#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e9k s SER 2 N 0.00 6.25 -0.47 1.61 0.01 -1.26 -5.04 113.70 114.80 2e9k s SER 2 Ca 0.00 0.28 -0.28 0.00 1.31 0.00 0.00 55.95 57.26 2e9k s SER 2 Cb 0.00 -2.19 0.03 0.00 0.21 0.00 0.00 66.02 64.07 2e9k s SER 2 CO 0.00 -0.12 1.08 -0.55 0.41 0.00 0.00 173.24 174.06 2e9k s SER 3 N 1.47 6.60 0.00 2.44 0.15 -1.26 -4.13 113.70 118.96 2e9k s SER 3 Ca 0.14 0.37 0.00 0.00 0.70 0.00 0.00 55.95 57.16 2e9k s SER 3 Cb -0.15 -2.52 0.00 0.00 -1.71 0.00 0.00 66.02 61.63 2e9k s SER 3 CO 0.09 -1.20 0.00 0.61 1.20 0.00 0.00 173.24 173.94 2e9k n GLY 4 N 4.87 0.54 2.83 9.45 0.00 -1.26 -5.11 105.19 116.51 2e9k n GLY 4 Ca 0.10 -0.51 -0.17 0.00 0.00 0.00 0.00 46.02 45.45 2e9k n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2e9k s SER 5 N -2.22 0.82 -0.35 1.61 0.01 -1.26 -5.12 113.70 107.20 2e9k s SER 5 Ca 0.00 0.28 -0.00 0.00 1.31 0.00 0.00 55.95 57.54 2e9k s SER 5 Cb 0.00 0.29 0.09 0.00 0.21 0.00 0.00 66.02 66.61 2e9k s SER 5 CO 0.00 -0.25 0.09 -0.55 0.41 0.00 0.00 173.24 172.94 2e9k s SER 6 N 2.30 4.99 0.00 2.44 0.15 -1.26 -4.96 113.70 117.36 2e9k s SER 6 Ca 0.03 -1.84 0.00 0.00 0.70 0.00 0.00 55.95 54.84 2e9k s SER 6 Cb -0.12 -1.73 0.00 0.00 -1.71 0.00 0.00 66.02 62.46 2e9k s SER 6 CO -0.06 -0.41 0.00 0.61 1.20 0.00 0.00 173.24 174.58 2e9k n GLY 7 N 4.50 -0.72 3.43 9.45 0.00 -1.26 -5.04 105.19 115.55 2e9k n GLY 7 Ca -0.04 -0.41 -0.36 0.00 0.00 0.00 0.00 46.02 45.21 2e9k n GLY 7 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2e9k n ASP 8 N 0.00 3.67 -4.78 1.61 8.00 -1.26 -4.85 116.55 118.94 2e9k n ASP 8 Ca 0.00 -2.78 -0.23 0.00 0.71 0.00 0.00 54.79 52.49 2e9k n ASP 8 Cb 0.00 -1.64 -0.05 0.00 -0.02 0.00 0.00 41.12 39.40 2e9k n ASP 8 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2e9k s ILE 9 N 7.25 4.26 -0.01 0.53 -1.09 -1.26 -5.08 121.20 125.81 2e9k s ILE 9 Ca 0.60 -1.43 -0.00 0.00 -2.23 0.00 0.00 60.65 57.59 2e9k s ILE 9 Cb 0.04 -3.27 -0.00 0.00 -1.58 0.00 0.00 42.46 37.65 2e9k s ILE 9 CO 0.10 -0.30 -0.01 0.03 -1.23 0.00 0.00 174.94 173.53 2e9k h ARG 10 N 1.78 0.00 0.14 2.79 3.08 -1.98 -3.35 114.38 116.83 2e9k h ARG 10 Ca -0.48 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.57 2e9k h ARG 10 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.28 2e9k h ARG 10 CO 0.61 0.00 -0.07 -1.00 -1.07 0.00 0.00 179.97 178.44 2e9k h PRO 11 N -0.05 -0.18 -0.42 0.04 0.13 -1.98 -0.95 132.00 128.59 2e9k h PRO 11 Ca 0.00 0.01 0.08 0.00 -0.87 0.00 0.00 66.00 65.23 2e9k h PRO 11 Cb 0.02 0.04 -0.09 0.00 0.13 0.00 0.00 31.00 31.10 2e9k h PRO 11 CO 0.00 0.24 -0.31 1.03 -0.23 0.00 0.00 178.00 178.73 2e9k h SER 12 N -0.68 -1.03 0.32 1.44 0.87 -1.95 0.24 113.55 112.77 2e9k h SER 12 Ca -0.02 0.19 -0.02 0.00 -1.23 0.00 0.00 61.79 60.72 2e9k h SER 12 Cb 0.50 0.49 0.00 0.00 -0.44 0.00 0.00 62.40 62.96 2e9k h SER 12 CO 0.03 -0.31 -0.15 0.50 -0.53 0.00 0.00 176.83 176.37 2e9k h LYS 13 N -0.22 -0.42 -0.87 2.24 3.11 -1.70 -3.08 116.57 115.62 2e9k h LYS 13 Ca 0.18 0.03 0.18 0.00 -2.81 0.00 0.00 60.65 58.24 2e9k h LYS 13 Cb 0.53 0.09 -0.16 0.00 -1.00 0.00 0.00 32.23 31.69 2e9k h LYS 13 CO -0.55 -0.13 -0.17 1.25 -2.81 0.00 0.00 179.45 177.05 2e9k h LEU 14 N -0.69 -0.72 -0.18 5.20 5.85 -0.72 0.12 115.31 124.17 2e9k h LEU 14 Ca -0.04 0.26 0.05 0.00 0.84 0.00 0.00 57.88 58.99 2e9k h LEU 14 Cb 0.48 0.51 -0.06 0.00 0.37 0.00 0.00 40.66 41.96 2e9k h LEU 14 CO 0.07 -0.28 -0.22 0.25 -0.34 0.00 0.00 178.44 177.92 2e9k h LEU 15 N 0.01 -0.71 -0.76 2.25 5.85 -0.92 -2.12 115.31 118.92 2e9k h LEU 15 Ca 0.44 0.12 0.14 0.00 0.84 0.00 0.00 57.88 59.42 2e9k h LEU 15 Cb 0.71 0.33 -0.14 0.00 0.37 0.00 0.00 40.66 41.93 2e9k h LEU 15 CO -0.87 -0.27 -0.26 0.74 -0.34 0.00 0.00 178.44 177.44 2e9k h THR 16 N -0.26 0.17 0.47 1.05 2.02 -0.68 0.95 112.91 116.63 2e9k h THR 16 Ca 0.12 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.28 2e9k h THR 16 Cb 0.43 0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 66.99 2e9k h THR 16 CO -0.33 0.00 -0.50 -0.25 0.37 0.00 0.00 175.52 174.81 2e9k h TRP 17 N -0.05 -1.39 -0.31 3.16 7.01 -1.13 -1.98 115.95 121.25 2e9k h TRP 17 Ca 0.33 0.01 0.07 0.00 2.11 0.00 0.00 58.89 61.41 2e9k h TRP 17 Cb 0.57 0.55 -0.08 0.00 -2.10 0.00 0.00 29.16 28.10 2e9k h TRP 17 CO -0.66 -0.66 -0.36 0.00 -2.79 0.00 0.00 178.44 173.97 2e9k h GLN 19 N -0.33 0.02 0.33 0.00 4.20 -0.68 -0.54 115.11 118.11 2e9k h GLN 19 Ca 0.14 -0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.83 2e9k h GLN 19 Cb 0.56 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.34 2e9k h GLN 19 CO -0.49 0.01 -0.16 1.96 -0.67 0.00 0.00 178.83 179.48 2e9k h GLN 20 N 0.02 -0.43 -0.80 1.46 4.20 -0.46 -2.65 115.11 116.44 2e9k h GLN 20 Ca 0.37 0.03 0.19 0.00 0.06 0.00 0.00 58.65 59.31 2e9k h GLN 20 Cb 0.59 0.10 -0.13 0.00 0.30 0.00 0.00 27.48 28.34 2e9k h GLN 20 CO -0.76 -0.28 0.10 1.96 -0.67 0.00 0.00 178.83 179.18 2e9k h GLN 21 N -0.47 0.15 -0.98 1.46 1.08 0.20 0.78 115.11 117.33 2e9k h GLN 21 Ca -0.05 -0.01 -0.23 0.00 -1.45 0.00 0.00 58.65 56.92 2e9k h GLN 21 Cb 0.36 -0.03 -0.13 0.00 -0.05 0.00 0.00 27.48 27.62 2e9k h GLN 21 CO 0.08 0.10 0.29 0.25 -0.95 0.00 0.00 178.83 178.59 2e9k n THR 22 N -5.29 1.99 -2.64 -0.54 -2.24 -0.51 -4.80 114.28 100.24 2e9k n THR 22 Ca 0.16 -0.90 -0.42 0.00 -2.27 0.00 0.00 64.05 60.62 2e9k n THR 22 Cb 0.54 -0.71 -0.03 0.00 -2.10 0.00 0.00 70.33 68.03 2e9k n THR 22 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2e9k s GLU 23 N -1.62 4.56 0.00 -0.78 2.12 0.27 -3.63 118.70 119.62 2e9k s GLU 23 Ca 0.27 1.51 0.00 0.00 0.36 0.00 0.00 54.97 57.12 2e9k s GLU 23 Cb 0.23 -3.41 0.00 0.00 0.26 0.00 0.00 34.13 31.21 2e9k s GLU 23 CO 0.06 -0.03 0.00 0.41 -0.54 0.00 0.00 175.26 175.15 2e9k n GLY 24 N 2.79 2.64 2.85 -1.50 0.00 -1.26 -5.02 105.19 105.68 2e9k n GLY 24 Ca 0.06 -0.67 -0.38 0.00 0.00 0.00 0.00 46.02 45.03 2e9k n GLY 24 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2e9k n TYR 25 N 0.00 -1.21 -2.84 1.61 4.02 -1.24 -4.92 117.16 112.58 2e9k n TYR 25 Ca 0.00 0.66 -0.28 0.00 -0.01 0.00 0.00 57.90 58.27 2e9k n TYR 25 Cb 0.00 -1.58 -0.01 0.00 -0.02 0.00 0.00 39.34 37.73 2e9k n TYR 25 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 176.86 175.20 2e9k s GLN 26 N -0.85 3.60 -0.35 -0.72 -0.21 -1.26 -3.99 119.66 115.87 2e9k s GLN 26 Ca 0.52 0.18 0.00 0.00 0.02 0.00 0.00 55.36 56.08 2e9k s GLN 26 Cb -0.65 -2.44 0.00 0.00 1.00 0.00 0.00 33.01 30.92 2e9k s GLN 26 CO 0.51 -0.08 0.00 0.72 -2.12 0.00 0.00 175.29 174.32 2e9k n HIS 27 N -1.84 -1.34 -3.80 0.91 8.25 -1.26 -4.84 115.22 111.29 2e9k n HIS 27 Ca 0.00 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.16 2e9k n HIS 27 Cb 0.55 -1.48 -0.14 0.00 1.12 0.00 0.00 29.99 30.03 2e9k n HIS 27 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2e9k s VAL 28 N -1.76 1.51 -0.38 1.59 1.01 -1.26 -5.07 120.40 116.03 2e9k s VAL 28 Ca 0.00 -2.19 -0.05 0.00 0.00 0.00 0.00 61.98 59.74 2e9k s VAL 28 Cb 0.00 -2.09 0.08 0.00 0.00 0.00 0.00 36.38 34.37 2e9k s VAL 28 CO 0.00 -0.75 0.17 0.21 0.00 0.00 0.00 175.10 174.73 2e9k s ASN 29 N 0.84 5.31 -0.31 3.32 2.47 -1.26 -4.81 114.94 120.49 2e9k s ASN 29 Ca 0.14 -1.64 -0.17 0.00 0.42 0.00 0.00 52.86 51.60 2e9k s ASN 29 Cb -0.21 -1.86 -0.02 0.00 -1.45 0.00 0.00 41.25 37.71 2e9k s ASN 29 CO -0.10 -0.47 0.46 -0.69 -3.72 0.00 0.00 177.10 172.58 2e9k s VAL 30 N 1.27 5.08 0.00 -5.21 1.01 -1.26 -4.86 120.40 116.44 2e9k s VAL 30 Ca 0.03 0.46 0.00 0.00 0.00 0.00 0.00 61.98 62.47 2e9k s VAL 30 Cb -0.22 -3.86 0.00 0.00 0.00 0.00 0.00 36.38 32.30 2e9k s VAL 30 CO -0.01 -0.05 0.00 0.35 0.00 0.00 0.00 175.10 175.38 2e9k n THR 31 N 5.28 0.00 -4.32 3.92 -2.24 -1.26 -4.93 114.28 110.73 2e9k n THR 31 Ca -0.06 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.56 2e9k n THR 31 Cb 0.50 -0.63 -0.04 0.00 -2.10 0.00 0.00 70.33 68.06 2e9k n THR 31 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2e9k n ASP 32 N -1.57 1.43 -1.21 3.42 8.00 -1.26 -5.07 116.55 120.28 2e9k n ASP 32 Ca 0.00 -2.29 -0.05 0.00 0.71 0.00 0.00 54.79 53.16 2e9k n ASP 32 Cb 0.33 0.54 0.13 0.00 -0.02 0.00 0.00 41.12 42.10 2e9k n ASP 32 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2e9k n LEU 33 N 0.00 3.39 0.07 0.64 4.77 -1.26 -4.40 117.00 120.22 2e9k n LEU 33 Ca -0.05 -4.10 0.00 0.00 -0.03 0.00 0.00 56.01 51.83 2e9k n LEU 33 Cb 0.36 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 41.04 2e9k n LEU 33 CO 0.19 1.61 -0.07 0.35 -1.33 0.00 0.00 177.39 178.14 2e9k n THR 34 N -0.89 0.30 0.08 -5.08 -2.24 -1.26 -4.78 114.28 100.41 2e9k n THR 34 Ca 0.27 0.10 -0.22 0.00 -2.27 0.00 0.00 64.05 61.93 2e9k n THR 34 Cb 0.81 -0.91 -0.15 0.00 -2.10 0.00 0.00 70.33 67.98 2e9k n THR 34 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 2e9k h THR 35 N 0.00 1.02 -1.03 4.28 1.35 -1.91 -3.30 112.91 113.31 2e9k h THR 35 Ca 0.00 -2.60 0.27 0.00 -0.55 0.00 0.00 66.41 63.53 2e9k h THR 35 Cb 0.15 2.79 -0.08 0.00 -1.73 0.00 0.00 68.15 69.28 2e9k h THR 35 CO 0.00 0.84 0.69 0.28 -0.25 0.00 0.00 175.52 177.08 2e9k h SER 36 N 0.10 0.33 -0.76 5.36 0.02 -1.90 0.31 113.55 117.01 2e9k h SER 36 Ca -0.31 0.06 -0.50 0.00 -0.84 0.00 0.00 61.79 60.20 2e9k h SER 36 Cb 2.09 0.00 -0.29 0.00 0.14 0.00 0.00 62.40 64.35 2e9k h SER 36 CO 0.19 0.08 0.09 0.79 -1.14 0.00 0.00 176.83 176.83 2e9k n TRP 37 N -4.50 2.52 -0.01 3.45 7.02 -1.25 -4.16 117.44 120.50 2e9k n TRP 37 Ca 0.24 -2.31 -0.09 0.00 -1.02 0.00 0.00 57.50 54.31 2e9k n TRP 37 Cb 0.92 -0.82 -0.14 0.00 -2.42 0.00 0.00 31.31 28.85 2e9k n TRP 37 CO 0.00 0.00 0.00 0.07 -2.02 0.00 0.00 177.69 175.74 2e9k h ARG 38 N 1.70 0.02 0.00 -0.99 0.11 -0.46 -3.40 114.38 111.37 2e9k h ARG 38 Ca 0.44 -0.03 -0.28 0.00 0.10 0.00 0.00 59.98 60.21 2e9k h ARG 38 Cb 1.45 0.01 -0.04 0.00 1.11 0.00 0.00 29.97 32.50 2e9k h ARG 38 CO 0.98 0.57 -1.53 0.45 0.10 0.00 0.00 179.97 180.55 2e9k n SER 39 N -3.09 1.88 0.00 0.08 2.88 -1.26 -2.95 113.62 111.16 2e9k n SER 39 Ca -0.17 0.40 0.00 0.00 -1.33 0.00 0.00 58.87 57.78 2e9k n SER 39 Cb 1.05 -0.94 0.00 0.00 -0.75 0.00 0.00 64.21 63.57 2e9k n SER 39 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2e9k n GLY 40 N 1.40 3.60 0.38 0.46 0.00 -1.26 -2.72 105.19 107.04 2e9k n GLY 40 Ca -0.37 -0.67 0.27 0.00 0.00 0.00 0.00 46.02 45.25 2e9k n GLY 40 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2e9k h LEU 41 N 0.00 0.43 -0.17 0.99 3.38 -1.87 -1.08 115.31 116.99 2e9k h LEU 41 Ca 0.00 0.17 0.02 0.00 0.09 0.00 0.00 57.88 58.16 2e9k h LEU 41 Cb 0.00 0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.83 2e9k h LEU 41 CO 0.00 -0.14 -0.31 0.00 0.09 0.00 0.00 178.44 178.09 2e9k h ALA 42 N 1.77 -0.62 -0.22 1.53 0.00 -1.94 0.35 119.26 120.13 2e9k h ALA 42 Ca 0.74 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.62 2e9k h ALA 42 Cb 1.91 0.89 -0.01 0.00 0.00 0.00 0.00 17.79 20.58 2e9k h ALA 42 CO -0.53 -0.75 0.07 1.25 0.00 0.00 0.00 179.25 179.30 2e9k h LEU 43 N -0.26 0.32 -1.33 0.00 5.85 -1.56 -2.72 115.31 115.61 2e9k h LEU 43 Ca 0.03 -0.19 0.25 0.00 0.84 0.00 0.00 57.88 58.81 2e9k h LEU 43 Cb 0.35 -0.08 -0.09 0.00 0.37 0.00 0.00 40.66 41.20 2e9k h LEU 43 CO -0.30 0.43 0.65 0.00 -0.34 0.00 0.00 178.44 178.88 2e9k h ALA 45 N 1.63 -0.62 -0.83 0.00 0.00 0.02 0.66 119.26 120.12 2e9k h ALA 45 Ca 0.58 -0.15 0.17 0.00 0.00 0.00 0.00 54.91 55.51 2e9k h ALA 45 Cb 1.39 0.24 -0.11 0.00 0.00 0.00 0.00 17.79 19.31 2e9k h ALA 45 CO -0.30 -0.81 0.35 0.82 0.00 0.00 0.00 179.25 179.31 2e9k h ILE 46 N -0.70 0.59 0.40 0.00 2.04 -1.18 0.16 117.51 118.83 2e9k h ILE 46 Ca -0.06 -0.15 -0.02 0.00 1.00 0.00 0.00 64.86 65.62 2e9k h ILE 46 Cb 0.51 0.10 0.00 0.00 -0.74 0.00 0.00 36.82 36.70 2e9k h ILE 46 CO 0.10 0.08 -0.19 0.40 0.00 0.00 0.00 178.15 178.54 2e9k h ILE 47 N 0.45 0.00 -0.78 -0.67 2.04 -1.27 -3.24 117.51 114.04 2e9k h ILE 47 Ca 0.48 -0.29 0.17 0.00 1.00 0.00 0.00 64.86 66.23 2e9k h ILE 47 Cb 0.80 0.00 -0.14 0.00 -0.74 0.00 0.00 36.82 36.74 2e9k h ILE 47 CO -0.45 0.00 -0.07 -0.74 0.00 0.00 0.00 178.15 176.89 2e9k h HIS 48 N -0.83 -0.19 -0.86 1.37 -0.00 -0.60 0.28 115.15 114.32 2e9k h HIS 48 Ca -0.06 0.06 0.08 0.00 -0.00 0.00 0.00 60.37 60.46 2e9k h HIS 48 Cb 0.42 0.21 -0.11 0.00 -0.00 0.00 0.00 27.41 27.92 2e9k h HIS 48 CO 0.04 -0.29 -0.58 -0.09 -0.00 0.00 0.00 177.93 177.01 2e9k h ARG 49 N 0.05 -0.09 0.08 5.26 1.12 -0.75 0.36 114.38 120.42 2e9k h ARG 49 Ca 0.41 0.01 -0.00 0.00 -1.11 0.00 0.00 59.98 59.29 2e9k h ARG 49 Cb 0.71 0.02 0.00 0.00 -0.01 0.00 0.00 29.97 30.69 2e9k h ARG 49 CO -0.74 -0.06 -0.04 0.74 -3.11 0.00 0.00 179.97 176.76 2e9k h PHE 50 N -0.10 -0.11 -3.17 2.20 -1.00 -1.26 -3.40 116.94 110.10 2e9k h PHE 50 Ca 0.14 -0.00 -0.62 0.00 2.81 0.00 0.00 57.97 60.29 2e9k h PHE 50 Cb 0.46 0.03 -0.41 0.00 3.61 0.00 0.00 35.95 39.64 2e9k h PHE 50 CO -0.96 0.40 -0.68 1.03 -1.61 0.00 0.00 178.31 176.49 2e9k s ARG 51 N -3.80 1.66 0.44 1.51 1.81 0.86 -4.94 118.95 116.49 2e9k s ARG 51 Ca -0.15 -2.36 0.30 0.00 -1.72 0.00 0.00 55.73 51.80 2e9k s ARG 51 Cb 0.01 -2.84 1.25 0.00 -0.45 0.00 0.00 34.95 32.92 2e9k s ARG 51 CO 0.59 -1.14 1.89 -1.00 -0.68 0.00 0.00 175.30 174.96 2e9k h PRO 52 N 6.55 0.00 -0.66 3.54 0.13 -0.48 -3.01 132.00 138.07 2e9k h PRO 52 Ca -0.03 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.03 2e9k h PRO 52 Cb 0.90 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.00 2e9k h PRO 52 CO 0.59 0.00 0.14 1.49 -0.23 0.00 0.00 178.00 179.99 2e9k h GLU 53 N 0.00 1.06 -0.09 0.86 4.57 -1.92 -3.08 114.58 115.98 2e9k h GLU 53 Ca 0.00 -0.26 -0.14 0.00 -1.18 0.00 0.00 59.36 57.78 2e9k h GLU 53 Cb 0.44 -0.14 0.01 0.00 -0.16 0.00 0.00 28.75 28.90 2e9k h GLU 53 CO 0.00 0.95 -0.51 -0.07 -1.18 0.00 0.00 179.01 178.20 2e9k h LEU 54 N 1.00 0.60 -7.97 1.64 3.38 -1.91 -3.45 115.31 108.60 2e9k h LEU 54 Ca 0.21 -0.65 -0.42 0.00 0.09 0.00 0.00 57.88 57.10 2e9k h LEU 54 Cb 0.38 -0.18 -0.31 0.00 0.09 0.00 0.00 40.66 40.65 2e9k h LEU 54 CO 0.01 1.16 -0.79 -0.63 0.09 0.00 0.00 178.44 178.28 2e9k s ILE 55 N -3.63 0.77 -0.45 1.22 1.01 -1.16 -5.06 121.20 113.89 2e9k s ILE 55 Ca -0.13 -0.35 0.04 0.00 0.00 0.00 0.00 60.65 60.21 2e9k s ILE 55 Cb 0.05 -0.68 0.12 0.00 0.01 0.00 0.00 42.46 41.96 2e9k s ILE 55 CO 0.82 0.24 0.18 0.21 0.00 0.00 0.00 174.94 176.40 2e9k s ASN 56 N 0.18 4.43 0.13 3.58 3.84 -1.25 -4.29 114.94 121.58 2e9k s ASN 56 Ca -0.03 -2.68 -0.30 0.00 0.21 0.00 0.00 52.86 50.06 2e9k s ASN 56 Cb -0.08 -1.59 -0.09 0.00 -0.55 0.00 0.00 41.25 38.93 2e9k s ASN 56 CO 0.00 -0.29 1.51 0.15 -2.79 0.00 0.00 177.10 175.69 2e9k h PHE 57 N 6.92 -1.67 -1.33 0.43 3.04 -1.90 0.50 116.94 122.92 2e9k h PHE 57 Ca -0.06 0.09 0.47 0.00 3.98 0.00 0.00 57.97 62.45 2e9k h PHE 57 Cb 0.94 0.81 -0.14 0.00 2.56 0.00 0.00 35.95 40.12 2e9k h PHE 57 CO 0.49 -0.42 0.85 -3.47 -2.02 0.00 0.00 178.31 173.74 2e9k n ASP 58 N -5.18 0.22 0.10 0.41 -0.08 -1.26 0.14 116.55 110.90 2e9k n ASP 58 Ca -0.01 1.39 -0.23 0.00 -1.51 0.00 0.00 54.79 54.42 2e9k n ASP 58 Cb 0.29 -0.68 -0.15 0.00 2.34 0.00 0.00 41.12 42.92 2e9k n ASP 58 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 2e9k h SER 59 N 0.00 0.69 -1.46 1.67 0.02 -0.59 -3.44 113.55 110.44 2e9k h SER 59 Ca 0.87 -0.88 -0.53 0.00 -0.84 0.00 0.00 61.79 60.41 2e9k h SER 59 Cb 2.76 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 65.06 2e9k h SER 59 CO -0.48 1.72 1.58 0.18 -1.14 0.00 0.00 176.83 178.69 2e9k n LEU 60 N -3.63 2.32 -4.59 5.07 4.77 0.36 -4.85 117.00 116.45 2e9k n LEU 60 Ca -0.20 -0.13 -0.42 0.00 -0.03 0.00 0.00 56.01 55.23 2e9k n LEU 60 Cb 1.09 -1.46 -0.03 0.00 -2.33 0.00 0.00 43.42 40.68 2e9k n LEU 60 CO 0.55 -1.15 1.82 0.21 -1.33 0.00 0.00 177.39 177.50 2e9k s ASN 61 N 10.22 5.38 0.54 -1.43 3.04 -1.26 -4.81 114.94 126.62 2e9k s ASN 61 Ca 1.04 1.66 0.36 0.00 0.04 0.00 0.00 52.86 55.96 2e9k s ASN 61 Cb -0.43 -2.51 1.54 0.00 -1.54 0.00 0.00 41.25 38.32 2e9k s ASN 61 CO 0.34 -2.06 1.81 1.05 -3.04 0.00 0.00 177.10 175.21 2e9k h GLU 62 N 15.33 0.00 -0.02 0.43 4.11 -1.90 0.86 114.58 133.40 2e9k h GLU 62 Ca -0.37 0.00 -0.17 0.00 0.07 0.00 0.00 59.36 58.89 2e9k h GLU 62 Cb 1.23 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.46 2e9k h GLU 62 CO 1.00 0.00 -0.75 0.22 0.07 0.00 0.00 179.01 179.56 2e9k h ASP 63 N 0.00 0.16 -0.00 3.06 3.58 -2.00 -3.30 116.42 117.92 2e9k h ASP 63 Ca 0.54 -0.11 -0.27 0.00 0.42 0.00 0.00 57.03 57.61 2e9k h ASP 63 Cb 2.20 -0.05 -0.05 0.00 1.72 0.00 0.00 39.33 43.14 2e9k h ASP 63 CO -0.01 0.85 0.30 0.47 -2.88 0.00 0.00 179.24 177.97 2e9k n ASP 64 N -3.72 5.81 0.01 2.28 9.92 0.30 -4.66 116.55 126.50 2e9k n ASP 64 Ca -0.02 -2.49 -0.15 0.00 -0.53 0.00 0.00 54.79 51.59 2e9k n ASP 64 Cb 0.72 -1.44 -0.10 0.00 -0.64 0.00 0.00 41.12 39.66 2e9k n ASP 64 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2e9k h ALA 65 N 3.32 -0.90 -1.00 2.24 0.00 -1.70 0.51 119.26 121.74 2e9k h ALA 65 Ca 0.30 -0.07 0.14 0.00 0.00 0.00 0.00 54.91 55.28 2e9k h ALA 65 Cb 1.32 0.98 -0.15 0.00 0.00 0.00 0.00 17.79 19.95 2e9k h ALA 65 CO 0.48 -1.09 -0.45 0.28 0.00 0.00 0.00 179.25 178.47 2e9k n VAL 66 N -5.44 -0.57 0.07 0.00 0.31 -1.26 -0.51 118.33 110.93 2e9k n VAL 66 Ca -0.06 2.36 -0.12 0.00 -0.01 0.00 0.00 64.34 66.50 2e9k n VAL 66 Cb 0.39 -3.06 -0.07 0.00 -0.91 0.00 0.00 33.84 30.19 2e9k n VAL 66 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2e9k h GLU 67 N 0.00 -0.09 -0.83 5.55 5.08 -1.72 -2.57 114.58 120.00 2e9k h GLU 67 Ca 0.29 0.01 0.13 0.00 -1.00 0.00 0.00 59.36 58.78 2e9k h GLU 67 Cb 0.54 0.02 -0.14 0.00 0.50 0.00 0.00 28.75 29.67 2e9k h GLU 67 CO -0.97 -0.06 -0.40 -0.91 -1.00 0.00 0.00 179.01 175.67 2e9k h ASN 68 N -0.09 -1.43 0.23 1.42 2.35 0.15 0.23 115.58 118.43 2e9k h ASN 68 Ca -0.01 0.28 -0.01 0.00 -0.55 0.00 0.00 56.30 56.02 2e9k h ASN 68 Cb 0.08 0.71 -0.00 0.00 0.05 0.00 0.00 38.32 39.16 2e9k h ASN 68 CO 0.01 -0.30 -0.15 0.78 -1.65 0.00 0.00 177.43 176.13 2e9k h ASN 69 N -0.08 -0.37 -0.99 5.81 2.35 -1.08 -2.24 115.58 118.98 2e9k h ASN 69 Ca 0.28 0.02 0.35 0.00 -0.55 0.00 0.00 56.30 56.40 2e9k h ASN 69 Cb 0.57 0.11 -0.18 0.00 0.05 0.00 0.00 38.32 38.87 2e9k h ASN 69 CO -0.86 -0.22 0.37 -0.61 -1.65 0.00 0.00 177.43 174.45 2e9k h GLN 70 N -0.36 0.05 0.33 0.81 5.75 -1.02 -0.33 115.11 120.34 2e9k h GLN 70 Ca -0.03 -0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.45 2e9k h GLN 70 Cb 0.29 -0.01 -0.00 0.00 1.07 0.00 0.00 27.48 28.82 2e9k h GLN 70 CO 0.03 0.03 -0.23 1.25 -2.65 0.00 0.00 178.83 177.26 2e9k h LEU 71 N 0.05 -0.59 -0.90 -2.39 5.85 -0.29 0.21 115.31 117.24 2e9k h LEU 71 Ca 0.74 0.04 0.23 0.00 0.84 0.00 0.00 57.88 59.73 2e9k h LEU 71 Cb 1.81 0.18 -0.13 0.00 0.37 0.00 0.00 40.66 42.90 2e9k h LEU 71 CO -0.79 -0.34 0.39 0.00 -0.34 0.00 0.00 178.44 177.36 2e9k h ALA 72 N -1.51 1.45 0.17 1.25 0.00 -0.51 0.17 119.26 120.28 2e9k h ALA 72 Ca -0.04 0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 2e9k h ALA 72 Cb 0.43 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2e9k h ALA 72 CO 0.03 -0.37 -0.08 0.74 0.00 0.00 0.00 179.25 179.57 2e9k h PHE 73 N 0.38 -0.21 -0.36 0.00 0.04 -0.96 -0.47 116.94 115.36 2e9k h PHE 73 Ca 0.57 -0.01 0.03 0.00 2.80 0.00 0.00 57.97 61.37 2e9k h PHE 73 Cb 1.10 0.07 -0.03 0.00 2.20 0.00 0.00 35.95 39.29 2e9k h PHE 73 CO -0.14 -0.01 0.16 0.22 -0.60 0.00 0.00 178.31 177.94 2e9k h ASP 74 N -0.38 0.23 -0.58 2.17 3.58 0.94 0.48 116.42 122.85 2e9k h ASP 74 Ca -0.02 0.02 0.01 0.00 0.42 0.00 0.00 57.03 57.46 2e9k h ASP 74 Cb 0.30 -0.01 -0.03 0.00 1.72 0.00 0.00 39.33 41.30 2e9k h ASP 74 CO 0.04 0.17 0.38 0.58 -2.88 0.00 0.00 179.24 177.53 2e9k h VAL 75 N 0.34 1.13 -0.06 2.25 2.07 -0.66 0.38 116.25 121.70 2e9k h VAL 75 Ca 0.16 -0.26 -0.13 0.00 0.82 0.00 0.00 66.70 67.28 2e9k h VAL 75 Cb 0.09 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 30.15 2e9k h VAL 75 CO -0.13 0.14 -0.56 0.00 0.02 0.00 0.00 177.57 177.04 2e9k h ALA 76 N 1.22 0.94 0.00 1.67 0.00 -0.64 0.30 119.26 122.75 2e9k h ALA 76 Ca 0.21 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2e9k h ALA 76 Cb -0.07 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.63 2e9k h ALA 76 CO -0.05 0.70 -0.18 -1.91 0.00 0.00 0.00 179.25 177.81 2e9k n GLU 77 N -3.90 0.14 -0.12 0.00 0.00 0.16 0.30 120.64 117.23 2e9k n GLU 77 Ca -0.02 0.09 -0.16 0.00 0.00 0.00 0.00 57.16 57.07 2e9k n GLU 77 Cb 0.58 -1.63 -0.11 0.00 0.00 0.00 0.00 31.44 30.28 2e9k n GLU 77 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.13 175.00 2e9k n ARG 78 N -1.86 0.62 -0.09 5.31 3.00 0.13 -3.56 116.66 120.21 2e9k n ARG 78 Ca 0.06 0.13 -0.13 0.00 -0.00 0.00 0.00 57.85 57.91 2e9k n ARG 78 Cb 0.39 -1.47 -0.06 0.00 0.00 0.00 0.00 32.46 31.31 2e9k n ARG 78 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 2e9k h GLU 79 N 0.00 0.00 0.00 -0.14 5.08 -0.52 -3.39 114.58 115.60 2e9k h GLU 79 Ca -0.53 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 57.72 2e9k h GLU 79 Cb 1.84 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 31.07 2e9k h GLU 79 CO -0.07 0.48 -0.73 0.74 -1.00 0.00 0.00 179.01 178.43 2e9k h PHE 80 N -1.00 0.00 -0.22 4.33 0.04 -1.33 -3.48 116.94 115.27 2e9k h PHE 80 Ca -0.16 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.55 2e9k h PHE 80 Cb 0.87 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.01 2e9k h PHE 80 CO -0.06 0.50 -0.06 0.41 -0.60 0.00 0.00 178.31 178.51 2e9k n GLY 81 N 1.26 0.48 3.63 -1.45 0.00 0.15 -4.95 105.19 104.31 2e9k n GLY 81 Ca -0.01 -0.89 -0.39 0.00 0.00 0.00 0.00 46.02 44.73 2e9k n GLY 81 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2e9k s ILE 82 N -2.12 5.11 0.09 -0.61 1.01 -0.76 -4.88 121.20 119.04 2e9k s ILE 82 Ca 0.00 0.81 -0.31 0.00 0.00 0.00 0.00 60.65 61.15 2e9k s ILE 82 Cb 0.00 -3.79 -0.07 0.00 0.01 0.00 0.00 42.46 38.61 2e9k s ILE 82 CO 0.00 0.14 1.38 -2.16 0.00 0.00 0.00 174.94 174.29 2e9k s PRO 83 N 2.02 4.32 0.21 2.79 0.04 -1.26 -3.46 135.00 139.66 2e9k s PRO 83 Ca 0.20 2.03 -0.30 0.00 0.04 0.00 0.00 61.00 62.97 2e9k s PRO 83 Cb -0.15 -3.32 -0.09 0.00 0.04 0.00 0.00 34.50 30.98 2e9k s PRO 83 CO 0.09 -0.45 1.30 -1.25 0.04 0.00 0.00 177.00 176.73 2e9k s PRO 84 N 1.34 4.40 0.17 0.56 0.04 -1.26 -4.94 135.00 135.31 2e9k s PRO 84 Ca 0.64 2.05 -0.06 0.00 0.04 0.00 0.00 61.00 63.66 2e9k s PRO 84 Cb -0.35 -3.19 0.05 0.00 0.04 0.00 0.00 34.50 31.05 2e9k s PRO 84 CO 0.30 -0.23 1.48 -0.39 0.04 0.00 0.00 177.00 178.20 2e9k h VAL 85 N 3.69 1.30 -3.19 -0.36 -1.51 -1.95 -3.45 116.25 110.77 2e9k h VAL 85 Ca -0.45 -1.72 -0.38 0.00 -1.23 0.00 0.00 66.70 62.92 2e9k h VAL 85 Cb 1.22 1.65 -0.14 0.00 -2.13 0.00 0.00 31.29 31.88 2e9k h VAL 85 CO 0.76 0.55 -0.71 0.28 -1.23 0.00 0.00 177.57 177.22 2e9k s THR 86 N -4.12 1.34 0.01 7.19 -1.32 -1.26 -5.14 115.64 112.34 2e9k s THR 86 Ca -0.09 -2.10 -0.20 0.00 -1.21 0.00 0.00 61.69 58.09 2e9k s THR 86 Cb 0.11 -2.02 -0.06 0.00 -1.51 0.00 0.00 72.50 69.03 2e9k s THR 86 CO 0.86 -0.61 0.58 0.42 -2.21 0.00 0.00 174.62 173.65 2e9k s THR 87 N -3.22 4.87 0.22 5.08 -4.23 -1.26 -4.88 115.64 112.22 2e9k s THR 87 Ca 0.21 1.22 -0.05 0.00 -1.18 0.00 0.00 61.69 61.89 2e9k s THR 87 Cb 0.02 -3.91 0.34 0.00 1.34 0.00 0.00 72.50 70.29 2e9k s THR 87 CO 0.04 0.46 1.18 0.61 -0.54 0.00 0.00 174.62 176.37 2e9k n GLY 88 N 2.25 -1.22 0.36 3.99 0.00 -1.26 0.32 105.19 109.63 2e9k n GLY 88 Ca -0.08 0.80 -0.14 0.00 0.00 0.00 0.00 46.02 46.60 2e9k n GLY 88 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2e9k h LYS 89 N 0.00 -0.60 -0.73 1.61 1.57 -1.93 -2.43 116.57 114.06 2e9k h LYS 89 Ca 0.38 0.04 0.02 0.00 -1.87 0.00 0.00 60.65 59.22 2e9k h LYS 89 Cb 0.63 0.14 -0.04 0.00 0.08 0.00 0.00 32.23 33.04 2e9k h LYS 89 CO -0.77 -0.40 0.48 1.49 -0.57 0.00 0.00 179.45 179.68 2e9k h GLU 90 N -0.62 0.93 -0.84 3.15 4.57 -0.52 0.29 114.58 121.54 2e9k h GLU 90 Ca 0.01 -0.06 0.21 0.00 -1.18 0.00 0.00 59.36 58.34 2e9k h GLU 90 Cb 0.62 -0.21 -0.13 0.00 -0.16 0.00 0.00 28.75 28.87 2e9k h GLU 90 CO -0.16 0.62 0.22 1.98 -1.18 0.00 0.00 179.01 180.49 2e9k h MET 91 N 0.96 0.24 0.13 1.92 4.05 -0.18 0.44 114.93 122.49 2e9k h MET 91 Ca 0.28 -0.01 -0.32 0.00 -0.28 0.00 0.00 59.70 59.36 2e9k h MET 91 Cb -0.07 -0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 30.67 2e9k h MET 91 CO -0.08 0.16 -1.66 0.00 0.23 0.00 0.00 176.91 175.56 2e9k h ALA 92 N 1.72 0.30 0.88 0.39 0.00 -1.02 -3.39 119.26 118.15 2e9k h ALA 92 Ca 0.51 -1.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.20 2e9k h ALA 92 Cb 0.97 0.39 0.01 0.00 0.00 0.00 0.00 17.79 19.16 2e9k h ALA 92 CO -0.60 1.16 -0.43 1.03 0.00 0.00 0.00 179.25 180.41 2e9k h SER 93 N 0.07 -1.02 -1.03 0.00 0.87 0.82 -3.41 113.55 109.85 2e9k h SER 93 Ca -0.30 0.04 -0.67 0.00 -1.23 0.00 0.00 61.79 59.63 2e9k h SER 93 Cb 2.04 0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 64.25 2e9k h SER 93 CO 0.15 -0.72 1.42 0.00 -0.53 0.00 0.00 176.83 177.15 2e9k n ALA 94 N -2.60 1.04 -0.28 6.23 0.00 0.14 -4.81 120.51 120.22 2e9k n ALA 94 Ca -0.15 -0.05 0.02 0.00 0.00 0.00 0.00 53.44 53.26 2e9k n ALA 94 Cb 0.47 -2.53 0.15 0.00 0.00 0.00 0.00 19.45 17.55 2e9k n ALA 94 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.50 176.94 2e9k h GLN 95 N 12.26 0.76 -3.16 0.00 3.07 -1.88 -3.36 115.11 122.80 2e9k h GLN 95 Ca -0.26 -0.05 -0.58 0.00 0.09 0.00 0.00 58.65 57.85 2e9k h GLN 95 Cb 1.33 -0.17 -0.40 0.00 0.08 0.00 0.00 27.48 28.32 2e9k h GLN 95 CO 1.03 0.50 -0.77 -2.00 0.09 0.00 0.00 178.83 177.68 2e9k s GLU 96 N -6.05 0.74 1.06 0.06 2.12 -1.26 -4.92 118.70 110.44 2e9k s GLU 96 Ca -0.12 -1.24 -0.14 0.00 0.36 0.00 0.00 54.97 53.83 2e9k s GLU 96 Cb 0.19 -1.83 0.22 0.00 0.26 0.00 0.00 34.13 32.96 2e9k s GLU 96 CO 0.78 -1.07 1.10 -1.25 -0.54 0.00 0.00 175.26 174.28 2e9k s PRO 97 N 1.32 -0.07 0.02 4.30 0.04 -1.26 -4.98 135.00 134.37 2e9k s PRO 97 Ca 0.13 0.35 -0.30 0.00 0.04 0.00 0.00 61.00 61.22 2e9k s PRO 97 Cb -0.20 -1.69 -0.04 0.00 0.04 0.00 0.00 34.50 32.61 2e9k s PRO 97 CO -0.17 -3.03 1.13 -0.51 0.04 0.00 0.00 177.00 174.45 2e9k s ASP 98 N -3.55 7.17 0.14 6.66 1.01 -1.26 -4.94 116.67 121.90 2e9k s ASP 98 Ca 0.67 1.86 -0.11 0.00 0.71 0.00 0.00 52.55 55.68 2e9k s ASP 98 Cb -0.17 -2.57 -0.03 0.00 1.01 0.00 0.00 42.92 41.16 2e9k s ASP 98 CO 0.57 -0.42 1.50 0.07 0.21 0.00 0.00 175.17 177.10 2e9k h LYS 99 N 6.90 0.92 0.94 8.23 2.10 -1.94 -2.61 116.57 131.12 2e9k h LYS 99 Ca -0.40 -0.43 -0.05 0.00 -2.00 0.00 0.00 60.65 57.77 2e9k h LYS 99 Cb 1.21 -0.01 0.01 0.00 -0.90 0.00 0.00 32.23 32.54 2e9k h LYS 99 CO 0.80 1.09 -0.45 -0.07 -2.00 0.00 0.00 179.45 178.82 2e9k h LEU 100 N 0.75 -1.07 -1.17 7.07 -0.00 -1.94 -0.85 115.31 118.11 2e9k h LEU 100 Ca 0.08 0.04 0.21 0.00 -0.00 0.00 0.00 57.88 58.21 2e9k h LEU 100 Cb 0.86 0.28 -0.10 0.00 -0.00 0.00 0.00 40.66 41.69 2e9k h LEU 100 CO 0.08 -0.74 0.62 0.28 -0.00 0.00 0.00 178.44 178.68 2e9k h SER 101 N -1.31 0.65 -0.17 -0.43 0.02 -1.98 0.58 113.55 110.90 2e9k h SER 101 Ca -0.13 0.09 -0.02 0.00 -0.84 0.00 0.00 61.79 60.89 2e9k h SER 101 Cb 0.97 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.47 2e9k h SER 101 CO 0.21 0.21 0.03 0.24 -1.14 0.00 0.00 176.83 176.38 2e9k h MET 102 N 0.62 0.28 0.83 3.45 2.86 -1.23 -2.03 114.93 119.70 2e9k h MET 102 Ca 0.57 -0.07 -0.04 0.00 -2.06 0.00 0.00 59.70 58.09 2e9k h MET 102 Cb 1.09 -0.03 0.01 0.00 0.06 0.00 0.00 31.60 32.72 2e9k h MET 102 CO -0.34 0.45 -0.40 0.28 1.06 0.00 0.00 176.91 177.96 2e9k h VAL 103 N 0.07 0.06 -0.93 -2.22 2.07 0.39 -1.05 116.25 114.65 2e9k h VAL 103 Ca 0.05 -0.15 0.24 0.00 0.82 0.00 0.00 66.70 67.66 2e9k h VAL 103 Cb 0.30 0.07 -0.13 0.00 -1.52 0.00 0.00 31.29 30.01 2e9k h VAL 103 CO 0.00 0.00 0.43 0.00 0.02 0.00 0.00 177.57 178.03 2e9k h MET 104 N -1.25 0.37 0.41 1.57 -0.00 -1.03 0.18 114.93 115.18 2e9k h MET 104 Ca -0.11 -0.02 -0.02 0.00 -0.00 0.00 0.00 59.70 59.54 2e9k h MET 104 Cb 0.86 -0.08 0.00 0.00 -0.00 0.00 0.00 31.60 32.38 2e9k h MET 104 CO 0.19 0.25 -0.20 -0.92 -0.00 0.00 0.00 176.91 176.23 2e9k h TYR 105 N 0.38 -0.51 -0.81 -0.10 3.20 -1.24 -3.22 116.97 114.67 2e9k h TYR 105 Ca 0.60 -0.01 0.20 0.00 3.14 0.00 0.00 58.73 62.66 2e9k h TYR 105 Cb 1.20 0.17 -0.13 0.00 1.54 0.00 0.00 36.73 39.51 2e9k h TYR 105 CO -0.12 -0.32 0.19 -0.07 -1.64 0.00 0.00 178.16 176.21 2e9k h LEU 106 N -0.69 -0.03 -1.00 2.82 3.38 -0.64 0.88 115.31 120.04 2e9k h LEU 106 Ca -0.06 0.18 0.37 0.00 0.09 0.00 0.00 57.88 58.46 2e9k h LEU 106 Cb 0.42 0.24 -0.18 0.00 0.09 0.00 0.00 40.66 41.24 2e9k h LEU 106 CO 0.09 -0.10 0.39 0.28 0.09 0.00 0.00 178.44 179.19 2e9k h SER 107 N 0.23 0.10 -0.34 -0.43 0.02 -0.67 0.43 113.55 112.89 2e9k h SER 107 Ca 0.48 0.26 0.08 0.00 -0.84 0.00 0.00 61.79 61.77 2e9k h SER 107 Cb 0.90 0.32 -0.08 0.00 0.14 0.00 0.00 62.40 63.68 2e9k h SER 107 CO -0.60 -0.39 -0.22 0.11 -1.14 0.00 0.00 176.83 174.59 2e9k h LYS 108 N 0.03 -0.17 0.02 3.45 1.57 -0.87 -1.68 116.57 118.92 2e9k h LYS 108 Ca 0.77 0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 59.56 2e9k h LYS 108 Cb 1.90 0.04 0.00 0.00 0.08 0.00 0.00 32.23 34.25 2e9k h LYS 108 CO -0.80 -0.12 -0.01 0.74 -0.57 0.00 0.00 179.45 178.69 2e9k h PHE 109 N -0.18 -0.02 -0.91 -1.35 0.04 -0.30 -2.09 116.94 112.13 2e9k h PHE 109 Ca 0.17 -0.00 0.18 0.00 2.80 0.00 0.00 57.97 61.12 2e9k h PHE 109 Cb 0.45 0.01 -0.17 0.00 2.20 0.00 0.00 35.95 38.43 2e9k h PHE 109 CO -0.43 0.28 -0.24 -0.92 -0.60 0.00 0.00 178.31 176.40 2e9k h TYR 110 N -0.32 -0.52 -0.21 -0.55 3.20 -0.84 0.25 116.97 117.98 2e9k h TYR 110 Ca -0.00 0.08 -0.06 0.00 3.14 0.00 0.00 58.73 61.89 2e9k h TYR 110 Cb 0.30 0.37 -0.01 0.00 1.54 0.00 0.00 36.73 38.94 2e9k h TYR 110 CO 0.03 -0.39 -0.10 0.93 -1.64 0.00 0.00 178.16 176.98 2e9k h GLU 111 N -0.00 0.44 -0.27 1.82 4.39 -1.28 0.28 114.58 119.96 2e9k h GLU 111 Ca 0.43 -0.19 0.06 0.00 0.34 0.00 0.00 59.36 60.00 2e9k h GLU 111 Cb 0.66 -0.01 -0.07 0.00 -0.10 0.00 0.00 28.75 29.23 2e9k h GLU 111 CO -0.94 0.73 -0.24 1.25 -1.16 0.00 0.00 179.01 178.65 2e9k h LEU 112 N 0.14 -0.77 0.06 1.33 5.85 0.07 -2.98 115.31 119.01 2e9k h LEU 112 Ca 0.05 0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.91 2e9k h LEU 112 Cb 0.60 0.37 0.00 0.00 0.37 0.00 0.00 40.66 41.99 2e9k h LEU 112 CO 0.03 -0.27 -0.03 -0.26 -0.34 0.00 0.00 178.44 177.57 2e9k h PHE 113 N -0.23 -0.07 -2.44 1.25 0.04 -0.79 -3.41 116.94 111.30 2e9k h PHE 113 Ca 0.15 -0.00 -0.58 0.00 2.80 0.00 0.00 57.97 60.33 2e9k h PHE 113 Cb 0.46 0.02 -0.11 0.00 2.20 0.00 0.00 35.95 38.52 2e9k h PHE 113 CO -0.40 0.52 0.87 0.50 -0.60 0.00 0.00 178.31 179.19 2e9k s ARG 114 N -3.45 3.18 0.00 1.51 3.52 0.98 -4.45 118.95 120.24 2e9k s ARG 114 Ca -0.15 -0.53 0.00 0.00 -0.13 0.00 0.00 55.73 54.92 2e9k s ARG 114 Cb 0.00 -4.25 0.00 0.00 -1.56 0.00 0.00 34.95 29.14 2e9k s ARG 114 CO 0.60 -2.01 0.00 0.41 -0.81 0.00 0.00 175.30 173.49 2e9k n GLY 115 N 5.41 -2.28 3.02 8.12 0.00 -1.25 -4.42 105.19 113.80 2e9k n GLY 115 Ca 0.02 0.75 -0.12 0.00 0.00 0.00 0.00 46.02 46.66 2e9k n GLY 115 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2e9k s THR 116 N 0.00 0.01 0.25 2.61 -1.32 -1.26 -5.14 115.64 110.79 2e9k s THR 116 Ca 0.00 -0.06 -0.30 0.00 -1.21 0.00 0.00 61.69 60.12 2e9k s THR 116 Cb 0.00 -0.21 -0.09 0.00 -1.51 0.00 0.00 72.50 70.69 2e9k s THR 116 CO 0.00 -0.03 1.27 -2.16 -2.21 0.00 0.00 174.62 171.48 2e9k s PRO 117 N -0.05 4.43 -0.15 7.08 0.04 -1.26 -4.99 135.00 140.09 2e9k s PRO 117 Ca -0.01 2.05 -0.08 0.00 0.04 0.00 0.00 61.00 63.00 2e9k s PRO 117 Cb -0.02 -3.16 -0.04 0.00 0.04 0.00 0.00 34.50 31.32 2e9k s PRO 117 CO 0.00 -0.14 0.12 -0.48 0.04 0.00 0.00 177.00 176.54 2e9k s LEU 118 N -0.88 4.22 -0.02 -3.56 0.05 -1.26 -5.10 118.68 112.13 2e9k s LEU 118 Ca 0.52 0.32 -0.03 0.00 0.05 0.00 0.00 54.13 54.99 2e9k s LEU 118 Cb -0.37 -2.05 0.00 0.00 -2.05 0.00 0.00 46.19 41.73 2e9k s LEU 118 CO 0.43 0.30 0.08 -0.13 -0.55 0.00 0.00 176.35 176.48 2e9k s ARG 119 N -0.35 0.19 -0.01 1.48 0.52 -1.26 -5.13 118.95 114.38 2e9k s ARG 119 Ca 0.11 -0.04 -0.30 0.00 -0.52 0.00 0.00 55.73 54.98 2e9k s ARG 119 Cb -0.12 0.08 -0.06 0.00 0.52 0.00 0.00 34.95 35.38 2e9k s ARG 119 CO 0.01 -0.03 1.46 -1.25 0.02 0.00 0.00 175.30 175.51 2e9k s PRO 120 N -0.35 4.25 0.00 3.54 0.04 -1.26 -5.34 135.00 135.88 2e9k s PRO 120 Ca -0.04 2.02 0.29 0.00 0.04 0.00 0.00 61.00 63.31 2e9k s PRO 120 Cb -0.03 -3.64 1.72 0.00 0.04 0.00 0.00 34.50 32.59 2e9k s PRO 120 CO 0.00 -0.64 2.06 1.55 0.04 0.00 0.00 177.00 180.01