#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 1.75 0.10 1.61 1.04 -1.26 -5.04 113.70 111.90 2e9k s SER 2 Ca 0.00 -0.27 -0.25 0.00 0.48 0.00 0.00 55.95 55.91 2e9k s SER 2 Cb 0.00 -0.77 -0.11 0.00 0.10 0.00 0.00 66.02 65.24 2e9k s SER 2 CO 0.00 -0.02 1.69 0.28 0.98 0.00 0.00 173.24 176.17 2e9k h SER 3 N 7.29 -0.35 0.00 7.02 0.02 -2.12 -3.47 113.55 121.94 2e9k h SER 3 Ca -0.31 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.67 2e9k h SER 3 Cb 1.17 0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.84 2e9k h SER 3 CO 0.46 -0.19 0.00 0.61 -1.14 0.00 0.00 176.83 176.57 2e9k n GLY 4 N -1.25 0.81 3.74 -3.77 0.00 -1.26 -5.19 105.19 98.26 2e9k n GLY 4 Ca -0.07 -0.30 -0.08 0.00 0.00 0.00 0.00 46.02 45.57 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 0.00 -0.19 -0.34 1.61 0.01 -1.26 -5.14 113.70 108.39 2e9k s SER 5 Ca 0.00 -0.73 0.02 0.00 1.31 0.00 0.00 55.95 56.55 2e9k s SER 5 Cb 0.00 0.67 0.09 0.00 0.21 0.00 0.00 66.02 66.99 2e9k s SER 5 CO 0.00 -1.25 0.06 -0.44 0.41 0.00 0.00 173.24 172.01 2e9k s SER 6 N -2.96 4.84 0.00 2.44 0.01 -1.26 -5.07 113.70 111.70 2e9k s SER 6 Ca 0.16 -1.94 0.00 0.00 1.31 0.00 0.00 55.95 55.47 2e9k s SER 6 Cb -0.04 -1.67 0.00 0.00 0.21 0.00 0.00 66.02 64.52 2e9k s SER 6 CO 0.07 -0.38 0.00 0.61 0.41 0.00 0.00 173.24 173.96 2e9k n GLY 7 N 4.38 0.67 3.91 3.44 0.00 -1.26 -5.09 105.19 111.25 2e9k n GLY 7 Ca -0.02 -0.11 -0.27 0.00 0.00 0.00 0.00 46.02 45.63 2e9k n GLY 7 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2e9k s ASP 8 N -1.00 5.91 -0.22 1.61 1.11 -1.26 -4.97 116.67 117.85 2e9k s ASP 8 Ca 0.00 0.81 -0.37 0.00 0.18 0.00 0.00 52.55 53.17 2e9k s ASP 8 Cb 0.00 -1.96 -0.13 0.00 1.07 0.00 0.00 42.92 41.90 2e9k s ASP 8 CO 0.00 -0.84 1.88 -0.38 1.18 0.00 0.00 175.17 177.01 2e9k n ILE 9 N -2.43 0.40 0.18 0.77 5.41 -1.26 -4.88 119.36 117.54 2e9k n ILE 9 Ca 0.03 -0.11 -0.09 0.00 1.00 0.00 0.00 62.75 63.58 2e9k n ILE 9 Cb 0.56 -1.56 -0.05 0.00 -0.71 0.00 0.00 39.64 37.89 2e9k n ILE 9 CO 0.00 0.00 0.00 0.03 0.00 0.00 0.00 176.55 176.58 2e9k h ARG 10 N 8.90 -0.51 0.00 0.38 3.08 -2.05 -3.19 114.38 121.00 2e9k h ARG 10 Ca -0.44 0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.64 2e9k h ARG 10 Cb 1.30 0.11 0.00 0.00 0.08 0.00 0.00 29.97 31.46 2e9k h ARG 10 CO 0.97 -0.29 0.00 -0.35 -1.07 0.00 0.00 179.97 179.22 2e9k n PRO 11 N -5.13 0.49 -0.09 0.04 -0.04 -1.26 -4.04 135.00 124.97 2e9k n PRO 11 Ca -0.07 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.32 2e9k n PRO 11 Cb 0.23 -1.25 -0.05 0.00 -0.04 0.00 0.00 33.50 32.38 2e9k n PRO 11 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2e9k h SER 12 N 0.00 -1.01 -0.32 3.54 0.87 -1.94 0.19 113.55 114.89 2e9k h SER 12 Ca 0.00 0.13 0.03 0.00 -1.23 0.00 0.00 61.79 60.73 2e9k h SER 12 Cb 0.00 0.42 -0.03 0.00 -0.44 0.00 0.00 62.40 62.34 2e9k h SER 12 CO 0.00 -0.21 0.11 0.50 -0.53 0.00 0.00 176.83 176.70 2e9k h LYS 13 N -0.19 0.24 -0.36 2.24 1.63 -1.83 -2.81 116.57 115.48 2e9k h LYS 13 Ca 0.04 -0.01 0.06 0.00 -0.85 0.00 0.00 60.65 59.89 2e9k h LYS 13 Cb 0.31 -0.05 -0.09 0.00 -0.60 0.00 0.00 32.23 31.80 2e9k h LYS 13 CO -0.33 0.16 -0.43 1.25 -3.45 0.00 0.00 179.45 176.64 2e9k h LEU 14 N 0.24 -1.43 -0.08 5.20 5.85 -1.59 -1.88 115.31 121.63 2e9k h LEU 14 Ca 0.14 0.21 0.02 0.00 0.84 0.00 0.00 57.88 59.09 2e9k h LEU 14 Cb 0.11 0.62 -0.04 0.00 0.37 0.00 0.00 40.66 41.72 2e9k h LEU 14 CO -0.15 -0.38 -0.32 0.25 -0.34 0.00 0.00 178.44 177.50 2e9k h LEU 15 N -0.36 -1.03 -0.96 2.25 5.85 -0.43 -2.16 115.31 118.48 2e9k h LEU 15 Ca 0.12 0.12 0.11 0.00 0.84 0.00 0.00 57.88 59.07 2e9k h LEU 15 Cb 0.59 0.40 -0.13 0.00 0.37 0.00 0.00 40.66 41.89 2e9k h LEU 15 CO -0.55 -0.29 -0.50 0.41 -0.34 0.00 0.00 178.44 177.17 2e9k n THR 16 N -4.26 -0.60 -0.18 1.05 -1.04 -0.99 -0.44 114.28 107.82 2e9k n THR 16 Ca -0.04 2.30 -0.09 0.00 -2.04 0.00 0.00 64.05 64.18 2e9k n THR 16 Cb 0.22 -2.91 -0.04 0.00 -1.82 0.00 0.00 70.33 65.79 2e9k n THR 16 CO 0.00 0.00 0.00 -0.25 -0.64 0.00 0.00 175.07 174.18 2e9k h TRP 17 N 0.00 -1.27 -0.22 -1.42 7.01 -0.88 0.27 115.95 119.44 2e9k h TRP 17 Ca 0.21 0.08 0.04 0.00 2.11 0.00 0.00 58.89 61.33 2e9k h TRP 17 Cb 0.45 0.63 -0.04 0.00 -2.10 0.00 0.00 29.16 28.10 2e9k h TRP 17 CO -0.94 -0.43 -0.01 0.00 -2.79 0.00 0.00 178.44 174.27 2e9k h GLN 19 N 0.06 -0.18 0.51 0.00 4.20 0.60 0.28 115.11 120.59 2e9k h GLN 19 Ca 0.11 0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.81 2e9k h GLN 19 Cb 0.14 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.94 2e9k h GLN 19 CO -0.19 -0.12 -0.43 1.96 -0.67 0.00 0.00 178.83 179.39 2e9k h GLN 20 N -0.18 -0.89 -0.89 1.46 4.20 -0.65 0.38 115.11 118.54 2e9k h GLN 20 Ca 0.18 0.06 0.17 0.00 0.06 0.00 0.00 58.65 59.12 2e9k h GLN 20 Cb 0.46 0.20 -0.07 0.00 0.30 0.00 0.00 27.48 28.37 2e9k h GLN 20 CO -0.46 -0.60 0.58 1.96 -0.67 0.00 0.00 178.83 179.64 2e9k h GLN 21 N -0.93 0.54 -0.93 1.46 1.08 -0.91 -0.75 115.11 114.68 2e9k h GLN 21 Ca -0.06 -0.03 -0.62 0.00 -1.45 0.00 0.00 58.65 56.49 2e9k h GLN 21 Cb 0.79 -0.12 -0.36 0.00 -0.05 0.00 0.00 27.48 27.74 2e9k h GLN 21 CO -0.01 0.36 0.03 0.25 -0.95 0.00 0.00 178.83 178.50 2e9k n THR 22 N -4.55 3.07 -0.01 -0.54 -2.24 0.95 -4.50 114.28 106.46 2e9k n THR 22 Ca 0.18 -3.65 0.09 0.00 -2.27 0.00 0.00 64.05 58.40 2e9k n THR 22 Cb 0.57 -1.16 -0.15 0.00 -2.10 0.00 0.00 70.33 67.49 2e9k n THR 22 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2e9k n GLU 23 N -0.79 0.60 0.04 -0.78 2.13 0.13 -4.41 120.64 117.56 2e9k n GLU 23 Ca 0.53 -0.17 -0.05 0.00 0.66 0.00 0.00 57.16 58.13 2e9k n GLU 23 Cb 0.79 -1.46 -0.10 0.00 0.27 0.00 0.00 31.44 30.94 2e9k n GLU 23 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 2e9k h GLY 24 N 3.53 0.00 -1.66 8.31 0.00 -1.79 -3.47 103.07 107.98 2e9k h GLY 24 Ca -0.02 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.81 2e9k h GLY 24 CO 0.00 0.00 -0.67 -1.72 0.00 0.00 0.00 176.54 174.16 2e9k n TYR 25 N -3.14 -1.27 -3.82 5.60 4.02 -1.26 -4.98 117.16 112.30 2e9k n TYR 25 Ca -0.07 0.18 -0.37 0.00 -0.01 0.00 0.00 57.90 57.63 2e9k n TYR 25 Cb 0.93 -1.71 -0.06 0.00 -0.02 0.00 0.00 39.34 38.48 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 -3.69 3.57 -1.62 -0.72 -0.21 -1.26 -4.29 119.66 111.43 2e9k s GLN 26 Ca 0.58 -0.08 -0.03 0.00 0.02 0.00 0.00 55.36 55.85 2e9k s GLN 26 Cb -0.18 -3.22 0.00 0.00 1.00 0.00 0.00 33.01 30.62 2e9k s GLN 26 CO 0.66 0.72 0.45 0.72 -2.12 0.00 0.00 175.29 175.72 2e9k n HIS 27 N 2.13 -1.72 -3.97 0.91 8.25 -1.26 -4.96 115.22 114.60 2e9k n HIS 27 Ca -0.19 0.38 -0.31 0.00 -0.26 0.00 0.00 57.72 57.35 2e9k n HIS 27 Cb 0.54 -4.36 -0.15 0.00 1.12 0.00 0.00 29.99 27.15 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 -3.14 2.22 -0.75 1.59 1.01 -1.26 -5.04 120.40 115.02 2e9k s VAL 28 Ca 0.22 -2.54 -0.05 0.00 0.00 0.00 0.00 61.98 59.61 2e9k s VAL 28 Cb -0.10 -2.61 0.19 0.00 0.00 0.00 0.00 36.38 33.86 2e9k s VAL 28 CO 0.28 -0.67 0.61 0.54 0.00 0.00 0.00 175.10 175.86 2e9k s ASN 29 N 0.62 5.80 -0.42 3.32 4.22 -1.26 -4.82 114.94 122.40 2e9k s ASN 29 Ca 0.13 -3.06 -0.26 0.00 -2.14 0.00 0.00 52.86 47.52 2e9k s ASN 29 Cb -0.21 -1.95 0.02 0.00 1.28 0.00 0.00 41.25 40.39 2e9k s ASN 29 CO -0.07 -0.36 0.97 -0.69 -2.04 0.00 0.00 177.10 174.91 2e9k s VAL 30 N -0.38 4.48 0.00 3.54 1.01 -1.26 -4.81 120.40 122.98 2e9k s VAL 30 Ca 0.20 1.06 0.00 0.00 0.00 0.00 0.00 61.98 63.24 2e9k s VAL 30 Cb -0.15 -4.42 0.00 0.00 0.00 0.00 0.00 36.38 31.81 2e9k s VAL 30 CO -0.07 -0.72 0.00 0.35 0.00 0.00 0.00 175.10 174.66 2e9k n THR 31 N 6.28 0.00 -4.55 3.92 -2.24 -1.26 -4.80 114.28 111.62 2e9k n THR 31 Ca 0.08 0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.58 2e9k n THR 31 Cb 0.48 -0.78 -0.07 0.00 -2.10 0.00 0.00 70.33 67.86 2e9k n THR 31 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2e9k s ASP 32 N -3.08 3.05 -0.28 3.42 1.11 -1.26 -5.06 116.67 114.58 2e9k s ASP 32 Ca 0.00 -1.75 0.09 0.00 0.18 0.00 0.00 52.55 51.07 2e9k s ASP 32 Cb 0.00 0.64 0.46 0.00 1.07 0.00 0.00 42.92 45.08 2e9k s ASP 32 CO 0.00 -1.00 1.31 0.18 1.18 0.00 0.00 175.17 176.84 2e9k n LEU 33 N -1.00 3.97 0.10 1.23 4.77 -1.26 -4.28 117.00 120.52 2e9k n LEU 33 Ca -0.08 -4.15 0.00 0.00 -0.03 0.00 0.00 56.01 51.75 2e9k n LEU 33 Cb 0.65 -0.52 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 2e9k n LEU 33 CO 0.34 1.59 0.00 0.35 -1.33 0.00 0.00 177.39 178.34 2e9k n THR 34 N -0.99 0.41 0.05 -5.08 -2.24 -1.26 -4.69 114.28 100.48 2e9k n THR 34 Ca 0.32 0.13 -0.18 0.00 -2.27 0.00 0.00 64.05 62.05 2e9k n THR 34 Cb 0.86 -0.85 -0.14 0.00 -2.10 0.00 0.00 70.33 68.10 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 0.99 -0.56 4.28 1.35 -1.86 -3.25 112.91 113.86 2e9k h THR 35 Ca 0.00 -2.65 0.11 0.00 -0.55 0.00 0.00 66.41 63.32 2e9k h THR 35 Cb 0.00 2.69 -0.03 0.00 -1.73 0.00 0.00 68.15 69.08 2e9k h THR 35 CO 0.00 0.81 0.38 0.28 -0.25 0.00 0.00 175.52 176.74 2e9k h SER 36 N 0.07 0.28 -0.58 5.36 0.02 -1.91 -0.16 113.55 116.64 2e9k h SER 36 Ca -0.30 0.01 -0.30 0.00 -0.84 0.00 0.00 61.79 60.36 2e9k h SER 36 Cb 2.04 -0.05 -0.18 0.00 0.14 0.00 0.00 62.40 64.35 2e9k h SER 36 CO 0.15 0.16 0.16 0.79 -1.14 0.00 0.00 176.83 176.95 2e9k n TRP 37 N -4.46 1.78 0.10 3.45 7.02 -1.25 -4.47 117.44 119.61 2e9k n TRP 37 Ca 0.09 -1.71 -0.20 0.00 -1.02 0.00 0.00 57.50 54.65 2e9k n TRP 37 Cb 0.41 -0.65 -0.15 0.00 -2.42 0.00 0.00 31.31 28.49 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 1.01 0.38 0.08 -0.99 0.11 -1.04 -3.37 114.38 110.56 2e9k h ARG 38 Ca 0.37 -0.64 -0.11 0.00 0.10 0.00 0.00 59.98 59.69 2e9k h ARG 38 Cb 2.06 0.24 0.01 0.00 1.11 0.00 0.00 29.97 33.39 2e9k h ARG 38 CO 0.64 1.28 -0.51 0.66 0.10 0.00 0.00 179.97 182.15 2e9k h SER 39 N 0.10 0.28 0.00 0.08 4.64 -1.80 -3.23 113.55 113.62 2e9k h SER 39 Ca -0.25 -0.97 0.00 0.00 -0.47 0.00 0.00 61.79 60.10 2e9k h SER 39 Cb 2.08 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 64.08 2e9k h SER 39 CO 0.21 1.24 0.00 0.61 -0.87 0.00 0.00 176.83 178.02 2e9k n GLY 40 N 1.65 3.61 0.25 -0.77 0.00 -1.26 -4.01 105.19 104.66 2e9k n GLY 40 Ca -0.13 -0.98 0.22 0.00 0.00 0.00 0.00 46.02 45.14 2e9k n GLY 40 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2e9k n LEU 41 N 0.00 0.21 -0.00 0.99 4.77 -1.26 -0.65 117.00 121.05 2e9k n LEU 41 Ca 0.00 1.27 -0.02 0.00 -0.03 0.00 0.00 56.01 57.23 2e9k n LEU 41 Cb 0.00 -0.59 -0.01 0.00 -2.33 0.00 0.00 43.42 40.49 2e9k n LEU 41 CO 0.00 -1.40 0.50 0.00 -1.33 0.00 0.00 177.39 175.16 2e9k h ALA 42 N 1.52 -0.46 0.16 -1.18 0.00 -1.93 -0.67 119.26 116.70 2e9k h ALA 42 Ca 0.62 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.51 2e9k h ALA 42 Cb 1.58 0.66 -0.00 0.00 0.00 0.00 0.00 17.79 20.03 2e9k h ALA 42 CO -0.61 -0.49 -0.09 1.25 0.00 0.00 0.00 179.25 179.31 2e9k h LEU 43 N -0.07 -0.23 -1.55 0.00 5.85 -1.22 -2.27 115.31 115.81 2e9k h LEU 43 Ca 0.01 0.01 0.47 0.00 0.84 0.00 0.00 57.88 59.21 2e9k h LEU 43 Cb 0.08 0.07 -0.12 0.00 0.37 0.00 0.00 40.66 41.06 2e9k h LEU 43 CO -0.06 -0.15 0.98 0.00 -0.34 0.00 0.00 178.44 178.86 2e9k h ALA 45 N 1.47 -0.94 -0.76 0.00 0.00 -0.50 -1.83 119.26 116.70 2e9k h ALA 45 Ca 0.85 -0.21 0.10 0.00 0.00 0.00 0.00 54.91 55.65 2e9k h ALA 45 Cb 2.87 0.36 -0.12 0.00 0.00 0.00 0.00 17.79 20.90 2e9k h ALA 45 CO -0.33 -0.88 -0.46 0.82 0.00 0.00 0.00 179.25 178.41 2e9k h ILE 46 N -1.24 0.05 0.38 0.00 2.04 -0.78 -0.31 117.51 117.64 2e9k h ILE 46 Ca -0.10 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.75 2e9k h ILE 46 Cb 0.72 0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.84 2e9k h ILE 46 CO 0.16 0.00 -0.32 0.40 0.00 0.00 0.00 178.15 178.39 2e9k h ILE 47 N -0.13 0.00 -0.93 -0.67 2.04 -1.54 -2.67 117.51 113.61 2e9k h ILE 47 Ca 0.22 0.00 0.27 0.00 1.00 0.00 0.00 64.86 66.34 2e9k h ILE 47 Cb 0.54 0.00 -0.17 0.00 -0.74 0.00 0.00 36.82 36.45 2e9k h ILE 47 CO -0.81 0.00 0.05 1.57 0.00 0.00 0.00 178.15 178.96 2e9k n HIS 48 N -4.32 0.63 -0.41 1.37 -0.00 -0.69 -0.54 115.22 111.25 2e9k n HIS 48 Ca -0.08 1.12 -0.11 0.00 0.46 0.00 0.00 57.72 59.11 2e9k n HIS 48 Cb 0.30 -1.22 -0.10 0.00 -0.12 0.00 0.00 29.99 28.85 2e9k n HIS 48 CO 0.00 0.00 0.00 -0.09 0.46 0.00 0.00 176.34 176.71 2e9k h ARG 49 N 0.00 -0.01 -0.02 1.57 9.65 -0.70 0.45 114.38 125.31 2e9k h ARG 49 Ca 0.58 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 59.44 2e9k h ARG 49 Cb 1.23 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.81 2e9k h ARG 49 CO -0.87 -0.01 -0.05 0.74 2.80 0.00 0.00 179.97 182.58 2e9k h PHE 50 N -0.01 0.10 -3.10 2.20 -1.00 -0.87 -3.40 116.94 110.85 2e9k h PHE 50 Ca 0.16 -0.04 -0.62 0.00 2.81 0.00 0.00 57.97 60.28 2e9k h PHE 50 Cb 0.42 -0.02 -0.40 0.00 3.61 0.00 0.00 35.95 39.55 2e9k h PHE 50 CO -1.02 0.64 -0.70 1.03 -1.61 0.00 0.00 178.31 176.65 2e9k s ARG 51 N -3.91 1.54 0.19 1.51 3.00 -0.39 -4.94 118.95 115.96 2e9k s ARG 51 Ca -0.16 -2.25 0.21 0.00 0.00 0.00 0.00 55.73 53.53 2e9k s ARG 51 Cb 0.02 -2.67 0.89 0.00 0.00 0.00 0.00 34.95 33.19 2e9k s ARG 51 CO 0.70 -1.15 1.64 -0.35 0.00 0.00 0.00 175.30 176.14 2e9k n PRO 52 N 3.34 0.14 0.06 3.54 -0.04 0.15 -2.76 135.00 139.44 2e9k n PRO 52 Ca 0.08 0.38 -0.20 0.00 -0.04 0.00 0.00 63.50 63.73 2e9k n PRO 52 Cb 0.34 -1.78 -0.11 0.00 -0.04 0.00 0.00 33.50 31.92 2e9k n PRO 52 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 2e9k h GLU 53 N 0.00 0.63 -0.69 0.54 4.11 -1.92 -3.29 114.58 113.95 2e9k h GLU 53 Ca 0.00 -0.73 -0.05 0.00 0.07 0.00 0.00 59.36 58.64 2e9k h GLU 53 Cb 0.33 0.22 -0.03 0.00 0.50 0.00 0.00 28.75 29.77 2e9k h GLU 53 CO 0.00 1.31 0.22 -0.07 0.07 0.00 0.00 179.01 180.55 2e9k h LEU 54 N 0.33 1.00 -8.09 3.06 3.38 -1.90 -3.43 115.31 109.66 2e9k h LEU 54 Ca -0.14 -0.20 -0.44 0.00 0.09 0.00 0.00 57.88 57.19 2e9k h LEU 54 Cb 1.76 -0.26 -0.29 0.00 0.09 0.00 0.00 40.66 41.96 2e9k h LEU 54 CO 0.21 0.94 -0.79 -0.63 0.09 0.00 0.00 178.44 178.26 2e9k s ILE 55 N -5.43 0.89 -0.79 1.22 1.01 -1.23 -5.02 121.20 111.85 2e9k s ILE 55 Ca -0.12 -0.47 0.02 0.00 0.00 0.00 0.00 60.65 60.08 2e9k s ILE 55 Cb 0.14 -0.75 0.19 0.00 0.01 0.00 0.00 42.46 42.05 2e9k s ILE 55 CO 0.83 0.26 0.63 0.54 0.00 0.00 0.00 174.94 177.19 2e9k s ASN 56 N -0.16 5.38 0.09 3.58 6.03 -1.26 -4.55 114.94 124.05 2e9k s ASN 56 Ca 0.03 -3.79 -0.19 0.00 -1.03 0.00 0.00 52.86 47.87 2e9k s ASN 56 Cb -0.05 -1.77 -0.05 0.00 -3.03 0.00 0.00 41.25 36.35 2e9k s ASN 56 CO -0.00 -0.13 1.33 0.15 -2.03 0.00 0.00 177.10 176.42 2e9k h PHE 57 N 5.69 -1.12 -1.05 1.54 3.04 -1.89 0.54 116.94 123.69 2e9k h PHE 57 Ca 0.15 0.07 0.42 0.00 3.98 0.00 0.00 57.97 62.59 2e9k h PHE 57 Cb 0.78 0.55 -0.16 0.00 2.56 0.00 0.00 35.95 39.68 2e9k h PHE 57 CO 0.70 -0.25 0.60 -3.47 -2.02 0.00 0.00 178.31 173.88 2e9k n ASP 58 N -4.36 0.30 0.08 0.41 2.03 -1.26 0.20 116.55 113.95 2e9k n ASP 58 Ca 0.00 1.53 -0.18 0.00 0.52 0.00 0.00 54.79 56.66 2e9k n ASP 58 Cb 0.17 -0.75 -0.10 0.00 -0.72 0.00 0.00 41.12 39.73 2e9k n ASP 58 CO 0.00 0.00 0.00 -1.28 -1.92 0.00 0.00 177.20 174.00 2e9k h SER 59 N 0.00 0.66 -1.14 1.67 0.87 -0.49 -3.44 113.55 111.69 2e9k h SER 59 Ca 0.82 -0.59 -0.52 0.00 -1.23 0.00 0.00 61.79 60.27 2e9k h SER 59 Cb 2.31 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 64.04 2e9k h SER 59 CO -0.66 1.41 1.61 0.18 -0.53 0.00 0.00 176.83 178.84 2e9k n LEU 60 N -3.73 1.86 -4.66 2.23 4.77 0.52 -4.85 117.00 113.14 2e9k n LEU 60 Ca -0.10 -0.10 -0.42 0.00 -0.03 0.00 0.00 56.01 55.36 2e9k n LEU 60 Cb 0.93 -1.36 -0.03 0.00 -2.33 0.00 0.00 43.42 40.63 2e9k n LEU 60 CO 0.55 -1.13 1.51 0.21 -1.33 0.00 0.00 177.39 177.19 2e9k s ASN 61 N 10.17 6.53 0.43 -1.43 3.04 -1.26 -4.85 114.94 127.57 2e9k s ASN 61 Ca 1.10 2.52 0.25 0.00 0.04 0.00 0.00 52.86 56.77 2e9k s ASN 61 Cb -0.59 -2.53 1.27 0.00 -1.54 0.00 0.00 41.25 37.85 2e9k s ASN 61 CO 0.37 -1.00 1.74 1.05 -3.04 0.00 0.00 177.10 176.21 2e9k h GLU 62 N 10.07 0.24 0.05 0.43 4.11 -1.93 0.60 114.58 128.15 2e9k h GLU 62 Ca -0.46 -0.01 -0.24 0.00 0.07 0.00 0.00 59.36 58.72 2e9k h GLU 62 Cb 1.22 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.41 2e9k h GLU 62 CO 0.94 0.16 -1.05 0.22 0.07 0.00 0.00 179.01 179.35 2e9k h ASP 63 N 0.24 0.45 0.00 3.06 3.58 -2.00 -3.32 116.42 118.43 2e9k h ASP 63 Ca 0.65 -0.40 -0.17 0.00 0.42 0.00 0.00 57.03 57.52 2e9k h ASP 63 Cb 1.94 -0.14 -0.06 0.00 1.72 0.00 0.00 39.33 42.78 2e9k h ASP 63 CO -0.28 1.24 -0.32 0.47 -2.88 0.00 0.00 179.24 177.47 2e9k n ASP 64 N -3.65 4.87 0.10 2.28 9.92 0.21 -4.56 116.55 125.72 2e9k n ASP 64 Ca -0.07 -2.41 -0.12 0.00 -0.53 0.00 0.00 54.79 51.66 2e9k n ASP 64 Cb 0.91 -1.32 -0.06 0.00 -0.64 0.00 0.00 41.12 40.01 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 3.19 -0.31 -0.51 2.24 0.00 -1.66 -1.10 119.26 121.12 2e9k h ALA 65 Ca 0.17 -0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.13 2e9k h ALA 65 Cb 1.41 0.29 -0.10 0.00 0.00 0.00 0.00 17.79 19.39 2e9k h ALA 65 CO 0.25 -0.71 -0.47 0.28 0.00 0.00 0.00 179.25 178.60 2e9k h VAL 66 N -0.35 0.07 -0.10 0.00 2.07 -1.80 0.24 116.25 116.38 2e9k h VAL 66 Ca 0.02 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.57 2e9k h VAL 66 Cb 0.37 0.07 -0.03 0.00 -1.52 0.00 0.00 31.29 30.18 2e9k h VAL 66 CO -0.10 0.00 -0.09 -0.33 0.02 0.00 0.00 177.57 177.07 2e9k h GLU 67 N -0.29 -0.10 -0.65 1.57 4.39 -1.88 -1.83 114.58 115.80 2e9k h GLU 67 Ca 0.14 0.01 0.12 0.00 0.34 0.00 0.00 59.36 59.97 2e9k h GLU 67 Cb 0.57 0.02 -0.09 0.00 -0.10 0.00 0.00 28.75 29.16 2e9k h GLU 67 CO -0.65 -0.07 0.19 -0.91 -1.16 0.00 0.00 179.01 176.42 2e9k h ASN 68 N -0.10 0.12 0.61 1.42 2.35 -0.08 -1.37 115.58 118.53 2e9k h ASN 68 Ca 0.07 0.11 -0.03 0.00 -0.55 0.00 0.00 56.30 55.90 2e9k h ASN 68 Cb 0.20 0.12 -0.00 0.00 0.05 0.00 0.00 38.32 38.69 2e9k h ASN 68 CO -0.16 0.06 -0.35 0.78 -1.65 0.00 0.00 177.43 176.11 2e9k h ASN 69 N 0.34 -0.88 -0.95 5.81 2.35 -0.05 -2.57 115.58 119.63 2e9k h ASN 69 Ca 0.34 0.05 0.29 0.00 -0.55 0.00 0.00 56.30 56.42 2e9k h ASN 69 Cb 0.50 0.25 -0.15 0.00 0.05 0.00 0.00 38.32 38.97 2e9k h ASN 69 CO -0.39 -0.55 0.41 -0.61 -1.65 0.00 0.00 177.43 174.64 2e9k h GLN 70 N -0.89 0.26 0.29 0.81 -0.00 -1.07 -1.09 115.11 113.41 2e9k h GLN 70 Ca -0.08 -0.02 -0.01 0.00 -0.00 0.00 0.00 58.65 58.55 2e9k h GLN 70 Cb 0.71 -0.06 -0.02 0.00 0.00 0.00 0.00 27.48 28.11 2e9k h GLN 70 CO 0.10 0.17 -0.35 1.25 0.00 0.00 0.00 178.83 180.00 2e9k h LEU 71 N 0.26 -0.97 -0.72 -2.39 5.85 -0.96 0.32 115.31 116.71 2e9k h LEU 71 Ca 0.66 0.08 0.14 0.00 0.84 0.00 0.00 57.88 59.60 2e9k h LEU 71 Cb 1.43 0.33 -0.10 0.00 0.37 0.00 0.00 40.66 42.69 2e9k h LEU 71 CO -0.64 -0.44 0.22 0.00 -0.34 0.00 0.00 178.44 177.24 2e9k h ALA 72 N -1.13 0.95 -0.70 1.25 0.00 -0.85 0.41 119.26 119.19 2e9k h ALA 72 Ca -0.04 0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2e9k h ALA 72 Cb 0.58 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.50 2e9k h ALA 72 CO -0.07 -0.28 0.41 0.74 0.00 0.00 0.00 179.25 180.05 2e9k h PHE 73 N 0.34 0.93 0.61 0.00 0.04 -0.92 -1.43 116.94 116.51 2e9k h PHE 73 Ca 0.40 -0.01 -0.03 0.00 2.80 0.00 0.00 57.97 61.13 2e9k h PHE 73 Cb 0.63 -0.30 0.01 0.00 2.20 0.00 0.00 35.95 38.48 2e9k h PHE 73 CO -0.22 0.64 -0.29 0.22 -0.60 0.00 0.00 178.31 178.05 2e9k h ASP 74 N 0.95 -0.70 -0.48 2.17 3.58 0.14 -2.66 116.42 119.42 2e9k h ASP 74 Ca 0.25 -0.02 0.10 0.00 0.42 0.00 0.00 57.03 57.77 2e9k h ASP 74 Cb -0.01 0.18 -0.09 0.00 1.72 0.00 0.00 39.33 41.13 2e9k h ASP 74 CO -0.04 -0.39 -0.12 0.58 -2.88 0.00 0.00 179.24 176.38 2e9k h VAL 75 N -0.98 0.51 -0.76 2.25 2.07 -0.94 0.21 116.25 118.62 2e9k h VAL 75 Ca -0.08 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.61 2e9k h VAL 75 Cb 0.68 0.51 -0.05 0.00 -1.52 0.00 0.00 31.29 30.91 2e9k h VAL 75 CO 0.14 0.00 0.52 0.00 0.02 0.00 0.00 177.57 178.25 2e9k h ALA 76 N 1.48 2.31 0.00 1.67 0.00 -1.24 0.58 119.26 124.06 2e9k h ALA 76 Ca 0.23 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2e9k h ALA 76 Cb 0.35 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2e9k h ALA 76 CO -0.50 -0.53 -0.45 -1.91 0.00 0.00 0.00 179.25 175.86 2e9k n GLU 77 N -4.44 0.14 -0.04 0.00 0.00 0.51 0.96 120.64 117.78 2e9k n GLU 77 Ca 0.15 0.05 -0.11 0.00 0.00 0.00 0.00 57.16 57.25 2e9k n GLU 77 Cb 0.64 -1.60 -0.14 0.00 0.00 0.00 0.00 31.44 30.34 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 -1.82 0.66 -0.09 5.31 0.63 0.17 -3.30 116.66 118.23 2e9k n ARG 78 Ca 0.05 0.21 -0.16 0.00 -0.92 0.00 0.00 57.85 57.03 2e9k n ARG 78 Cb 0.39 -1.70 -0.05 0.00 0.45 0.00 0.00 32.46 31.54 2e9k n ARG 78 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 2e9k n GLU 79 N -3.05 0.43 0.12 -0.14 1.02 0.93 -4.65 120.64 115.30 2e9k n GLU 79 Ca -0.24 0.18 0.06 0.00 -0.02 0.00 0.00 57.16 57.14 2e9k n GLU 79 Cb 1.07 -1.24 0.02 0.00 -0.02 0.00 0.00 31.44 31.27 2e9k n GLU 79 CO 0.00 0.00 0.00 0.74 1.18 0.00 0.00 177.13 179.05 2e9k h PHE 80 N -0.77 0.00 -2.18 -0.32 0.04 -1.25 -3.48 116.94 108.98 2e9k h PHE 80 Ca -0.32 0.00 -0.20 0.00 2.80 0.00 0.00 57.97 60.26 2e9k h PHE 80 Cb 1.18 0.00 0.02 0.00 2.20 0.00 0.00 35.95 39.35 2e9k h PHE 80 CO -0.18 0.29 -0.28 0.41 -0.60 0.00 0.00 178.31 177.95 2e9k n GLY 81 N 1.23 0.07 3.53 -1.45 0.00 0.27 -4.91 105.19 103.93 2e9k n GLY 81 Ca -0.01 -0.37 -0.39 0.00 0.00 0.00 0.00 46.02 45.25 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 -2.76 5.14 0.15 -0.61 1.01 -0.80 -4.86 121.20 118.47 2e9k s ILE 82 Ca 0.11 -0.10 -0.31 0.00 0.00 0.00 0.00 60.65 60.36 2e9k s ILE 82 Cb -0.05 -3.55 -0.08 0.00 0.01 0.00 0.00 42.46 38.79 2e9k s ILE 82 CO 0.14 0.12 1.34 -2.16 0.00 0.00 0.00 174.94 174.38 2e9k s PRO 83 N 1.71 4.36 0.35 2.79 0.04 -1.26 -3.72 135.00 139.27 2e9k s PRO 83 Ca 0.06 2.04 -0.27 0.00 0.04 0.00 0.00 61.00 62.87 2e9k s PRO 83 Cb -0.17 -3.23 -0.09 0.00 0.04 0.00 0.00 34.50 31.05 2e9k s PRO 83 CO 0.10 -0.33 1.21 -1.25 0.04 0.00 0.00 177.00 176.76 2e9k s PRO 84 N 0.52 4.29 0.11 0.56 0.04 -1.26 -4.95 135.00 134.31 2e9k s PRO 84 Ca 0.60 1.99 0.07 0.00 0.04 0.00 0.00 61.00 63.70 2e9k s PRO 84 Cb -0.36 -2.94 -0.21 0.00 0.04 0.00 0.00 34.50 31.03 2e9k s PRO 84 CO 0.34 -0.16 1.25 -0.39 0.04 0.00 0.00 177.00 178.08 2e9k h VAL 85 N 2.77 1.67 -4.03 -0.36 -1.51 -1.94 -3.47 116.25 109.37 2e9k h VAL 85 Ca -0.48 -3.38 -0.18 0.00 -1.23 0.00 0.00 66.70 61.43 2e9k h VAL 85 Cb 1.23 2.82 -0.15 0.00 -2.13 0.00 0.00 31.29 33.06 2e9k h VAL 85 CO 0.65 0.95 -0.69 0.28 -1.23 0.00 0.00 177.57 177.53 2e9k s THR 86 N -2.71 0.45 -0.03 7.19 -1.32 -1.26 -5.15 115.64 112.82 2e9k s THR 86 Ca 0.01 -1.88 -0.20 0.00 -1.21 0.00 0.00 61.69 58.41 2e9k s THR 86 Cb 0.10 -1.63 -0.05 0.00 -1.51 0.00 0.00 72.50 69.41 2e9k s THR 86 CO 0.82 -0.91 0.58 0.42 -2.21 0.00 0.00 174.62 173.32 2e9k s THR 87 N -3.78 4.98 0.16 5.08 -4.23 -1.26 -4.92 115.64 111.67 2e9k s THR 87 Ca 0.10 1.19 -0.20 0.00 -1.18 0.00 0.00 61.69 61.61 2e9k s THR 87 Cb 0.07 -3.91 0.07 0.00 1.34 0.00 0.00 72.50 70.06 2e9k s THR 87 CO -0.07 0.39 1.27 0.61 -0.54 0.00 0.00 174.62 176.28 2e9k n GLY 88 N 2.62 -1.91 0.36 3.99 0.00 -1.26 0.00 105.19 108.99 2e9k n GLY 88 Ca -0.07 0.95 -0.06 0.00 0.00 0.00 0.00 46.02 46.84 2e9k n GLY 88 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2e9k h LYS 89 N 0.00 -0.18 -0.78 1.61 3.64 -1.93 0.17 116.57 119.09 2e9k h LYS 89 Ca 0.21 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.59 2e9k h LYS 89 Cb 0.41 0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.24 2e9k h LYS 89 CO -0.79 -0.12 0.45 1.49 -2.27 0.00 0.00 179.45 178.21 2e9k h GLU 90 N -0.19 1.07 -0.98 1.90 4.57 -0.82 -1.12 114.58 119.02 2e9k h GLU 90 Ca 0.21 -0.11 0.19 0.00 -1.18 0.00 0.00 59.36 58.48 2e9k h GLU 90 Cb 0.56 -0.22 -0.09 0.00 -0.16 0.00 0.00 28.75 28.83 2e9k h GLU 90 CO -0.68 0.77 0.61 1.98 -1.18 0.00 0.00 179.01 180.51 2e9k h MET 91 N 1.08 0.66 0.14 1.92 4.05 0.20 0.40 114.93 123.38 2e9k h MET 91 Ca 0.28 -0.04 -0.32 0.00 -0.28 0.00 0.00 59.70 59.34 2e9k h MET 91 Cb -0.01 -0.15 -0.00 0.00 -0.80 0.00 0.00 31.60 30.64 2e9k h MET 91 CO -0.05 0.44 -1.57 0.00 0.23 0.00 0.00 176.91 175.96 2e9k h ALA 92 N 1.62 0.24 0.37 0.39 0.00 -0.77 -3.39 119.26 117.72 2e9k h ALA 92 Ca 0.54 -1.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.32 2e9k h ALA 92 Cb 0.95 0.31 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2e9k h ALA 92 CO -0.31 1.10 -0.18 0.77 0.00 0.00 0.00 179.25 180.64 2e9k h SER 93 N 0.08 -0.42 -1.73 0.00 0.02 -0.01 -3.42 113.55 108.06 2e9k h SER 93 Ca -0.26 0.01 -0.69 0.00 -0.84 0.00 0.00 61.79 60.01 2e9k h SER 93 Cb 2.04 0.11 0.02 0.00 0.14 0.00 0.00 62.40 64.71 2e9k h SER 93 CO 0.17 -0.30 0.92 0.00 -1.14 0.00 0.00 176.83 176.49 2e9k n ALA 94 N -2.26 0.14 -0.07 3.77 0.00 0.01 -4.86 120.51 117.24 2e9k n ALA 94 Ca -0.06 0.37 -0.10 0.00 0.00 0.00 0.00 53.44 53.64 2e9k n ALA 94 Cb 0.20 -2.30 -0.03 0.00 0.00 0.00 0.00 19.45 17.31 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 7.57 0.36 -3.36 0.00 3.07 -1.90 -3.40 115.11 117.45 2e9k h GLN 95 Ca -0.47 -0.06 -0.54 0.00 0.09 0.00 0.00 58.65 57.67 2e9k h GLN 95 Cb 1.30 -0.06 -0.40 0.00 0.08 0.00 0.00 27.48 28.40 2e9k h GLN 95 CO 0.94 0.37 -0.76 -2.00 0.09 0.00 0.00 178.83 177.47 2e9k s GLU 96 N -5.66 0.55 1.24 0.06 2.12 -1.26 -4.78 118.70 110.97 2e9k s GLU 96 Ca -0.13 -0.69 -0.21 0.00 0.36 0.00 0.00 54.97 54.30 2e9k s GLU 96 Cb 0.08 -1.84 0.31 0.00 0.26 0.00 0.00 34.13 32.94 2e9k s GLU 96 CO 0.71 -0.86 1.10 -0.35 -0.54 0.00 0.00 175.26 175.33 2e9k n PRO 97 N 5.03 -3.17 -2.64 4.30 -0.04 -1.26 -4.94 135.00 132.27 2e9k n PRO 97 Ca -0.06 -1.77 -0.42 0.00 -0.04 0.00 0.00 63.50 61.22 2e9k n PRO 97 Cb 0.44 -1.66 -0.03 0.00 -0.04 0.00 0.00 33.50 32.21 2e9k n PRO 97 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2e9k s ASP 98 N -4.48 6.26 0.23 3.54 1.11 -1.26 -4.89 116.67 117.18 2e9k s ASP 98 Ca 0.72 -0.37 0.03 0.00 0.18 0.00 0.00 52.55 53.11 2e9k s ASP 98 Cb -0.07 -2.52 0.61 0.00 1.07 0.00 0.00 42.92 42.01 2e9k s ASP 98 CO 0.55 -1.62 1.14 1.17 1.18 0.00 0.00 175.17 177.59 2e9k n LYS 99 N 8.66 -0.06 0.11 8.23 0.00 -1.26 -0.67 118.16 133.18 2e9k n LYS 99 Ca 0.03 1.08 -0.04 0.00 0.00 0.00 0.00 58.31 59.37 2e9k n LYS 99 Cb 0.48 -1.74 -0.02 0.00 0.00 0.00 0.00 35.03 33.75 2e9k n LYS 99 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.40 177.33 2e9k h LEU 100 N 0.00 -0.25 -1.04 3.14 4.07 -1.94 0.07 115.31 119.36 2e9k h LEU 100 Ca 0.47 0.01 0.41 0.00 0.08 0.00 0.00 57.88 58.85 2e9k h LEU 100 Cb 1.01 0.06 -0.16 0.00 1.08 0.00 0.00 40.66 42.65 2e9k h LEU 100 CO -0.67 -0.16 0.59 -0.24 -1.08 0.00 0.00 178.44 176.88 2e9k n SER 101 N -2.84 0.30 0.18 -0.43 2.88 0.15 -0.13 113.62 113.73 2e9k n SER 101 Ca -0.04 1.52 -0.11 0.00 -1.33 0.00 0.00 58.87 58.92 2e9k n SER 101 Cb 0.11 -0.74 -0.06 0.00 -0.75 0.00 0.00 64.21 62.77 2e9k n SER 101 CO 0.00 0.00 0.00 0.24 -1.23 0.00 0.00 175.04 174.05 2e9k h MET 102 N 0.00 -0.49 0.14 -1.46 2.86 -1.06 -3.01 114.93 111.91 2e9k h MET 102 Ca 0.82 0.03 0.02 0.00 -2.06 0.00 0.00 59.70 58.51 2e9k h MET 102 Cb 2.28 0.11 -0.04 0.00 0.06 0.00 0.00 31.60 34.01 2e9k h MET 102 CO -0.67 -0.21 -0.37 0.28 1.06 0.00 0.00 176.91 177.00 2e9k h VAL 103 N -1.04 0.24 -1.26 -2.22 2.07 0.15 0.25 116.25 114.44 2e9k h VAL 103 Ca -0.05 0.00 0.36 0.00 0.82 0.00 0.00 66.70 67.83 2e9k h VAL 103 Cb 0.50 0.24 -0.07 0.00 -1.52 0.00 0.00 31.29 30.44 2e9k h VAL 103 CO 0.09 0.00 0.88 0.00 0.02 0.00 0.00 177.57 178.55 2e9k h MET 104 N -0.61 0.10 0.10 1.57 -0.00 -0.65 0.30 114.93 115.73 2e9k h MET 104 Ca 0.02 -0.01 -0.19 0.00 -0.00 0.00 0.00 59.70 59.53 2e9k h MET 104 Cb 0.63 -0.02 0.01 0.00 -0.00 0.00 0.00 31.60 32.22 2e9k h MET 104 CO -0.21 0.06 -0.92 -0.92 -0.00 0.00 0.00 176.91 174.93 2e9k h TYR 105 N 0.10 0.40 0.23 -0.10 3.20 -0.99 -3.35 116.97 116.45 2e9k h TYR 105 Ca 0.64 -0.29 -0.01 0.00 3.14 0.00 0.00 58.73 62.21 2e9k h TYR 105 Cb 2.30 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 40.56 2e9k h TYR 105 CO -0.00 1.36 -0.12 -0.07 -1.64 0.00 0.00 178.16 177.69 2e9k h LEU 106 N -0.48 -0.28 -0.96 2.82 3.38 0.20 -2.92 115.31 117.07 2e9k h LEU 106 Ca -0.19 0.01 0.18 0.00 0.09 0.00 0.00 57.88 57.98 2e9k h LEU 106 Cb 1.57 0.08 -0.18 0.00 0.09 0.00 0.00 40.66 42.21 2e9k h LEU 106 CO 0.08 -0.19 -0.26 -1.54 0.09 0.00 0.00 178.44 176.61 2e9k n SER 107 N -5.23 -0.40 -0.32 -0.43 3.41 0.79 0.47 113.62 111.90 2e9k n SER 107 Ca -0.09 1.65 0.13 0.00 -0.26 0.00 0.00 58.87 60.30 2e9k n SER 107 Cb 0.15 -0.48 0.26 0.00 -0.26 0.00 0.00 64.21 63.89 2e9k n SER 107 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2e9k n LYS 108 N -5.53 -0.07 -0.03 4.33 5.02 -1.10 0.02 118.16 120.79 2e9k n LYS 108 Ca 0.14 1.38 -0.14 0.00 -2.02 0.00 0.00 58.31 57.68 2e9k n LYS 108 Cb 0.46 -2.19 -0.11 0.00 -0.02 0.00 0.00 35.03 33.18 2e9k n LYS 108 CO 0.00 0.00 0.00 0.74 -0.52 0.00 0.00 177.40 177.62 2e9k h PHE 109 N 0.00 0.12 -0.94 2.13 0.04 -0.12 -2.79 116.94 115.38 2e9k h PHE 109 Ca 0.55 -0.05 0.09 0.00 2.80 0.00 0.00 57.97 61.36 2e9k h PHE 109 Cb 1.13 -0.02 -0.12 0.00 2.20 0.00 0.00 35.95 39.14 2e9k h PHE 109 CO -0.48 0.74 -0.58 -0.92 -0.60 0.00 0.00 178.31 176.46 2e9k h TYR 110 N -0.53 -1.87 -0.06 -0.55 3.20 0.12 0.18 116.97 117.46 2e9k h TYR 110 Ca -0.01 0.13 0.00 0.00 3.14 0.00 0.00 58.73 61.99 2e9k h TYR 110 Cb 0.75 0.94 -0.00 0.00 1.54 0.00 0.00 36.73 39.95 2e9k h TYR 110 CO 0.15 -0.38 0.04 0.93 -1.64 0.00 0.00 178.16 177.26 2e9k h GLU 111 N -0.04 0.08 -0.45 1.82 5.08 -1.42 0.29 114.58 119.94 2e9k h GLU 111 Ca 0.15 -0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.58 2e9k h GLU 111 Cb 0.43 -0.02 -0.09 0.00 0.50 0.00 0.00 28.75 29.57 2e9k h GLU 111 CO -0.91 0.08 -0.45 1.25 -1.00 0.00 0.00 179.01 177.98 2e9k h LEU 112 N 0.06 -1.52 0.13 1.33 5.85 -0.73 -1.85 115.31 118.59 2e9k h LEU 112 Ca 0.02 0.23 -0.01 0.00 0.84 0.00 0.00 57.88 58.97 2e9k h LEU 112 Cb 0.02 0.66 0.00 0.00 0.37 0.00 0.00 40.66 41.71 2e9k h LEU 112 CO -0.00 -0.37 -0.06 -0.26 -0.34 0.00 0.00 178.44 177.41 2e9k h PHE 113 N -0.31 -0.16 -0.73 1.25 0.04 -0.65 -3.21 116.94 113.17 2e9k h PHE 113 Ca 0.14 -0.00 0.14 0.00 2.80 0.00 0.00 57.97 61.05 2e9k h PHE 113 Cb 0.58 0.05 -0.14 0.00 2.20 0.00 0.00 35.95 38.65 2e9k h PHE 113 CO -0.66 0.21 -0.19 -2.13 -0.60 0.00 0.00 178.31 174.93 2e9k n ARG 114 N -4.99 -0.08 0.00 1.51 3.00 0.10 -4.65 116.66 111.55 2e9k n ARG 114 Ca -0.09 1.13 0.00 0.00 -0.00 0.00 0.00 57.85 58.89 2e9k n ARG 114 Cb 0.23 -1.69 0.00 0.00 0.00 0.00 0.00 32.46 31.00 2e9k n ARG 114 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2e9k n GLY 115 N -1.45 -0.54 3.55 5.14 0.00 -0.74 -5.08 105.19 106.09 2e9k n GLY 115 Ca 0.11 0.26 -0.44 0.00 0.00 0.00 0.00 46.02 45.95 2e9k n GLY 115 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2e9k n THR 116 N 0.00 2.01 -1.14 2.61 5.66 -1.22 -4.95 114.28 117.26 2e9k n THR 116 Ca 0.00 -0.50 -0.29 0.00 -3.05 0.00 0.00 64.05 60.21 2e9k n THR 116 Cb 0.00 -0.85 0.20 0.00 -1.55 0.00 0.00 70.33 68.13 2e9k n THR 116 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 2e9k s PRO 117 N -1.53 -0.08 0.52 1.09 0.04 -1.26 -5.01 135.00 128.77 2e9k s PRO 117 Ca 0.60 0.35 -0.20 0.00 0.04 0.00 0.00 61.00 61.79 2e9k s PRO 117 Cb -0.71 -1.69 -0.07 0.00 0.04 0.00 0.00 34.50 32.07 2e9k s PRO 117 CO 0.59 -3.03 1.11 -0.51 0.04 0.00 0.00 177.00 175.20 2e9k s LEU 118 N -6.61 3.81 0.73 -3.56 1.43 -1.26 -4.96 118.68 108.26 2e9k s LEU 118 Ca 0.67 2.13 -0.17 0.00 -1.03 0.00 0.00 54.13 55.73 2e9k s LEU 118 Cb -0.16 -4.53 -0.10 0.00 0.03 0.00 0.00 46.19 41.42 2e9k s LEU 118 CO 0.57 -1.07 -0.03 0.54 0.23 0.00 0.00 176.35 176.59 2e9k n ARG 119 N -1.11 0.10 -2.13 1.70 5.12 -1.26 -4.90 116.66 114.17 2e9k n ARG 119 Ca 0.11 0.05 -0.35 0.00 -1.93 0.00 0.00 57.85 55.73 2e9k n ARG 119 Cb 0.51 -1.35 0.01 0.00 -1.16 0.00 0.00 32.46 30.47 2e9k n ARG 119 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 2e9k s PRO 120 N -2.04 3.22 0.00 5.56 0.04 -1.26 -5.32 135.00 135.20 2e9k s PRO 120 Ca 0.56 1.55 0.00 0.00 0.04 0.00 0.00 61.00 63.15 2e9k s PRO 120 Cb -0.35 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.20 2e9k s PRO 120 CO 0.67 -0.95 0.30 1.55 0.04 0.00 0.00 177.00 178.62