#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r3n n THR 19 N 0.00 -8.36 -3.15 2.61 5.66 -1.26 -5.01 114.28 104.77 1r3n n THR 19 Ca 0.00 -0.91 -0.40 0.00 -3.05 0.00 0.00 64.05 59.69 1r3n n THR 19 Cb 0.00 -6.19 -0.06 0.00 -1.55 0.00 0.00 70.33 62.53 1r3n n THR 19 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 1r3n s LEU 20 N -4.70 4.10 -1.20 1.09 1.43 -1.26 -4.99 118.68 113.14 1r3n s LEU 20 Ca 0.29 0.71 -0.08 0.00 -1.03 0.00 0.00 54.13 54.02 1r3n s LEU 20 Cb -0.04 -2.81 0.22 0.00 0.03 0.00 0.00 46.19 43.59 1r3n s LEU 20 CO 0.64 -0.30 1.71 -3.20 0.23 0.00 0.00 176.35 175.43 1r3n n ASN 21 N 5.36 5.58 -4.78 2.29 5.15 -1.26 -5.01 115.26 122.59 1r3n n ASN 21 Ca -0.02 -3.21 -0.36 0.00 -0.60 0.00 0.00 54.58 50.39 1r3n n ASN 21 Cb 0.49 -1.41 -0.01 0.00 -0.53 0.00 0.00 39.78 38.33 1r3n n ASN 21 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1r3n s LEU 22 N -1.05 3.87 0.88 1.20 1.43 -1.26 -5.01 118.68 118.73 1r3n s LEU 22 Ca 0.36 2.18 -0.12 0.00 -1.03 0.00 0.00 54.13 55.52 1r3n s LEU 22 Cb 0.07 -4.45 0.11 0.00 0.03 0.00 0.00 46.19 41.95 1r3n s LEU 22 CO 0.04 -1.02 1.08 -2.65 0.23 0.00 0.00 176.35 174.04 1r3n n PRO 23 N -0.92 -0.19 -2.08 1.29 -0.02 -1.26 -4.94 135.00 126.89 1r3n n PRO 23 Ca 0.09 0.02 -0.37 0.00 -2.02 0.00 0.00 63.50 61.22 1r3n n PRO 23 Cb 0.50 -2.34 0.02 0.00 -0.02 0.00 0.00 33.50 31.66 1r3n n PRO 23 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1r3n s ALA 24 N -2.40 2.79 -0.63 3.55 0.00 -1.26 -4.89 121.76 118.91 1r3n s ALA 24 Ca 0.68 1.04 -0.27 0.00 0.00 0.00 0.00 51.96 53.41 1r3n s ALA 24 Cb -0.25 -3.44 -0.01 0.00 0.00 0.00 0.00 23.12 19.41 1r3n s ALA 24 CO 0.56 -0.98 1.73 0.00 0.00 0.00 0.00 175.76 177.07 1r3n s ALA 25 N -1.52 2.33 -0.40 0.00 0.00 -1.26 -4.94 121.76 115.96 1r3n s ALA 25 Ca 0.70 -0.77 -0.22 0.00 0.00 0.00 0.00 51.96 51.67 1r3n s ALA 25 Cb -0.31 -4.28 0.01 0.00 0.00 0.00 0.00 23.12 18.54 1r3n s ALA 25 CO 0.36 -3.71 0.74 0.00 0.00 0.00 0.00 175.76 173.15 1r3n s ALA 26 N 8.26 3.38 -0.04 0.00 0.00 -1.26 -5.04 121.76 127.05 1r3n s ALA 26 Ca 0.61 -0.86 -0.24 0.00 0.00 0.00 0.00 51.96 51.47 1r3n s ALA 26 Cb -0.12 -3.35 -0.04 0.00 0.00 0.00 0.00 23.12 19.61 1r3n s ALA 26 CO 0.20 -1.62 0.73 -1.25 0.00 0.00 0.00 175.76 173.82 1r3n s PRO 27 N 3.05 4.45 0.29 0.00 0.05 -1.26 -5.05 135.00 136.54 1r3n s PRO 27 Ca 0.29 0.96 -0.16 0.00 0.05 0.00 0.00 61.00 62.13 1r3n s PRO 27 Cb -0.13 -3.43 -0.09 0.00 0.05 0.00 0.00 34.50 30.90 1r3n s PRO 27 CO 0.19 0.10 0.73 -0.51 0.05 0.00 0.00 177.00 177.55 1r3n s LEU 28 N 0.66 4.15 -0.22 -3.56 1.43 -1.26 -4.99 118.68 114.88 1r3n s LEU 28 Ca 0.39 1.31 -0.33 0.00 -1.03 0.00 0.00 54.13 54.47 1r3n s LEU 28 Cb -0.18 -3.93 -0.10 0.00 0.03 0.00 0.00 46.19 42.01 1r3n s LEU 28 CO 0.20 -0.13 2.08 -0.24 0.23 0.00 0.00 176.35 178.48 1r3n n SER 29 N -0.04 2.91 -4.82 2.29 2.88 -1.26 -4.98 113.62 110.60 1r3n n SER 29 Ca 0.02 0.58 -0.33 0.00 -1.33 0.00 0.00 58.87 57.81 1r3n n SER 29 Cb 0.53 -1.37 -0.06 0.00 -0.75 0.00 0.00 64.21 62.55 1r3n n SER 29 CO 0.00 0.00 0.00 0.27 -1.23 0.00 0.00 175.04 174.08 1r3n s ILE 30 N 6.29 4.98 -0.51 2.46 -4.36 -1.26 -4.81 121.20 123.98 1r3n s ILE 30 Ca 1.01 -0.29 -0.28 0.00 -0.26 0.00 0.00 60.65 60.83 1r3n s ILE 30 Cb -0.67 -3.28 0.02 0.00 1.25 0.00 0.00 42.46 39.78 1r3n s ILE 30 CO 0.47 0.37 1.32 0.00 0.24 0.00 0.00 174.94 177.34 1r3n s ALA 31 N -1.22 2.96 0.14 2.27 0.00 -1.26 -4.99 121.76 119.67 1r3n s ALA 31 Ca 0.23 -0.54 -0.31 0.00 0.00 0.00 0.00 51.96 51.34 1r3n s ALA 31 Cb -0.12 -4.02 -0.10 0.00 0.00 0.00 0.00 23.12 18.88 1r3n s ALA 31 CO 0.14 -2.63 1.68 0.45 0.00 0.00 0.00 175.76 175.40 1r3n s SER 32 N 3.68 6.51 0.00 0.00 0.15 -1.26 -2.55 113.70 120.23 1r3n s SER 32 Ca 0.52 2.67 0.00 0.00 0.70 0.00 0.00 55.95 59.84 1r3n s SER 32 Cb -0.10 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.63 1r3n s SER 32 CO 0.28 -0.91 0.00 0.61 1.20 0.00 0.00 173.24 174.42 1r3n n GLY 33 N 3.97 1.71 0.15 9.45 0.00 -1.26 -4.93 105.19 114.27 1r3n n GLY 33 Ca 0.16 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.05 1r3n n GLY 33 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1r3n h ARG 34 N 2.86 0.41 -0.02 1.61 2.43 -1.92 -1.48 114.38 118.27 1r3n h ARG 34 Ca 0.00 -0.18 0.01 0.00 -0.81 0.00 0.00 59.98 59.00 1r3n h ARG 34 Cb 0.00 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 1r3n h ARG 34 CO 0.00 0.71 -0.05 1.25 -1.51 0.00 0.00 179.97 180.37 1r3n h LEU 35 N 0.10 -0.13 -0.66 3.80 5.85 -1.92 0.75 115.31 123.10 1r3n h LEU 35 Ca 0.04 0.02 0.09 0.00 0.84 0.00 0.00 57.88 58.88 1r3n h LEU 35 Cb 0.59 0.06 -0.07 0.00 0.37 0.00 0.00 40.66 41.61 1r3n h LEU 35 CO 0.03 -0.07 0.29 -1.13 -0.34 0.00 0.00 178.44 177.22 1r3n h ASN 36 N -0.07 0.35 -0.49 1.25 -1.24 -1.90 -0.95 115.58 112.51 1r3n h ASN 36 Ca 0.03 0.07 -0.06 0.00 0.71 0.00 0.00 56.30 57.05 1r3n h ASN 36 Cb 0.11 0.02 -0.02 0.00 0.73 0.00 0.00 38.32 39.15 1r3n h ASN 36 CO -0.06 0.20 0.11 -0.61 -1.29 0.00 0.00 177.43 175.77 1r3n h GLN 37 N 0.50 0.86 -0.45 6.67 5.75 -0.71 -2.18 115.11 125.55 1r3n h GLN 37 Ca 0.33 -0.19 -0.08 0.00 -0.15 0.00 0.00 58.65 58.56 1r3n h GLN 37 Cb 0.37 -0.12 -0.02 0.00 1.07 0.00 0.00 27.48 28.78 1r3n h GLN 37 CO -0.28 0.79 -0.03 1.15 -2.65 0.00 0.00 178.83 177.81 1r3n h THR 38 N 0.82 1.27 -0.41 2.39 2.02 -0.05 0.38 112.91 119.32 1r3n h THR 38 Ca 0.18 -1.09 0.07 0.00 0.77 0.00 0.00 66.41 66.33 1r3n h THR 38 Cb 0.34 1.07 -0.06 0.00 -1.74 0.00 0.00 68.15 67.76 1r3n h THR 38 CO 0.00 0.38 0.04 0.40 0.37 0.00 0.00 175.52 176.71 1r3n h ILE 39 N 0.65 0.73 -0.18 3.11 1.08 -0.90 -1.13 117.51 120.87 1r3n h ILE 39 Ca 0.12 -0.05 -0.17 0.00 -0.39 0.00 0.00 64.86 64.37 1r3n h ILE 39 Cb 0.54 0.56 -0.00 0.00 -3.07 0.00 0.00 36.82 34.84 1r3n h ILE 39 CO 0.03 0.03 -0.59 -0.07 -0.69 0.00 0.00 178.15 176.85 1r3n h LEU 40 N 0.16 0.68 -0.08 1.44 3.38 -1.19 -2.14 115.31 117.56 1r3n h LEU 40 Ca 0.20 -0.38 -0.07 0.00 0.09 0.00 0.00 57.88 57.72 1r3n h LEU 40 Cb 0.27 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1r3n h LEU 40 CO -0.30 1.12 -0.22 -0.33 0.09 0.00 0.00 178.44 178.80 1r3n h GLU 41 N 0.46 0.29 -0.09 1.13 5.08 -0.67 -2.63 114.58 118.14 1r3n h GLU 41 Ca -0.00 -0.21 -0.11 0.00 -1.00 0.00 0.00 59.36 58.04 1r3n h GLU 41 Cb 1.16 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.43 1r3n h GLU 41 CO 0.11 0.82 -0.44 1.79 -1.00 0.00 0.00 179.01 180.30 1r3n h THR 42 N -0.18 1.32 0.31 1.13 1.35 -1.29 -2.16 112.91 113.39 1r3n h THR 42 Ca -0.00 -1.58 -0.02 0.00 -0.55 0.00 0.00 66.41 64.26 1r3n h THR 42 Cb 0.83 1.74 0.00 0.00 -1.73 0.00 0.00 68.15 68.99 1r3n h THR 42 CO 0.05 0.47 -0.15 1.23 -0.25 0.00 0.00 175.52 176.87 1r3n h GLY 43 N 1.26 -0.43 1.97 5.82 0.00 -1.43 0.16 103.07 110.42 1r3n h GLY 43 Ca 0.01 0.16 -0.01 0.00 0.00 0.00 0.00 47.33 47.49 1r3n h GLY 43 CO 0.07 -0.16 -0.04 0.23 0.00 0.00 0.00 176.54 176.64 1r3n h SER 44 N -0.66 0.03 0.02 0.19 0.87 -1.44 0.54 113.55 113.10 1r3n h SER 44 Ca -0.04 -0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.46 1r3n h SER 44 Cb 0.46 -0.01 0.01 0.00 -0.44 0.00 0.00 62.40 62.42 1r3n h SER 44 CO 0.07 0.08 -0.23 -0.61 -0.53 0.00 0.00 176.83 175.61 1r3n h GLN 45 N 0.04 0.13 -2.73 2.24 4.15 -1.29 -3.36 115.11 114.29 1r3n h GLN 45 Ca 0.01 -0.16 -0.61 0.00 0.77 0.00 0.00 58.65 58.66 1r3n h GLN 45 Cb 0.10 0.05 -0.42 0.00 0.21 0.00 0.00 27.48 27.42 1r3n h GLN 45 CO 0.01 0.96 -0.59 1.19 -1.93 0.00 0.00 178.83 178.46 1r3n n PHE 46 N -4.51 3.29 0.00 3.99 3.01 0.03 -4.77 117.46 118.50 1r3n n PHE 46 Ca -0.10 -4.23 0.00 0.00 1.01 0.00 0.00 57.45 54.13 1r3n n PHE 46 Cb 0.52 -0.58 0.00 0.00 -0.01 0.00 0.00 39.48 39.41 1r3n n PHE 46 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1r3n n GLY 47 N 1.55 1.23 3.67 1.37 0.00 -1.20 -4.76 105.19 107.05 1r3n n GLY 47 Ca 0.24 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.84 1r3n n GLY 47 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1r3n s GLY 48 N -1.66 1.58 0.28 -0.02 0.00 0.17 0.03 107.32 107.70 1r3n s GLY 48 Ca 0.00 1.05 0.02 0.00 0.00 0.00 0.00 44.72 45.79 1r3n s GLY 48 CO 0.00 2.93 0.15 -1.34 0.00 0.00 0.00 173.10 174.85 1r3n s VAL 49 N 3.33 0.30 -1.51 1.40 -7.23 0.32 -4.93 120.40 112.08 1r3n s VAL 49 Ca 0.73 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.84 1r3n s VAL 49 Cb -0.36 -2.53 0.05 0.00 0.56 0.00 0.00 36.38 34.10 1r3n s VAL 49 CO 0.31 0.00 0.51 0.00 -0.31 0.00 0.00 175.10 175.61 1r3n n ALA 50 N -0.52 -1.77 -1.74 1.32 0.00 -1.26 -1.24 120.51 115.30 1r3n n ALA 50 Ca 0.01 -0.19 -0.42 0.00 0.00 0.00 0.00 53.44 52.84 1r3n n ALA 50 Cb 0.65 -2.10 -0.03 0.00 0.00 0.00 0.00 19.45 17.97 1r3n n ALA 50 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1r3n s ARG 51 N -6.72 4.13 0.00 0.00 3.52 -1.26 -4.09 118.95 114.53 1r3n s ARG 51 Ca 0.23 2.59 0.06 0.00 -0.13 0.00 0.00 55.73 58.49 1r3n s ARG 51 Cb -0.13 -3.17 0.08 0.00 -1.56 0.00 0.00 34.95 30.16 1r3n s ARG 51 CO 0.91 -0.76 0.79 -2.67 -0.81 0.00 0.00 175.30 172.76 1r3n n TRP 52 N 4.30 0.06 -3.83 5.12 2.14 -0.03 -4.98 117.44 120.22 1r3n n TRP 52 Ca 0.16 -0.11 -0.06 0.00 2.07 0.00 0.00 57.50 59.55 1r3n n TRP 52 Cb 0.36 -0.01 0.00 0.00 -0.81 0.00 0.00 31.31 30.85 1r3n n TRP 52 CO 0.00 0.00 0.00 0.20 2.07 0.00 0.00 177.69 179.96 1r3n s GLY 53 N -0.62 0.10 0.14 -1.67 0.00 -1.21 -5.05 107.32 99.02 1r3n s GLY 53 Ca 0.08 -0.41 0.26 0.00 0.00 0.00 0.00 44.72 44.65 1r3n s GLY 53 CO 0.08 0.25 1.79 -1.06 0.00 0.00 0.00 173.10 174.16 1r3n n GLN 54 N -0.53 0.16 -2.49 2.90 1.13 -1.26 -4.76 117.38 112.54 1r3n n GLN 54 Ca -0.06 0.18 -0.33 0.00 -1.94 0.00 0.00 57.00 54.85 1r3n n GLN 54 Cb 0.60 -1.71 -0.04 0.00 0.11 0.00 0.00 30.24 29.20 1r3n n GLN 54 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1r3n s GLU 55 N -3.09 3.88 0.58 -1.09 0.41 -1.26 -4.95 118.70 113.17 1r3n s GLU 55 Ca 0.11 1.16 0.38 0.00 -0.41 0.00 0.00 54.97 56.20 1r3n s GLU 55 Cb 0.14 -2.12 1.81 0.00 -1.78 0.00 0.00 34.13 32.18 1r3n s GLU 55 CO 0.53 -0.34 2.13 0.66 -0.49 0.00 0.00 175.26 177.75 1r3n h SER 56 N 1.28 0.00 -0.08 -0.19 4.64 -2.03 -2.18 113.55 115.00 1r3n h SER 56 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1r3n h SER 56 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1r3n h SER 56 CO 0.60 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.56 1r3n n HIS 57 N -3.00 0.07 -2.32 4.77 1.44 -1.26 -4.80 115.22 110.12 1r3n n HIS 57 Ca -0.01 -0.04 -0.41 0.00 -2.01 0.00 0.00 57.72 55.26 1r3n n HIS 57 Cb 0.19 -0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.30 1r3n n HIS 57 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1r3n n GLU 58 N 1.31 4.78 -4.06 -1.40 1.02 -0.82 -4.87 120.64 116.60 1r3n n GLU 58 Ca 0.14 -3.95 -0.10 0.00 -0.02 0.00 0.00 57.16 53.23 1r3n n GLU 58 Cb 0.58 -2.60 -0.07 0.00 -0.02 0.00 0.00 31.44 29.33 1r3n n GLU 58 CO 0.00 0.00 0.00 -0.59 1.18 0.00 0.00 177.13 177.72 1r3n s PHE 59 N -2.18 0.61 0.36 -0.32 -0.12 -1.26 -0.85 117.98 114.21 1r3n s PHE 59 Ca 0.46 -0.93 0.01 0.00 -0.05 0.00 0.00 56.93 56.42 1r3n s PHE 59 Cb 0.17 -0.06 0.01 0.00 -0.63 0.00 0.00 43.02 42.51 1r3n s PHE 59 CO -0.08 -0.87 0.09 0.41 -0.05 0.00 0.00 175.22 174.73 1r3n n GLY 60 N -0.34 3.45 3.27 1.99 0.00 -0.37 -4.77 105.19 108.43 1r3n n GLY 60 Ca -0.01 -2.30 -0.25 0.00 0.00 0.00 0.00 46.02 43.46 1r3n n GLY 60 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1r3n s MET 61 N -3.35 1.32 -0.30 1.61 -1.94 -0.03 -0.52 119.30 116.08 1r3n s MET 61 Ca 0.07 -1.03 -0.01 0.00 -1.71 0.00 0.00 55.69 53.01 1r3n s MET 61 Cb -0.01 -1.50 0.13 0.00 2.01 0.00 0.00 34.83 35.46 1r3n s MET 61 CO 0.05 0.37 0.25 0.50 -0.01 0.00 0.00 175.02 176.18 1r3n s ARG 62 N -1.45 0.32 -0.44 2.03 3.52 0.10 -1.72 118.95 121.31 1r3n s ARG 62 Ca 0.07 -0.38 0.03 0.00 -0.13 0.00 0.00 55.73 55.33 1r3n s ARG 62 Cb -0.09 -0.84 0.15 0.00 -1.56 0.00 0.00 34.95 32.61 1r3n s ARG 62 CO 0.03 -1.05 0.31 0.50 -0.81 0.00 0.00 175.30 174.27 1r3n s ARG 63 N 2.14 1.10 0.48 5.12 3.52 -1.26 -4.58 118.95 125.48 1r3n s ARG 63 Ca 0.10 -2.05 -0.19 0.00 -0.13 0.00 0.00 55.73 53.46 1r3n s ARG 63 Cb -0.15 -1.86 -0.09 0.00 -1.56 0.00 0.00 34.95 31.30 1r3n s ARG 63 CO -0.30 -1.28 0.99 -0.51 -0.81 0.00 0.00 175.30 173.39 1r3n s LEU 64 N 0.18 3.80 0.24 -0.88 1.43 -1.26 0.16 118.68 122.35 1r3n s LEU 64 Ca 0.25 1.74 -0.31 0.00 -1.03 0.00 0.00 54.13 54.79 1r3n s LEU 64 Cb -0.10 -4.54 -0.11 0.00 0.03 0.00 0.00 46.19 41.47 1r3n s LEU 64 CO -0.10 -0.62 1.57 0.00 0.23 0.00 0.00 176.35 177.43 1r3n s ALA 65 N -2.25 3.75 -0.17 4.21 0.00 -1.26 -2.66 121.76 123.38 1r3n s ALA 65 Ca 0.63 1.47 0.00 0.00 0.00 0.00 0.00 51.96 54.06 1r3n s ALA 65 Cb -0.12 -3.63 0.00 0.00 0.00 0.00 0.00 23.12 19.37 1r3n s ALA 65 CO 0.22 -0.87 0.00 0.41 0.00 0.00 0.00 175.76 175.52 1r3n n GLY 66 N 2.76 0.43 3.94 0.00 0.00 -1.26 -4.93 105.19 106.12 1r3n n GLY 66 Ca 0.10 -0.11 -0.27 0.00 0.00 0.00 0.00 46.02 45.74 1r3n n GLY 66 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1r3n s THR 67 N -1.71 2.17 0.28 2.61 -4.23 -1.09 -4.63 115.64 109.04 1r3n s THR 67 Ca 0.00 -0.23 0.02 0.00 -1.18 0.00 0.00 61.69 60.30 1r3n s THR 67 Cb 0.00 -2.94 0.27 0.00 1.34 0.00 0.00 72.50 71.18 1r3n s THR 67 CO 0.00 0.00 1.78 0.00 -0.54 0.00 0.00 174.62 175.86 1r3n h ALA 68 N -0.85 1.49 -0.07 3.99 0.00 -1.95 -1.77 119.26 120.10 1r3n h ALA 68 Ca -0.43 0.07 -0.17 0.00 0.00 0.00 0.00 54.91 54.37 1r3n h ALA 68 Cb 1.29 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 1r3n h ALA 68 CO 0.54 -0.00 -0.69 -0.07 0.00 0.00 0.00 179.25 179.02 1r3n h LEU 69 N 0.76 0.37 -0.12 0.00 3.38 -1.94 -2.34 115.31 115.44 1r3n h LEU 69 Ca 0.52 -0.24 0.03 0.00 0.09 0.00 0.00 57.88 58.28 1r3n h LEU 69 Cb 0.72 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.33 1r3n h LEU 69 CO -0.35 0.95 -0.07 -0.78 0.09 0.00 0.00 178.44 178.29 1r3n h ASP 70 N 0.22 -0.22 -0.71 -0.43 3.58 -1.55 -2.02 116.42 115.29 1r3n h ASP 70 Ca -0.02 0.05 -0.05 0.00 0.42 0.00 0.00 57.03 57.43 1r3n h ASP 70 Cb 1.25 0.12 -0.03 0.00 1.72 0.00 0.00 39.33 42.38 1r3n h ASP 70 CO 0.11 -0.09 0.27 1.23 -2.88 0.00 0.00 179.24 177.88 1r3n h GLY 71 N -0.06 1.17 0.96 -0.78 0.00 -1.34 -1.86 103.07 101.16 1r3n h GLY 71 Ca 0.07 -0.65 -0.02 0.00 0.00 0.00 0.00 47.33 46.74 1r3n h GLY 71 CO -0.16 0.61 0.21 0.00 0.00 0.00 0.00 176.54 177.20 1r3n h ALA 72 N 1.23 0.59 -0.47 3.60 0.00 -1.21 0.12 119.26 123.12 1r3n h ALA 72 Ca 0.24 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.93 1r3n h ALA 72 Cb 0.24 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1r3n h ALA 72 CO -0.02 0.15 -0.13 1.98 0.00 0.00 0.00 179.25 181.23 1r3n h MET 73 N 0.59 0.87 -0.60 0.00 -1.53 -1.24 -1.47 114.93 111.56 1r3n h MET 73 Ca 0.16 -0.31 -0.04 0.00 -3.44 0.00 0.00 59.70 56.06 1r3n h MET 73 Cb 0.13 -0.06 -0.03 0.00 -0.55 0.00 0.00 31.60 31.09 1r3n h MET 73 CO -0.02 0.95 0.21 0.00 0.14 0.00 0.00 176.91 178.19 1r3n h ARG 74 N 0.78 0.91 -0.02 0.39 3.08 -1.04 -0.04 114.38 118.43 1r3n h ARG 74 Ca 0.12 -0.18 0.01 0.00 0.07 0.00 0.00 59.98 60.00 1r3n h ARG 74 Cb 0.65 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.55 1r3n h ARG 74 CO 0.05 0.80 -0.03 -0.44 -1.07 0.00 0.00 179.97 179.27 1r3n h ASP 75 N 0.84 -0.10 -0.52 7.04 5.19 -0.58 -0.58 116.42 127.71 1r3n h ASP 75 Ca 0.19 0.02 0.06 0.00 -0.62 0.00 0.00 57.03 56.69 1r3n h ASP 75 Cb 0.25 0.05 -0.06 0.00 0.18 0.00 0.00 39.33 39.76 1r3n h ASP 75 CO -0.01 -0.05 0.21 -0.25 -3.12 0.00 0.00 179.24 176.02 1r3n h TRP 76 N -0.05 0.38 -0.55 4.55 7.01 -0.95 -1.72 115.95 124.62 1r3n h TRP 76 Ca 0.02 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.03 1r3n h TRP 76 Cb 0.08 -0.09 -0.03 0.00 -2.10 0.00 0.00 29.16 27.02 1r3n h TRP 76 CO -0.12 0.14 0.26 0.35 -2.79 0.00 0.00 178.44 176.29 1r3n h PHE 77 N 0.41 0.79 -0.39 2.65 3.57 -0.68 -2.00 116.94 121.29 1r3n h PHE 77 Ca 0.25 -0.04 -0.10 0.00 3.53 0.00 0.00 57.97 61.61 1r3n h PHE 77 Cb 0.24 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 38.72 1r3n h PHE 77 CO -0.14 0.61 -0.15 1.79 -2.23 0.00 0.00 178.31 178.19 1r3n h THR 78 N 0.74 1.26 -0.46 4.41 1.35 -0.77 -2.33 112.91 117.11 1r3n h THR 78 Ca 0.19 -1.21 -0.01 0.00 -0.55 0.00 0.00 66.41 64.83 1r3n h THR 78 Cb 0.12 1.12 -0.02 0.00 -1.73 0.00 0.00 68.15 67.64 1r3n h THR 78 CO -0.02 0.41 0.22 0.78 -0.25 0.00 0.00 175.52 176.65 1r3n h ASN 79 N 0.65 0.57 -0.09 5.36 2.35 -1.06 -1.26 115.58 122.09 1r3n h ASN 79 Ca 0.10 -0.05 -0.05 0.00 -0.55 0.00 0.00 56.30 55.76 1r3n h ASN 79 Cb 0.62 -0.14 -0.00 0.00 0.05 0.00 0.00 38.32 38.85 1r3n h ASN 79 CO 0.04 0.49 -0.15 -0.33 -1.65 0.00 0.00 177.43 175.83 1r3n h GLU 80 N 0.64 0.26 -0.53 0.81 4.39 -1.08 -2.98 114.58 116.08 1r3n h GLU 80 Ca 0.16 -0.16 -0.09 0.00 0.34 0.00 0.00 59.36 59.61 1r3n h GLU 80 Cb 0.07 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.71 1r3n h GLU 80 CO -0.02 0.73 -0.04 0.00 -1.16 0.00 0.00 179.01 178.52 1r3n h GLU 82 N 0.86 0.86 0.00 0.00 5.08 -1.32 -1.56 114.58 118.51 1r3n h GLU 82 Ca 0.15 -0.27 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 1r3n h GLU 82 Cb 0.56 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.73 1r3n h GLU 82 CO 0.03 0.90 0.00 -1.13 -1.00 0.00 0.00 179.01 177.81 1r3n n SER 83 N -4.18 0.42 0.07 1.42 3.41 -1.08 -1.31 113.62 112.37 1r3n n SER 83 Ca 0.02 0.61 0.12 0.00 -0.26 0.00 0.00 58.87 59.35 1r3n n SER 83 Cb 0.35 -0.70 0.06 0.00 -0.26 0.00 0.00 64.21 63.66 1r3n n SER 83 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1r3n n LEU 84 N -1.97 0.71 0.00 1.04 4.77 -0.68 -4.96 117.00 115.91 1r3n n LEU 84 Ca 0.02 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 1r3n n LEU 84 Cb 0.20 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 1r3n n LEU 84 CO 0.17 -0.08 0.00 0.61 -1.33 0.00 0.00 177.39 176.76 1r3n n GLY 85 N 1.29 1.12 3.78 -0.72 0.00 -0.43 -5.03 105.19 105.19 1r3n n GLY 85 Ca 0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 1r3n n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r3n s LYS 87 N -3.53 4.11 -0.56 0.00 2.20 -0.75 -4.45 119.74 116.76 1r3n s LYS 87 Ca 0.70 0.02 -0.14 0.00 -0.36 0.00 0.00 55.97 56.19 1r3n s LYS 87 Cb -0.22 -3.56 0.14 0.00 -1.51 0.00 0.00 37.83 32.69 1r3n s LYS 87 CO 0.30 -0.04 0.49 0.08 -0.36 0.00 0.00 175.35 175.82 1r3n s VAL 88 N 1.34 4.97 0.15 4.02 1.01 -1.26 -0.36 120.40 130.26 1r3n s VAL 88 Ca 0.14 -1.71 -0.24 0.00 0.00 0.00 0.00 61.98 60.18 1r3n s VAL 88 Cb -0.14 -4.20 -0.08 0.00 0.00 0.00 0.00 36.38 31.96 1r3n s VAL 88 CO 0.07 -0.86 0.74 -0.54 0.00 0.00 0.00 175.10 174.50 1r3n s LYS 89 N 1.35 4.50 -0.12 2.72 1.02 0.67 -4.89 119.74 125.00 1r3n s LYS 89 Ca 0.06 1.08 0.03 0.00 0.02 0.00 0.00 55.97 57.15 1r3n s LYS 89 Cb -0.27 -3.26 0.01 0.00 -0.52 0.00 0.00 37.83 33.79 1r3n s LYS 89 CO 0.01 0.59 -0.21 0.08 -0.92 0.00 0.00 175.35 174.89 1r3n s VAL 90 N -1.14 1.90 0.68 3.17 1.01 -1.26 0.09 120.40 124.84 1r3n s VAL 90 Ca 0.34 -0.90 0.02 0.00 0.00 0.00 0.00 61.98 61.44 1r3n s VAL 90 Cb -0.22 -1.67 0.11 0.00 0.00 0.00 0.00 36.38 34.60 1r3n s VAL 90 CO 0.25 0.52 0.93 1.51 0.00 0.00 0.00 175.10 178.31 1r3n s ASP 91 N 0.68 4.57 0.63 3.32 1.47 -0.29 -1.77 116.67 125.27 1r3n s ASP 91 Ca -0.12 -0.47 0.35 0.00 1.18 0.00 0.00 52.55 53.49 1r3n s ASP 91 Cb -0.16 0.02 1.96 0.00 -0.34 0.00 0.00 42.92 44.40 1r3n s ASP 91 CO 0.02 -1.70 2.21 0.11 0.68 0.00 0.00 175.17 176.49 1r3n h LYS 92 N -0.33 0.00 -0.21 2.11 1.79 -1.41 -1.51 116.57 117.01 1r3n h LYS 92 Ca -0.35 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.12 1r3n h LYS 92 Cb 1.27 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.92 1r3n h LYS 92 CO 0.41 0.00 0.00 1.51 -1.08 0.00 0.00 179.45 180.29 1r3n n ILE 93 N -3.45 0.37 -0.10 1.86 0.00 -1.26 -4.36 119.36 112.41 1r3n n ILE 93 Ca -0.02 -0.68 0.00 0.00 0.00 0.00 0.00 62.75 62.05 1r3n n ILE 93 Cb 0.19 1.04 0.00 0.00 0.00 0.00 0.00 39.64 40.87 1r3n n ILE 93 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1r3n n GLY 94 N 1.00 0.86 3.75 4.50 0.00 -0.63 -4.75 105.19 109.93 1r3n n GLY 94 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 1r3n n GLY 94 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1r3n s ASN 95 N -2.21 7.08 -0.10 1.61 0.01 -1.26 -4.38 114.94 115.69 1r3n s ASN 95 Ca 0.00 2.33 -0.01 0.00 -0.71 0.00 0.00 52.86 54.47 1r3n s ASN 95 Cb 0.00 -2.62 -0.03 0.00 0.41 0.00 0.00 41.25 39.01 1r3n s ASN 95 CO 0.00 -0.33 -0.04 -0.04 -1.51 0.00 0.00 177.10 175.17 1r3n s MET 96 N -0.89 3.11 -0.25 -0.60 -1.94 -0.42 -1.14 119.30 117.17 1r3n s MET 96 Ca 0.50 -0.51 0.01 0.00 -1.71 0.00 0.00 55.69 53.97 1r3n s MET 96 Cb -0.34 -2.74 0.07 0.00 2.01 0.00 0.00 34.83 33.83 1r3n s MET 96 CO 0.41 0.53 -0.01 -0.06 -0.01 0.00 0.00 175.02 175.87 1r3n s PHE 97 N -0.43 2.33 -0.74 -0.03 0.40 0.11 -1.24 117.98 118.39 1r3n s PHE 97 Ca 0.07 -1.81 -0.18 0.00 -0.60 0.00 0.00 56.93 54.40 1r3n s PHE 97 Cb -0.12 -1.70 0.13 0.00 0.51 0.00 0.00 43.02 41.84 1r3n s PHE 97 CO 0.02 -0.79 0.86 0.00 0.70 0.00 0.00 175.22 176.01 1r3n s ALA 98 N 1.41 3.49 -0.28 5.36 0.00 -0.32 -0.23 121.76 131.19 1r3n s ALA 98 Ca -0.01 -2.54 -0.22 0.00 0.00 0.00 0.00 51.96 49.18 1r3n s ALA 98 Cb -0.18 -3.70 -0.01 0.00 0.00 0.00 0.00 23.12 19.22 1r3n s ALA 98 CO -0.09 -2.55 0.72 0.08 0.00 0.00 0.00 175.76 173.92 1r3n s VAL 99 N 2.36 4.88 -0.23 0.00 1.01 0.51 -2.06 120.40 126.86 1r3n s VAL 99 Ca 0.19 1.16 -0.11 0.00 0.00 0.00 0.00 61.98 63.22 1r3n s VAL 99 Cb -0.16 -4.06 -0.05 0.00 0.00 0.00 0.00 36.38 32.12 1r3n s VAL 99 CO -0.01 -0.13 0.19 -0.47 0.00 0.00 0.00 175.10 174.68 1r3n s TYR 100 N 2.75 3.34 0.05 5.22 5.04 0.12 -1.81 117.35 132.07 1r3n s TYR 100 Ca 0.30 0.30 -0.31 0.00 -2.44 0.00 0.00 57.07 54.92 1r3n s TYR 100 Cb -0.15 -2.29 -0.06 0.00 0.35 0.00 0.00 41.96 39.81 1r3n s TYR 100 CO 0.10 0.10 1.35 -1.25 -1.34 0.00 0.00 175.55 174.51 1r3n s PRO 101 N 0.95 4.33 0.00 4.97 0.04 -1.26 -1.72 135.00 142.30 1r3n s PRO 101 Ca 0.09 1.95 0.00 0.00 0.04 0.00 0.00 61.00 63.08 1r3n s PRO 101 Cb -0.13 -3.41 0.00 0.00 0.04 0.00 0.00 34.50 31.00 1r3n s PRO 101 CO 0.04 -0.45 0.00 0.41 0.04 0.00 0.00 177.00 177.03 1r3n n GLY 102 N 3.49 0.94 0.14 0.56 0.00 -1.26 -4.67 105.19 104.39 1r3n n GLY 102 Ca 0.12 -1.96 -0.22 0.00 0.00 0.00 0.00 46.02 43.96 1r3n n GLY 102 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1r3n h LYS 103 N 0.00 0.42 0.00 1.61 3.11 -0.68 -3.43 116.57 117.60 1r3n h LYS 103 Ca 0.00 -0.73 -0.31 0.00 -2.81 0.00 0.00 60.65 56.80 1r3n h LYS 103 Cb 0.00 0.27 -0.05 0.00 -1.00 0.00 0.00 32.23 31.45 1r3n h LYS 103 CO 0.00 1.33 -1.98 0.09 -2.81 0.00 0.00 179.45 176.09 1r3n n ASN 104 N -3.62 1.94 0.00 4.20 3.02 0.32 -5.00 115.26 116.12 1r3n n ASN 104 Ca -0.18 0.35 0.00 0.00 -0.03 0.00 0.00 54.58 54.73 1r3n n ASN 104 Cb 1.08 -0.81 0.00 0.00 -0.61 0.00 0.00 39.78 39.44 1r3n n ASN 104 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1r3n n GLY 105 N 1.33 0.81 5.91 7.41 0.00 -1.26 -5.02 105.19 114.37 1r3n n GLY 105 Ca -0.41 -0.72 0.01 0.00 0.00 0.00 0.00 46.02 44.89 1r3n n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r3n n GLY 106 N 0.00 -0.19 3.76 -0.02 0.00 -1.26 -3.27 105.19 104.21 1r3n n GLY 106 Ca 0.00 -0.18 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 1r3n n GLY 106 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1r3n s LYS 107 N -0.20 4.36 0.51 1.61 1.02 -1.26 -4.73 119.74 121.05 1r3n s LYS 107 Ca 0.00 2.18 -0.21 0.00 0.02 0.00 0.00 55.97 57.95 1r3n s LYS 107 Cb 0.00 -3.12 -0.06 0.00 -0.52 0.00 0.00 37.83 34.13 1r3n s LYS 107 CO 0.00 -0.24 1.19 -1.25 -0.92 0.00 0.00 175.35 174.13 1r3n s PRO 108 N -1.04 3.47 -0.22 -1.68 0.04 -1.26 -4.27 135.00 130.05 1r3n s PRO 108 Ca 0.53 1.81 -0.29 0.00 0.04 0.00 0.00 61.00 63.09 1r3n s PRO 108 Cb -0.39 -2.23 -0.00 0.00 0.04 0.00 0.00 34.50 31.91 1r3n s PRO 108 CO 0.47 -0.80 1.20 0.99 0.04 0.00 0.00 177.00 178.89 1r3n s THR 109 N -1.56 4.38 -0.05 1.26 2.01 -0.16 -0.19 115.64 121.33 1r3n s THR 109 Ca 0.69 1.64 -0.04 0.00 0.31 0.00 0.00 61.69 64.29 1r3n s THR 109 Cb -0.30 -4.14 -0.04 0.00 0.01 0.00 0.00 72.50 68.03 1r3n s THR 109 CO 0.35 -0.24 0.16 0.00 -0.69 0.00 0.00 174.62 174.20 1r3n s ALA 110 N 3.59 3.91 -0.01 7.40 0.00 -0.53 -1.06 121.76 135.05 1r3n s ALA 110 Ca 0.51 -0.73 0.04 0.00 0.00 0.00 0.00 51.96 51.78 1r3n s ALA 110 Cb -0.18 -1.90 -0.01 0.00 0.00 0.00 0.00 23.12 21.03 1r3n s ALA 110 CO 0.14 0.70 -0.12 -0.08 0.00 0.00 0.00 175.76 176.41 1r3n s THR 111 N -1.22 0.95 0.08 0.00 -1.32 0.23 -0.96 115.64 113.40 1r3n s THR 111 Ca 0.23 -0.50 -0.27 0.00 -1.21 0.00 0.00 61.69 59.95 1r3n s THR 111 Cb -0.12 -0.80 0.09 0.00 -1.51 0.00 0.00 72.50 70.16 1r3n s THR 111 CO 0.14 0.27 1.13 -0.83 -2.21 0.00 0.00 174.62 173.12 1r3n s GLY 112 N -0.17 -0.22 0.00 6.08 0.00 -0.87 -0.05 107.32 112.08 1r3n s GLY 112 Ca 0.03 0.24 0.00 0.00 0.00 0.00 0.00 44.72 44.98 1r3n s GLY 112 CO -0.00 1.07 0.00 -1.26 0.00 0.00 0.00 173.10 172.91 1r3n n SER 113 N -0.68 0.47 -4.27 1.64 2.88 -0.91 -4.49 113.62 108.25 1r3n n SER 113 Ca -0.05 0.00 -0.24 0.00 -1.33 0.00 0.00 58.87 57.25 1r3n n SER 113 Cb 0.61 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.94 1r3n n SER 113 CO 0.00 0.00 0.00 -1.38 -1.23 0.00 0.00 175.04 172.43 1r3n s HIS 114 N -0.81 1.75 -0.04 0.66 -3.43 -1.25 -1.33 115.29 110.84 1r3n s HIS 114 Ca 0.00 -0.41 0.22 0.00 -0.80 0.00 0.00 55.06 54.07 1r3n s HIS 114 Cb 0.00 -0.97 -0.32 0.00 -1.43 0.00 0.00 32.58 29.85 1r3n s HIS 114 CO 0.00 0.18 0.50 1.28 -2.00 0.00 0.00 174.74 174.70 1r3n n LEU 115 N 1.22 0.04 -4.84 5.38 4.77 -1.26 -2.43 117.00 119.88 1r3n n LEU 115 Ca -0.19 0.02 -0.32 0.00 -0.03 0.00 0.00 56.01 55.48 1r3n n LEU 115 Cb 0.54 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.60 1r3n n LEU 115 CO 0.22 -0.01 0.69 1.51 -1.33 0.00 0.00 177.39 178.48 1r3n s ASP 116 N -4.57 6.44 0.44 -1.43 -4.77 -1.26 -4.84 116.67 106.68 1r3n s ASP 116 Ca -0.08 1.60 0.04 0.00 -3.30 0.00 0.00 52.55 50.82 1r3n s ASP 116 Cb 0.14 -2.51 -0.05 0.00 -1.09 0.00 0.00 42.92 39.41 1r3n s ASP 116 CO 0.90 -0.71 0.02 0.42 0.70 0.00 0.00 175.17 176.50 1r3n s THR 117 N -2.64 1.47 0.83 2.11 -4.23 0.12 -4.77 115.64 108.53 1r3n s THR 117 Ca 0.59 -2.00 -0.12 0.00 -1.18 0.00 0.00 61.69 58.99 1r3n s THR 117 Cb -0.11 -2.60 0.09 0.00 1.34 0.00 0.00 72.50 71.22 1r3n s THR 117 CO 0.34 0.00 1.12 -1.10 -0.54 0.00 0.00 174.62 174.44 1r3n s GLN 118 N -3.79 1.79 0.30 3.99 -1.52 -1.26 -4.50 119.66 114.66 1r3n s GLN 118 Ca 0.23 0.42 -0.02 0.00 -1.95 0.00 0.00 55.36 54.04 1r3n s GLN 118 Cb 0.06 -1.90 0.45 0.00 -0.22 0.00 0.00 33.01 31.40 1r3n s GLN 118 CO 0.12 -1.78 1.95 -1.35 -0.25 0.00 0.00 175.29 173.98 1r3n h PRO 119 N -1.20 1.09 -4.30 2.91 0.11 -1.96 -3.33 132.00 125.31 1r3n h PRO 119 Ca -0.48 -0.07 -0.65 0.00 0.11 0.00 0.00 66.00 64.91 1r3n h PRO 119 Cb 1.30 -0.25 -0.40 0.00 0.11 0.00 0.00 31.00 31.76 1r3n h PRO 119 CO 0.62 0.72 -0.70 -2.00 -0.21 0.00 0.00 178.00 176.42 1r3n s GLU 120 N -5.94 1.53 0.31 1.05 -6.30 -1.26 -4.61 118.70 103.48 1r3n s GLU 120 Ca -0.12 -1.98 0.04 0.00 -2.50 0.00 0.00 54.97 50.41 1r3n s GLU 120 Cb 0.18 -3.13 -0.06 0.00 0.00 0.00 0.00 34.13 31.12 1r3n s GLU 120 CO 0.80 -0.98 0.05 0.00 0.02 0.00 0.00 175.26 175.15 1r3n s ALA 121 N 0.69 2.26 0.52 6.30 0.00 -0.70 -2.91 121.76 127.92 1r3n s ALA 121 Ca 0.12 -2.02 0.05 0.00 0.00 0.00 0.00 51.96 50.12 1r3n s ALA 121 Cb -0.20 0.67 0.04 0.00 0.00 0.00 0.00 23.12 23.63 1r3n s ALA 121 CO -0.07 -0.31 0.72 0.20 0.00 0.00 0.00 175.76 176.29 1r3n s GLY 122 N -3.46 1.86 0.00 0.00 0.00 -1.05 -0.85 107.32 103.82 1r3n s GLY 122 Ca 0.36 -1.64 0.28 0.00 0.00 0.00 0.00 44.72 43.72 1r3n s GLY 122 CO 0.15 -1.34 1.78 0.28 0.00 0.00 0.00 173.10 173.97 1r3n n LYS 123 N -2.18 0.42 -0.05 2.90 5.02 -1.26 -4.38 118.16 118.63 1r3n n LYS 123 Ca 0.10 -0.15 -0.06 0.00 -2.02 0.00 0.00 58.31 56.18 1r3n n LYS 123 Cb 0.60 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 34.04 1r3n n LYS 123 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1r3n n TYR 124 N -1.16 0.00 -1.87 2.13 4.02 -1.26 -4.67 117.16 114.35 1r3n n TYR 124 Ca 0.11 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.58 1r3n n TYR 124 Cb 0.30 -0.46 -0.03 0.00 -0.02 0.00 0.00 39.34 39.13 1r3n n TYR 124 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1r3n s ASP 125 N -4.49 6.54 0.00 7.72 3.68 -1.26 -1.34 116.67 127.52 1r3n s ASP 125 Ca -0.08 2.63 0.00 0.00 2.13 0.00 0.00 52.55 57.23 1r3n s ASP 125 Cb 0.03 -2.58 0.00 0.00 -1.45 0.00 0.00 42.92 38.92 1r3n s ASP 125 CO 0.35 -0.89 0.00 0.61 0.13 0.00 0.00 175.17 175.37 1r3n n GLY 126 N 3.94 0.97 0.29 2.66 0.00 -1.26 -4.54 105.19 107.25 1r3n n GLY 126 Ca 0.15 -0.01 0.09 0.00 0.00 0.00 0.00 46.02 46.26 1r3n n GLY 126 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1r3n h ILE 127 N 0.00 0.47 -0.20 -0.61 1.08 -1.47 -2.30 117.51 114.48 1r3n h ILE 127 Ca 0.00 -0.10 0.06 0.00 -0.39 0.00 0.00 64.86 64.42 1r3n h ILE 127 Cb 0.00 0.14 -0.07 0.00 -3.07 0.00 0.00 36.82 33.82 1r3n h ILE 127 CO 0.00 0.06 -0.31 0.25 -0.69 0.00 0.00 178.15 177.46 1r3n h LEU 128 N 0.30 -0.98 -0.91 1.44 5.85 -1.45 -0.50 115.31 119.06 1r3n h LEU 128 Ca 0.48 0.15 -0.05 0.00 0.84 0.00 0.00 57.88 59.31 1r3n h LEU 128 Cb 0.88 0.43 -0.03 0.00 0.37 0.00 0.00 40.66 42.31 1r3n h LEU 128 CO -0.54 -0.34 0.25 1.23 -0.34 0.00 0.00 178.44 178.70 1r3n h GLY 129 N -0.35 1.13 0.57 3.75 0.00 -1.12 0.74 103.07 107.79 1r3n h GLY 129 Ca 0.12 -0.62 -0.01 0.00 0.00 0.00 0.00 47.33 46.82 1r3n h GLY 129 CO -0.39 0.59 -0.05 -2.08 0.00 0.00 0.00 176.54 174.60 1r3n h VAL 130 N 1.02 1.09 0.00 4.60 2.07 -1.22 -0.99 116.25 122.82 1r3n h VAL 130 Ca 0.23 -0.90 -0.05 0.00 0.82 0.00 0.00 66.70 66.80 1r3n h VAL 130 Cb 0.24 1.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.65 1r3n h VAL 130 CO -0.02 0.21 -0.25 -0.07 0.02 0.00 0.00 177.57 177.47 1r3n h LEU 131 N -0.58 0.00 -0.53 2.57 3.38 -1.06 -1.20 115.31 117.89 1r3n h LEU 131 Ca -0.02 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.79 1r3n h LEU 131 Cb 0.46 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 1r3n h LEU 131 CO 0.02 0.25 -0.71 0.00 0.09 0.00 0.00 178.44 178.10 1r3n h ALA 132 N 1.75 0.75 -0.46 1.53 0.00 -0.81 -0.78 119.26 121.23 1r3n h ALA 132 Ca -0.00 -0.62 -0.02 0.00 0.00 0.00 0.00 54.91 54.27 1r3n h ALA 132 Cb 0.87 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 1r3n h ALA 132 CO 0.03 0.82 0.22 0.78 0.00 0.00 0.00 179.25 181.10 1r3n h GLY 133 N 1.74 0.72 1.01 0.00 0.00 -0.26 -2.18 103.07 104.10 1r3n h GLY 133 Ca -0.02 -0.36 0.01 0.00 0.00 0.00 0.00 47.33 46.96 1r3n h GLY 133 CO 0.10 0.34 0.60 -2.00 0.00 0.00 0.00 176.54 175.58 1r3n h LEU 134 N 0.61 1.05 -1.41 3.11 5.85 -1.05 -2.40 115.31 121.07 1r3n h LEU 134 Ca 0.16 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 1r3n h LEU 134 Cb 0.12 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.87 1r3n h LEU 134 CO -0.02 0.76 0.22 -0.08 -0.34 0.00 0.00 178.44 178.98 1r3n h GLU 135 N 1.23 0.62 -0.60 1.25 4.57 -0.90 0.10 114.58 120.86 1r3n h GLU 135 Ca 0.33 -0.07 -0.08 0.00 -1.18 0.00 0.00 59.36 58.37 1r3n h GLU 135 Cb -0.14 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 28.30 1r3n h GLU 135 CO -0.07 0.48 0.06 0.28 -1.18 0.00 0.00 179.01 178.58 1r3n h VAL 136 N 0.63 1.26 -0.08 0.32 2.07 -0.89 0.81 116.25 120.36 1r3n h VAL 136 Ca 0.16 -1.04 -0.24 0.00 0.82 0.00 0.00 66.70 66.40 1r3n h VAL 136 Cb 0.06 0.73 0.01 0.00 -1.52 0.00 0.00 31.29 30.57 1r3n h VAL 136 CO -0.02 0.38 -0.89 -0.07 0.02 0.00 0.00 177.57 176.99 1r3n h LEU 137 N 0.94 0.89 -1.18 2.57 3.38 -1.13 -1.49 115.31 119.28 1r3n h LEU 137 Ca 0.18 -0.64 0.04 0.00 0.09 0.00 0.00 57.88 57.56 1r3n h LEU 137 Cb 0.46 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.89 1r3n h LEU 137 CO 0.02 1.43 0.57 0.03 0.09 0.00 0.00 178.44 180.58 1r3n h ARG 138 N 0.45 1.01 -0.17 1.13 3.08 -0.58 -1.99 114.38 117.31 1r3n h ARG 138 Ca -0.08 -0.06 -0.18 0.00 0.07 0.00 0.00 59.98 59.72 1r3n h ARG 138 Cb 1.53 -0.23 0.01 0.00 0.08 0.00 0.00 29.97 31.36 1r3n h ARG 138 CO 0.18 0.67 -0.61 1.15 -1.07 0.00 0.00 179.97 180.28 1r3n h THR 139 N 1.04 1.31 -0.87 2.04 2.02 -0.77 -1.69 112.91 115.99 1r3n h THR 139 Ca 0.35 -1.84 0.03 0.00 0.77 0.00 0.00 66.41 65.73 1r3n h THR 139 Cb 0.08 1.96 -0.05 0.00 -1.74 0.00 0.00 68.15 68.40 1r3n h THR 139 CO -0.11 0.58 0.56 -0.26 0.37 0.00 0.00 175.52 176.66 1r3n h PHE 140 N 0.42 1.05 -0.01 3.16 0.05 -1.02 -0.53 116.94 120.07 1r3n h PHE 140 Ca -0.03 0.03 -0.00 0.00 3.82 0.00 0.00 57.97 61.79 1r3n h PHE 140 Cb 1.24 -0.35 -0.00 0.00 2.00 0.00 0.00 35.95 38.84 1r3n h PHE 140 CO 0.09 0.60 0.00 -0.22 -0.18 0.00 0.00 178.31 178.61 1r3n h LYS 141 N 1.09 0.01 0.00 1.51 3.11 -1.33 0.21 116.57 121.17 1r3n h LYS 141 Ca 0.35 -0.00 -0.03 0.00 -2.81 0.00 0.00 60.65 58.16 1r3n h LYS 141 Cb 0.01 -0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 31.24 1r3n h LYS 141 CO -0.12 0.25 -0.14 -0.44 -2.81 0.00 0.00 179.45 176.20 1r3n h ASP 142 N -0.23 0.00 -0.21 4.20 3.45 -0.86 -1.32 116.42 121.45 1r3n h ASP 142 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 1r3n h ASP 142 Cb 0.25 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.02 1r3n h ASP 142 CO 0.00 0.14 0.00 0.59 -1.57 0.00 0.00 179.24 178.40 1r3n n ASN 143 N -4.05 3.23 -3.66 6.45 3.02 -0.25 -4.96 115.26 115.04 1r3n n ASN 143 Ca -0.02 -1.99 -0.28 0.00 -0.03 0.00 0.00 54.58 52.26 1r3n n ASN 143 Cb 0.22 -0.12 -0.01 0.00 -0.61 0.00 0.00 39.78 39.26 1r3n n ASN 143 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1r3n n ASN 144 N 1.42 -3.73 -4.65 6.41 3.02 -0.50 -4.93 115.26 112.30 1r3n n ASN 144 Ca 0.17 -0.60 -0.41 0.00 -0.03 0.00 0.00 54.58 53.71 1r3n n ASN 144 Cb 0.60 -3.06 -0.05 0.00 -0.61 0.00 0.00 39.78 36.66 1r3n n ASN 144 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1r3n s TYR 145 N -3.06 3.36 -0.28 3.10 6.14 0.65 -5.02 117.35 122.23 1r3n s TYR 145 Ca 0.53 1.01 -0.07 0.00 0.64 0.00 0.00 57.07 59.19 1r3n s TYR 145 Cb -0.28 -2.89 0.00 0.00 0.42 0.00 0.00 41.96 39.21 1r3n s TYR 145 CO 0.65 -0.25 0.07 0.14 0.64 0.00 0.00 175.55 176.80 1r3n s VAL 146 N 2.22 3.97 0.81 3.14 -7.23 -1.26 -4.64 120.40 117.41 1r3n s VAL 146 Ca 0.31 -0.59 -0.11 0.00 -1.81 0.00 0.00 61.98 59.78 1r3n s VAL 146 Cb -0.16 -3.00 0.08 0.00 0.56 0.00 0.00 36.38 33.86 1r3n s VAL 146 CO 0.10 0.15 1.10 -2.84 -0.31 0.00 0.00 175.10 173.30 1r3n s PRO 147 N 1.52 1.96 0.28 4.82 0.02 -1.26 -4.76 135.00 137.57 1r3n s PRO 147 Ca 0.03 1.18 -0.01 0.00 0.02 0.00 0.00 61.00 62.23 1r3n s PRO 147 Cb -0.17 -1.86 0.41 0.00 0.02 0.00 0.00 34.50 32.90 1r3n s PRO 147 CO 0.02 -1.86 1.82 -0.91 -0.33 0.00 0.00 177.00 175.74 1r3n h ASN 148 N -1.29 0.75 -3.45 2.53 2.35 -1.95 0.19 115.58 114.71 1r3n h ASN 148 Ca -0.44 -0.14 -0.44 0.00 -0.55 0.00 0.00 56.30 54.73 1r3n h ASN 148 Cb 1.24 -0.20 -0.14 0.00 0.05 0.00 0.00 38.32 39.28 1r3n h ASN 148 CO 0.50 0.75 -0.64 -0.31 -1.65 0.00 0.00 177.43 176.09 1r3n s TYR 149 N -5.16 1.81 0.60 1.19 1.51 -1.26 -0.52 117.35 115.52 1r3n s TYR 149 Ca -0.10 -0.91 -0.19 0.00 -1.01 0.00 0.00 57.07 54.87 1r3n s TYR 149 Cb 0.15 -1.11 -0.04 0.00 -0.11 0.00 0.00 41.96 40.85 1r3n s TYR 149 CO 0.80 0.03 1.07 -0.25 -1.11 0.00 0.00 175.55 176.09 1r3n n ASP 150 N -0.57 1.25 -4.10 2.29 8.00 -1.20 -4.11 116.55 118.10 1r3n n ASP 150 Ca -0.04 0.83 -0.23 0.00 0.71 0.00 0.00 54.79 56.07 1r3n n ASP 150 Cb 0.65 -1.44 -0.15 0.00 -0.02 0.00 0.00 41.12 40.15 1r3n n ASP 150 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1r3n s VAL 151 N -1.46 1.16 0.05 2.53 1.01 -0.70 -0.99 120.40 122.00 1r3n s VAL 151 Ca 0.77 -0.61 0.03 0.00 0.00 0.00 0.00 61.98 62.17 1r3n s VAL 151 Cb -0.41 -0.98 -0.03 0.00 0.00 0.00 0.00 36.38 34.96 1r3n s VAL 151 CO 0.46 0.33 -0.09 0.00 0.00 0.00 0.00 175.10 175.81 1r3n s VAL 153 N -1.55 5.14 -0.11 0.00 1.01 -0.88 -0.60 120.40 123.41 1r3n s VAL 153 Ca -0.07 0.09 -0.02 0.00 0.00 0.00 0.00 61.98 61.98 1r3n s VAL 153 Cb -0.09 -3.32 -0.03 0.00 0.00 0.00 0.00 36.38 32.94 1r3n s VAL 153 CO 0.00 0.46 -0.02 -0.69 0.00 0.00 0.00 175.10 174.86 1r3n s VAL 154 N 0.25 4.14 -0.33 2.92 1.01 0.93 -1.17 120.40 128.15 1r3n s VAL 154 Ca 0.06 -0.30 -0.02 0.00 0.00 0.00 0.00 61.98 61.72 1r3n s VAL 154 Cb -0.12 -2.76 0.07 0.00 0.00 0.00 0.00 36.38 33.57 1r3n s VAL 154 CO -0.01 0.56 0.06 -0.69 0.00 0.00 0.00 175.10 175.03 1r3n s VAL 155 N -0.44 3.12 0.12 2.92 1.01 -0.38 -2.15 120.40 124.60 1r3n s VAL 155 Ca 0.08 -1.56 -0.30 0.00 0.00 0.00 0.00 61.98 60.20 1r3n s VAL 155 Cb -0.12 -2.90 -0.06 0.00 0.00 0.00 0.00 36.38 33.30 1r3n s VAL 155 CO 0.02 -0.28 0.94 0.26 0.00 0.00 0.00 175.10 176.05 1r3n s TRP 156 N 1.23 3.83 0.21 5.22 0.52 -0.44 -1.30 118.94 128.21 1r3n s TRP 156 Ca -0.01 1.79 -0.30 0.00 0.02 0.00 0.00 56.10 57.61 1r3n s TRP 156 Cb -0.20 -3.03 -0.08 0.00 -1.15 0.00 0.00 33.47 29.00 1r3n s TRP 156 CO -0.02 0.24 1.14 0.12 0.02 0.00 0.00 176.95 178.46 1r3n s PHE 157 N -0.16 3.51 -1.07 -1.98 5.36 -1.26 -4.38 117.98 118.00 1r3n s PHE 157 Ca 0.46 1.55 -0.19 0.00 -0.96 0.00 0.00 56.93 57.78 1r3n s PHE 157 Cb -0.23 -3.35 0.01 0.00 -0.34 0.00 0.00 43.02 39.11 1r3n s PHE 157 CO 0.30 -0.86 0.72 -1.71 -1.46 0.00 0.00 175.22 172.20 1r3n n ASN 158 N 2.06 -5.08 0.07 6.13 5.15 -1.26 -0.73 115.26 121.60 1r3n n ASN 158 Ca 0.02 -1.02 -0.07 0.00 -0.60 0.00 0.00 54.58 52.91 1r3n n ASN 158 Cb 0.45 -2.65 0.08 0.00 -0.53 0.00 0.00 39.78 37.12 1r3n n ASN 158 CO 0.00 0.00 0.00 -0.08 1.40 0.00 0.00 177.26 178.58 1r3n h GLU 159 N -1.62 0.30 -0.01 1.20 4.22 -1.90 -2.17 114.58 114.61 1r3n h GLU 159 Ca -0.62 -0.23 -0.16 0.00 0.08 0.00 0.00 59.36 58.43 1r3n h GLU 159 Cb 1.36 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.63 1r3n h GLU 159 CO 0.45 0.86 -0.74 0.93 -2.18 0.00 0.00 179.01 178.34 1r3n h GLU 160 N 0.21 0.06 -3.99 1.92 4.39 -1.89 -0.63 114.58 114.66 1r3n h GLU 160 Ca -0.02 -0.06 -0.34 0.00 0.34 0.00 0.00 59.36 59.29 1r3n h GLU 160 Cb 1.21 0.01 0.06 0.00 -0.10 0.00 0.00 28.75 29.93 1r3n h GLU 160 CO 0.11 0.77 -0.51 0.41 -1.16 0.00 0.00 179.01 178.63 1r3n n GLY 161 N 0.58 -0.31 0.05 -3.84 0.00 -1.25 -4.68 105.19 95.75 1r3n n GLY 161 Ca -0.01 -0.01 -0.03 0.00 0.00 0.00 0.00 46.02 45.97 1r3n n GLY 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r3n h ALA 162 N 0.83 0.00 -0.28 4.61 0.00 -1.89 -3.39 119.26 119.15 1r3n h ALA 162 Ca -0.45 -0.35 -0.13 0.00 0.00 0.00 0.00 54.91 53.98 1r3n h ALA 162 Cb 1.30 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 19.40 1r3n h ALA 162 CO 0.47 0.31 -0.37 -0.09 0.00 0.00 0.00 179.25 179.57 1r3n h ARG 163 N -0.80 0.63 -5.19 0.00 2.43 -1.90 -3.41 114.38 106.13 1r3n h ARG 163 Ca 0.00 -0.31 -0.67 0.00 -0.81 0.00 0.00 59.98 58.20 1r3n h ARG 163 Cb 0.31 -0.00 -0.32 0.00 -0.42 0.00 0.00 29.97 29.54 1r3n h ARG 163 CO 0.00 0.90 -0.83 -0.06 -1.51 0.00 0.00 179.97 178.47 1r3n s PHE 164 N -4.32 2.74 -0.28 2.20 0.40 -1.26 -0.77 117.98 116.69 1r3n s PHE 164 Ca -0.08 -1.16 -0.05 0.00 -0.60 0.00 0.00 56.93 55.04 1r3n s PHE 164 Cb 0.12 -1.87 -0.16 0.00 0.51 0.00 0.00 43.02 41.63 1r3n s PHE 164 CO 0.83 -0.53 2.66 0.00 0.70 0.00 0.00 175.22 178.88 1r3n n ALA 165 N 4.09 5.05 -3.52 5.36 0.00 -1.26 -4.29 120.51 125.94 1r3n n ALA 165 Ca -0.19 -1.60 -0.14 0.00 0.00 0.00 0.00 53.44 51.51 1r3n n ALA 165 Cb 0.52 -2.50 -0.12 0.00 0.00 0.00 0.00 19.45 17.35 1r3n n ALA 165 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1r3n s ARG 166 N 1.90 0.23 0.51 0.00 6.06 -1.26 -5.08 118.95 121.30 1r3n s ARG 166 Ca 0.48 0.50 -0.19 0.00 -2.50 0.00 0.00 55.73 54.03 1r3n s ARG 166 Cb 0.21 -0.58 -0.08 0.00 0.06 0.00 0.00 34.95 34.56 1r3n s ARG 166 CO -0.01 -0.52 1.03 -1.54 -2.50 0.00 0.00 175.30 171.77 1r3n s SER 167 N 2.43 6.28 -1.39 -2.12 1.04 -1.26 -3.75 113.70 114.93 1r3n s SER 167 Ca 0.06 1.87 -0.08 0.00 0.48 0.00 0.00 55.95 58.28 1r3n s SER 167 Cb -0.14 -2.55 0.03 0.00 0.10 0.00 0.00 66.02 63.46 1r3n s SER 167 CO -0.12 -0.82 1.06 0.00 0.98 0.00 0.00 173.24 174.34 1r3n h THR 169 N -2.35 0.64 -0.03 0.00 2.02 -1.49 -0.29 112.91 111.42 1r3n h THR 169 Ca -0.58 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 66.60 1r3n h THR 169 Cb 1.37 0.64 -0.00 0.00 -1.74 0.00 0.00 68.15 68.41 1r3n h THR 169 CO 0.59 0.00 0.01 1.23 0.37 0.00 0.00 175.52 177.72 1r3n h GLY 170 N -0.16 0.04 2.00 2.16 0.00 -1.15 -1.59 103.07 104.37 1r3n h GLY 170 Ca 0.09 -0.02 -0.06 0.00 0.00 0.00 0.00 47.33 47.34 1r3n h GLY 170 CO -0.22 0.02 -0.30 1.48 0.00 0.00 0.00 176.54 177.52 1r3n h SER 171 N -0.08 0.00 0.29 0.19 4.64 -1.77 -2.62 113.55 114.20 1r3n h SER 171 Ca 0.01 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.18 1r3n h SER 171 Cb 0.12 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.20 1r3n h SER 171 CO -0.00 0.30 -0.58 0.28 -0.87 0.00 0.00 176.83 175.95 1r3n h SER 172 N 0.00 0.34 0.02 4.97 0.02 -0.87 -0.61 113.55 117.43 1r3n h SER 172 Ca -0.00 -0.19 -0.00 0.00 -0.84 0.00 0.00 61.79 60.76 1r3n h SER 172 Cb 1.07 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.51 1r3n h SER 172 CO 0.04 0.85 -0.01 0.58 -1.14 0.00 0.00 176.83 177.15 1r3n h VAL 173 N 0.23 1.34 -0.90 2.27 2.07 -1.19 0.16 116.25 120.23 1r3n h VAL 173 Ca -0.00 -1.16 0.17 0.00 0.82 0.00 0.00 66.70 66.54 1r3n h VAL 173 Cb 1.09 2.11 -0.07 0.00 -1.52 0.00 0.00 31.29 32.89 1r3n h VAL 173 CO 0.09 0.29 0.58 -0.25 0.02 0.00 0.00 177.57 178.31 1r3n h TRP 174 N -0.54 0.72 -0.01 1.57 7.01 -1.46 -1.36 115.95 121.88 1r3n h TRP 174 Ca -0.00 0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.02 1r3n h TRP 174 Cb 0.51 -0.22 0.00 0.00 -2.10 0.00 0.00 29.16 27.34 1r3n h TRP 174 CO 0.10 0.22 -0.05 -1.13 -2.79 0.00 0.00 178.44 174.79 1r3n n SER 175 N -4.56 1.10 -1.10 2.65 3.41 -0.24 -0.96 113.62 113.93 1r3n n SER 175 Ca 0.19 -1.23 -0.11 0.00 -0.26 0.00 0.00 58.87 57.46 1r3n n SER 175 Cb 0.58 0.01 -0.02 0.00 -0.26 0.00 0.00 64.21 64.52 1r3n n SER 175 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1r3n n HIS 176 N -0.25 -0.32 0.13 7.33 8.25 -0.51 -4.91 115.22 124.94 1r3n n HIS 176 Ca 0.18 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.73 1r3n n HIS 176 Cb 0.31 -2.38 0.04 0.00 1.12 0.00 0.00 29.99 29.09 1r3n n HIS 176 CO 0.00 0.00 0.00 -0.44 0.64 0.00 0.00 176.34 176.54 1r3n h ASP 177 N 0.00 0.00 -3.47 0.41 3.32 -1.21 -3.46 116.42 112.01 1r3n h ASP 177 Ca -0.25 0.00 -0.29 0.00 0.02 0.00 0.00 57.03 56.51 1r3n h ASP 177 Cb 1.01 0.00 -0.34 0.00 0.22 0.00 0.00 39.33 40.22 1r3n h ASP 177 CO 0.32 0.16 -0.69 -0.22 -1.72 0.00 0.00 179.24 177.08 1r3n s LEU 178 N -5.84 0.89 0.55 1.55 2.96 -0.94 -4.99 118.68 112.87 1r3n s LEU 178 Ca 0.02 0.12 -0.20 0.00 -0.22 0.00 0.00 54.13 53.85 1r3n s LEU 178 Cb 0.08 0.05 -0.05 0.00 0.50 0.00 0.00 46.19 46.77 1r3n s LEU 178 CO 0.75 -0.15 1.19 -0.94 -1.32 0.00 0.00 176.35 175.88 1r3n s SER 179 N 1.21 5.50 0.39 3.68 1.04 -1.26 -4.07 113.70 120.19 1r3n s SER 179 Ca -0.08 2.34 0.07 0.00 0.48 0.00 0.00 55.95 58.76 1r3n s SER 179 Cb -0.13 -2.60 0.82 0.00 0.10 0.00 0.00 66.02 64.22 1r3n s SER 179 CO -0.04 -1.38 2.02 0.25 0.98 0.00 0.00 173.24 175.08 1r3n h LEU 180 N 1.20 0.54 -0.59 2.42 5.85 -1.94 -2.37 115.31 120.42 1r3n h LEU 180 Ca -0.50 -0.01 -0.15 0.00 0.84 0.00 0.00 57.88 58.06 1r3n h LEU 180 Cb 1.28 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 42.17 1r3n h LEU 180 CO 0.57 0.38 -0.49 -0.33 -0.34 0.00 0.00 178.44 178.23 1r3n h GLU 181 N 0.63 0.55 -0.36 1.25 3.07 -1.99 -1.35 114.58 116.38 1r3n h GLU 181 Ca 0.21 -0.32 -0.16 0.00 -0.50 0.00 0.00 59.36 58.59 1r3n h GLU 181 Cb 0.06 0.02 -0.00 0.00 -0.84 0.00 0.00 28.75 27.99 1r3n h GLU 181 CO -0.05 0.91 -0.40 1.49 -1.40 0.00 0.00 179.01 179.56 1r3n h GLU 182 N 0.43 0.90 -0.12 2.33 4.81 -1.86 -2.88 114.58 118.20 1r3n h GLU 182 Ca 0.02 -0.49 0.03 0.00 -0.13 0.00 0.00 59.36 58.78 1r3n h GLU 182 Cb 1.01 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 30.39 1r3n h GLU 182 CO 0.09 1.14 -0.05 0.00 -0.73 0.00 0.00 179.01 179.47 1r3n h ALA 183 N 0.75 0.05 -0.80 2.92 0.00 -1.33 -2.77 119.26 118.07 1r3n h ALA 183 Ca 0.05 0.05 0.11 0.00 0.00 0.00 0.00 54.91 55.12 1r3n h ALA 183 Cb 1.00 0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.85 1r3n h ALA 183 CO 0.10 -0.50 0.53 1.88 0.00 0.00 0.00 179.25 181.25 1r3n h TYR 184 N -0.03 0.74 -0.16 0.00 0.99 -1.20 -2.36 116.97 114.95 1r3n h TYR 184 Ca 0.06 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.81 1r3n h TYR 184 Cb 0.13 -0.24 0.00 0.00 1.00 0.00 0.00 36.73 37.62 1r3n h TYR 184 CO -0.18 0.32 0.00 0.41 -0.00 0.00 0.00 178.16 178.72 1r3n n GLY 185 N -1.45 0.34 3.70 3.88 0.00 -1.06 -2.77 105.19 107.82 1r3n n GLY 185 Ca 0.14 -0.44 -0.42 0.00 0.00 0.00 0.00 46.02 45.30 1r3n n GLY 185 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1r3n s LEU 186 N -1.63 4.33 0.49 0.99 1.43 -0.89 -4.87 118.68 118.53 1r3n s LEU 186 Ca 0.33 2.10 0.01 0.00 -1.03 0.00 0.00 54.13 55.55 1r3n s LEU 186 Cb 0.18 -3.57 0.01 0.00 0.03 0.00 0.00 46.19 42.84 1r3n s LEU 186 CO 0.28 -0.65 0.71 -0.04 0.23 0.00 0.00 176.35 176.87 1r3n s MET 187 N 1.90 2.87 -0.16 1.70 -1.94 -1.26 -1.74 119.30 120.67 1r3n s MET 187 Ca 0.62 -0.62 -0.12 0.00 -1.71 0.00 0.00 55.69 53.86 1r3n s MET 187 Cb -0.31 -2.54 -0.05 0.00 2.01 0.00 0.00 34.83 33.94 1r3n s MET 187 CO 0.27 -0.43 0.25 -1.54 -0.01 0.00 0.00 175.02 173.56 1r3n s SER 188 N -4.30 6.40 0.32 3.03 1.04 -0.99 -4.52 113.70 114.69 1r3n s SER 188 Ca 0.52 0.46 -0.27 0.00 0.48 0.00 0.00 55.95 57.15 1r3n s SER 188 Cb -0.10 -2.16 -0.10 0.00 0.10 0.00 0.00 66.02 63.77 1r3n s SER 188 CO 0.38 0.15 0.98 -0.69 0.98 0.00 0.00 173.24 175.05 1r3n s VAL 189 N 0.25 4.00 0.00 5.02 1.01 0.05 -4.52 120.40 126.21 1r3n s VAL 189 Ca 0.15 1.72 0.00 0.00 0.00 0.00 0.00 61.98 63.84 1r3n s VAL 189 Cb -0.13 -3.98 0.00 0.00 0.00 0.00 0.00 36.38 32.28 1r3n s VAL 189 CO 0.03 0.19 0.00 0.61 0.00 0.00 0.00 175.10 175.93 1r3n n GLY 190 N 0.71 3.11 3.92 4.51 0.00 -1.26 -4.79 105.19 111.38 1r3n n GLY 190 Ca 0.02 -0.84 -0.27 0.00 0.00 0.00 0.00 46.02 44.93 1r3n n GLY 190 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1r3n s GLU 191 N 0.00 3.13 -0.06 1.61 8.01 -1.26 -5.03 118.70 125.09 1r3n s GLU 191 Ca 0.00 0.03 -0.25 0.00 0.01 0.00 0.00 54.97 54.76 1r3n s GLU 191 Cb 0.00 -2.32 -0.24 0.00 -4.31 0.00 0.00 34.13 27.26 1r3n s GLU 191 CO 0.00 -0.51 1.00 -0.44 0.01 0.00 0.00 175.26 175.32 1r3n h ASP 192 N -0.01 0.20 -3.92 -0.19 5.19 -1.97 -3.36 116.42 112.36 1r3n h ASP 192 Ca -0.46 -0.80 -0.72 0.00 -0.62 0.00 0.00 57.03 54.44 1r3n h ASP 192 Cb 1.24 -0.06 -0.34 0.00 0.18 0.00 0.00 39.33 40.35 1r3n h ASP 192 CO 0.61 0.97 -0.21 -1.59 -3.12 0.00 0.00 179.24 175.90 1r3n s LYS 193 N -3.04 2.94 0.44 3.56 0.00 -1.26 -5.08 119.74 117.31 1r3n s LYS 193 Ca -0.16 -2.73 -0.24 0.00 0.00 0.00 0.00 55.97 52.85 1r3n s LYS 193 Cb 0.00 -3.91 -0.08 0.00 0.00 0.00 0.00 37.83 33.85 1r3n s LYS 193 CO 0.74 -1.22 1.19 -2.14 0.00 0.00 0.00 175.35 173.92 1r3n s PRO 194 N -0.38 3.82 0.35 1.78 0.02 -1.26 -5.05 135.00 134.28 1r3n s PRO 194 Ca 0.20 1.84 0.08 0.00 0.02 0.00 0.00 61.00 63.14 1r3n s PRO 194 Cb -0.15 -2.49 -0.04 0.00 0.02 0.00 0.00 34.50 31.84 1r3n s PRO 194 CO -0.06 -0.52 0.19 -1.83 -0.33 0.00 0.00 177.00 174.44 1r3n s GLU 195 N -2.57 2.43 0.69 5.54 -1.05 -1.26 -4.84 118.70 117.63 1r3n s GLU 195 Ca 0.62 -1.53 -0.04 0.00 -0.15 0.00 0.00 54.97 53.86 1r3n s GLU 195 Cb -0.30 -2.22 0.07 0.00 -0.44 0.00 0.00 34.13 31.24 1r3n s GLU 195 CO 0.37 0.06 0.97 -1.54 0.95 0.00 0.00 175.26 176.07 1r3n s SER 196 N -3.90 4.74 0.16 0.83 1.04 -1.26 -2.34 113.70 112.97 1r3n s SER 196 Ca 0.39 0.19 -0.16 0.00 0.48 0.00 0.00 55.95 56.86 1r3n s SER 196 Cb -0.02 -0.81 0.03 0.00 0.10 0.00 0.00 66.02 65.31 1r3n s SER 196 CO 0.24 -1.60 1.81 0.58 0.98 0.00 0.00 173.24 175.24 1r3n h VAL 197 N -0.49 1.12 -0.16 5.02 2.07 -1.25 -0.02 116.25 122.55 1r3n h VAL 197 Ca -0.42 -0.25 -0.00 0.00 0.82 0.00 0.00 66.70 66.85 1r3n h VAL 197 Cb 1.30 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.56 1r3n h VAL 197 CO 0.53 0.12 0.10 0.22 0.02 0.00 0.00 177.57 178.56 1r3n h TYR 198 N 0.59 0.21 -0.69 1.57 3.20 -1.81 -0.50 116.97 119.55 1r3n h TYR 198 Ca 0.16 -0.00 0.13 0.00 3.14 0.00 0.00 58.73 62.16 1r3n h TYR 198 Cb -0.04 -0.07 -0.09 0.00 1.54 0.00 0.00 36.73 38.06 1r3n h TYR 198 CO -0.04 0.18 0.23 -0.44 -1.64 0.00 0.00 178.16 176.45 1r3n h ASP 199 N 0.18 0.16 0.03 -2.11 5.19 -1.80 -1.35 116.42 116.73 1r3n h ASP 199 Ca 0.06 0.11 -0.00 0.00 -0.62 0.00 0.00 57.03 56.58 1r3n h ASP 199 Cb 0.03 0.12 0.00 0.00 0.18 0.00 0.00 39.33 39.65 1r3n h ASP 199 CO -0.01 0.06 -0.02 0.28 -3.12 0.00 0.00 179.24 176.44 1r3n h SER 200 N 0.37 -0.04 0.33 6.45 0.02 -0.53 -2.80 113.55 117.35 1r3n h SER 200 Ca 0.37 -0.26 -0.06 0.00 -0.84 0.00 0.00 61.79 61.00 1r3n h SER 200 Cb 0.57 0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.11 1r3n h SER 200 CO -0.41 0.24 -0.29 -0.07 -1.14 0.00 0.00 176.83 175.17 1r3n h LEU 201 N -0.32 0.00 -0.21 5.07 3.38 -0.80 -2.67 115.31 119.76 1r3n h LEU 201 Ca -0.00 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1r3n h LEU 201 Cb 0.30 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 1r3n h LEU 201 CO 0.01 0.29 -0.15 0.50 0.09 0.00 0.00 178.44 179.18 1r3n h LYS 202 N 0.00 0.47 -0.60 1.13 3.64 -1.25 0.69 116.57 120.64 1r3n h LYS 202 Ca -0.00 -0.22 0.09 0.00 -1.27 0.00 0.00 60.65 59.24 1r3n h LYS 202 Cb 0.54 -0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.32 1r3n h LYS 202 CO 0.04 0.78 0.40 -0.97 -2.27 0.00 0.00 179.45 177.43 1r3n h ASN 203 N 0.15 0.42 -0.03 4.20 -1.24 -1.20 -0.87 115.58 117.00 1r3n h ASN 203 Ca 0.04 0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.06 1r3n h ASN 203 Cb 0.66 -0.08 0.00 0.00 0.73 0.00 0.00 38.32 39.63 1r3n h ASN 203 CO 0.04 0.26 -0.03 2.30 -1.29 0.00 0.00 177.43 178.70 1r3n n ILE 204 N -4.47 0.00 -2.49 2.57 -5.35 -1.10 -4.99 119.36 103.54 1r3n n ILE 204 Ca 0.09 -0.48 -0.11 0.00 -0.27 0.00 0.00 62.75 61.99 1r3n n ILE 204 Cb 0.33 1.47 0.01 0.00 -1.74 0.00 0.00 39.64 39.70 1r3n n ILE 204 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1r3n n GLY 205 N 1.31 0.05 0.96 3.28 0.00 -0.33 -4.93 105.19 105.53 1r3n n GLY 205 Ca 0.13 -0.38 0.01 0.00 0.00 0.00 0.00 46.02 45.78 1r3n n GLY 205 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1r3n n TYR 206 N -3.90 0.87 -2.62 1.61 4.02 0.23 -4.83 117.16 112.53 1r3n n TYR 206 Ca -0.08 -1.38 -0.41 0.00 -0.01 0.00 0.00 57.90 56.02 1r3n n TYR 206 Cb 0.57 -0.40 -0.03 0.00 -0.02 0.00 0.00 39.34 39.46 1r3n n TYR 206 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1r3n s ILE 207 N -3.12 3.87 0.76 -0.72 -1.09 -1.18 -3.48 121.20 116.25 1r3n s ILE 207 Ca 0.42 0.16 -0.06 0.00 -2.23 0.00 0.00 60.65 58.94 1r3n s ILE 207 Cb 0.38 -4.87 0.12 0.00 -1.58 0.00 0.00 42.46 36.50 1r3n s ILE 207 CO 0.02 -1.77 1.07 -0.83 -1.23 0.00 0.00 174.94 172.19 1r3n s GLY 208 N 3.79 1.74 -0.05 6.18 0.00 -0.86 -4.95 107.32 113.17 1r3n s GLY 208 Ca 0.33 -1.29 0.21 0.00 0.00 0.00 0.00 44.72 43.96 1r3n s GLY 208 CO 0.12 -0.75 0.40 1.22 0.00 0.00 0.00 173.10 174.10 1r3n n ASP 209 N -3.06 0.19 -4.77 1.64 9.92 -0.73 -3.69 116.55 116.06 1r3n n ASP 209 Ca 0.12 0.00 -0.40 0.00 -0.53 0.00 0.00 54.79 53.98 1r3n n ASP 209 Cb 0.60 1.82 -0.02 0.00 -0.64 0.00 0.00 41.12 42.88 1r3n n ASP 209 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1r3n s THR 210 N -3.32 2.90 0.28 -3.53 2.01 -1.01 -4.84 115.64 108.14 1r3n s THR 210 Ca -0.08 0.88 -0.29 0.00 0.31 0.00 0.00 61.69 62.51 1r3n s THR 210 Cb 0.12 -3.55 -0.10 0.00 0.01 0.00 0.00 72.50 68.98 1r3n s THR 210 CO 0.86 0.20 1.40 -2.84 -0.69 0.00 0.00 174.62 173.55 1r3n s PRO 211 N -1.80 4.28 -1.20 4.92 0.02 -1.26 -1.73 135.00 138.23 1r3n s PRO 211 Ca 0.49 2.30 -0.12 0.00 0.02 0.00 0.00 61.00 63.69 1r3n s PRO 211 Cb -0.37 -3.09 0.20 0.00 0.02 0.00 0.00 34.50 31.26 1r3n s PRO 211 CO 0.49 -0.36 1.44 0.00 -0.33 0.00 0.00 177.00 178.24 1r3n n ALA 212 N 1.75 4.23 -3.63 -1.55 0.00 -1.26 -4.29 120.51 115.76 1r3n n ALA 212 Ca 0.04 -4.37 -0.09 0.00 0.00 0.00 0.00 53.44 49.02 1r3n n ALA 212 Cb 0.41 -2.89 -0.08 0.00 0.00 0.00 0.00 19.45 16.89 1r3n n ALA 212 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1r3n s SER 213 N 1.99 -0.82 0.53 0.00 0.15 -1.26 -3.97 113.70 110.31 1r3n s SER 213 Ca 0.39 1.38 0.34 0.00 0.70 0.00 0.00 55.95 58.77 1r3n s SER 213 Cb -0.02 1.30 1.56 0.00 -1.71 0.00 0.00 66.02 67.14 1r3n s SER 213 CO -0.01 -0.23 2.02 0.10 1.20 0.00 0.00 173.24 176.32 1r3n h TYR 214 N 6.47 0.00 0.00 3.44 -0.00 -1.29 0.17 116.97 125.76 1r3n h TYR 214 Ca -0.31 0.00 -0.21 0.00 0.00 0.00 0.00 58.73 58.21 1r3n h TYR 214 Cb 1.20 0.00 -0.03 0.00 0.00 0.00 0.00 36.73 37.91 1r3n h TYR 214 CO 0.17 0.00 -1.02 0.87 -0.00 0.00 0.00 178.16 178.18 1r3n h LYS 215 N 0.00 0.01 0.00 0.10 6.56 -1.96 -3.37 116.57 117.91 1r3n h LYS 215 Ca 0.00 -0.02 -0.28 0.00 -1.06 0.00 0.00 60.65 59.29 1r3n h LYS 215 Cb 0.35 0.01 -0.04 0.00 -0.57 0.00 0.00 32.23 31.97 1r3n h LYS 215 CO 0.00 1.00 -1.79 -1.91 -2.06 0.00 0.00 179.45 174.69 1r3n n GLU 216 N -3.35 0.56 -3.33 3.15 4.07 -0.87 -4.73 120.64 116.14 1r3n n GLU 216 Ca -0.01 0.34 -0.46 0.00 -0.06 0.00 0.00 57.16 56.97 1r3n n GLU 216 Cb 0.95 -1.55 -0.01 0.00 -0.06 0.00 0.00 31.44 30.77 1r3n n GLU 216 CO 0.00 0.00 0.00 1.21 -0.06 0.00 0.00 177.13 178.28 1r3n s ASN 217 N -6.89 7.11 0.31 4.31 2.47 0.53 -5.01 114.94 117.77 1r3n s ASN 217 Ca -0.33 -3.24 -0.17 0.00 0.42 0.00 0.00 52.86 49.54 1r3n s ASN 217 Cb 0.10 -2.21 -0.09 0.00 -1.45 0.00 0.00 41.25 37.59 1r3n s ASN 217 CO 0.47 -0.41 0.76 -1.61 -3.72 0.00 0.00 177.10 172.60 1r3n s GLU 218 N -0.66 4.10 0.18 0.43 2.02 -1.26 -4.57 118.70 118.94 1r3n s GLU 218 Ca 0.26 0.78 0.09 0.00 0.02 0.00 0.00 54.97 56.12 1r3n s GLU 218 Cb -0.10 -2.52 -0.04 0.00 0.10 0.00 0.00 34.13 31.57 1r3n s GLU 218 CO -0.08 0.19 -0.18 0.96 0.02 0.00 0.00 175.26 176.17 1r3n s ILE 219 N -1.89 1.83 -0.10 -1.63 -4.36 -1.26 -4.29 121.20 109.50 1r3n s ILE 219 Ca 0.52 -2.00 -0.11 0.00 -0.26 0.00 0.00 60.65 58.81 1r3n s ILE 219 Cb -0.12 -1.90 -0.27 0.00 1.25 0.00 0.00 42.46 41.42 1r3n s ILE 219 CO 0.18 -0.37 0.48 -0.78 0.24 0.00 0.00 174.94 174.69 1r3n h ASP 220 N 3.07 0.45 -5.35 4.36 3.58 -0.75 -3.47 116.42 118.31 1r3n h ASP 220 Ca -0.41 -0.91 -0.12 0.00 0.42 0.00 0.00 57.03 56.01 1r3n h ASP 220 Cb 1.21 -0.15 -0.10 0.00 1.72 0.00 0.00 39.33 42.01 1r3n h ASP 220 CO 0.53 1.78 -0.25 0.00 -2.88 0.00 0.00 179.24 178.42 1r3n s ALA 221 N -2.54 0.18 -0.12 -0.78 0.00 -1.26 -4.04 121.76 113.20 1r3n s ALA 221 Ca -0.20 -1.13 -0.04 0.00 0.00 0.00 0.00 51.96 50.59 1r3n s ALA 221 Cb 0.06 1.16 0.05 0.00 0.00 0.00 0.00 23.12 24.39 1r3n s ALA 221 CO 0.78 -0.78 0.11 -1.58 0.00 0.00 0.00 175.76 174.29 1r3n s HIS 222 N -3.99 0.04 -0.09 0.00 2.46 -0.56 -1.46 115.29 111.69 1r3n s HIS 222 Ca 0.27 0.07 0.00 0.00 0.47 0.00 0.00 55.06 55.88 1r3n s HIS 222 Cb 0.01 -0.52 -0.03 0.00 -0.13 0.00 0.00 32.58 31.92 1r3n s HIS 222 CO 0.11 -0.38 -0.07 -0.06 -2.47 0.00 0.00 174.74 171.86 1r3n s PHE 223 N 2.20 2.93 -0.10 3.88 0.40 -0.13 -2.07 117.98 125.09 1r3n s PHE 223 Ca 0.04 -0.09 0.01 0.00 -0.60 0.00 0.00 56.93 56.29 1r3n s PHE 223 Cb -0.14 -1.76 0.02 0.00 0.51 0.00 0.00 43.02 41.65 1r3n s PHE 223 CO -0.07 0.23 -0.10 -2.00 0.70 0.00 0.00 175.22 173.98 1r3n s GLU 224 N -0.53 1.65 -0.17 0.44 2.12 -0.87 -2.05 118.70 119.29 1r3n s GLU 224 Ca 0.08 -0.33 -0.15 0.00 0.36 0.00 0.00 54.97 54.93 1r3n s GLU 224 Cb -0.12 -1.56 -0.04 0.00 0.26 0.00 0.00 34.13 32.66 1r3n s GLU 224 CO 0.02 -0.16 0.33 -1.17 -0.54 0.00 0.00 175.26 173.73 1r3n s LEU 225 N 1.33 4.23 0.04 2.70 2.96 -1.26 -0.93 118.68 127.75 1r3n s LEU 225 Ca -0.02 0.53 -0.12 0.00 -0.22 0.00 0.00 54.13 54.30 1r3n s LEU 225 Cb -0.14 -2.43 0.01 0.00 0.50 0.00 0.00 46.19 44.14 1r3n s LEU 225 CO -0.04 0.05 0.26 -2.28 -1.32 0.00 0.00 176.35 173.02 1r3n s HIS 226 N 0.66 -0.04 0.63 5.38 2.46 -0.58 -2.52 115.29 121.29 1r3n s HIS 226 Ca 0.18 -0.13 -0.15 0.00 0.47 0.00 0.00 55.06 55.42 1r3n s HIS 226 Cb -0.14 0.04 -0.01 0.00 -0.13 0.00 0.00 32.58 32.34 1r3n s HIS 226 CO 0.05 -0.47 1.10 0.96 -2.47 0.00 0.00 174.74 173.91 1r3n s ILE 227 N -2.55 3.40 0.36 0.89 -4.36 -1.26 -2.65 121.20 115.04 1r3n s ILE 227 Ca -0.05 0.66 0.16 0.00 -0.26 0.00 0.00 60.65 61.16 1r3n s ILE 227 Cb -0.01 -3.19 0.14 0.00 1.25 0.00 0.00 42.46 40.65 1r3n s ILE 227 CO -0.03 -0.39 1.87 -0.08 0.24 0.00 0.00 174.94 176.55 1r3n h GLU 228 N 0.21 0.00 -1.75 0.37 4.81 -1.52 -3.45 114.58 113.25 1r3n h GLU 228 Ca -0.47 0.00 -0.37 0.00 -0.13 0.00 0.00 59.36 58.39 1r3n h GLU 228 Cb 1.24 0.00 -0.11 0.00 0.63 0.00 0.00 28.75 30.51 1r3n h GLU 228 CO 0.55 0.31 -0.37 1.04 -0.73 0.00 0.00 179.01 179.81 1r3n n GLN 229 N -3.98 -1.53 -3.90 1.92 6.02 -1.26 -4.89 117.38 109.76 1r3n n GLN 229 Ca -0.02 1.01 -0.09 0.00 -0.01 0.00 0.00 57.00 57.89 1r3n n GLN 229 Cb 0.37 -5.44 -0.05 0.00 1.02 0.00 0.00 30.24 26.14 1r3n n GLN 229 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1r3n s GLY 230 N -2.39 0.30 0.00 1.08 0.00 -1.25 -4.73 107.32 100.33 1r3n s GLY 230 Ca 0.00 -0.66 0.28 0.00 0.00 0.00 0.00 44.72 44.34 1r3n s GLY 230 CO 0.00 -0.59 1.72 -1.55 0.00 0.00 0.00 173.10 172.68 1r3n n PRO 231 N -0.30 1.37 0.06 2.90 -0.04 -1.26 -4.04 135.00 133.68 1r3n n PRO 231 Ca -0.07 -0.76 -0.13 0.00 -0.04 0.00 0.00 63.50 62.50 1r3n n PRO 231 Cb 0.62 -1.48 -0.08 0.00 -0.04 0.00 0.00 33.50 32.52 1r3n n PRO 231 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1r3n h ILE 232 N 1.86 1.03 -0.61 0.52 2.04 -1.97 -1.58 117.51 118.81 1r3n h ILE 232 Ca 0.00 -0.49 -0.06 0.00 1.00 0.00 0.00 64.86 65.32 1r3n h ILE 232 Cb 0.48 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.88 1r3n h ILE 232 CO 0.00 0.12 0.15 -0.07 0.00 0.00 0.00 178.15 178.35 1r3n h LEU 233 N -0.35 0.92 -0.13 1.44 3.38 -1.91 -1.75 115.31 116.91 1r3n h LEU 233 Ca -0.01 -0.23 0.01 0.00 0.09 0.00 0.00 57.88 57.74 1r3n h LEU 233 Cb 0.29 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1r3n h LEU 233 CO 0.02 0.91 0.04 -0.08 0.09 0.00 0.00 178.44 179.43 1r3n h GLU 234 N 0.88 0.10 -0.89 1.13 4.81 -1.81 -1.53 114.58 117.28 1r3n h GLU 234 Ca 0.19 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.40 1r3n h GLU 234 Cb 0.35 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.66 1r3n h GLU 234 CO 0.00 0.07 0.52 0.22 -0.73 0.00 0.00 179.01 179.09 1r3n h ASP 235 N 0.11 1.08 -0.23 1.04 3.58 -1.01 -2.40 116.42 118.59 1r3n h ASP 235 Ca 0.05 -0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.43 1r3n h ASP 235 Cb 0.03 -0.27 0.00 0.00 1.72 0.00 0.00 39.33 40.80 1r3n h ASP 235 CO -0.05 0.85 0.00 -0.62 -2.88 0.00 0.00 179.24 176.53 1r3n n GLU 236 N -4.35 1.78 -2.39 0.28 1.02 -0.68 -4.93 120.64 111.36 1r3n n GLU 236 Ca 0.10 -1.18 -0.20 0.00 -0.02 0.00 0.00 57.16 55.86 1r3n n GLU 236 Cb 0.08 -1.37 -0.01 0.00 -0.02 0.00 0.00 31.44 30.12 1r3n n GLU 236 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1r3n n ASN 237 N 0.41 -5.72 -4.89 1.62 3.02 -0.85 -4.99 115.26 103.86 1r3n n ASN 237 Ca 0.15 0.01 -0.29 0.00 -0.03 0.00 0.00 54.58 54.42 1r3n n ASN 237 Cb 0.33 -4.78 -0.03 0.00 -0.61 0.00 0.00 39.78 34.70 1r3n n ASN 237 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1r3n s LYS 238 N -5.03 3.68 -0.22 3.52 -0.14 -0.64 -4.84 119.74 116.08 1r3n s LYS 238 Ca 0.00 0.24 0.09 0.00 -1.36 0.00 0.00 55.97 54.94 1r3n s LYS 238 Cb 0.00 -2.48 -0.21 0.00 -1.68 0.00 0.00 37.83 33.46 1r3n s LYS 238 CO 0.00 0.03 -0.05 0.00 -0.76 0.00 0.00 175.35 174.56 1r3n n ALA 239 N -1.36 1.45 -3.21 5.17 0.00 0.11 -4.63 120.51 118.04 1r3n n ALA 239 Ca 0.00 -1.19 -0.17 0.00 0.00 0.00 0.00 53.44 52.09 1r3n n ALA 239 Cb 0.54 -0.17 -0.15 0.00 0.00 0.00 0.00 19.45 19.67 1r3n n ALA 239 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1r3n s ILE 240 N -2.51 0.33 -0.27 0.00 1.09 -1.03 -4.38 121.20 114.44 1r3n s ILE 240 Ca -0.22 -0.10 -0.07 0.00 -1.10 0.00 0.00 60.65 59.16 1r3n s ILE 240 Cb 0.08 -0.34 -0.01 0.00 -1.06 0.00 0.00 42.46 41.12 1r3n s ILE 240 CO 0.72 0.14 0.08 -0.83 -0.10 0.00 0.00 174.94 174.94 1r3n s GLY 241 N 0.41 1.77 -0.46 6.18 0.00 -0.09 -1.70 107.32 113.44 1r3n s GLY 241 Ca -0.04 -1.25 -0.27 0.00 0.00 0.00 0.00 44.72 43.16 1r3n s GLY 241 CO -0.01 0.58 1.03 -0.42 0.00 0.00 0.00 173.10 174.28 1r3n s ILE 242 N 1.58 4.35 -0.30 0.90 1.01 0.47 -1.00 121.20 128.20 1r3n s ILE 242 Ca 0.05 1.00 -0.25 0.00 0.00 0.00 0.00 60.65 61.45 1r3n s ILE 242 Cb -0.16 -4.52 0.00 0.00 0.01 0.00 0.00 42.46 37.80 1r3n s ILE 242 CO 0.03 -0.91 0.87 -0.69 0.00 0.00 0.00 174.94 174.25 1r3n s VAL 243 N 4.09 4.72 -0.34 2.92 1.01 -1.00 -0.91 120.40 130.88 1r3n s VAL 243 Ca 0.42 1.38 0.22 0.00 0.00 0.00 0.00 61.98 64.01 1r3n s VAL 243 Cb -0.09 -4.22 -0.14 0.00 0.00 0.00 0.00 36.38 31.93 1r3n s VAL 243 CO 0.29 -0.29 0.88 0.35 0.00 0.00 0.00 175.10 176.33 1r3n n THR 244 N 5.58 0.26 -0.69 3.92 -2.24 -0.63 -4.05 114.28 116.43 1r3n n THR 244 Ca 0.06 -0.40 0.00 0.00 -2.27 0.00 0.00 64.05 61.44 1r3n n THR 244 Cb 0.48 -0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.70 1r3n n THR 244 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1r3n n GLY 245 N 1.28 -1.48 3.42 3.38 0.00 -1.26 -1.68 105.19 108.85 1r3n n GLY 245 Ca -0.00 -1.05 -0.33 0.00 0.00 0.00 0.00 46.02 44.64 1r3n n GLY 245 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1r3n s VAL 246 N -2.21 3.03 0.44 1.61 1.01 -0.06 0.04 120.40 124.26 1r3n s VAL 246 Ca 0.00 -0.70 -0.25 0.00 0.00 0.00 0.00 61.98 61.03 1r3n s VAL 246 Cb 0.00 -2.23 -0.08 0.00 0.00 0.00 0.00 36.38 34.07 1r3n s VAL 246 CO 0.00 0.56 1.30 -1.10 0.00 0.00 0.00 175.10 175.86 1r3n s GLN 247 N -0.15 3.80 0.63 2.72 -0.21 -0.52 -1.19 119.66 124.75 1r3n s GLN 247 Ca -0.01 2.14 -0.16 0.00 0.02 0.00 0.00 55.36 57.36 1r3n s GLN 247 Cb -0.13 -2.63 -0.01 0.00 1.00 0.00 0.00 33.01 31.23 1r3n s GLN 247 CO 0.03 -0.63 1.10 0.00 -2.12 0.00 0.00 175.29 173.68 1r3n s ALA 248 N -1.30 2.55 0.04 6.09 0.00 0.07 -4.62 121.76 124.58 1r3n s ALA 248 Ca 0.60 0.56 -0.04 0.00 0.00 0.00 0.00 51.96 53.08 1r3n s ALA 248 Cb -0.38 -3.31 -0.02 0.00 0.00 0.00 0.00 23.12 19.42 1r3n s ALA 248 CO 0.48 -1.12 0.05 1.52 0.00 0.00 0.00 175.76 176.68 1r3n s TYR 249 N -2.28 0.28 -0.05 0.00 -0.85 0.58 -2.20 117.35 112.83 1r3n s TYR 249 Ca 0.67 -0.65 -0.00 0.00 -0.52 0.00 0.00 57.07 56.57 1r3n s TYR 249 Cb -0.20 -0.21 0.03 0.00 0.38 0.00 0.00 41.96 41.96 1r3n s TYR 249 CO 0.39 -0.35 -0.02 1.21 -1.52 0.00 0.00 175.55 175.26 1r3n s ASN 250 N -2.24 1.07 -0.11 -0.18 2.47 -0.35 -1.13 114.94 114.47 1r3n s ASN 250 Ca -0.03 -0.08 -0.04 0.00 0.42 0.00 0.00 52.86 53.12 1r3n s ASN 250 Cb -0.00 -0.39 -0.04 0.00 -1.45 0.00 0.00 41.25 39.37 1r3n s ASN 250 CO -0.06 -0.12 0.04 0.26 -3.72 0.00 0.00 177.10 173.50 1r3n s TRP 251 N 1.35 3.26 0.03 0.43 0.51 0.13 -1.22 118.94 123.43 1r3n s TRP 251 Ca -0.05 0.23 0.01 0.00 -2.12 0.00 0.00 56.10 54.18 1r3n s TRP 251 Cb -0.13 -1.87 -0.02 0.00 -0.81 0.00 0.00 33.47 30.64 1r3n s TRP 251 CO -0.02 0.46 -0.06 -1.14 -0.51 0.00 0.00 176.95 175.68 1r3n s GLN 252 N -0.70 0.43 -0.13 4.98 2.00 0.41 -1.10 119.66 125.56 1r3n s GLN 252 Ca 0.11 -0.60 0.03 0.00 -2.00 0.00 0.00 55.36 52.90 1r3n s GLN 252 Cb -0.12 -0.19 0.00 0.00 0.80 0.00 0.00 33.01 33.50 1r3n s GLN 252 CO 0.02 0.03 -0.21 0.21 -0.50 0.00 0.00 175.29 174.84 1r3n s LYS 253 N -1.27 3.08 -0.14 1.67 2.20 0.99 0.23 119.74 126.50 1r3n s LYS 253 Ca -0.09 -0.84 -0.01 0.00 -0.36 0.00 0.00 55.97 54.67 1r3n s LYS 253 Cb -0.08 -2.42 -0.02 0.00 -1.51 0.00 0.00 37.83 33.80 1r3n s LYS 253 CO -0.00 0.08 -0.11 0.08 -0.36 0.00 0.00 175.35 175.04 1r3n s VAL 254 N 0.60 3.22 -0.20 4.02 1.01 0.10 -0.53 120.40 128.62 1r3n s VAL 254 Ca -0.12 -0.59 -0.03 0.00 0.00 0.00 0.00 61.98 61.24 1r3n s VAL 254 Cb -0.16 -2.38 -0.01 0.00 0.00 0.00 0.00 36.38 33.83 1r3n s VAL 254 CO 0.03 0.51 -0.08 -0.89 0.00 0.00 0.00 175.10 174.67 1r3n s THR 255 N 0.48 3.16 -0.19 3.92 2.01 -0.09 -1.12 115.64 123.81 1r3n s THR 255 Ca -0.08 -0.58 -0.11 0.00 0.31 0.00 0.00 61.69 61.24 1r3n s THR 255 Cb -0.15 -2.41 -0.05 0.00 0.01 0.00 0.00 72.50 69.90 1r3n s THR 255 CO 0.04 0.46 0.16 -0.69 -0.69 0.00 0.00 174.62 173.90 1r3n s VAL 256 N 1.26 5.39 -0.21 3.82 1.01 0.10 -1.35 120.40 130.41 1r3n s VAL 256 Ca 0.03 0.25 -0.05 0.00 0.00 0.00 0.00 61.98 62.21 1r3n s VAL 256 Cb -0.14 -3.50 -0.02 0.00 0.00 0.00 0.00 36.38 32.72 1r3n s VAL 256 CO -0.03 0.44 -0.01 -1.00 0.00 0.00 0.00 175.10 174.50 1r3n s HIS 257 N 0.34 3.01 0.00 5.22 3.76 0.11 -1.61 115.29 126.13 1r3n s HIS 257 Ca 0.10 -0.63 0.00 0.00 -0.15 0.00 0.00 55.06 54.38 1r3n s HIS 257 Cb -0.11 -2.11 0.00 0.00 1.11 0.00 0.00 32.58 31.46 1r3n s HIS 257 CO -0.01 -0.37 0.00 0.41 -0.85 0.00 0.00 174.74 173.92 1r3n n GLY 258 N 4.55 5.28 2.72 -2.22 0.00 0.11 -2.51 105.19 113.13 1r3n n GLY 258 Ca -0.17 -1.22 -0.22 0.00 0.00 0.00 0.00 46.02 44.41 1r3n n GLY 258 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1r3n s VAL 259 N 3.19 0.18 -0.10 1.61 1.01 -0.77 -4.82 120.40 120.69 1r3n s VAL 259 Ca 0.00 0.21 -0.29 0.00 0.00 0.00 0.00 61.98 61.89 1r3n s VAL 259 Cb 0.00 -0.40 -0.04 0.00 0.00 0.00 0.00 36.38 35.94 1r3n s VAL 259 CO 0.00 0.19 1.55 -0.83 0.00 0.00 0.00 175.10 176.01 1r3n s GLY 260 N 2.05 1.52 0.05 4.51 0.00 -1.26 -4.34 107.32 109.85 1r3n s GLY 260 Ca 0.05 0.75 -0.10 0.00 0.00 0.00 0.00 44.72 45.42 1r3n s GLY 260 CO -0.05 2.90 0.20 0.00 0.00 0.00 0.00 173.10 176.16 1r3n s ALA 261 N 4.07 -0.36 0.29 3.20 0.00 -1.17 -4.95 121.76 122.85 1r3n s ALA 261 Ca 0.68 -0.34 -0.30 0.00 0.00 0.00 0.00 51.96 52.01 1r3n s ALA 261 Cb -0.29 0.34 -0.11 0.00 0.00 0.00 0.00 23.12 23.06 1r3n s ALA 261 CO 0.26 -0.40 1.49 -1.58 0.00 0.00 0.00 175.76 175.52 1r3n s HIS 262 N -2.89 2.87 0.44 0.00 2.46 -1.26 0.06 115.29 116.97 1r3n s HIS 262 Ca -0.03 1.01 0.40 0.00 0.47 0.00 0.00 55.06 56.91 1r3n s HIS 262 Cb 0.00 -3.92 2.01 0.00 -0.13 0.00 0.00 32.58 30.55 1r3n s HIS 262 CO -0.06 -2.94 2.22 0.00 -2.47 0.00 0.00 174.74 171.49 1r3n h ALA 263 N 4.49 1.00 0.00 1.58 0.00 -0.43 -3.06 119.26 122.85 1r3n h ALA 263 Ca -0.47 -0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.16 1r3n h ALA 263 Cb 1.22 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.96 1r3n h ALA 263 CO 0.75 0.00 -2.03 0.41 0.00 0.00 0.00 179.25 178.38 1r3n n GLY 264 N -0.63 -0.45 0.19 0.00 0.00 -1.26 -4.58 105.19 98.46 1r3n n GLY 264 Ca -0.02 -0.17 0.12 0.00 0.00 0.00 0.00 46.02 45.95 1r3n n GLY 264 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1r3n h THR 265 N 0.00 0.00 -3.56 2.61 1.35 -1.96 -3.44 112.91 107.91 1r3n h THR 265 Ca -0.41 -0.99 -0.69 0.00 -0.55 0.00 0.00 66.41 63.78 1r3n h THR 265 Cb 1.75 1.87 -0.18 0.00 -1.73 0.00 0.00 68.15 69.85 1r3n h THR 265 CO -0.03 0.00 -0.23 -0.89 -0.25 0.00 0.00 175.52 174.13 1r3n s THR 266 N -3.25 5.11 0.65 6.82 2.01 -1.16 -5.06 115.64 120.77 1r3n s THR 266 Ca 0.05 -0.26 -0.12 0.00 0.31 0.00 0.00 61.69 61.67 1r3n s THR 266 Cb 0.06 -3.99 -0.01 0.00 0.01 0.00 0.00 72.50 68.57 1r3n s THR 266 CO 0.70 -0.35 1.05 -2.16 -0.69 0.00 0.00 174.62 173.17 1r3n s PRO 267 N 2.11 3.13 0.22 4.92 0.04 -1.26 -4.86 135.00 139.30 1r3n s PRO 267 Ca 0.12 1.01 -0.15 0.00 0.04 0.00 0.00 61.00 62.02 1r3n s PRO 267 Cb -0.17 -2.01 0.25 0.00 0.04 0.00 0.00 34.50 32.61 1r3n s PRO 267 CO 0.13 -0.94 1.58 -1.49 0.04 0.00 0.00 177.00 176.32 1r3n h TRP 268 N -0.29 -0.71 0.00 0.56 4.06 -1.97 -0.89 115.95 116.71 1r3n h TRP 268 Ca -0.45 0.08 0.00 0.00 2.06 0.00 0.00 58.89 60.58 1r3n h TRP 268 Cb 1.21 0.43 0.00 0.00 -1.00 0.00 0.00 29.16 29.80 1r3n h TRP 268 CO 0.61 -0.37 0.00 2.89 -3.56 0.00 0.00 178.44 178.02 1r3n n ARG 269 N -5.49 0.24 -0.30 0.49 1.85 -1.26 -2.27 116.66 109.93 1r3n n ARG 269 Ca 0.09 0.08 0.03 0.00 -1.00 0.00 0.00 57.85 57.04 1r3n n ARG 269 Cb 0.39 -1.50 0.04 0.00 -1.05 0.00 0.00 32.46 30.34 1r3n n ARG 269 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1r3n n LEU 270 N -1.11 0.74 -4.96 2.89 4.77 -0.35 -3.06 117.00 115.91 1r3n n LEU 270 Ca 0.06 -1.49 -0.22 0.00 -0.03 0.00 0.00 56.01 54.33 1r3n n LEU 270 Cb 0.05 -0.11 -0.01 0.00 -2.33 0.00 0.00 43.42 41.02 1r3n n LEU 270 CO 0.06 0.36 0.10 0.00 -1.33 0.00 0.00 177.39 176.58 1r3n s ARG 271 N -0.82 3.36 -0.43 3.23 1.70 -0.96 -4.87 118.95 120.16 1r3n s ARG 271 Ca 0.08 -0.60 0.06 0.00 -0.47 0.00 0.00 55.73 54.81 1r3n s ARG 271 Cb 0.07 -2.75 0.22 0.00 -0.57 0.00 0.00 34.95 31.92 1r3n s ARG 271 CO 0.01 0.17 0.47 1.63 -1.08 0.00 0.00 175.30 176.50 1r3n n LYS 272 N -1.68 0.69 -2.50 3.89 5.02 -1.26 -4.11 118.16 118.21 1r3n n LYS 272 Ca -0.05 -3.36 -0.43 0.00 -2.02 0.00 0.00 58.31 52.46 1r3n n LYS 272 Cb 0.57 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 34.07 1r3n n LYS 272 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1r3n s ASP 273 N -0.84 6.61 0.21 4.39 -1.08 -1.26 -1.84 116.67 122.85 1r3n s ASP 273 Ca 0.34 0.82 0.03 0.00 -0.52 0.00 0.00 52.55 53.22 1r3n s ASP 273 Cb 0.11 -2.54 0.16 0.00 -1.46 0.00 0.00 42.92 39.19 1r3n s ASP 273 CO -0.14 -1.20 1.50 0.00 0.52 0.00 0.00 175.17 175.85 1r3n h ALA 274 N 9.45 0.73 0.04 3.66 0.00 -1.66 -2.89 119.26 128.59 1r3n h ALA 274 Ca -0.24 -0.59 -0.24 0.00 0.00 0.00 0.00 54.91 53.83 1r3n h ALA 274 Cb 1.08 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.80 1r3n h ALA 274 CO 1.08 0.78 -1.03 1.25 0.00 0.00 0.00 179.25 181.33 1r3n h LEU 275 N 0.18 0.55 -0.80 0.00 5.85 -1.92 0.05 115.31 119.22 1r3n h LEU 275 Ca -0.02 -0.47 -0.05 0.00 0.84 0.00 0.00 57.88 58.18 1r3n h LEU 275 Cb 1.23 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 42.06 1r3n h LEU 275 CO 0.11 1.29 0.29 0.25 -0.34 0.00 0.00 178.44 180.03 1r3n h LEU 276 N 0.21 1.10 -0.25 2.25 5.85 -1.95 0.43 115.31 122.95 1r3n h LEU 276 Ca -0.10 -0.18 -0.02 0.00 0.84 0.00 0.00 57.88 58.42 1r3n h LEU 276 Cb 1.68 -0.29 -0.01 0.00 0.37 0.00 0.00 40.66 42.42 1r3n h LEU 276 CO 0.18 0.98 0.07 -0.03 -0.34 0.00 0.00 178.44 179.30 1r3n h MET 277 N 1.14 0.39 -0.67 1.25 4.05 -1.37 -1.92 114.93 117.80 1r3n h MET 277 Ca 0.26 -0.09 -0.04 0.00 -0.28 0.00 0.00 59.70 59.55 1r3n h MET 277 Cb 0.25 -0.05 -0.03 0.00 -0.80 0.00 0.00 31.60 30.96 1r3n h MET 277 CO -0.02 0.47 0.27 0.77 0.23 0.00 0.00 176.91 178.64 1r3n h SER 278 N 0.23 0.90 -0.51 1.39 0.02 -0.79 -0.85 113.55 113.93 1r3n h SER 278 Ca 0.08 -0.12 0.01 0.00 -0.84 0.00 0.00 61.79 60.92 1r3n h SER 278 Cb 0.25 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.53 1r3n h SER 278 CO -0.00 0.80 0.33 0.28 -1.14 0.00 0.00 176.83 177.10 1r3n h SER 279 N 0.96 0.56 -0.60 3.07 0.02 -0.64 0.04 113.55 116.97 1r3n h SER 279 Ca 0.23 -0.01 -0.05 0.00 -0.84 0.00 0.00 61.79 61.12 1r3n h SER 279 Cb 0.18 -0.13 -0.03 0.00 0.14 0.00 0.00 62.40 62.56 1r3n h SER 279 CO -0.02 0.40 0.18 0.11 -1.14 0.00 0.00 176.83 176.37 1r3n h LYS 280 N 0.67 0.94 -0.60 3.45 1.57 -0.93 -2.17 116.57 119.49 1r3n h LYS 280 Ca 0.19 -0.21 0.01 0.00 -1.87 0.00 0.00 60.65 58.78 1r3n h LYS 280 Cb -0.05 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.10 1r3n h LYS 280 CO -0.06 0.84 0.40 0.52 -0.57 0.00 0.00 179.45 180.58 1r3n h MET 281 N 0.86 0.78 -0.13 3.15 2.86 -0.65 0.02 114.93 121.83 1r3n h MET 281 Ca 0.19 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.78 1r3n h MET 281 Cb 0.30 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.78 1r3n h MET 281 CO -0.00 0.52 0.06 0.82 1.06 0.00 0.00 176.91 179.36 1r3n h ILE 282 N 0.81 1.13 -0.75 -1.22 2.04 -0.87 0.41 117.51 119.06 1r3n h ILE 282 Ca 0.22 -0.38 0.02 0.00 1.00 0.00 0.00 64.86 65.72 1r3n h ILE 282 Cb -0.08 1.14 -0.04 0.00 -0.74 0.00 0.00 36.82 37.10 1r3n h ILE 282 CO -0.05 0.12 0.49 0.58 0.00 0.00 0.00 178.15 179.28 1r3n h VAL 283 N 0.08 1.15 -0.40 1.67 2.07 -1.19 -1.63 116.25 118.00 1r3n h VAL 283 Ca 0.04 -0.33 -0.07 0.00 0.82 0.00 0.00 66.70 67.16 1r3n h VAL 283 Cb 0.13 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 29.99 1r3n h VAL 283 CO -0.01 0.18 -0.04 0.00 0.02 0.00 0.00 177.57 177.72 1r3n h ALA 284 N 1.29 0.54 -0.73 1.67 0.00 -0.67 -2.01 119.26 119.35 1r3n h ALA 284 Ca 0.29 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1r3n h ALA 284 Cb -0.06 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 1r3n h ALA 284 CO -0.08 0.36 0.39 0.00 0.00 0.00 0.00 179.25 179.92 1r3n h ALA 285 N 0.86 1.33 -0.15 0.00 0.00 -0.74 -1.53 119.26 119.03 1r3n h ALA 285 Ca 0.11 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.93 1r3n h ALA 285 Cb 0.53 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1r3n h ALA 285 CO 0.03 0.55 0.00 0.77 0.00 0.00 0.00 179.25 180.60 1r3n h SER 286 N 1.01 -0.05 0.14 0.00 0.02 -1.02 -1.61 113.55 112.04 1r3n h SER 286 Ca 0.26 0.03 -0.09 0.00 -0.84 0.00 0.00 61.79 61.15 1r3n h SER 286 Cb 0.03 0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 1r3n h SER 286 CO -0.04 -0.01 -0.31 -0.33 -1.14 0.00 0.00 176.83 175.00 1r3n h GLU 287 N 0.05 0.27 -0.17 3.45 5.08 -0.95 -2.44 114.58 119.87 1r3n h GLU 287 Ca 0.07 -0.11 -0.05 0.00 -1.00 0.00 0.00 59.36 58.28 1r3n h GLU 287 Cb 0.08 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 1r3n h GLU 287 CO -0.12 0.56 -0.07 0.82 -1.00 0.00 0.00 179.01 179.20 1r3n h ILE 288 N 0.24 1.31 -0.92 3.13 2.04 -1.04 -2.34 117.51 119.93 1r3n h ILE 288 Ca 0.03 -1.11 0.02 0.00 1.00 0.00 0.00 64.86 64.81 1r3n h ILE 288 Cb 0.68 1.69 -0.05 0.00 -0.74 0.00 0.00 36.82 38.40 1r3n h ILE 288 CO 0.05 0.33 0.61 0.00 0.00 0.00 0.00 178.15 179.13 1r3n h ALA 289 N 0.68 1.20 -0.67 1.87 0.00 -1.16 -2.38 119.26 118.81 1r3n h ALA 289 Ca 0.04 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 1r3n h ALA 289 Cb 0.54 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1r3n h ALA 289 CO 0.02 0.51 0.16 1.96 0.00 0.00 0.00 179.25 181.91 1r3n h GLN 290 N 1.20 1.07 -0.75 0.00 4.20 -1.41 0.61 115.11 120.03 1r3n h GLN 290 Ca 0.35 -0.26 0.08 0.00 0.06 0.00 0.00 58.65 58.88 1r3n h GLN 290 Cb -0.07 -0.14 -0.05 0.00 0.30 0.00 0.00 27.48 27.53 1r3n h GLN 290 CO -0.10 0.95 0.49 0.00 -0.67 0.00 0.00 178.83 179.51 1r3n h ARG 291 N 0.99 0.73 -0.51 1.46 3.08 -0.92 -1.98 114.38 117.24 1r3n h ARG 291 Ca 0.21 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.22 1r3n h ARG 291 Cb 0.37 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.25 1r3n h ARG 291 CO 0.00 0.48 0.00 0.72 -1.07 0.00 0.00 179.97 180.10 1r3n n HIS 292 N -4.49 0.67 -3.12 3.04 8.25 -1.01 -4.95 115.22 113.61 1r3n n HIS 292 Ca 0.12 -0.33 -0.23 0.00 -0.26 0.00 0.00 57.72 57.01 1r3n n HIS 292 Cb 0.26 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.42 1r3n n HIS 292 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1r3n n ASN 293 N 1.44 -6.22 -1.29 0.41 4.05 -0.62 -5.00 115.26 108.03 1r3n n ASN 293 Ca 0.21 -0.33 0.00 0.00 0.45 0.00 0.00 54.58 54.91 1r3n n ASN 293 Cb 0.58 -5.00 0.00 0.00 1.23 0.00 0.00 39.78 36.59 1r3n n ASN 293 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1r3n n GLY 294 N -1.61 4.34 3.21 8.20 0.00 0.11 -4.89 105.19 114.55 1r3n n GLY 294 Ca -0.10 -2.13 -0.23 0.00 0.00 0.00 0.00 46.02 43.56 1r3n n GLY 294 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1r3n s LEU 295 N 0.00 2.19 -0.01 0.99 1.43 0.00 -4.30 118.68 118.98 1r3n s LEU 295 Ca 0.00 -0.52 0.02 0.00 -1.03 0.00 0.00 54.13 52.61 1r3n s LEU 295 Cb 0.00 -0.81 -0.00 0.00 0.03 0.00 0.00 46.19 45.41 1r3n s LEU 295 CO 0.00 0.10 -0.08 0.12 0.23 0.00 0.00 176.35 176.72 1r3n s PHE 296 N -0.87 0.79 -0.03 0.29 5.36 -1.26 -0.91 117.98 121.35 1r3n s PHE 296 Ca 0.05 -0.17 -0.01 0.00 -0.96 0.00 0.00 56.93 55.84 1r3n s PHE 296 Cb -0.09 -0.54 0.02 0.00 -0.34 0.00 0.00 43.02 42.07 1r3n s PHE 296 CO 0.02 -0.05 0.06 0.99 -1.46 0.00 0.00 175.22 174.77 1r3n s THR 297 N 0.01 -0.03 -0.31 0.12 2.01 -0.56 -4.93 115.64 111.97 1r3n s THR 297 Ca 0.00 0.10 -0.06 0.00 0.31 0.00 0.00 61.69 62.04 1r3n s THR 297 Cb -0.06 -0.10 0.02 0.00 0.01 0.00 0.00 72.50 72.37 1r3n s THR 297 CO -0.00 0.04 0.08 0.00 -0.69 0.00 0.00 174.62 174.05 1r3n n GLY 299 N 4.83 -0.40 2.94 0.00 0.00 -1.26 -4.96 105.19 106.34 1r3n n GLY 299 Ca -0.14 -0.41 -0.20 0.00 0.00 0.00 0.00 46.02 45.27 1r3n n GLY 299 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1r3n s ILE 300 N -2.43 0.64 -0.13 -0.61 1.01 -1.26 -5.03 121.20 113.39 1r3n s ILE 300 Ca 0.05 -0.22 -0.10 0.00 0.00 0.00 0.00 60.65 60.37 1r3n s ILE 300 Cb 0.11 -0.62 0.04 0.00 0.01 0.00 0.00 42.46 42.00 1r3n s ILE 300 CO 0.60 0.23 0.33 -0.51 0.00 0.00 0.00 174.94 175.59 1r3n s ILE 301 N 0.60 -0.01 -0.08 2.92 2.07 -1.26 -1.78 121.20 123.66 1r3n s ILE 301 Ca -0.09 0.05 -0.04 0.00 -1.41 0.00 0.00 60.65 59.16 1r3n s ILE 301 Cb -0.12 -0.48 0.04 0.00 0.13 0.00 0.00 42.46 42.03 1r3n s ILE 301 CO 0.01 0.02 0.18 -1.81 -1.91 0.00 0.00 174.94 171.42 1r3n s ASP 302 N 0.63 -0.13 -0.06 4.50 1.01 -0.04 -5.00 116.67 117.57 1r3n s ASP 302 Ca -0.04 0.37 0.03 0.00 0.71 0.00 0.00 52.55 53.62 1r3n s ASP 302 Cb -0.05 0.26 -0.03 0.00 1.01 0.00 0.00 42.92 44.11 1r3n s ASP 302 CO -0.04 -0.16 -0.12 0.00 0.21 0.00 0.00 175.17 175.06 1r3n s ALA 303 N 1.24 2.74 0.09 5.23 0.00 -1.26 -1.15 121.76 128.65 1r3n s ALA 303 Ca -0.09 -0.96 0.06 0.00 0.00 0.00 0.00 51.96 50.98 1r3n s ALA 303 Cb -0.11 -1.04 -0.04 0.00 0.00 0.00 0.00 23.12 21.93 1r3n s ALA 303 CO -0.07 0.55 -0.08 0.15 0.00 0.00 0.00 175.76 176.31 1r3n s LYS 304 N -0.72 2.22 -0.01 0.00 1.02 0.48 -3.38 119.74 119.35 1r3n s LYS 304 Ca 0.11 -0.97 0.08 0.00 0.02 0.00 0.00 55.97 55.21 1r3n s LYS 304 Cb -0.11 -2.36 0.25 0.00 -0.52 0.00 0.00 37.83 35.09 1r3n s LYS 304 CO 0.01 0.52 1.17 -2.30 -0.92 0.00 0.00 175.35 173.83 1r3n n PRO 305 N 0.75 1.73 -2.09 -1.68 -0.02 -1.26 -1.42 135.00 131.00 1r3n n PRO 305 Ca -0.13 -1.00 -0.01 0.00 -2.02 0.00 0.00 63.50 60.34 1r3n n PRO 305 Cb 0.52 -1.28 0.00 0.00 -0.02 0.00 0.00 33.50 32.72 1r3n n PRO 305 CO 0.00 0.00 0.00 0.98 1.98 0.00 0.00 175.50 178.46 1r3n n TYR 306 N 0.29 -1.24 -3.75 6.00 9.36 -1.22 -5.10 117.16 121.51 1r3n n TYR 306 Ca 0.09 0.48 -0.13 0.00 3.32 0.00 0.00 57.90 61.66 1r3n n TYR 306 Cb 0.27 -2.53 -0.10 0.00 -0.63 0.00 0.00 39.34 36.36 1r3n n TYR 306 CO 0.00 0.00 0.00 -1.12 0.22 0.00 0.00 176.86 175.96 1r3n s SER 307 N -2.16 -0.28 0.45 2.98 0.01 -1.26 -5.03 113.70 108.41 1r3n s SER 307 Ca 0.03 0.39 0.13 0.00 1.31 0.00 0.00 55.95 57.81 1r3n s SER 307 Cb -0.01 0.51 1.06 0.00 0.21 0.00 0.00 66.02 67.79 1r3n s SER 307 CO 0.30 -0.29 2.04 0.58 0.41 0.00 0.00 173.24 176.28 1r3n h VAL 308 N 4.20 0.97 -0.52 3.43 2.07 -2.04 -3.04 116.25 121.32 1r3n h VAL 308 Ca -0.28 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.12 1r3n h VAL 308 Cb 1.18 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 31.56 1r3n h VAL 308 CO 0.34 0.06 0.00 -0.46 0.02 0.00 0.00 177.57 177.54 1r3n n ASN 309 N -4.48 3.42 -4.27 0.57 6.94 -1.26 -4.91 115.26 111.26 1r3n n ASN 309 Ca 0.05 -1.98 -0.32 0.00 -0.02 0.00 0.00 54.58 52.31 1r3n n ASN 309 Cb 0.23 -0.34 -0.16 0.00 -2.36 0.00 0.00 39.78 37.14 1r3n n ASN 309 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1r3n s ILE 310 N -1.05 2.37 0.10 1.53 -1.09 -1.15 0.36 121.20 122.27 1r3n s ILE 310 Ca 0.36 -0.91 -0.31 0.00 -2.23 0.00 0.00 60.65 57.56 1r3n s ILE 310 Cb 0.19 -1.93 -0.10 0.00 -1.58 0.00 0.00 42.46 39.04 1r3n s ILE 310 CO 0.25 0.55 1.87 -0.63 -1.23 0.00 0.00 174.94 175.75 1r3n s ILE 311 N 0.28 2.65 0.17 2.92 1.01 0.11 -4.68 121.20 123.67 1r3n s ILE 311 Ca -0.15 0.04 -0.32 0.00 0.00 0.00 0.00 60.65 60.22 1r3n s ILE 311 Cb -0.17 -3.02 -0.11 0.00 0.01 0.00 0.00 42.46 39.17 1r3n s ILE 311 CO 0.07 -0.00 1.66 -2.84 0.00 0.00 0.00 174.94 173.84 1r3n s PRO 312 N 3.19 4.17 0.03 2.79 0.02 -1.26 -3.03 135.00 140.91 1r3n s PRO 312 Ca 0.83 2.49 0.23 0.00 0.02 0.00 0.00 61.00 64.56 1r3n s PRO 312 Cb -0.45 -3.19 0.02 0.00 0.02 0.00 0.00 34.50 30.90 1r3n s PRO 312 CO 0.38 -0.70 1.01 0.41 -0.33 0.00 0.00 177.00 177.77 1r3n n GLY 313 N 3.91 -1.16 3.03 0.52 0.00 -0.51 -1.75 105.19 109.23 1r3n n GLY 313 Ca 0.15 -0.44 -0.13 0.00 0.00 0.00 0.00 46.02 45.60 1r3n n GLY 313 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1r3n s GLU 314 N -3.16 0.18 -0.03 1.61 2.12 -1.15 0.10 118.70 118.37 1r3n s GLU 314 Ca 0.04 0.41 0.01 0.00 0.36 0.00 0.00 54.97 55.80 1r3n s GLU 314 Cb 0.15 -0.07 0.02 0.00 0.26 0.00 0.00 34.13 34.49 1r3n s GLU 314 CO 0.81 -0.12 -0.04 0.08 -0.54 0.00 0.00 175.26 175.45 1r3n s VAL 315 N 0.89 0.46 -0.08 3.70 1.01 -0.63 -0.39 120.40 125.36 1r3n s VAL 315 Ca -0.06 -0.11 0.04 0.00 0.00 0.00 0.00 61.98 61.84 1r3n s VAL 315 Cb -0.08 -0.47 -0.01 0.00 0.00 0.00 0.00 36.38 35.81 1r3n s VAL 315 CO -0.05 0.19 -0.19 -0.44 0.00 0.00 0.00 175.10 174.61 1r3n s SER 316 N 0.72 3.56 0.09 3.32 0.01 -0.30 0.01 113.70 121.12 1r3n s SER 316 Ca -0.09 -0.39 -0.06 0.00 1.31 0.00 0.00 55.95 56.72 1r3n s SER 316 Cb -0.12 -1.12 -0.02 0.00 0.21 0.00 0.00 66.02 64.98 1r3n s SER 316 CO -0.00 0.24 0.13 0.72 0.41 0.00 0.00 173.24 174.74 1r3n s PHE 317 N -0.10 0.35 0.14 2.43 -0.12 -0.27 -0.86 117.98 119.54 1r3n s PHE 317 Ca -0.04 -0.80 0.05 0.00 -0.05 0.00 0.00 56.93 56.10 1r3n s PHE 317 Cb -0.14 -0.19 -0.04 0.00 -0.63 0.00 0.00 43.02 42.02 1r3n s PHE 317 CO 0.04 -0.52 0.06 0.95 -0.05 0.00 0.00 175.22 175.70 1r3n s THR 318 N -3.91 4.18 -0.13 -4.49 -4.23 -0.73 -0.72 115.64 105.60 1r3n s THR 318 Ca 0.09 -1.10 0.01 0.00 -1.18 0.00 0.00 61.69 59.51 1r3n s THR 318 Cb 0.06 -3.07 0.02 0.00 1.34 0.00 0.00 72.50 70.85 1r3n s THR 318 CO -0.08 -0.02 -0.13 -0.76 -0.54 0.00 0.00 174.62 173.09 1r3n s LEU 319 N -2.76 1.60 -0.46 4.79 1.43 0.14 -4.16 118.68 119.26 1r3n s LEU 319 Ca 0.28 -0.43 -0.01 0.00 -1.03 0.00 0.00 54.13 52.94 1r3n s LEU 319 Cb -0.11 -1.08 0.12 0.00 0.03 0.00 0.00 46.19 45.16 1r3n s LEU 319 CO 0.21 -0.04 0.25 -0.62 0.23 0.00 0.00 176.35 176.37 1r3n s ASP 320 N 1.36 5.10 -0.08 2.29 -1.08 0.28 -0.45 116.67 124.08 1r3n s ASP 320 Ca 0.01 -2.35 -0.10 0.00 -0.52 0.00 0.00 52.55 49.59 1r3n s ASP 320 Cb -0.13 -1.79 -0.05 0.00 -1.46 0.00 0.00 42.92 39.49 1r3n s ASP 320 CO -0.07 -0.45 0.24 -0.36 0.52 0.00 0.00 175.17 175.05 1r3n s PHE 321 N 0.67 3.64 -0.01 -5.34 0.40 -0.36 -1.49 117.98 115.49 1r3n s PHE 321 Ca 0.12 0.69 -0.01 0.00 -0.60 0.00 0.00 56.93 57.12 1r3n s PHE 321 Cb -0.22 -2.07 0.00 0.00 0.51 0.00 0.00 43.02 41.24 1r3n s PHE 321 CO -0.04 0.69 0.03 1.03 0.70 0.00 0.00 175.22 177.63 1r3n s ARG 322 N -0.99 0.08 -0.18 0.44 0.52 -0.09 -1.21 118.95 117.51 1r3n s ARG 322 Ca 0.18 -0.04 -0.26 0.00 -0.52 0.00 0.00 55.73 55.09 1r3n s ARG 322 Cb -0.14 0.03 0.07 0.00 0.52 0.00 0.00 34.95 35.44 1r3n s ARG 322 CO 0.07 -0.01 0.68 -1.58 0.02 0.00 0.00 175.30 174.47 1r3n s HIS 323 N -0.19 -0.71 0.42 -0.53 2.46 -0.93 -0.82 115.29 114.99 1r3n s HIS 323 Ca -0.02 1.57 0.18 0.00 0.47 0.00 0.00 55.06 57.26 1r3n s HIS 323 Cb -0.02 0.30 1.09 0.00 -0.13 0.00 0.00 32.58 33.83 1r3n s HIS 323 CO -0.00 -0.44 1.84 -1.35 -2.47 0.00 0.00 174.74 172.31 1r3n h PRO 324 N 4.35 0.39 -5.42 2.88 0.11 -1.90 0.24 132.00 132.65 1r3n h PRO 324 Ca -0.28 -0.02 -0.63 0.00 0.11 0.00 0.00 66.00 65.17 1r3n h PRO 324 Cb 1.16 -0.09 -0.13 0.00 0.11 0.00 0.00 31.00 32.05 1r3n h PRO 324 CO 0.18 0.26 -0.53 0.45 -0.21 0.00 0.00 178.00 178.15 1r3n s SER 325 N -5.56 5.89 0.27 -2.05 0.15 -1.26 -4.44 113.70 106.69 1r3n s SER 325 Ca -0.08 0.21 -0.04 0.00 0.70 0.00 0.00 55.95 56.73 1r3n s SER 325 Cb 0.23 -1.97 0.34 0.00 -1.71 0.00 0.00 66.02 62.92 1r3n s SER 325 CO 0.79 0.25 1.90 0.44 1.20 0.00 0.00 173.24 177.81 1r3n h ASP 326 N 6.17 1.00 -0.31 5.45 5.19 -1.97 -2.24 116.42 129.71 1r3n h ASP 326 Ca -0.43 -0.07 -0.16 0.00 -0.62 0.00 0.00 57.03 55.74 1r3n h ASP 326 Cb 1.18 -0.25 -0.00 0.00 0.18 0.00 0.00 39.33 40.43 1r3n h ASP 326 CO 0.68 0.79 -0.45 0.44 -3.12 0.00 0.00 179.24 177.58 1r3n h ASP 327 N 1.14 0.93 0.65 6.45 3.32 -1.96 -2.03 116.42 124.91 1r3n h ASP 327 Ca 0.29 -0.51 -0.08 0.00 0.02 0.00 0.00 57.03 56.75 1r3n h ASP 327 Cb -0.00 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.27 1r3n h ASP 327 CO -0.05 1.25 -0.39 0.58 -1.72 0.00 0.00 179.24 178.92 1r3n h VAL 328 N 0.63 1.03 -0.32 -1.35 2.07 -1.96 -1.50 116.25 114.85 1r3n h VAL 328 Ca 0.03 -1.46 -0.06 0.00 0.82 0.00 0.00 66.70 66.02 1r3n h VAL 328 Cb 1.05 1.85 -0.01 0.00 -1.52 0.00 0.00 31.29 32.66 1r3n h VAL 328 CO 0.10 0.38 -0.05 0.25 0.02 0.00 0.00 177.57 178.28 1r3n h LEU 329 N 0.00 0.59 -0.95 2.57 5.85 -1.28 -0.60 115.31 121.49 1r3n h LEU 329 Ca -0.00 -0.34 -0.00 0.00 0.84 0.00 0.00 57.88 58.37 1r3n h LEU 329 Cb 0.82 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.64 1r3n h LEU 329 CO 0.05 0.79 0.57 0.00 -0.34 0.00 0.00 178.44 179.52 1r3n h ALA 330 N 0.81 1.21 -0.65 1.25 0.00 -1.09 -1.63 119.26 119.16 1r3n h ALA 330 Ca 0.08 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 1r3n h ALA 330 Cb 0.52 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 1r3n h ALA 330 CO 0.03 0.66 0.14 1.15 0.00 0.00 0.00 179.25 181.22 1r3n h THR 331 N 1.30 1.26 -0.49 0.00 2.02 -1.11 -1.89 112.91 114.00 1r3n h THR 331 Ca 0.34 -0.97 0.00 0.00 0.77 0.00 0.00 66.41 66.56 1r3n h THR 331 Cb -0.06 0.63 -0.02 0.00 -1.74 0.00 0.00 68.15 66.96 1r3n h THR 331 CO -0.06 0.37 0.33 0.24 0.37 0.00 0.00 175.52 176.76 1r3n h MET 332 N 0.98 0.65 -0.48 6.66 2.07 -0.62 -1.35 114.93 122.84 1r3n h MET 332 Ca 0.20 -0.04 -0.13 0.00 -2.07 0.00 0.00 59.70 57.66 1r3n h MET 332 Cb 0.39 -0.15 -0.01 0.00 -1.87 0.00 0.00 31.60 29.96 1r3n h MET 332 CO 0.01 0.43 -0.22 -0.07 1.07 0.00 0.00 176.91 178.13 1r3n h LEU 333 N 0.67 1.01 -0.67 1.22 3.38 -1.17 -1.07 115.31 118.68 1r3n h LEU 333 Ca 0.18 -0.39 -0.08 0.00 0.09 0.00 0.00 57.88 57.68 1r3n h LEU 333 Cb -0.08 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.37 1r3n h LEU 333 CO -0.04 1.18 0.11 0.50 0.09 0.00 0.00 178.44 180.29 1r3n h LYS 334 N 0.85 1.11 -0.06 1.13 3.64 -1.14 -0.73 116.57 121.38 1r3n h LYS 334 Ca 0.11 -0.30 -0.18 0.00 -1.27 0.00 0.00 60.65 59.02 1r3n h LYS 334 Cb 0.80 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.48 1r3n h LYS 334 CO 0.07 1.02 -0.73 0.93 -2.27 0.00 0.00 179.45 178.47 1r3n h GLU 335 N 1.04 0.31 0.11 1.90 5.08 -1.18 -2.18 114.58 119.65 1r3n h GLU 335 Ca 0.20 -0.26 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1r3n h GLU 335 Cb 0.44 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.75 1r3n h GLU 335 CO 0.01 0.91 -0.05 0.00 -1.00 0.00 0.00 179.01 178.88 1r3n h ALA 336 N 1.02 -0.14 -0.82 3.43 0.00 -1.06 -1.93 119.26 119.75 1r3n h ALA 336 Ca -0.03 -0.14 0.14 0.00 0.00 0.00 0.00 54.91 54.89 1r3n h ALA 336 Cb 1.29 0.06 -0.09 0.00 0.00 0.00 0.00 17.79 19.05 1r3n h ALA 336 CO 0.12 -0.46 0.41 0.00 0.00 0.00 0.00 179.25 179.32 1r3n h ALA 337 N 0.47 1.22 -0.62 0.00 0.00 -1.11 0.13 119.26 119.36 1r3n h ALA 337 Ca -0.01 0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 1r3n h ALA 337 Cb 0.32 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1r3n h ALA 337 CO 0.02 -0.10 0.15 0.00 0.00 0.00 0.00 179.25 179.32 1r3n h ALA 338 N 1.55 0.81 -0.06 0.00 0.00 -1.34 -0.28 119.26 119.94 1r3n h ALA 338 Ca 0.45 -0.23 -0.15 0.00 0.00 0.00 0.00 54.91 54.98 1r3n h ALA 338 Cb 0.62 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1r3n h ALA 338 CO -0.36 0.52 -0.62 1.49 0.00 0.00 0.00 179.25 180.28 1r3n h GLU 339 N 0.90 0.21 -0.32 0.00 4.57 -0.44 -1.94 114.58 117.56 1r3n h GLU 339 Ca 0.19 -0.15 -0.08 0.00 -1.18 0.00 0.00 59.36 58.15 1r3n h GLU 339 Cb 0.35 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.96 1r3n h GLU 339 CO 0.00 0.77 -0.10 0.74 -1.18 0.00 0.00 179.01 179.24 1r3n h PHE 340 N 0.15 0.72 0.00 0.92 0.05 -0.61 -0.75 116.94 117.43 1r3n h PHE 340 Ca -0.01 -0.16 -0.01 0.00 3.82 0.00 0.00 57.97 61.61 1r3n h PHE 340 Cb 1.13 -0.17 -0.00 0.00 2.00 0.00 0.00 35.95 38.91 1r3n h PHE 340 CO 0.02 0.82 -0.03 -0.44 -0.18 0.00 0.00 178.31 178.50 1r3n h ASP 341 N 0.40 0.00 0.00 2.17 3.32 -0.88 -1.69 116.42 119.74 1r3n h ASP 341 Ca 0.08 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.06 1r3n h ASP 341 Cb 0.60 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.14 1r3n h ASP 341 CO 0.04 0.03 -0.40 -0.09 -1.72 0.00 0.00 179.24 177.10 1r3n h ARG 342 N 0.00 0.00 -0.93 3.56 2.43 -1.15 -3.39 114.38 114.89 1r3n h ARG 342 Ca -0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 1r3n h ARG 342 Cb 0.31 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.82 1r3n h ARG 342 CO 0.00 0.75 0.56 -0.07 -1.51 0.00 0.00 179.97 179.70 1r3n h LEU 343 N -1.00 1.13 -2.39 3.80 3.38 -0.93 -2.39 115.31 116.92 1r3n h LEU 343 Ca -0.10 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1r3n h LEU 343 Cb 0.88 -0.29 0.00 0.00 0.09 0.00 0.00 40.66 41.35 1r3n h LEU 343 CO -0.06 0.87 0.02 0.16 0.09 0.00 0.00 178.44 179.52 1r3n h ILE 344 N 1.29 0.00 0.00 1.22 3.07 -1.51 -1.30 117.51 120.28 1r3n h ILE 344 Ca 0.33 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.74 1r3n h ILE 344 Cb -0.04 0.80 0.00 0.00 -0.27 0.00 0.00 36.82 37.30 1r3n h ILE 344 CO -0.06 0.00 -1.07 0.29 -1.05 0.00 0.00 178.15 176.26 1r3n n LYS 345 N -2.77 0.34 -2.74 0.16 4.76 -0.90 -1.78 118.16 115.22 1r3n n LYS 345 Ca -0.02 -0.00 -0.43 0.00 -2.87 0.00 0.00 58.31 54.99 1r3n n LYS 345 Cb 0.08 -1.61 -0.02 0.00 -1.84 0.00 0.00 35.03 31.63 1r3n n LYS 345 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1r3n s ILE 346 N -3.23 4.36 -0.30 -0.18 -1.09 -0.49 -4.61 121.20 115.66 1r3n s ILE 346 Ca 0.03 -1.37 -0.13 0.00 -2.23 0.00 0.00 60.65 56.95 1r3n s ILE 346 Cb 0.14 -4.95 0.14 0.00 -1.58 0.00 0.00 42.46 36.21 1r3n s ILE 346 CO 0.80 -1.75 0.81 0.21 -1.23 0.00 0.00 174.94 173.78 1r3n s ASN 347 N 4.18 -0.87 0.36 3.58 2.47 -1.26 -5.04 114.94 118.35 1r3n s ASN 347 Ca 0.41 1.22 0.08 0.00 0.42 0.00 0.00 52.86 54.99 1r3n s ASN 347 Cb -0.02 1.94 0.79 0.00 -1.45 0.00 0.00 41.25 42.52 1r3n s ASN 347 CO -0.07 -0.17 1.90 0.44 -3.72 0.00 0.00 177.10 175.48 1r3n h ASP 348 N 7.65 0.65 0.00 -4.21 3.32 -1.88 -0.93 116.42 121.02 1r3n h ASP 348 Ca -0.18 0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.89 1r3n h ASP 348 Cb 1.12 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.56 1r3n h ASP 348 CO 0.10 0.37 0.00 0.61 -1.72 0.00 0.00 179.24 178.60 1r3n n GLY 349 N -1.44 -0.86 0.00 2.75 0.00 -1.17 -4.86 105.19 99.60 1r3n n GLY 349 Ca 0.15 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1r3n n GLY 349 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r3n n GLY 350 N 0.65 3.00 3.74 -0.02 0.00 -0.35 -4.84 105.19 107.37 1r3n n GLY 350 Ca 0.16 -1.95 -0.41 0.00 0.00 0.00 0.00 46.02 43.82 1r3n n GLY 350 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r3n s ALA 351 N -2.97 3.47 0.93 4.61 0.00 -1.26 -4.56 121.76 121.98 1r3n s ALA 351 Ca 0.00 1.03 -0.12 0.00 0.00 0.00 0.00 51.96 52.86 1r3n s ALA 351 Cb 0.00 -3.44 0.21 0.00 0.00 0.00 0.00 23.12 19.89 1r3n s ALA 351 CO 0.00 -0.44 1.27 -0.51 0.00 0.00 0.00 175.76 176.08 1r3n s LEU 352 N -0.35 2.81 0.11 0.00 1.02 -0.74 -5.02 118.68 116.51 1r3n s LEU 352 Ca 0.54 -0.03 0.00 0.00 0.02 0.00 0.00 54.13 54.66 1r3n s LEU 352 Cb -0.35 -1.98 -0.04 0.00 0.02 0.00 0.00 46.19 43.84 1r3n s LEU 352 CO 0.38 -2.68 -0.01 -0.94 0.02 0.00 0.00 176.35 173.13 1r3n s SER 353 N -4.92 0.79 0.02 2.29 1.04 -1.05 -4.71 113.70 107.15 1r3n s SER 353 Ca 0.74 -1.09 -0.06 0.00 0.48 0.00 0.00 55.95 56.02 1r3n s SER 353 Cb -0.03 0.18 -0.00 0.00 0.10 0.00 0.00 66.02 66.27 1r3n s SER 353 CO 0.52 -0.59 0.11 -0.72 0.98 0.00 0.00 173.24 173.54 1r3n s TYR 354 N -3.81 0.11 0.15 5.02 -0.85 -1.26 0.09 117.35 116.80 1r3n s TYR 354 Ca 0.17 -0.29 0.09 0.00 -0.52 0.00 0.00 57.07 56.52 1r3n s TYR 354 Cb 0.07 -0.09 -0.04 0.00 0.38 0.00 0.00 41.96 42.28 1r3n s TYR 354 CO -0.02 -0.31 -0.21 -1.21 -1.52 0.00 0.00 175.55 172.28 1r3n s GLU 355 N -1.81 1.29 0.03 -3.49 0.41 -0.46 -4.98 118.70 109.68 1r3n s GLU 355 Ca -0.12 -1.35 0.06 0.00 -0.41 0.00 0.00 54.97 53.16 1r3n s GLU 355 Cb -0.06 -1.50 -0.02 0.00 -1.78 0.00 0.00 34.13 30.77 1r3n s GLU 355 CO -0.01 0.33 -0.18 0.45 -0.49 0.00 0.00 175.26 175.36 1r3n s SER 356 N -2.38 2.13 -0.07 -0.19 0.15 -1.26 -0.91 113.70 111.17 1r3n s SER 356 Ca 0.14 -0.45 -0.03 0.00 0.70 0.00 0.00 55.95 56.30 1r3n s SER 356 Cb -0.08 -0.18 0.04 0.00 -1.71 0.00 0.00 66.02 64.09 1r3n s SER 356 CO 0.06 0.13 0.15 -0.70 1.20 0.00 0.00 173.24 174.09 1r3n s GLU 357 N -0.99 0.09 -0.08 5.44 2.12 0.31 -4.98 118.70 120.61 1r3n s GLU 357 Ca 0.06 0.38 -0.30 0.00 0.36 0.00 0.00 54.97 55.47 1r3n s GLU 357 Cb -0.08 -0.19 -0.02 0.00 0.26 0.00 0.00 34.13 34.10 1r3n s GLU 357 CO 0.01 -0.17 1.11 0.99 -0.54 0.00 0.00 175.26 176.65 1r3n s THR 358 N 1.23 4.51 -0.16 -1.70 2.01 -1.26 -0.01 115.64 120.26 1r3n s THR 358 Ca -0.09 1.81 -0.18 0.00 0.31 0.00 0.00 61.69 63.54 1r3n s THR 358 Cb -0.12 -4.16 -0.23 0.00 0.01 0.00 0.00 72.50 68.00 1r3n s THR 358 CO -0.06 -0.00 0.37 -0.07 -0.69 0.00 0.00 174.62 174.17 1r3n h LEU 359 N 8.14 0.17 -7.00 4.42 3.38 -1.45 -3.48 115.31 119.49 1r3n h LEU 359 Ca -0.32 -0.71 0.02 0.00 0.09 0.00 0.00 57.88 56.95 1r3n h LEU 359 Cb 1.15 -0.05 -0.17 0.00 0.09 0.00 0.00 40.66 41.68 1r3n h LEU 359 CO 0.87 1.54 0.33 -1.58 0.09 0.00 0.00 178.44 179.70 1r3n s GLN 360 N -2.41 0.99 -0.02 1.13 0.74 -1.23 -5.02 119.66 113.83 1r3n s GLN 360 Ca -0.25 -0.11 -0.11 0.00 0.05 0.00 0.00 55.36 54.94 1r3n s GLN 360 Cb 0.05 0.46 0.02 0.00 1.10 0.00 0.00 33.01 34.63 1r3n s GLN 360 CO 0.67 -0.38 0.23 0.08 -0.55 0.00 0.00 175.29 175.35 1r3n s VAL 361 N -2.40 0.06 -0.26 1.34 1.01 -1.26 -0.69 120.40 118.19 1r3n s VAL 361 Ca -0.02 -0.46 -0.08 0.00 0.00 0.00 0.00 61.98 61.42 1r3n s VAL 361 Cb -0.01 -0.49 0.12 0.00 0.00 0.00 0.00 36.38 36.00 1r3n s VAL 361 CO -0.03 -0.25 0.55 -0.55 0.00 0.00 0.00 175.10 174.82 1r3n s SER 362 N -1.05 -0.76 0.71 3.32 0.15 -0.28 -4.99 113.70 110.79 1r3n s SER 362 Ca -0.11 1.26 -0.12 0.00 0.70 0.00 0.00 55.95 57.68 1r3n s SER 362 Cb -0.05 1.88 0.02 0.00 -1.71 0.00 0.00 66.02 66.16 1r3n s SER 362 CO 0.02 -0.23 1.08 -2.16 1.20 0.00 0.00 173.24 173.15 1r3n s PRO 363 N 2.77 2.71 0.72 5.44 0.04 -1.26 -0.31 135.00 145.12 1r3n s PRO 363 Ca -0.02 1.13 -0.15 0.00 0.04 0.00 0.00 61.00 62.00 1r3n s PRO 363 Cb -0.12 -1.96 0.04 0.00 0.04 0.00 0.00 34.50 32.50 1r3n s PRO 363 CO -0.17 -1.29 1.21 0.00 0.04 0.00 0.00 177.00 176.80 1r3n s ALA 364 N -2.82 2.14 -0.15 8.56 0.00 -1.26 -4.55 121.76 123.68 1r3n s ALA 364 Ca 0.61 0.89 0.01 0.00 0.00 0.00 0.00 51.96 53.47 1r3n s ALA 364 Cb -0.16 -3.47 -0.00 0.00 0.00 0.00 0.00 23.12 19.48 1r3n s ALA 364 CO 0.51 -1.85 -0.17 0.08 0.00 0.00 0.00 175.76 174.33 1r3n s VAL 365 N -1.96 2.52 -0.30 0.00 1.01 -0.33 -4.93 120.40 116.42 1r3n s VAL 365 Ca 0.75 -0.83 -0.10 0.00 0.00 0.00 0.00 61.98 61.80 1r3n s VAL 365 Cb -0.29 -2.05 -0.02 0.00 0.00 0.00 0.00 36.38 34.02 1r3n s VAL 365 CO 0.45 0.53 0.16 0.20 0.00 0.00 0.00 175.10 176.43 1r3n s ASN 366 N 0.75 5.64 0.75 3.32 -0.87 -1.26 -0.89 114.94 122.38 1r3n s ASN 366 Ca -0.07 -0.34 -0.11 0.00 -1.57 0.00 0.00 52.86 50.77 1r3n s ASN 366 Cb -0.16 -2.03 0.04 0.00 -0.02 0.00 0.00 41.25 39.09 1r3n s ASN 366 CO 0.01 -0.14 1.08 -0.36 -2.57 0.00 0.00 177.10 175.12 1r3n s PHE 367 N 1.66 2.77 0.15 2.20 0.08 -0.67 -4.96 117.98 119.20 1r3n s PHE 367 Ca 0.06 1.48 -0.30 0.00 0.12 0.00 0.00 56.93 58.28 1r3n s PHE 367 Cb -0.16 -3.00 -0.07 0.00 -0.57 0.00 0.00 43.02 39.22 1r3n s PHE 367 CO 0.07 -1.63 1.17 -1.58 -0.10 0.00 0.00 175.22 173.15 1r3n s HIS 368 N -2.97 3.48 0.39 0.36 2.46 -0.62 -4.93 115.29 113.46 1r3n s HIS 368 Ca 0.60 1.44 0.12 0.00 0.47 0.00 0.00 55.06 57.69 1r3n s HIS 368 Cb -0.16 -3.38 0.91 0.00 -0.13 0.00 0.00 32.58 29.83 1r3n s HIS 368 CO 0.56 -1.04 1.91 1.05 -2.47 0.00 0.00 174.74 174.75 1r3n h GLU 369 N 5.64 0.56 -0.23 2.88 4.11 -1.93 -0.89 114.58 124.72 1r3n h GLU 369 Ca -0.44 -0.03 -0.14 0.00 0.07 0.00 0.00 59.36 58.83 1r3n h GLU 369 Cb 1.21 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 30.34 1r3n h GLU 369 CO 0.76 0.37 -0.38 0.28 0.07 0.00 0.00 179.01 180.10 1r3n h VAL 370 N 0.57 1.31 -0.44 -1.06 2.07 -1.97 -2.27 116.25 114.47 1r3n h VAL 370 Ca 0.39 -1.59 -0.09 0.00 0.82 0.00 0.00 66.70 66.22 1r3n h VAL 370 Cb 0.70 1.76 -0.02 0.00 -1.52 0.00 0.00 31.29 32.21 1r3n h VAL 370 CO -0.15 0.50 -0.10 0.00 0.02 0.00 0.00 177.57 177.84 1r3n h ILE 372 N 0.72 1.21 -0.48 0.00 2.04 -1.15 -1.68 117.51 118.17 1r3n h ILE 372 Ca 0.12 -0.53 -0.06 0.00 1.00 0.00 0.00 64.86 65.39 1r3n h ILE 372 Cb 0.58 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 37.01 1r3n h ILE 372 CO 0.04 0.23 0.05 -0.08 0.00 0.00 0.00 178.15 178.39 1r3n h GLU 373 N 0.90 0.76 -0.39 2.37 4.57 -1.18 0.16 114.58 121.75 1r3n h GLU 373 Ca 0.23 -0.17 -0.06 0.00 -1.18 0.00 0.00 59.36 58.17 1r3n h GLU 373 Cb 0.05 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 28.53 1r3n h GLU 373 CO -0.04 0.73 -0.00 0.00 -1.18 0.00 0.00 179.01 178.52 1r3n h VAL 375 N 0.52 1.21 0.17 0.00 2.07 -0.98 -2.17 116.25 117.07 1r3n h VAL 375 Ca 0.11 -0.68 -0.00 0.00 0.82 0.00 0.00 66.70 66.95 1r3n h VAL 375 Cb 0.48 1.28 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 1r3n h VAL 375 CO 0.02 0.21 -0.12 0.28 0.02 0.00 0.00 177.57 177.98 1r3n h SER 376 N 0.13 -0.32 0.13 0.57 0.02 -0.66 0.47 113.55 113.89 1r3n h SER 376 Ca 0.06 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.01 1r3n h SER 376 Cb 0.28 0.10 -0.00 0.00 0.14 0.00 0.00 62.40 62.92 1r3n h SER 376 CO 0.00 -0.20 -0.12 0.03 -1.14 0.00 0.00 176.83 175.41 1r3n h ARG 377 N -0.30 0.00 -0.14 3.45 2.47 -1.25 0.12 114.38 118.73 1r3n h ARG 377 Ca -0.01 0.00 -0.09 0.00 -1.26 0.00 0.00 59.98 58.62 1r3n h ARG 377 Cb 0.26 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.58 1r3n h ARG 377 CO -0.00 0.12 -0.26 1.03 0.56 0.00 0.00 179.97 181.41 1r3n h SER 378 N 0.00 0.47 -0.03 7.04 0.87 -0.98 -3.01 113.55 117.91 1r3n h SER 378 Ca -0.00 -0.55 -0.01 0.00 -1.23 0.00 0.00 61.79 60.00 1r3n h SER 378 Cb 0.22 -0.14 -0.00 0.00 -0.44 0.00 0.00 62.40 62.04 1r3n h SER 378 CO 0.02 0.94 -0.01 0.00 -0.53 0.00 0.00 176.83 177.24 1r3n h ALA 379 N 0.55 0.04 0.00 6.23 0.00 -0.01 -3.13 119.26 122.94 1r3n h ALA 379 Ca 0.01 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1r3n h ALA 379 Cb 0.85 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1r3n h ALA 379 CO 0.06 -0.23 0.00 0.74 0.00 0.00 0.00 179.25 179.82 1r3n h PHE 380 N -0.33 0.00 0.00 0.00 0.05 -0.94 0.11 116.94 115.83 1r3n h PHE 380 Ca 0.01 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.80 1r3n h PHE 380 Cb 0.44 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.39 1r3n h PHE 380 CO 0.07 0.00 -0.05 0.00 -0.18 0.00 0.00 178.31 178.15 1r3n h ALA 381 N 2.03 0.97 0.00 2.45 0.00 -1.47 -3.35 119.26 119.88 1r3n h ALA 381 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1r3n h ALA 381 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1r3n h ALA 381 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 179.25 180.29 1r3n n GLN 382 N -2.35 3.55 -4.03 0.00 6.02 -0.64 -5.06 117.38 114.87 1r3n n GLN 382 Ca 0.05 -0.10 -0.10 0.00 -0.01 0.00 0.00 57.00 56.85 1r3n n GLN 382 Cb 0.44 -0.50 -0.11 0.00 1.02 0.00 0.00 30.24 31.09 1r3n n GLN 382 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1r3n s PHE 383 N -0.54 0.44 0.46 1.08 0.40 0.30 -5.09 117.98 115.05 1r3n s PHE 383 Ca 0.00 -0.63 -0.23 0.00 -0.60 0.00 0.00 56.93 55.46 1r3n s PHE 383 Cb 0.00 -0.29 -0.07 0.00 0.51 0.00 0.00 43.02 43.17 1r3n s PHE 383 CO 0.00 -0.19 1.24 0.15 0.70 0.00 0.00 175.22 177.12 1r3n s LYS 384 N -2.02 3.67 0.34 0.44 1.02 -1.26 -4.50 119.74 117.42 1r3n s LYS 384 Ca -0.09 1.98 0.11 0.00 0.02 0.00 0.00 55.97 57.98 1r3n s LYS 384 Cb -0.06 -2.47 1.04 0.00 -0.52 0.00 0.00 37.83 35.82 1r3n s LYS 384 CO -0.02 -0.68 1.58 -0.22 -0.92 0.00 0.00 175.35 175.09 1r3n h LYS 385 N 2.08 0.02 0.00 1.68 3.64 -1.94 0.30 116.57 122.36 1r3n h LYS 385 Ca -0.50 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.88 1r3n h LYS 385 Cb 1.26 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.07 1r3n h LYS 385 CO 0.60 0.02 0.00 -0.40 -2.27 0.00 0.00 179.45 177.40 1r3n n ASP 386 N -5.36 0.00 0.00 4.20 5.68 -1.26 -2.58 116.55 117.24 1r3n n ASP 386 Ca 0.30 -0.89 0.11 0.00 -0.50 0.00 0.00 54.79 53.81 1r3n n ASP 386 Cb 1.01 -0.01 -0.02 0.00 -1.14 0.00 0.00 41.12 40.96 1r3n n ASP 386 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1r3n n GLN 387 N -1.01 0.11 -4.86 0.11 1.13 0.09 -4.70 117.38 108.25 1r3n n GLN 387 Ca 0.22 -0.02 -0.32 0.00 -1.94 0.00 0.00 57.00 54.94 1r3n n GLN 387 Cb 0.10 -1.52 -0.13 0.00 0.11 0.00 0.00 30.24 28.80 1r3n n GLN 387 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1r3n s VAL 388 N -3.08 2.76 -0.06 5.09 1.01 -1.06 0.10 120.40 125.16 1r3n s VAL 388 Ca 0.07 -1.00 -0.05 0.00 0.00 0.00 0.00 61.98 60.99 1r3n s VAL 388 Cb 0.16 -2.10 0.02 0.00 0.00 0.00 0.00 36.38 34.46 1r3n s VAL 388 CO 0.82 0.47 0.16 -0.60 0.00 0.00 0.00 175.10 175.96 1r3n s ARG 389 N -1.03 0.18 0.26 2.72 3.52 -0.69 -4.99 118.95 118.92 1r3n s ARG 389 Ca 0.13 0.25 -0.30 0.00 -0.13 0.00 0.00 55.73 55.68 1r3n s ARG 389 Cb -0.10 0.06 -0.09 0.00 -1.56 0.00 0.00 34.95 33.25 1r3n s ARG 389 CO 0.02 -0.04 0.99 -0.65 -0.81 0.00 0.00 175.30 174.81 1r3n s GLN 390 N 0.23 4.78 0.02 5.12 -0.21 -1.26 -0.39 119.66 127.94 1r3n s GLN 390 Ca -0.01 1.58 -0.09 0.00 0.02 0.00 0.00 55.36 56.85 1r3n s GLN 390 Cb -0.02 -3.23 0.01 0.00 1.00 0.00 0.00 33.01 30.76 1r3n s GLN 390 CO -0.01 0.41 0.19 -1.50 -2.12 0.00 0.00 175.29 172.26 1r3n s ILE 391 N -1.19 0.09 -0.14 1.08 2.07 -0.09 -4.86 121.20 118.16 1r3n s ILE 391 Ca 0.43 -0.75 -0.07 0.00 -1.41 0.00 0.00 60.65 58.85 1r3n s ILE 391 Cb -0.28 -0.66 -0.04 0.00 0.13 0.00 0.00 42.46 41.61 1r3n s ILE 391 CO 0.34 -0.41 0.11 0.26 -1.91 0.00 0.00 174.94 173.34 1r3n s TRP 392 N -1.87 3.47 0.07 3.50 0.52 -1.26 -1.61 118.94 121.76 1r3n s TRP 392 Ca -0.11 0.40 -0.30 0.00 0.02 0.00 0.00 56.10 56.11 1r3n s TRP 392 Cb -0.04 -1.99 -0.05 0.00 -1.15 0.00 0.00 33.47 30.24 1r3n s TRP 392 CO -0.00 0.54 1.05 0.45 0.02 0.00 0.00 176.95 179.02 1r3n s SER 393 N -0.55 7.30 0.23 2.95 0.15 0.11 -4.93 113.70 118.96 1r3n s SER 393 Ca 0.12 1.86 0.23 0.00 0.70 0.00 0.00 55.95 58.87 1r3n s SER 393 Cb -0.12 -2.58 0.24 0.00 -1.71 0.00 0.00 66.02 61.85 1r3n s SER 393 CO 0.02 -0.26 1.31 1.23 1.20 0.00 0.00 173.24 176.74 1r3n h GLY 394 N 6.21 0.00 -2.76 9.45 0.00 -1.90 -1.37 103.07 112.71 1r3n h GLY 394 Ca -0.42 0.00 -0.62 0.00 0.00 0.00 0.00 47.33 46.28 1r3n h GLY 394 CO 0.75 0.00 -0.77 0.00 0.00 0.00 0.00 176.54 176.53 1r3n s ALA 395 N -3.25 2.74 0.48 3.60 0.00 -1.26 -4.79 121.76 119.28 1r3n s ALA 395 Ca 0.04 -1.72 -0.19 0.00 0.00 0.00 0.00 51.96 50.09 1r3n s ALA 395 Cb 0.10 -0.40 -0.09 0.00 0.00 0.00 0.00 23.12 22.73 1r3n s ALA 395 CO 0.73 0.36 0.99 0.20 0.00 0.00 0.00 175.76 178.03 1r3n s GLY 396 N -3.13 2.28 0.29 0.00 0.00 -1.26 -4.90 107.32 100.60 1r3n s GLY 396 Ca 0.26 0.37 -0.01 0.00 0.00 0.00 0.00 44.72 45.34 1r3n s GLY 396 CO 0.14 0.66 0.34 0.30 0.00 0.00 0.00 173.10 174.54 1r3n s HIS 397 N -2.31 1.14 0.50 1.90 3.76 -1.26 -5.04 115.29 113.98 1r3n s HIS 397 Ca 0.62 -1.31 0.17 0.00 -0.15 0.00 0.00 55.06 54.39 1r3n s HIS 397 Cb -0.11 -0.31 1.24 0.00 1.11 0.00 0.00 32.58 34.51 1r3n s HIS 397 CO 0.22 -0.93 2.10 -0.44 -0.85 0.00 0.00 174.74 174.84 1r3n h ASP 398 N 2.27 0.00 -0.30 1.40 3.32 -1.96 -1.12 116.42 120.01 1r3n h ASP 398 Ca -0.29 0.00 0.09 0.00 0.02 0.00 0.00 57.03 56.85 1r3n h ASP 398 Cb 1.24 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.78 1r3n h ASP 398 CO 0.41 0.07 0.32 0.28 -1.72 0.00 0.00 179.24 178.61 1r3n h SER 399 N 0.00 0.00 0.01 6.45 0.02 -1.96 0.22 113.55 118.29 1r3n h SER 399 Ca -0.00 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.92 1r3n h SER 399 Cb 0.14 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.67 1r3n h SER 399 CO 0.01 0.00 -0.07 0.00 -1.14 0.00 0.00 176.83 175.62 1r3n h GLN 401 N 0.17 0.17 0.00 0.00 1.08 -1.11 -3.34 115.11 112.08 1r3n h GLN 401 Ca 0.04 -0.30 -0.19 0.00 -1.45 0.00 0.00 58.65 56.75 1r3n h GLN 401 Cb 0.25 0.11 -0.03 0.00 -0.05 0.00 0.00 27.48 27.76 1r3n h GLN 401 CO 0.01 1.10 -1.11 1.79 -0.95 0.00 0.00 178.83 179.68 1r3n h THR 402 N 0.05 1.07 -0.65 -0.54 1.35 -1.45 -3.39 112.91 109.35 1r3n h THR 402 Ca -0.12 -2.68 0.02 0.00 -0.55 0.00 0.00 66.41 63.09 1r3n h THR 402 Cb 1.92 2.48 -0.03 0.00 -1.73 0.00 0.00 68.15 70.79 1r3n h THR 402 CO 0.17 0.61 0.43 0.00 -0.25 0.00 0.00 175.52 176.48 1r3n h ALA 403 N 1.21 1.60 0.00 6.62 0.00 -1.52 0.23 119.26 127.40 1r3n h ALA 403 Ca -0.10 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1r3n h ALA 403 Cb 1.69 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 19.24 1r3n h ALA 403 CO 0.09 0.35 -0.06 -1.35 0.00 0.00 0.00 179.25 178.28 1r3n h PRO 404 N 0.82 0.00 0.00 0.00 0.11 -1.78 -3.36 132.00 127.79 1r3n h PRO 404 Ca 0.25 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 66.17 1r3n h PRO 404 Cb 0.00 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.08 1r3n h PRO 404 CO -0.06 0.06 -1.73 0.72 -0.21 0.00 0.00 178.00 176.77 1r3n n HIS 405 N -3.56 0.00 -4.25 0.65 8.25 0.63 -5.04 115.22 111.90 1r3n n HIS 405 Ca -0.02 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 57.26 1r3n n HIS 405 Cb 0.17 -0.50 -0.11 0.00 1.12 0.00 0.00 29.99 30.67 1r3n n HIS 405 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 1r3n s VAL 406 N -2.26 1.36 -0.16 1.59 -7.23 -0.06 -5.10 120.40 108.55 1r3n s VAL 406 Ca -0.15 -1.75 -0.34 0.00 -1.81 0.00 0.00 61.98 57.93 1r3n s VAL 406 Cb 0.04 -1.57 -0.11 0.00 0.56 0.00 0.00 36.38 35.30 1r3n s VAL 406 CO 0.32 -0.42 1.98 -2.65 -0.31 0.00 0.00 175.10 174.02 1r3n n PRO 407 N 0.47 1.95 -4.10 4.82 -0.02 -1.26 -4.27 135.00 132.59 1r3n n PRO 407 Ca -0.15 0.67 -0.09 0.00 -2.02 0.00 0.00 63.50 61.92 1r3n n PRO 407 Cb 0.57 -2.68 -0.10 0.00 -0.02 0.00 0.00 33.50 31.27 1r3n n PRO 407 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1r3n s THR 408 N 5.20 0.38 0.20 3.45 -4.23 -1.26 -1.50 115.64 117.87 1r3n s THR 408 Ca 0.97 -1.73 -0.19 0.00 -1.18 0.00 0.00 61.69 59.55 1r3n s THR 408 Cb -0.68 -1.41 0.04 0.00 1.34 0.00 0.00 72.50 71.79 1r3n s THR 408 CO 0.49 -0.88 0.57 -0.55 -0.54 0.00 0.00 174.62 173.71 1r3n s SER 409 N -2.76 -0.34 0.17 3.99 0.15 -0.88 -1.59 113.70 112.44 1r3n s SER 409 Ca 0.06 -0.36 0.06 0.00 0.70 0.00 0.00 55.95 56.41 1r3n s SER 409 Cb 0.05 0.60 -0.04 0.00 -1.71 0.00 0.00 66.02 64.91 1r3n s SER 409 CO -0.07 -1.07 -0.13 -0.04 1.20 0.00 0.00 173.24 173.13 1r3n s MET 410 N -3.84 1.17 -0.07 5.44 -1.94 -1.26 -2.05 119.30 116.76 1r3n s MET 410 Ca 0.07 -1.47 0.04 0.00 -1.71 0.00 0.00 55.69 52.62 1r3n s MET 410 Cb -0.02 -0.90 0.00 0.00 2.01 0.00 0.00 34.83 35.93 1r3n s MET 410 CO -0.05 0.14 -0.18 0.42 -0.01 0.00 0.00 175.02 175.34 1r3n s ILE 411 N -2.93 1.58 -0.00 2.53 1.01 -0.10 -2.39 121.20 120.90 1r3n s ILE 411 Ca 0.18 -0.77 0.05 0.00 0.00 0.00 0.00 60.65 60.10 1r3n s ILE 411 Cb -0.00 -1.38 -0.03 0.00 0.01 0.00 0.00 42.46 41.06 1r3n s ILE 411 CO 0.04 0.45 -0.14 -0.36 0.00 0.00 0.00 174.94 174.93 1r3n s PHE 412 N 0.27 2.68 0.24 3.97 2.99 -0.17 -1.53 117.98 126.43 1r3n s PHE 412 Ca -0.11 -0.17 0.10 0.00 0.00 0.00 0.00 56.93 56.75 1r3n s PHE 412 Cb -0.15 -1.56 -0.05 0.00 0.00 0.00 0.00 43.02 41.26 1r3n s PHE 412 CO 0.05 0.25 -0.18 0.96 -0.00 0.00 0.00 175.22 176.29 1r3n s ILE 413 N -0.86 2.14 0.45 0.64 -0.00 -1.08 -0.91 121.20 121.58 1r3n s ILE 413 Ca 0.14 -2.27 -0.25 0.00 -0.00 0.00 0.00 60.65 58.27 1r3n s ILE 413 Cb -0.11 -2.16 -0.09 0.00 -0.00 0.00 0.00 42.46 40.11 1r3n s ILE 413 CO 0.04 -0.45 1.32 -2.65 -0.00 0.00 0.00 174.94 173.20 1r3n n PRO 414 N -0.40 1.98 -4.26 0.37 -0.02 -1.26 -1.42 135.00 129.98 1r3n n PRO 414 Ca -0.07 0.71 -0.34 0.00 -2.02 0.00 0.00 63.50 61.78 1r3n n PRO 414 Cb 0.60 -2.47 -0.15 0.00 -0.02 0.00 0.00 33.50 31.46 1r3n n PRO 414 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1r3n s SER 415 N -0.57 3.88 0.11 2.55 0.01 -1.26 -4.56 113.70 113.86 1r3n s SER 415 Ca 0.62 -0.44 -0.33 0.00 1.31 0.00 0.00 55.95 57.11 1r3n s SER 415 Cb -0.48 -1.63 -0.12 0.00 0.21 0.00 0.00 66.02 64.00 1r3n s SER 415 CO 0.57 0.05 1.73 1.17 0.41 0.00 0.00 173.24 177.16 1r3n n LYS 416 N 4.33 2.41 -1.09 12.44 4.81 -0.40 -1.33 118.16 139.32 1r3n n LYS 416 Ca -0.19 0.88 -0.05 0.00 -0.87 0.00 0.00 58.31 58.08 1r3n n LYS 416 Cb 0.51 -2.70 -0.02 0.00 0.02 0.00 0.00 35.03 32.84 1r3n n LYS 416 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1r3n n ASP 417 N 4.73 -5.44 -1.39 3.14 10.43 -1.26 -1.68 116.55 125.09 1r3n n ASP 417 Ca 0.18 0.13 -0.18 0.00 2.57 0.00 0.00 54.79 57.49 1r3n n ASP 417 Cb 0.32 -3.61 -0.07 0.00 1.84 0.00 0.00 41.12 39.60 1r3n n ASP 417 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1r3n n GLY 418 N 0.59 1.65 3.71 0.44 0.00 -0.45 -4.72 105.19 106.41 1r3n n GLY 418 Ca -0.05 -0.17 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 1r3n n GLY 418 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1r3n s LEU 419 N -4.08 4.36 0.21 0.99 2.96 -0.67 -3.84 118.68 118.61 1r3n s LEU 419 Ca 0.00 1.67 -0.05 0.00 -0.22 0.00 0.00 54.13 55.52 1r3n s LEU 419 Cb 0.00 -3.57 -0.03 0.00 0.50 0.00 0.00 46.19 43.09 1r3n s LEU 419 CO 0.00 -0.28 0.25 -0.55 -1.32 0.00 0.00 176.35 174.45 1r3n s SER 420 N 1.02 0.08 -1.38 3.68 0.15 -1.26 -4.49 113.70 111.50 1r3n s SER 420 Ca 0.52 -1.18 -0.03 0.00 0.70 0.00 0.00 55.95 55.96 1r3n s SER 420 Cb -0.21 0.44 0.02 0.00 -1.71 0.00 0.00 66.02 64.56 1r3n s SER 420 CO 0.27 -0.93 0.73 1.41 1.20 0.00 0.00 173.24 175.93 1r3n n HIS 421 N -0.29 -1.97 -3.55 3.44 8.25 -1.26 -4.96 115.22 114.88 1r3n n HIS 421 Ca -0.01 0.84 -0.17 0.00 -0.26 0.00 0.00 57.72 58.13 1r3n n HIS 421 Cb 0.64 -4.20 -0.06 0.00 1.12 0.00 0.00 29.99 27.48 1r3n n HIS 421 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 1r3n s ASN 422 N -4.11 -0.68 0.30 0.41 3.84 -1.15 -4.70 114.94 108.85 1r3n s ASN 422 Ca 0.17 0.93 0.05 0.00 0.21 0.00 0.00 52.86 54.22 1r3n s ASN 422 Cb -0.08 0.82 0.72 0.00 -0.55 0.00 0.00 41.25 42.16 1r3n s ASN 422 CO 0.83 -0.49 1.75 1.88 -2.79 0.00 0.00 177.10 178.27 1r3n h TYR 423 N 3.60 0.93 -0.11 0.43 0.99 -1.75 -2.43 116.97 118.64 1r3n h TYR 423 Ca -0.27 0.04 0.00 0.00 2.00 0.00 0.00 58.73 60.49 1r3n h TYR 423 Cb 1.15 -0.26 0.00 0.00 1.00 0.00 0.00 36.73 38.61 1r3n h TYR 423 CO 0.38 0.14 0.00 0.66 -0.00 0.00 0.00 178.16 179.34 1r3n n TYR 424 N -4.86 0.14 -1.66 4.88 4.02 -1.26 -4.40 117.16 114.02 1r3n n TYR 424 Ca 0.23 -0.07 -0.44 0.00 -0.01 0.00 0.00 57.90 57.61 1r3n n TYR 424 Cb 0.59 0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 39.90 1r3n n TYR 424 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 176.86 173.94 1r3n n GLU 425 N -0.18 1.86 -3.72 -0.72 2.13 -0.94 -4.99 120.64 114.07 1r3n n GLU 425 Ca 0.12 0.65 -0.12 0.00 0.66 0.00 0.00 57.16 58.48 1r3n n GLU 425 Cb 0.18 -2.19 -0.11 0.00 0.27 0.00 0.00 31.44 29.59 1r3n n GLU 425 CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 1r3n s TYR 426 N -0.86 -0.49 0.00 4.31 5.04 -1.26 -4.65 117.35 119.44 1r3n s TYR 426 Ca 0.59 1.12 0.03 0.00 -2.44 0.00 0.00 57.07 56.37 1r3n s TYR 426 Cb -0.63 0.19 -0.01 0.00 0.35 0.00 0.00 41.96 41.86 1r3n s TYR 426 CO 0.59 -0.27 -0.09 -1.12 -1.34 0.00 0.00 175.55 173.32 1r3n s SER 427 N 0.80 1.09 0.59 4.32 0.01 -1.26 -1.28 113.70 117.96 1r3n s SER 427 Ca -0.05 -0.23 -0.16 0.00 1.31 0.00 0.00 55.95 56.82 1r3n s SER 427 Cb -0.06 -0.10 -0.04 0.00 0.21 0.00 0.00 66.02 66.03 1r3n s SER 427 CO -0.06 0.07 1.07 -0.94 0.41 0.00 0.00 173.24 173.79 1r3n s SER 428 N -0.45 5.76 0.35 2.44 1.04 -1.26 -4.84 113.70 116.74 1r3n s SER 428 Ca 0.02 1.88 0.11 0.00 0.48 0.00 0.00 55.95 58.44 1r3n s SER 428 Cb -0.05 -2.54 0.89 0.00 0.10 0.00 0.00 66.02 64.42 1r3n s SER 428 CO -0.00 -1.18 1.79 -0.65 0.98 0.00 0.00 173.24 174.18 1r3n h PRO 429 N 0.58 0.59 -0.12 4.02 0.11 -1.99 0.44 132.00 135.63 1r3n h PRO 429 Ca -0.47 -0.04 -0.17 0.00 0.11 0.00 0.00 66.00 65.43 1r3n h PRO 429 Cb 1.23 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 1r3n h PRO 429 CO 0.57 0.39 -0.64 1.49 -0.21 0.00 0.00 178.00 179.60 1r3n h GLU 430 N 0.61 0.44 -0.45 1.05 4.81 -1.99 -1.16 114.58 117.89 1r3n h GLU 430 Ca 0.56 -0.32 -0.08 0.00 -0.13 0.00 0.00 59.36 59.39 1r3n h GLU 430 Cb 1.07 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.49 1r3n h GLU 430 CO -0.32 0.94 -0.03 0.93 -0.73 0.00 0.00 179.01 179.80 1r3n h GLU 431 N 0.32 0.82 -0.16 1.92 5.08 -1.68 -1.91 114.58 118.97 1r3n h GLU 431 Ca -0.01 -0.27 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 1r3n h GLU 431 Cb 1.19 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.37 1r3n h GLU 431 CO 0.11 0.89 0.10 0.82 -1.00 0.00 0.00 179.01 179.93 1r3n h ILE 432 N 0.66 1.04 -0.68 3.13 1.08 -0.81 -1.79 117.51 120.14 1r3n h ILE 432 Ca 0.13 -0.08 0.05 0.00 -0.39 0.00 0.00 64.86 64.56 1r3n h ILE 432 Cb 0.54 0.81 -0.05 0.00 -3.07 0.00 0.00 36.82 35.05 1r3n h ILE 432 CO 0.03 0.04 0.40 -0.08 -0.69 0.00 0.00 178.15 177.85 1r3n h GLU 433 N 0.21 0.74 -0.33 2.37 4.57 -1.18 -1.40 114.58 119.56 1r3n h GLU 433 Ca 0.06 -0.04 0.05 0.00 -1.18 0.00 0.00 59.36 58.25 1r3n h GLU 433 Cb -0.02 -0.17 -0.05 0.00 -0.16 0.00 0.00 28.75 28.35 1r3n h GLU 433 CO -0.01 0.49 0.03 -0.91 -1.18 0.00 0.00 179.01 177.43 1r3n h ASN 434 N 0.76 -0.06 -0.41 1.04 2.35 -1.13 -0.69 115.58 117.44 1r3n h ASN 434 Ca 0.29 0.07 0.01 0.00 -0.55 0.00 0.00 56.30 56.12 1r3n h ASN 434 Cb 0.11 0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.56 1r3n h ASN 434 CO -0.15 0.01 0.26 1.23 -1.65 0.00 0.00 177.43 177.13 1r3n h GLY 435 N 0.14 0.57 1.05 2.83 0.00 -0.83 -2.05 103.07 104.78 1r3n h GLY 435 Ca 0.16 -0.20 -0.06 0.00 0.00 0.00 0.00 47.33 47.24 1r3n h GLY 435 CO -0.24 0.18 0.26 -2.75 0.00 0.00 0.00 176.54 174.00 1r3n h PHE 436 N 0.52 1.20 -0.86 5.60 3.57 -1.02 -1.34 116.94 124.62 1r3n h PHE 436 Ca 0.16 -0.11 0.01 0.00 3.53 0.00 0.00 57.97 61.56 1r3n h PHE 436 Cb -0.03 -0.35 -0.04 0.00 2.79 0.00 0.00 35.95 38.31 1r3n h PHE 436 CO -0.06 0.94 0.57 0.87 -2.23 0.00 0.00 178.31 178.39 1r3n h LYS 437 N 1.12 1.11 -0.14 1.11 1.57 -0.72 0.62 116.57 121.24 1r3n h LYS 437 Ca 0.25 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.93 1r3n h LYS 437 Cb 0.28 -0.25 -0.00 0.00 0.08 0.00 0.00 32.23 32.34 1r3n h LYS 437 CO -0.01 0.73 -0.04 0.28 -0.57 0.00 0.00 179.45 179.84 1r3n h VAL 438 N 1.14 1.30 -0.28 0.50 2.07 -1.05 -2.71 116.25 117.21 1r3n h VAL 438 Ca 0.32 -1.01 0.02 0.00 0.82 0.00 0.00 66.70 66.85 1r3n h VAL 438 Cb -0.10 1.68 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 1r3n h VAL 438 CO -0.08 0.29 0.12 0.25 0.02 0.00 0.00 177.57 178.18 1r3n h LEU 439 N -0.04 0.16 -0.22 2.57 5.85 -0.87 0.02 115.31 122.78 1r3n h LEU 439 Ca 0.03 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.81 1r3n h LEU 439 Cb 0.48 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 1r3n h LEU 439 CO 0.02 0.13 0.01 0.25 -0.34 0.00 0.00 178.44 178.51 1r3n h LEU 440 N 0.26 -0.06 -0.99 2.25 5.85 -0.88 -0.94 115.31 120.80 1r3n h LEU 440 Ca 0.12 0.04 -0.09 0.00 0.84 0.00 0.00 57.88 58.79 1r3n h LEU 440 Cb 0.06 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 1r3n h LEU 440 CO -0.10 0.00 -0.44 -0.61 -0.34 0.00 0.00 178.44 176.95 1r3n h GLN 441 N 0.09 0.00 -0.36 1.25 5.75 -1.32 -2.39 115.11 118.13 1r3n h GLN 441 Ca 0.10 0.00 -0.05 0.00 -0.15 0.00 0.00 58.65 58.56 1r3n h GLN 441 Cb 0.12 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.66 1r3n h GLN 441 CO -0.16 0.44 0.04 0.00 -2.65 0.00 0.00 178.83 176.49 1r3n h ALA 442 N 1.56 0.48 -0.03 3.38 0.00 -0.25 0.22 119.26 124.62 1r3n h ALA 442 Ca -0.00 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 54.69 1r3n h ALA 442 Cb 0.89 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1r3n h ALA 442 CO 0.06 0.20 -0.03 0.82 0.00 0.00 0.00 179.25 180.30 1r3n h ILE 443 N 0.43 0.91 -0.95 0.00 1.08 -1.14 -0.58 117.51 117.26 1r3n h ILE 443 Ca 0.11 0.00 0.07 0.00 -0.39 0.00 0.00 64.86 64.65 1r3n h ILE 443 Cb 0.40 0.91 -0.07 0.00 -3.07 0.00 0.00 36.82 34.99 1r3n h ILE 443 CO 0.01 0.00 0.60 0.40 -0.69 0.00 0.00 178.15 178.47 1r3n h ILE 444 N -0.04 1.05 -0.13 -0.67 2.04 -1.28 0.06 117.51 118.54 1r3n h ILE 444 Ca 0.02 -0.37 -0.00 0.00 1.00 0.00 0.00 64.86 65.51 1r3n h ILE 444 Cb 0.08 -0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.03 1r3n h ILE 444 CO -0.06 0.20 0.07 0.78 0.00 0.00 0.00 178.15 179.14 1r3n h ASN 445 N 1.07 0.16 -0.43 1.72 2.35 -0.15 -1.35 115.58 118.95 1r3n h ASN 445 Ca 0.42 -0.10 -0.04 0.00 -0.55 0.00 0.00 56.30 56.03 1r3n h ASN 445 Cb 0.21 -0.04 -0.02 0.00 0.05 0.00 0.00 38.32 38.52 1r3n h ASN 445 CO -0.19 0.21 0.13 0.22 -1.65 0.00 0.00 177.43 176.15 1r3n h TYR 446 N 0.10 0.71 -0.81 1.19 3.20 -0.66 -0.58 116.97 120.12 1r3n h TYR 446 Ca 0.04 -0.08 0.11 0.00 3.14 0.00 0.00 58.73 61.95 1r3n h TYR 446 Cb 0.09 -0.20 -0.06 0.00 1.54 0.00 0.00 36.73 38.10 1r3n h TYR 446 CO -0.04 0.65 0.53 0.22 -1.64 0.00 0.00 178.16 177.88 1r3n h ASP 447 N 0.56 0.63 1.30 -2.11 3.58 -0.92 -0.31 116.42 119.17 1r3n h ASP 447 Ca 0.14 0.02 -0.12 0.00 0.42 0.00 0.00 57.03 57.49 1r3n h ASP 447 Cb 0.28 -0.11 -0.02 0.00 1.72 0.00 0.00 39.33 41.21 1r3n h ASP 447 CO -0.00 0.36 -0.59 0.78 -2.88 0.00 0.00 179.24 176.91 1r3n h ASN 448 N 0.69 0.00 -0.27 2.28 2.35 -0.74 -3.24 115.58 116.66 1r3n h ASN 448 Ca 0.38 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 56.02 1r3n h ASN 448 Cb 0.53 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.89 1r3n h ASN 448 CO -0.15 0.59 -0.23 0.22 -1.65 0.00 0.00 177.43 176.21 1r3n h TYR 449 N 0.00 0.84 -0.04 1.19 5.03 0.50 -3.03 116.97 121.47 1r3n h TYR 449 Ca -0.01 -0.19 0.01 0.00 2.58 0.00 0.00 58.73 61.13 1r3n h TYR 449 Cb 1.40 -0.20 -0.00 0.00 1.55 0.00 0.00 36.73 39.48 1r3n h TYR 449 CO 0.00 0.90 0.03 0.00 -1.32 0.00 0.00 178.16 177.77 1r3n h ARG 450 N 0.65 0.00 -0.13 1.82 3.08 -1.26 0.05 114.38 118.58 1r3n h ARG 450 Ca 0.09 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 59.92 1r3n h ARG 450 Cb 0.73 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.78 1r3n h ARG 450 CO 0.06 0.00 -0.79 0.28 -1.07 0.00 0.00 179.97 178.45 1r3n h VAL 451 N 0.00 1.29 0.08 2.04 2.07 -1.64 -2.92 116.25 117.18 1r3n h VAL 451 Ca 0.02 -2.02 -0.00 0.00 0.82 0.00 0.00 66.70 65.52 1r3n h VAL 451 Cb 0.08 2.03 0.00 0.00 -1.52 0.00 0.00 31.29 31.87 1r3n h VAL 451 CO -0.00 0.63 -0.04 0.40 0.02 0.00 0.00 177.57 178.58 1r3n h ILE 452 N 0.49 1.10 -0.05 4.57 1.08 -1.25 -3.30 117.51 120.16 1r3n h ILE 452 Ca -0.05 -0.69 0.02 0.00 -0.39 0.00 0.00 64.86 63.74 1r3n h ILE 452 Cb 1.41 1.55 -0.02 0.00 -3.07 0.00 0.00 36.82 36.70 1r3n h ILE 452 CO 0.16 0.17 -0.05 -0.09 -0.69 0.00 0.00 178.15 177.65 1r3n h ARG 453 N -0.43 -0.06 -0.54 2.37 2.43 -1.13 -2.97 114.38 114.05 1r3n h ARG 453 Ca -0.01 0.00 0.16 0.00 -0.81 0.00 0.00 59.98 59.32 1r3n h ARG 453 Cb 0.36 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.91 1r3n h ARG 453 CO 0.02 -0.04 0.43 0.78 -1.51 0.00 0.00 179.97 179.65 1r3n h GLY 454 N -0.06 0.00 0.00 2.80 0.00 -1.60 -3.51 103.07 100.69 1r3n h GLY 454 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.37 1r3n h GLY 454 CO -0.09 0.00 0.00 1.42 0.00 0.00 0.00 176.54 177.87