89 2r0k n PRO 147 N 3.04 0.84 -0.80 10.12 -0.04 -1.26 -0.78 135.00 146.13 2r0k n PRO 147 Ca -0.13 -1.27 -0.32 0.00 -0.04 0.00 0.00 63.50 61.74 2r0k n PRO 147 Cb 0.58 -0.09 0.16 0.00 -0.04 0.00 0.00 33.50 34.10 2r0k n PRO 147 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2r0k s GLU 148 N -3.06 1.16 0.27 0.54 0.41 -1.26 -4.78 118.70 111.98 2r0k s GLU 148 Ca 0.24 1.62 0.06 0.00 -0.41 0.00 0.00 54.97 56.48 2r0k s GLU 148 Cb -0.02 -1.74 -0.03 0.00 -1.78 0.00 0.00 34.13 30.56 2r0k s GLU 148 CO 0.16 -2.54 0.31 -1.25 -0.49 0.00 0.00 175.26 171.44 2r0k s PRO 149 N -4.51 3.11 0.34 0.39 0.04 -1.26 -4.98 135.00 128.13 2r0k s PRO 149 Ca 0.69 -0.98 0.09 0.00 0.04 0.00 0.00 61.00 60.84 2r0k s PRO 149 Cb -0.24 -2.70 -0.06 0.00 0.04 0.00 0.00 34.50 31.54 2r0k s PRO 149 CO 0.56 0.32 -0.02 0.54 0.04 0.00 0.00 177.00 178.45 2r0k s VAL 150 N -2.11 2.53 0.02 -0.36 0.11 -1.26 -4.51 120.40 114.83 2r0k s VAL 150 Ca 0.36 -2.03 0.04 0.00 -2.93 0.00 0.00 61.98 57.42 2r0k s VAL 150 Cb -0.08 -2.76 -0.02 0.00 -1.53 0.00 0.00 36.38 31.99 2r0k s VAL 150 CO 0.27 -0.20 -0.12 -0.89 -3.33 0.00 0.00 175.10 170.83 2r0k s THR 151 N -2.54 0.96 -0.02 5.04 2.01 0.33 -4.97 115.64 116.45 2r0k s THR 151 Ca 0.34 -0.81 -0.07 0.00 0.31 0.00 0.00 61.69 61.46 2r0k s THR 151 Cb 0.01 -0.86 0.01 0.00 0.01 0.00 0.00 72.50 71.66 2r0k s THR 151 CO 0.19 0.06 0.15 -0.69 -0.69 0.00 0.00 174.62 173.63 2r0k s VAL 152 N -0.68 0.06 0.00 3.82 1.01 -1.26 -1.00 120.40 122.35 2r0k s VAL 152 Ca 0.02 -0.46 0.00 0.00 0.00 0.00 0.00 61.98 61.54 2r0k s VAL 152 Cb -0.07 -0.37 0.00 0.00 0.00 0.00 0.00 36.38 35.94 2r0k s VAL 152 CO 0.01 -0.25 0.00 -1.54 0.00 0.00 0.00 175.10 173.31 2r0k n SER 153 N 1.96 0.00 0.00 3.32 3.41 -0.57 -4.96 113.62 116.78 2r0k n SER 153 Ca -0.19 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.42 2r0k n SER 153 Cb 0.57 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.52 2r0k n SER 153 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 2r0k n TRP 154 N -1.31 0.00 -4.15 7.33 5.03 -1.15 -0.13 117.44 123.06 2r0k n TRP 154 Ca 0.00 0.00 -0.42 0.00 3.03 0.00 0.00 57.50 60.11 2r0k n TRP 154 Cb 0.00 0.00 -0.02 0.00 -1.03 0.00 0.00 31.31 30.26 2r0k n TRP 154 CO 0.00 0.00 0.00 0.09 -0.03 0.00 0.00 177.69 177.75 2r0k n ASN 155 N 0.00 -2.53 -2.65 -0.99 5.03 0.66 -2.53 115.26 112.26 2r0k n ASN 155 Ca 0.00 -1.29 -0.05 0.00 0.87 0.00 0.00 54.58 54.11 2r0k n ASN 155 Cb 0.00 -1.66 0.11 0.00 -1.02 0.00 0.00 39.78 37.21 2r0k n ASN 155 CO 0.00 0.00 0.00 -0.24 -1.83 0.00 0.00 177.26 175.19 2r0k n SER 156 N -2.38 -1.64 0.00 6.41 2.88 -1.26 -2.29 113.62 115.33 2r0k n SER 156 Ca -0.18 -2.27 0.00 0.00 -1.33 0.00 0.00 58.87 55.09 2r0k n SER 156 Cb 0.61 0.87 0.00 0.00 -0.75 0.00 0.00 64.21 64.93 2r0k n SER 156 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2r0k n GLY 157 N -0.91 1.36 0.08 0.46 0.00 -1.25 -4.99 105.19 99.95 2r0k n GLY 157 Ca -0.10 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.83 2r0k n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r0k n ALA 158 N 0.00 1.61 -2.75 4.61 0.00 -1.19 -4.82 120.51 117.97 2r0k n ALA 158 Ca 0.00 -0.94 -0.43 0.00 0.00 0.00 0.00 53.44 52.07 2r0k n ALA 158 Cb 0.00 -0.03 -0.04 0.00 0.00 0.00 0.00 19.45 19.38 2r0k n ALA 158 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2r0k s LEU 159 N -5.46 4.27 -0.18 0.00 2.96 -0.97 -4.82 118.68 114.49 2r0k s LEU 159 Ca -0.14 -0.70 -0.00 0.00 -0.22 0.00 0.00 54.13 53.07 2r0k s LEU 159 Cb 0.05 -2.60 -0.11 0.00 0.50 0.00 0.00 46.19 44.03 2r0k s LEU 159 CO 0.56 -1.32 -0.17 0.35 -1.32 0.00 0.00 176.35 174.45 2r0k n THR 160 N 6.03 1.00 -2.18 3.68 -2.24 -1.26 -4.85 114.28 114.46 2r0k n THR 160 Ca -0.02 -0.37 -0.42 0.00 -2.27 0.00 0.00 64.05 60.97 2r0k n THR 160 Cb 0.46 -1.20 -0.03 0.00 -2.10 0.00 0.00 70.33 67.46 2r0k n THR 160 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2r0k s SER 161 N -5.83 6.80 -0.25 3.42 0.01 -1.26 -2.73 113.70 113.86 2r0k s SER 161 Ca -0.24 2.08 0.00 0.00 1.31 0.00 0.00 55.95 59.10 2r0k s SER 161 Cb 0.07 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.75 2r0k s SER 161 CO 0.39 -0.81 0.00 0.61 0.41 0.00 0.00 173.24 173.84 2r0k n GLY 162 N 3.83 0.52 3.67 3.44 0.00 -1.26 -4.75 105.19 110.63 2r0k n GLY 162 Ca 0.15 -0.94 -0.42 0.00 0.00 0.00 0.00 46.02 44.81 2r0k n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2r0k s VAL 163 N -2.10 4.84 -0.35 1.61 1.01 -1.10 -2.83 120.40 121.48 2r0k s VAL 163 Ca 0.00 1.77 0.03 0.00 0.00 0.00 0.00 61.98 63.78 2r0k s VAL 163 Cb 0.00 -4.20 0.10 0.00 0.00 0.00 0.00 36.38 32.29 2r0k s VAL 163 CO 0.00 -0.00 0.08 -1.00 0.00 0.00 0.00 175.10 174.17 2r0k s HIS 164 N 2.25 3.36 -0.20 5.22 3.76 0.68 -4.98 115.29 125.39 2r0k s HIS 164 Ca 0.41 -2.81 -0.13 0.00 -0.15 0.00 0.00 55.06 52.38 2r0k s HIS 164 Cb -0.17 -2.71 -0.05 0.00 1.11 0.00 0.00 32.58 30.77 2r0k s HIS 164 CO 0.13 -0.92 0.24 0.99 -0.85 0.00 0.00 174.74 174.33 2r0k s THR 165 N 0.90 5.32 0.11 1.30 2.01 -1.26 -0.28 115.64 123.75 2r0k s THR 165 Ca 0.11 0.41 0.02 0.00 0.31 0.00 0.00 61.69 62.54 2r0k s THR 165 Cb -0.19 -3.58 -0.04 0.00 0.01 0.00 0.00 72.50 68.70 2r0k s THR 165 CO -0.10 0.36 0.25 -0.36 -0.69 0.00 0.00 174.62 174.08 2r0k s PHE 166 N 0.78 3.49 -0.29 4.92 0.40 -0.23 -4.99 117.98 122.05 2r0k s PHE 166 Ca 0.13 0.16 -0.40 0.00 -0.60 0.00 0.00 56.93 56.22 2r0k s PHE 166 Cb -0.13 -1.70 -0.16 0.00 0.51 0.00 0.00 43.02 41.55 2r0k s PHE 166 CO 0.04 0.54 1.76 -2.30 0.70 0.00 0.00 175.22 175.96 2r0k n PRO 167 N -0.21 1.13 -1.79 0.24 -0.02 -1.26 -4.61 135.00 128.48 2r0k n PRO 167 Ca -0.06 0.41 -0.41 0.00 -2.02 0.00 0.00 63.50 61.42 2r0k n PRO 167 Cb 0.53 -2.10 -0.01 0.00 -0.02 0.00 0.00 33.50 31.90 2r0k n PRO 167 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2r0k s ALA 168 N 3.66 3.66 0.12 3.55 0.00 -1.26 -4.85 121.76 126.63 2r0k s ALA 168 Ca 0.99 1.58 0.04 0.00 0.00 0.00 0.00 51.96 54.57 2r0k s ALA 168 Cb -1.08 -3.63 -0.04 0.00 0.00 0.00 0.00 23.12 18.37 2r0k s ALA 168 CO 0.66 -1.03 0.10 0.54 0.00 0.00 0.00 175.76 176.03 2r0k s VAL 169 N -0.60 4.48 -0.57 0.00 0.11 -0.40 -4.90 120.40 118.53 2r0k s VAL 169 Ca 0.58 -0.92 -0.17 0.00 -2.93 0.00 0.00 61.98 58.54 2r0k s VAL 169 Cb -0.47 -3.22 0.12 0.00 -1.53 0.00 0.00 36.38 31.28 2r0k s VAL 169 CO 0.56 0.02 0.59 -0.22 -3.33 0.00 0.00 175.10 172.73 2r0k s LEU 170 N -2.70 5.87 0.72 2.54 2.96 -1.26 -2.83 118.68 123.98 2r0k s LEU 170 Ca 0.30 -1.66 -0.14 0.00 -0.22 0.00 0.00 54.13 52.41 2r0k s LEU 170 Cb -0.11 -2.25 0.03 0.00 0.50 0.00 0.00 46.19 44.36 2r0k s LEU 170 CO 0.22 -0.96 1.13 -1.10 -1.32 0.00 0.00 176.35 174.33 2r0k s GLN 171 N 2.03 2.37 0.00 1.98 -0.21 -0.76 -4.88 119.66 120.19 2r0k s GLN 171 Ca 0.07 1.46 0.01 0.00 0.02 0.00 0.00 55.36 56.92 2r0k s GLN 171 Cb -0.27 -1.89 0.08 0.00 1.00 0.00 0.00 33.01 31.93 2r0k s GLN 171 CO 0.04 -1.59 0.67 0.45 -2.12 0.00 0.00 175.29 172.74 2r0k n SER 172 N -2.85 0.00 -1.37 5.90 2.88 -1.26 -0.19 113.62 116.73 2r0k n SER 172 Ca 0.11 0.07 0.08 0.00 -1.33 0.00 0.00 58.87 57.79 2r0k n SER 172 Cb 0.52 -0.10 0.30 0.00 -0.75 0.00 0.00 64.21 64.17 2r0k n SER 172 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2r0k n SER 173 N -1.10 4.03 -3.98 -3.46 3.41 -1.26 -4.91 113.62 106.34 2r0k n SER 173 Ca 0.01 -2.38 -0.31 0.00 -0.26 0.00 0.00 58.87 55.92 2r0k n SER 173 Cb 0.01 -0.53 0.01 0.00 -0.26 0.00 0.00 64.21 63.44 2r0k n SER 173 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2r0k n GLY 174 N 0.97 -0.47 3.12 5.00 0.00 0.73 -4.97 105.19 109.57 2r0k n GLY 174 Ca 0.21 0.18 -0.21 0.00 0.00 0.00 0.00 46.02 46.20 2r0k n GLY 174 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2r0k s LEU 175 N -7.25 2.11 0.25 0.99 1.02 -1.22 -4.87 118.68 109.71 2r0k s LEU 175 Ca 0.64 -0.37 -0.18 0.00 0.02 0.00 0.00 54.13 54.24 2r0k s LEU 175 Cb -0.33 -0.63 -0.08 0.00 0.02 0.00 0.00 46.19 45.17 2r0k s LEU 175 CO 0.85 0.08 0.72 -0.31 0.02 0.00 0.00 176.35 177.71 2r0k s TYR 176 N -0.64 3.57 -0.16 0.29 2.02 0.79 -1.83 117.35 121.38 2r0k s TYR 176 Ca 0.03 1.32 -0.08 0.00 -0.37 0.00 0.00 57.07 57.97 2r0k s TYR 176 Cb -0.07 -2.58 0.07 0.00 -0.40 0.00 0.00 41.96 38.98 2r0k s TYR 176 CO 0.01 0.27 0.38 0.45 -1.57 0.00 0.00 175.55 175.08 2r0k s SER 177 N -1.84 -0.32 0.23 2.29 0.15 -1.13 -0.56 113.70 112.53 2r0k s SER 177 Ca 0.46 0.84 0.00 0.00 0.70 0.00 0.00 55.95 57.95 2r0k s SER 177 Cb -0.15 0.87 -0.05 0.00 -1.71 0.00 0.00 66.02 64.99 2r0k s SER 177 CO 0.20 -0.21 0.11 -1.48 1.20 0.00 0.00 173.24 173.06 2r0k s LEU 178 N 1.82 1.44 0.04 3.45 0.05 -0.74 -1.27 118.68 123.46 2r0k s LEU 178 Ca -0.06 -1.38 0.07 0.00 0.05 0.00 0.00 54.13 52.80 2r0k s LEU 178 Cb -0.10 0.17 -0.02 0.00 -2.05 0.00 0.00 46.19 44.19 2r0k s LEU 178 CO -0.12 -0.78 -0.19 -0.44 -0.55 0.00 0.00 176.35 174.28 2r0k s SER 179 N -3.25 2.23 -0.25 1.48 0.01 -1.26 -2.47 113.70 110.19 2r0k s SER 179 Ca 0.38 -0.49 -0.00 0.00 1.31 0.00 0.00 55.95 57.15 2r0k s SER 179 Cb 0.07 -0.18 0.07 0.00 0.21 0.00 0.00 66.02 66.20 2r0k s SER 179 CO 0.13 0.13 0.01 -0.55 0.41 0.00 0.00 173.24 173.37 2r0k s SER 180 N -1.11 3.74 0.33 2.44 0.15 -1.11 -1.07 113.70 117.07 2r0k s SER 180 Ca 0.06 -1.28 0.04 0.00 0.70 0.00 0.00 55.95 55.47 2r0k s SER 180 Cb -0.08 -1.00 -0.02 0.00 -1.71 0.00 0.00 66.02 63.21 2r0k s SER 180 CO 0.01 -0.31 0.49 0.54 1.20 0.00 0.00 173.24 175.18 2r0k s VAL 181 N 1.52 4.64 -0.01 4.45 0.11 0.62 -2.35 120.40 129.38 2r0k s VAL 181 Ca 0.00 -0.78 -0.00 0.00 -2.93 0.00 0.00 61.98 58.27 2r0k s VAL 181 Cb -0.18 -3.66 0.01 0.00 -1.53 0.00 0.00 36.38 31.02 2r0k s VAL 181 CO -0.11 -0.33 0.01 0.54 -3.33 0.00 0.00 175.10 171.88 2r0k s VAL 182 N -2.22 -0.01 -0.25 2.04 0.11 0.42 -0.23 120.40 120.26 2r0k s VAL 182 Ca 0.41 0.04 -0.14 0.00 -2.93 0.00 0.00 61.98 59.36 2r0k s VAL 182 Cb -0.09 -0.03 -0.04 0.00 -1.53 0.00 0.00 36.38 34.68 2r0k s VAL 182 CO 0.33 0.02 0.33 0.42 -3.33 0.00 0.00 175.10 172.86 2r0k s THR 183 N 0.19 5.22 0.11 5.04 -4.23 -1.13 -0.74 115.64 120.11 2r0k s THR 183 Ca -0.02 0.51 0.01 0.00 -1.18 0.00 0.00 61.69 61.02 2r0k s THR 183 Cb -0.02 -3.66 -0.04 0.00 1.34 0.00 0.00 72.50 70.11 2r0k s THR 183 CO -0.01 0.22 -0.04 0.68 -0.54 0.00 0.00 174.62 174.94 2r0k s VAL 184 N 1.70 0.57 0.44 2.29 -7.23 -0.81 -4.86 120.40 112.51 2r0k s VAL 184 Ca 0.14 -1.93 -0.26 0.00 -1.81 0.00 0.00 61.98 58.13 2r0k s VAL 184 Cb -0.15 -1.78 -0.09 0.00 0.56 0.00 0.00 36.38 34.92 2r0k s VAL 184 CO 0.09 -0.77 1.45 -2.65 -0.31 0.00 0.00 175.10 172.90 2r0k n PRO 185 N -0.07 2.32 0.25 4.82 -0.02 -1.26 -1.04 135.00 140.00 2r0k n PRO 185 Ca -0.11 0.83 0.14 0.00 -2.02 0.00 0.00 63.50 62.34 2r0k n PRO 185 Cb 0.62 -2.65 0.45 0.00 -0.02 0.00 0.00 33.50 31.90 2r0k n PRO 185 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 2r0k h SER 186 N 2.38 0.00 0.04 2.55 0.02 -1.89 -2.86 113.55 113.80 2r0k h SER 186 Ca -0.51 0.00 -0.25 0.00 -0.84 0.00 0.00 61.79 60.19 2r0k h SER 186 Cb 1.26 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.82 2r0k h SER 186 CO 0.61 0.05 -0.96 0.77 -1.14 0.00 0.00 176.83 176.17 2r0k h SER 187 N 0.00 0.83 0.33 3.07 4.64 -1.91 -3.20 113.55 117.31 2r0k h SER 187 Ca -0.00 -0.63 -0.06 0.00 -0.47 0.00 0.00 61.79 60.62 2r0k h SER 187 Cb 0.75 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.58 2r0k h SER 187 CO 0.01 1.43 -0.29 0.77 -0.87 0.00 0.00 176.83 177.88 2r0k h SER 188 N 0.39 0.00 -3.86 4.97 4.64 -1.92 -3.41 113.55 114.36 2r0k h SER 188 Ca -0.10 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.68 2r0k h SER 188 Cb 1.60 0.00 0.11 0.00 -0.31 0.00 0.00 62.40 63.80 2r0k h SER 188 CO 0.18 0.29 0.74 0.18 -0.87 0.00 0.00 176.83 177.36 2r0k n LEU 189 N -4.10 4.70 0.00 5.97 4.77 -1.09 -2.10 117.00 125.15 2r0k n LEU 189 Ca -0.02 1.21 0.00 0.00 -0.03 0.00 0.00 56.01 57.17 2r0k n LEU 189 Cb 0.35 -1.61 0.00 0.00 -2.33 0.00 0.00 43.42 39.83 2r0k n LEU 189 CO 0.37 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.10 2r0k n GLY 190 N 0.50 2.74 0.03 -0.72 0.00 -1.26 -4.85 105.19 101.63 2r0k n GLY 190 Ca 0.02 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.02 2r0k n GLY 190 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2r0k n THR 191 N -2.00 0.53 -2.69 2.61 -2.24 -0.89 -5.05 114.28 104.54 2r0k n THR 191 Ca 0.00 0.39 0.00 0.00 -2.27 0.00 0.00 64.05 62.17 2r0k n THR 191 Cb 0.00 -1.82 0.00 0.00 -2.10 0.00 0.00 70.33 66.41 2r0k n THR 191 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 2r0k n GLN 192 N -3.15 2.74 -4.31 -0.78 0.00 -1.21 -5.16 117.38 105.51 2r0k n GLN 192 Ca -0.04 0.00 -0.16 0.00 -0.00 0.00 0.00 57.00 56.80 2r0k n GLN 192 Cb 0.14 0.00 -0.10 0.00 0.00 0.00 0.00 30.24 30.28 2r0k n GLN 192 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.06 178.01 2r0k s THR 193 N 1.20 1.37 -0.06 1.69 -4.23 -1.26 -4.86 115.64 109.49 2r0k s THR 193 Ca 0.00 -2.11 0.04 0.00 -1.18 0.00 0.00 61.69 58.44 2r0k s THR 193 Cb 0.00 -2.03 -0.00 0.00 1.34 0.00 0.00 72.50 71.81 2r0k s THR 193 CO 0.00 -0.61 -0.19 -0.31 -0.54 0.00 0.00 174.62 172.98 2r0k s TYR 194 N -3.20 1.95 -0.09 3.99 2.02 -1.24 -5.01 117.35 115.77 2r0k s TYR 194 Ca 0.21 -0.65 0.00 0.00 -0.37 0.00 0.00 57.07 56.26 2r0k s TYR 194 Cb 0.02 -1.32 0.02 0.00 -0.40 0.00 0.00 41.96 40.28 2r0k s TYR 194 CO 0.05 -0.25 -0.07 0.42 -1.57 0.00 0.00 175.55 174.12 2r0k s ILE 195 N 0.20 0.92 -0.12 2.71 1.09 -1.26 0.18 121.20 124.92 2r0k s ILE 195 Ca -0.09 -0.26 -0.13 0.00 -1.10 0.00 0.00 60.65 59.07 2r0k s ILE 195 Cb -0.14 -0.94 -0.05 0.00 -1.06 0.00 0.00 42.46 40.27 2r0k s ILE 195 CO 0.04 0.34 0.29 0.00 -0.10 0.00 0.00 174.94 175.51 2r0k s ASN 197 N -0.12 5.18 -0.15 0.00 -0.87 0.81 -0.92 114.94 118.87 2r0k s ASN 197 Ca 0.18 -0.25 -0.00 0.00 -1.57 0.00 0.00 52.86 51.22 2r0k s ASN 197 Cb -0.14 -1.93 -0.01 0.00 -0.02 0.00 0.00 41.25 39.16 2r0k s ASN 197 CO 0.06 -0.05 -0.14 -0.69 -2.57 0.00 0.00 177.10 173.71 2r0k s VAL 198 N 1.61 2.84 -0.11 1.60 1.01 0.22 -1.52 120.40 126.06 2r0k s VAL 198 Ca 0.06 -0.71 0.03 0.00 0.00 0.00 0.00 61.98 61.36 2r0k s VAL 198 Cb -0.15 -2.21 0.01 0.00 0.00 0.00 0.00 36.38 34.03 2r0k s VAL 198 CO 0.04 0.51 -0.21 0.21 0.00 0.00 0.00 175.10 175.64 2r0k s ASN 199 N 0.75 2.89 -0.70 3.32 3.04 -0.17 -0.48 114.94 123.59 2r0k s ASN 199 Ca -0.06 -0.53 0.05 0.00 0.04 0.00 0.00 52.86 52.36 2r0k s ASN 199 Cb -0.15 -1.33 0.17 0.00 -1.54 0.00 0.00 41.25 38.40 2r0k s ASN 199 CO 0.01 0.11 0.49 -2.28 -3.04 0.00 0.00 177.10 172.40 2r0k s HIS 200 N 0.55 3.57 0.34 0.43 5.65 -0.18 -0.52 115.29 125.14 2r0k s HIS 200 Ca -0.14 -3.32 0.14 0.00 0.25 0.00 0.00 55.06 51.99 2r0k s HIS 200 Cb -0.17 -2.75 1.05 0.00 -1.18 0.00 0.00 32.58 29.54 2r0k s HIS 200 CO 0.05 -0.57 1.68 0.87 -0.65 0.00 0.00 174.74 176.12 2r0k h LYS 201 N 5.50 0.37 0.00 2.88 1.57 -1.79 -0.97 116.57 124.13 2r0k h LYS 201 Ca 0.13 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 2r0k h LYS 201 Cb 0.77 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.99 2r0k h LYS 201 CO 0.72 0.25 0.24 -1.35 -0.57 0.00 0.00 179.45 178.74 2r0k h PRO 202 N 0.38 0.00 0.00 3.15 0.11 -1.91 -2.63 132.00 131.10 2r0k h PRO 202 Ca 0.71 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.76 2r0k h PRO 202 Cb 1.59 0.00 -0.13 0.00 0.11 0.00 0.00 31.00 32.58 2r0k h PRO 202 CO -0.55 0.00 -0.58 -1.13 -0.21 0.00 0.00 178.00 175.53 2r0k n SER 203 N -2.68 1.22 -1.03 -2.05 3.41 -0.38 -4.96 113.62 107.15 2r0k n SER 203 Ca -0.02 -2.71 -0.01 0.00 -0.26 0.00 0.00 58.87 55.87 2r0k n SER 203 Cb 0.28 -0.36 -0.00 0.00 -0.26 0.00 0.00 64.21 63.86 2r0k n SER 203 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2r0k n ASN 204 N -0.41 -0.23 -4.66 4.04 5.15 -0.99 -4.88 115.26 113.29 2r0k n ASN 204 Ca 0.10 0.02 -0.43 0.00 -0.60 0.00 0.00 54.58 53.67 2r0k n ASN 204 Cb 0.83 -0.68 -0.02 0.00 -0.53 0.00 0.00 39.78 39.38 2r0k n ASN 204 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2r0k s THR 205 N -1.08 4.69 -0.12 -0.44 2.01 -1.15 -4.97 115.64 114.59 2r0k s THR 205 Ca 0.00 2.01 0.03 0.00 0.31 0.00 0.00 61.69 64.04 2r0k s THR 205 Cb 0.00 -4.30 0.01 0.00 0.01 0.00 0.00 72.50 68.22 2r0k s THR 205 CO 0.00 -0.17 -0.20 -0.75 -0.69 0.00 0.00 174.62 172.81 2r0k s LYS 206 N 3.12 2.76 -0.04 4.92 2.20 -1.26 -1.01 119.74 130.43 2r0k s LYS 206 Ca 0.44 -0.77 0.00 0.00 -0.36 0.00 0.00 55.97 55.28 2r0k s LYS 206 Cb -0.15 -2.22 0.03 0.00 -1.51 0.00 0.00 37.83 33.98 2r0k s LYS 206 CO 0.07 0.02 -0.01 0.08 -0.36 0.00 0.00 175.35 175.15 2r0k s VAL 207 N 0.74 0.30 -0.11 4.02 1.01 0.37 -5.00 120.40 121.73 2r0k s VAL 207 Ca -0.10 0.06 -0.02 0.00 0.00 0.00 0.00 61.98 61.91 2r0k s VAL 207 Cb -0.16 -0.40 -0.03 0.00 0.00 0.00 0.00 36.38 35.79 2r0k s VAL 207 CO 0.01 0.19 -0.02 -1.81 0.00 0.00 0.00 175.10 173.48 2r0k s ASP 208 N 1.26 5.03 -0.07 3.32 1.11 -1.26 0.72 116.67 126.78 2r0k s ASP 208 Ca -0.06 0.02 -0.03 0.00 0.18 0.00 0.00 52.55 52.67 2r0k s ASP 208 Cb -0.13 -1.57 0.04 0.00 1.07 0.00 0.00 42.92 42.33 2r0k s ASP 208 CO -0.02 0.29 0.07 -0.75 1.18 0.00 0.00 175.17 175.94 2r0k s LYS 209 N -0.36 -0.05 -0.19 8.23 2.47 -0.10 -4.98 119.74 124.76 2r0k s LYS 209 Ca 0.07 0.29 -0.26 0.00 -1.56 0.00 0.00 55.97 54.51 2r0k s LYS 209 Cb -0.12 -0.76 -0.01 0.00 -1.46 0.00 0.00 37.83 35.48 2r0k s LYS 209 CO 0.02 -0.40 0.87 0.21 0.16 0.00 0.00 175.35 176.22 2r0k s LYS 210 N 2.17 4.28 -0.29 4.03 2.20 -1.26 -1.14 119.74 129.73 2r0k s LYS 210 Ca 0.04 1.07 -0.16 0.00 -0.36 0.00 0.00 55.97 56.57 2r0k s LYS 210 Cb -0.13 -3.59 -0.03 0.00 -1.51 0.00 0.00 37.83 32.57 2r0k s LYS 210 CO -0.04 -0.40 0.40 0.08 -0.36 0.00 0.00 175.35 175.02 2r0k s VAL 211 N 2.42 5.15 0.05 4.02 1.01 0.48 -4.96 120.40 128.56 2r0k s VAL 211 Ca 0.39 0.48 0.06 0.00 0.00 0.00 0.00 61.98 62.92 2r0k s VAL 211 Cb -0.16 -3.76 -0.03 0.00 0.00 0.00 0.00 36.38 32.43 2r0k s VAL 211 CO 0.11 0.07 -0.18 -1.61 0.00 0.00 0.00 175.10 173.49 2r0k s GLU 212 N 2.12 1.14 0.82 2.72 0.41 -1.26 -3.65 118.70 121.00 2r0k s GLU 212 Ca 0.15 -0.90 -0.12 0.00 -0.41 0.00 0.00 54.97 53.70 2r0k s GLU 212 Cb -0.16 -1.22 0.09 0.00 -1.78 0.00 0.00 34.13 31.05 2r0k s GLU 212 CO 0.11 0.30 1.12 -2.14 -0.49 0.00 0.00 175.26 174.15 2r0k s PRO 213 N -1.30 1.86 0.00 0.39 0.02 -1.26 -4.69 135.00 130.02 2r0k s PRO 213 Ca 0.04 0.47 0.00 0.00 0.02 0.00 0.00 61.00 61.53 2r0k s PRO 213 Cb -0.09 -1.91 0.00 0.00 0.02 0.00 0.00 34.50 32.53 2r0k s PRO 213 CO 0.02 -1.74 0.00 0.36 -0.33 0.00 0.00 177.00 175.31 2r0k n LYS 214 N -3.48 0.90 0.00 5.54 2.85 -1.26 -4.98 118.16 117.72 2r0k n LYS 214 Ca 0.07 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.33 2r0k n LYS 214 Cb 0.58 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.96 2r0k n LYS 214 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 2r0k n SER 215 N 0.00 0.00 0.00 -5.58 2.88 -1.26 -5.06 113.62 104.60 2r0k n SER 215 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2r0k n SER 215 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2r0k n SER 215 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81