#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r3n s THR 19 N 0.00 4.93 0.14 2.61 -4.23 -1.26 -5.04 115.64 112.78 1r3n s THR 19 Ca 0.00 -1.17 -0.31 0.00 -1.18 0.00 0.00 61.69 59.02 1r3n s THR 19 Cb 0.00 -4.47 -0.09 0.00 1.34 0.00 0.00 72.50 69.28 1r3n s THR 19 CO 0.00 -1.08 1.56 -0.76 -0.54 0.00 0.00 174.62 173.80 1r3n s LEU 20 N 2.36 4.37 -0.93 4.79 1.43 -1.26 -4.96 118.68 124.47 1r3n s LEU 20 Ca 0.10 2.55 -0.02 0.00 -1.03 0.00 0.00 54.13 55.73 1r3n s LEU 20 Cb -0.24 -3.59 0.27 0.00 0.03 0.00 0.00 46.19 42.66 1r3n s LEU 20 CO 0.05 -0.82 1.09 -3.20 0.23 0.00 0.00 176.35 173.70 1r3n n ASN 21 N 4.33 5.12 -4.78 2.29 5.15 -1.26 -5.07 115.26 121.04 1r3n n ASN 21 Ca 0.14 -3.31 -0.36 0.00 -0.60 0.00 0.00 54.58 50.45 1r3n n ASN 21 Cb 0.39 -1.08 -0.02 0.00 -0.53 0.00 0.00 39.78 38.54 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 -2.19 3.97 0.98 1.20 1.43 -1.26 -5.02 118.68 117.78 1r3n s LEU 22 Ca 0.32 2.15 -0.14 0.00 -1.03 0.00 0.00 54.13 55.43 1r3n s LEU 22 Cb 0.03 -4.35 0.04 0.00 0.03 0.00 0.00 46.19 41.94 1r3n s LEU 22 CO -0.00 -0.84 0.31 -2.65 0.23 0.00 0.00 176.35 173.39 1r3n n PRO 23 N -0.62 -0.51 -2.14 1.29 -0.02 -1.26 -4.91 135.00 126.84 1r3n n PRO 23 Ca 0.08 -0.11 -0.40 0.00 -2.02 0.00 0.00 63.50 61.05 1r3n n PRO 23 Cb 0.50 -1.81 -0.01 0.00 -0.02 0.00 0.00 33.50 32.15 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 -2.36 3.32 -0.66 3.55 0.00 -1.26 -4.92 121.76 119.43 1r3n s ALA 24 Ca 0.56 1.18 -0.26 0.00 0.00 0.00 0.00 51.96 53.43 1r3n s ALA 24 Cb -0.19 -3.46 -0.01 0.00 0.00 0.00 0.00 23.12 19.46 1r3n s ALA 24 CO 0.68 -0.68 1.77 0.00 0.00 0.00 0.00 175.76 177.53 1r3n s ALA 25 N -1.24 2.23 -0.46 0.00 0.00 -1.26 -4.94 121.76 116.08 1r3n s ALA 25 Ca 0.54 -0.86 -0.16 0.00 0.00 0.00 0.00 51.96 51.48 1r3n s ALA 25 Cb -0.37 -4.32 0.06 0.00 0.00 0.00 0.00 23.12 18.49 1r3n s ALA 25 CO 0.48 -3.88 0.41 0.00 0.00 0.00 0.00 175.76 172.77 1r3n s ALA 26 N 8.58 3.51 0.13 0.00 0.00 -1.26 -5.05 121.76 127.68 1r3n s ALA 26 Ca 0.62 -1.94 -0.30 0.00 0.00 0.00 0.00 51.96 50.34 1r3n s ALA 26 Cb -0.11 -3.07 -0.07 0.00 0.00 0.00 0.00 23.12 19.87 1r3n s ALA 26 CO 0.18 -1.71 1.07 -2.14 0.00 0.00 0.00 175.76 173.16 1r3n s PRO 27 N 1.82 4.59 0.41 0.00 0.02 -1.26 -5.00 135.00 135.58 1r3n s PRO 27 Ca 0.06 1.64 -0.22 0.00 0.02 0.00 0.00 61.00 62.50 1r3n s PRO 27 Cb -0.22 -3.32 -0.10 0.00 0.02 0.00 0.00 34.50 30.87 1r3n s PRO 27 CO 0.08 0.05 0.96 -0.51 -0.33 0.00 0.00 177.00 177.26 1r3n s LEU 28 N 0.00 4.04 0.46 -5.54 1.43 -1.26 -5.01 118.68 112.81 1r3n s LEU 28 Ca 0.50 1.77 -0.24 0.00 -1.03 0.00 0.00 54.13 55.13 1r3n s LEU 28 Cb -0.27 -4.39 -0.08 0.00 0.03 0.00 0.00 46.19 41.48 1r3n s LEU 28 CO 0.32 -0.34 1.34 -0.55 0.23 0.00 0.00 176.35 177.36 1r3n s SER 29 N -1.98 5.91 0.01 2.29 0.15 -1.26 -5.01 113.70 113.81 1r3n s SER 29 Ca 0.59 2.73 0.02 0.00 0.70 0.00 0.00 55.95 59.99 1r3n s SER 29 Cb -0.13 -2.64 -0.01 0.00 -1.71 0.00 0.00 66.02 61.53 1r3n s SER 29 CO 0.17 -1.13 -0.05 -0.63 1.20 0.00 0.00 173.24 172.80 1r3n s ILE 30 N -1.28 0.39 -0.56 6.45 1.01 -1.26 -4.85 121.20 121.10 1r3n s ILE 30 Ca 0.62 -0.40 -0.26 0.00 0.00 0.00 0.00 60.65 60.61 1r3n s ILE 30 Cb -0.39 -0.37 0.03 0.00 0.01 0.00 0.00 42.46 41.74 1r3n s ILE 30 CO 0.50 -0.02 1.07 0.00 0.00 0.00 0.00 174.94 176.49 1r3n s ALA 31 N -0.42 3.08 0.17 9.38 0.00 -1.26 -4.99 121.76 127.72 1r3n s ALA 31 Ca -0.01 -1.00 -0.31 0.00 0.00 0.00 0.00 51.96 50.63 1r3n s ALA 31 Cb -0.04 -3.89 -0.10 0.00 0.00 0.00 0.00 23.12 19.10 1r3n s ALA 31 CO -0.00 -2.51 1.53 0.45 0.00 0.00 0.00 175.76 175.23 1r3n s SER 32 N 2.87 6.62 0.00 0.00 0.15 -1.26 -2.62 113.70 119.46 1r3n s SER 32 Ca 0.37 2.59 0.00 0.00 0.70 0.00 0.00 55.95 59.61 1r3n s SER 32 Cb -0.10 -2.60 0.00 0.00 -1.71 0.00 0.00 66.02 61.62 1r3n s SER 32 CO 0.23 -0.79 0.00 0.61 1.20 0.00 0.00 173.24 174.49 1r3n n GLY 33 N 3.57 1.97 0.14 9.45 0.00 -1.26 -4.93 105.19 114.12 1r3n n GLY 33 Ca 0.13 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.03 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 2.71 0.37 -0.04 1.61 2.43 -1.93 -0.99 114.38 118.54 1r3n h ARG 34 Ca 0.00 -0.14 0.03 0.00 -0.81 0.00 0.00 59.98 59.05 1r3n h ARG 34 Cb 0.00 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.50 1r3n h ARG 34 CO 0.00 0.63 -0.12 1.25 -1.51 0.00 0.00 179.97 180.21 1r3n h LEU 35 N 0.09 -0.37 -0.72 3.80 5.85 -1.92 0.89 115.31 122.94 1r3n h LEU 35 Ca 0.05 0.06 0.04 0.00 0.84 0.00 0.00 57.88 58.87 1r3n h LEU 35 Cb 0.49 0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.63 1r3n h LEU 35 CO 0.02 -0.17 0.44 -1.13 -0.34 0.00 0.00 178.44 177.25 1r3n h ASN 36 N -0.19 0.70 -0.74 1.25 -0.73 -1.89 -1.14 115.58 112.83 1r3n h ASN 36 Ca 0.06 0.01 -0.01 0.00 1.87 0.00 0.00 56.30 58.23 1r3n h ASN 36 Cb 0.27 -0.14 -0.04 0.00 0.27 0.00 0.00 38.32 38.69 1r3n h ASN 36 CO -0.15 0.47 0.43 -0.61 -0.37 0.00 0.00 177.43 177.19 1r3n h GLN 37 N 0.83 1.02 -0.58 6.67 5.75 -0.68 -2.02 115.11 126.11 1r3n h GLN 37 Ca 0.30 -0.11 -0.10 0.00 -0.15 0.00 0.00 58.65 58.59 1r3n h GLN 37 Cb 0.09 -0.21 -0.02 0.00 1.07 0.00 0.00 27.48 28.41 1r3n h GLN 37 CO -0.14 0.75 -0.04 1.15 -2.65 0.00 0.00 178.83 177.90 1r3n h THR 38 N 1.02 1.27 -0.60 2.39 2.02 0.07 0.52 112.91 119.60 1r3n h THR 38 Ca 0.26 -1.19 0.05 0.00 0.77 0.00 0.00 66.41 66.31 1r3n h THR 38 Cb 0.00 0.87 -0.05 0.00 -1.74 0.00 0.00 68.15 67.23 1r3n h THR 38 CO -0.05 0.43 0.32 0.40 0.37 0.00 0.00 175.52 176.99 1r3n h ILE 39 N 0.93 0.96 -0.11 3.11 2.04 -1.00 -0.93 117.51 122.52 1r3n h ILE 39 Ca 0.16 -0.20 -0.19 0.00 1.00 0.00 0.00 64.86 65.62 1r3n h ILE 39 Cb 0.60 0.31 -0.00 0.00 -0.74 0.00 0.00 36.82 36.99 1r3n h ILE 39 CO 0.04 0.11 -0.72 -0.07 0.00 0.00 0.00 178.15 177.50 1r3n h LEU 40 N 0.60 0.61 0.20 1.44 3.38 -1.08 -2.25 115.31 118.22 1r3n h LEU 40 Ca 0.27 -0.40 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 1r3n h LEU 40 Cb 0.17 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1r3n h LEU 40 CO -0.17 1.15 -0.10 -0.33 0.09 0.00 0.00 178.44 179.08 1r3n h GLU 41 N 0.36 -0.26 -0.10 1.13 5.08 -0.69 -2.51 114.58 117.59 1r3n h GLU 41 Ca -0.03 0.02 -0.12 0.00 -1.00 0.00 0.00 59.36 58.23 1r3n h GLU 41 Cb 1.31 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.60 1r3n h GLU 41 CO 0.13 0.07 -0.47 1.79 -1.00 0.00 0.00 179.01 179.53 1r3n h THR 42 N -0.61 1.33 0.24 1.13 1.35 -1.27 -2.06 112.91 113.03 1r3n h THR 42 Ca -0.03 -1.66 -0.01 0.00 -0.55 0.00 0.00 66.41 64.16 1r3n h THR 42 Cb 0.45 1.78 0.00 0.00 -1.73 0.00 0.00 68.15 68.65 1r3n h THR 42 CO 0.04 0.49 -0.12 1.23 -0.25 0.00 0.00 175.52 176.92 1r3n h GLY 43 N 1.30 -0.34 2.00 5.82 0.00 -1.47 -0.09 103.07 110.29 1r3n h GLY 43 Ca 0.01 0.13 -0.05 0.00 0.00 0.00 0.00 47.33 47.42 1r3n h GLY 43 CO 0.07 -0.12 -0.21 0.23 0.00 0.00 0.00 176.54 176.50 1r3n h SER 44 N -0.46 0.00 0.21 0.19 0.87 -1.37 0.72 113.55 113.71 1r3n h SER 44 Ca -0.03 0.00 -0.31 0.00 -1.23 0.00 0.00 61.79 60.22 1r3n h SER 44 Cb 0.34 0.00 0.03 0.00 -0.44 0.00 0.00 62.40 62.33 1r3n h SER 44 CO 0.05 0.21 -1.41 -0.61 -0.53 0.00 0.00 176.83 174.55 1r3n h GLN 45 N 0.00 0.45 -2.30 2.24 4.15 -1.32 -3.36 115.11 114.97 1r3n h GLN 45 Ca -0.00 -0.77 -0.60 0.00 0.77 0.00 0.00 58.65 58.05 1r3n h GLN 45 Cb 0.38 0.29 -0.42 0.00 0.21 0.00 0.00 27.48 27.94 1r3n h GLN 45 CO 0.03 1.37 -0.62 1.19 -1.93 0.00 0.00 178.83 178.86 1r3n n PHE 46 N -3.79 3.34 0.00 3.99 3.01 -0.05 -4.78 117.46 119.18 1r3n n PHE 46 Ca -0.19 -4.14 0.00 0.00 1.01 0.00 0.00 57.45 54.14 1r3n n PHE 46 Cb 1.03 -0.55 0.00 0.00 -0.01 0.00 0.00 39.48 39.95 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 1.04 1.31 3.68 1.37 0.00 -1.20 -4.77 105.19 106.61 1r3n n GLY 47 Ca 0.28 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.88 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 1.63 0.30 -0.02 0.00 0.23 -0.14 107.32 107.66 1r3n s GLY 48 Ca 0.00 1.08 0.03 0.00 0.00 0.00 0.00 44.72 45.83 1r3n s GLY 48 CO 0.00 2.82 0.17 -1.34 0.00 0.00 0.00 173.10 174.75 1r3n s VAL 49 N 2.81 0.27 -1.47 1.40 -7.23 0.43 -4.92 120.40 111.68 1r3n s VAL 49 Ca 0.71 -2.00 -0.05 0.00 -1.81 0.00 0.00 61.98 58.84 1r3n s VAL 49 Cb -0.37 -2.50 0.04 0.00 0.56 0.00 0.00 36.38 34.11 1r3n s VAL 49 CO 0.30 0.00 0.53 0.00 -0.31 0.00 0.00 175.10 175.62 1r3n n ALA 50 N -0.57 -1.82 -1.83 1.32 0.00 -1.26 -1.29 120.51 115.06 1r3n n ALA 50 Ca 0.02 -0.19 -0.42 0.00 0.00 0.00 0.00 53.44 52.85 1r3n n ALA 50 Cb 0.65 -2.06 -0.03 0.00 0.00 0.00 0.00 19.45 18.01 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 -6.63 4.17 0.00 0.00 3.52 -1.26 -4.10 118.95 114.65 1r3n s ARG 51 Ca 0.19 2.48 0.08 0.00 -0.13 0.00 0.00 55.73 58.35 1r3n s ARG 51 Cb -0.10 -3.19 0.08 0.00 -1.56 0.00 0.00 34.95 30.18 1r3n s ARG 51 CO 0.89 -0.70 0.81 -2.67 -0.81 0.00 0.00 175.30 172.83 1r3n n TRP 52 N 4.24 0.04 -3.83 5.12 2.14 0.21 -4.98 117.44 120.39 1r3n n TRP 52 Ca 0.15 -0.06 -0.04 0.00 2.07 0.00 0.00 57.50 59.63 1r3n n TRP 52 Cb 0.37 -0.00 0.01 0.00 -0.81 0.00 0.00 31.31 30.88 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 -0.72 0.02 0.00 -1.67 0.00 -1.21 -5.05 107.32 98.69 1r3n s GLY 53 Ca 0.10 -0.21 0.28 0.00 0.00 0.00 0.00 44.72 44.89 1r3n s GLY 53 CO 0.10 1.41 1.72 -1.06 0.00 0.00 0.00 173.10 175.28 1r3n n GLN 54 N -0.61 0.37 -2.44 2.90 1.13 -1.26 -4.73 117.38 112.74 1r3n n GLN 54 Ca -0.04 -0.15 -0.33 0.00 -1.94 0.00 0.00 57.00 54.53 1r3n n GLN 54 Cb 0.60 -1.50 -0.03 0.00 0.11 0.00 0.00 30.24 29.42 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 -2.73 3.76 0.59 -1.09 0.41 -1.26 -4.95 118.70 113.43 1r3n s GLU 55 Ca 0.20 1.23 0.36 0.00 -0.41 0.00 0.00 54.97 56.35 1r3n s GLU 55 Cb 0.19 -2.10 1.80 0.00 -1.78 0.00 0.00 34.13 32.25 1r3n s GLU 55 CO 0.55 -0.44 2.17 0.66 -0.49 0.00 0.00 175.26 177.70 1r3n h SER 56 N 1.24 0.00 -0.17 -0.19 4.64 -2.03 -2.09 113.55 114.95 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 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1r3n h SER 56 CO 0.59 0.04 0.00 0.00 -0.87 0.00 0.00 176.83 176.59 1r3n n HIS 57 N -3.29 0.20 -2.08 4.77 1.44 -1.26 -4.80 115.22 110.20 1r3n n HIS 57 Ca -0.02 -0.11 -0.40 0.00 -2.01 0.00 0.00 57.72 55.18 1r3n n HIS 57 Cb 0.19 -0.00 -0.00 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 1.27 4.72 -4.04 -1.40 1.02 -0.79 -4.87 120.64 116.56 1r3n n GLU 58 Ca 0.15 -3.63 -0.10 0.00 -0.02 0.00 0.00 57.16 53.56 1r3n n GLU 58 Cb 0.55 -2.61 -0.06 0.00 -0.02 0.00 0.00 31.44 29.30 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 -1.59 0.52 0.28 -0.32 -0.12 -1.26 -0.62 117.98 114.87 1r3n s PHE 59 Ca 0.52 -0.86 0.01 0.00 -0.05 0.00 0.00 56.93 56.55 1r3n s PHE 59 Cb 0.19 0.06 0.01 0.00 -0.63 0.00 0.00 43.02 42.64 1r3n s PHE 59 CO -0.10 -0.94 0.06 0.41 -0.05 0.00 0.00 175.22 174.59 1r3n n GLY 60 N -0.37 3.60 3.25 1.99 0.00 -0.41 -4.79 105.19 108.47 1r3n n GLY 60 Ca -0.01 -2.28 -0.25 0.00 0.00 0.00 0.00 46.02 43.47 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 -3.06 1.38 -0.33 1.61 -1.94 -0.07 -0.43 119.30 116.46 1r3n s MET 61 Ca 0.04 -0.94 0.01 0.00 -1.71 0.00 0.00 55.69 53.10 1r3n s MET 61 Cb -0.00 -1.49 0.14 0.00 2.01 0.00 0.00 34.83 35.49 1r3n s MET 61 CO 0.03 0.38 0.32 0.50 -0.01 0.00 0.00 175.02 176.24 1r3n s ARG 62 N -1.17 0.48 -0.46 2.03 3.52 0.80 -1.58 118.95 122.57 1r3n s ARG 62 Ca 0.07 -0.59 0.03 0.00 -0.13 0.00 0.00 55.73 55.11 1r3n s ARG 62 Cb -0.09 -0.76 0.15 0.00 -1.56 0.00 0.00 34.95 32.69 1r3n s ARG 62 CO 0.02 -1.12 0.30 0.50 -0.81 0.00 0.00 175.30 174.19 1r3n s ARG 63 N 1.81 1.23 0.49 5.12 3.52 -1.26 -4.61 118.95 125.24 1r3n s ARG 63 Ca 0.14 -2.12 -0.19 0.00 -0.13 0.00 0.00 55.73 53.42 1r3n s ARG 63 Cb -0.15 -2.06 -0.09 0.00 -1.56 0.00 0.00 34.95 31.09 1r3n s ARG 63 CO -0.17 -1.25 1.00 -0.51 -0.81 0.00 0.00 175.30 173.56 1r3n s LEU 64 N 0.12 3.79 0.26 -0.88 1.43 -1.26 0.10 118.68 122.24 1r3n s LEU 64 Ca 0.23 1.77 -0.31 0.00 -1.03 0.00 0.00 54.13 54.79 1r3n s LEU 64 Cb -0.13 -4.54 -0.12 0.00 0.03 0.00 0.00 46.19 41.43 1r3n s LEU 64 CO -0.08 -0.66 1.64 0.00 0.23 0.00 0.00 176.35 177.48 1r3n n ALA 65 N -1.12 2.60 -1.00 4.21 0.00 -1.26 -2.70 120.51 121.24 1r3n n ALA 65 Ca 0.08 0.38 -0.00 0.00 0.00 0.00 0.00 53.44 53.90 1r3n n ALA 65 Cb 0.53 -2.48 -0.00 0.00 0.00 0.00 0.00 19.45 17.50 1r3n n ALA 65 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1r3n n GLY 66 N 2.78 0.28 3.92 0.00 0.00 -1.26 -4.95 105.19 105.97 1r3n n GLY 66 Ca 0.11 -0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.56 2.16 0.26 2.61 -4.23 -1.10 -4.63 115.64 109.16 1r3n s THR 67 Ca 0.00 -0.18 -0.02 0.00 -1.18 0.00 0.00 61.69 60.31 1r3n s THR 67 Cb 0.00 -2.98 0.24 0.00 1.34 0.00 0.00 72.50 71.10 1r3n s THR 67 CO 0.00 0.00 1.71 0.00 -0.54 0.00 0.00 174.62 175.79 1r3n h ALA 68 N -0.82 1.14 -0.00 3.99 0.00 -1.95 -1.63 119.26 119.99 1r3n h ALA 68 Ca -0.45 0.14 -0.16 0.00 0.00 0.00 0.00 54.91 54.45 1r3n h ALA 68 Cb 1.31 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 19.23 1r3n h ALA 68 CO 0.59 -0.28 -0.74 -0.07 0.00 0.00 0.00 179.25 178.75 1r3n h LEU 69 N 0.38 0.02 -0.10 0.00 3.38 -1.93 -2.17 115.31 114.90 1r3n h LEU 69 Ca 0.46 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.43 1r3n h LEU 69 Cb 0.78 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.50 1r3n h LEU 69 CO -0.47 0.76 -0.04 -0.78 0.09 0.00 0.00 178.44 177.99 1r3n h ASP 70 N 0.01 -0.13 -0.98 -0.43 3.58 -1.52 -1.84 116.42 115.11 1r3n h ASP 70 Ca -0.01 0.03 0.01 0.00 0.42 0.00 0.00 57.03 57.48 1r3n h ASP 70 Cb 1.31 0.08 -0.05 0.00 1.72 0.00 0.00 39.33 42.39 1r3n h ASP 70 CO 0.10 -0.05 0.64 1.23 -2.88 0.00 0.00 179.24 178.27 1r3n h GLY 71 N -0.02 1.39 1.00 -0.78 0.00 -1.28 -1.74 103.07 101.63 1r3n h GLY 71 Ca 0.05 -0.53 -0.05 0.00 0.00 0.00 0.00 47.33 46.80 1r3n h GLY 71 CO -0.11 0.52 0.16 0.00 0.00 0.00 0.00 176.54 177.11 1r3n h ALA 72 N 1.37 0.74 -0.41 3.60 0.00 -1.13 0.37 119.26 123.80 1r3n h ALA 72 Ca 0.36 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 1r3n h ALA 72 Cb -0.14 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 1r3n h ALA 72 CO -0.08 0.42 -0.04 1.98 0.00 0.00 0.00 179.25 181.53 1r3n h MET 73 N 0.79 0.75 -0.77 0.00 -1.53 -1.15 -1.70 114.93 111.32 1r3n h MET 73 Ca 0.18 -0.26 -0.01 0.00 -3.44 0.00 0.00 59.70 56.17 1r3n h MET 73 Cb 0.30 -0.06 -0.04 0.00 -0.55 0.00 0.00 31.60 31.26 1r3n h MET 73 CO -0.00 0.85 0.45 0.00 0.14 0.00 0.00 176.91 178.35 1r3n h ARG 74 N 0.57 1.05 0.09 0.39 3.08 -1.14 0.48 114.38 118.90 1r3n h ARG 74 Ca 0.11 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1r3n h ARG 74 Cb 0.54 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 1r3n h ARG 74 CO 0.03 0.76 -0.08 -0.44 -1.07 0.00 0.00 179.97 179.17 1r3n h ASP 75 N 1.06 -0.20 -0.52 7.04 5.19 -0.76 -0.65 116.42 127.57 1r3n h ASP 75 Ca 0.27 0.02 0.05 0.00 -0.62 0.00 0.00 57.03 56.75 1r3n h ASP 75 Cb -0.01 0.07 -0.05 0.00 0.18 0.00 0.00 39.33 39.52 1r3n h ASP 75 CO -0.05 -0.12 0.26 -0.25 -3.12 0.00 0.00 179.24 175.96 1r3n h TRP 76 N -0.18 0.48 -0.41 4.55 7.01 -0.92 -1.85 115.95 124.62 1r3n h TRP 76 Ca 0.00 0.02 0.03 0.00 2.11 0.00 0.00 58.89 61.05 1r3n h TRP 76 Cb 0.17 -0.14 -0.03 0.00 -2.10 0.00 0.00 29.16 27.06 1r3n h TRP 76 CO -0.10 0.23 0.22 0.35 -2.79 0.00 0.00 178.44 176.34 1r3n h PHE 77 N 0.50 0.40 -0.60 2.65 3.57 -0.66 -2.02 116.94 120.78 1r3n h PHE 77 Ca 0.23 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.78 1r3n h PHE 77 Cb 0.15 -0.12 -0.04 0.00 2.79 0.00 0.00 35.95 38.73 1r3n h PHE 77 CO -0.11 0.22 0.36 1.15 -2.23 0.00 0.00 178.31 177.71 1r3n h THR 78 N 0.44 1.06 -0.15 4.41 2.02 -0.82 -2.22 112.91 117.66 1r3n h THR 78 Ca 0.17 -0.24 -0.04 0.00 0.77 0.00 0.00 66.41 67.06 1r3n h THR 78 Cb 0.06 0.28 -0.01 0.00 -1.74 0.00 0.00 68.15 66.74 1r3n h THR 78 CO -0.11 0.13 -0.10 -1.13 0.37 0.00 0.00 175.52 174.68 1r3n h ASN 79 N 0.71 0.21 -0.05 4.18 -0.73 -1.05 -1.30 115.58 117.55 1r3n h ASN 79 Ca 0.25 -0.04 -0.08 0.00 1.87 0.00 0.00 56.30 58.30 1r3n h ASN 79 Cb 0.04 -0.06 0.00 0.00 0.27 0.00 0.00 38.32 38.58 1r3n h ASN 79 CO -0.11 0.35 -0.28 -0.33 -0.37 0.00 0.00 177.43 176.69 1r3n h GLU 80 N 0.22 0.27 -0.67 6.67 4.39 -0.94 -2.97 114.58 121.55 1r3n h GLU 80 Ca 0.05 -0.23 -0.05 0.00 0.34 0.00 0.00 59.36 59.47 1r3n h GLU 80 Cb 0.33 0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 29.00 1r3n h GLU 80 CO 0.02 0.89 0.22 0.00 -1.16 0.00 0.00 179.01 178.97 1r3n h GLU 82 N 0.97 0.76 0.00 0.00 5.08 -1.33 -1.09 114.58 118.97 1r3n h GLU 82 Ca 0.22 -0.19 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1r3n h GLU 82 Cb 0.28 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1r3n h GLU 82 CO -0.01 0.75 0.00 -1.13 -1.00 0.00 0.00 179.01 177.62 1r3n n SER 83 N -4.24 0.58 0.08 1.42 3.41 -1.04 -1.32 113.62 112.51 1r3n n SER 83 Ca 0.03 0.66 0.12 0.00 -0.26 0.00 0.00 58.87 59.42 1r3n n SER 83 Cb 0.27 -0.78 0.03 0.00 -0.26 0.00 0.00 64.21 63.47 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 -2.16 0.76 0.00 1.04 4.77 -0.47 -4.96 117.00 115.98 1r3n n LEU 84 Ca 0.02 0.26 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 1r3n n LEU 84 Cb 0.19 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 1r3n n LEU 84 CO 0.17 -0.13 0.00 0.61 -1.33 0.00 0.00 177.39 176.71 1r3n n GLY 85 N 1.23 1.15 3.78 -0.72 0.00 -0.44 -5.02 105.19 105.16 1r3n n GLY 85 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 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 -3.57 4.13 -0.51 0.00 2.20 -0.85 -4.46 119.74 116.69 1r3n s LYS 87 Ca 0.70 0.01 -0.13 0.00 -0.36 0.00 0.00 55.97 56.19 1r3n s LYS 87 Cb -0.22 -3.53 0.12 0.00 -1.51 0.00 0.00 37.83 32.69 1r3n s LYS 87 CO 0.31 0.01 0.43 0.08 -0.36 0.00 0.00 175.35 175.82 1r3n s VAL 88 N 1.19 4.78 0.08 4.02 1.01 -1.26 -0.63 120.40 129.58 1r3n s VAL 88 Ca 0.14 -1.61 -0.25 0.00 0.00 0.00 0.00 61.98 60.26 1r3n s VAL 88 Cb -0.14 -4.09 -0.06 0.00 0.00 0.00 0.00 36.38 32.09 1r3n s VAL 88 CO 0.06 -0.82 0.76 -0.54 0.00 0.00 0.00 175.10 174.57 1r3n s LYS 89 N 1.50 4.51 -0.14 2.72 1.02 0.73 -4.89 119.74 125.19 1r3n s LYS 89 Ca 0.04 1.08 0.02 0.00 0.02 0.00 0.00 55.97 57.13 1r3n s LYS 89 Cb -0.28 -3.33 0.00 0.00 -0.52 0.00 0.00 37.83 33.70 1r3n s LYS 89 CO 0.02 0.37 -0.19 0.08 -0.92 0.00 0.00 175.35 174.70 1r3n s VAL 90 N -0.37 2.36 0.70 3.17 1.01 -1.26 0.05 120.40 126.06 1r3n s VAL 90 Ca 0.38 -0.88 0.01 0.00 0.00 0.00 0.00 61.98 61.48 1r3n s VAL 90 Cb -0.21 -1.96 0.12 0.00 0.00 0.00 0.00 36.38 34.33 1r3n s VAL 90 CO 0.24 0.54 0.96 1.51 0.00 0.00 0.00 175.10 178.34 1r3n s ASP 91 N 0.73 4.46 0.56 3.32 1.47 -0.34 -2.03 116.67 124.84 1r3n s ASP 91 Ca -0.08 -0.44 0.37 0.00 1.18 0.00 0.00 52.55 53.57 1r3n s ASP 91 Cb -0.16 0.04 1.80 0.00 -0.34 0.00 0.00 42.92 44.27 1r3n s ASP 91 CO 0.01 -1.78 2.11 0.11 0.68 0.00 0.00 175.17 176.29 1r3n h LYS 92 N -0.42 0.00 -0.43 2.11 1.79 -1.47 -1.39 116.57 116.76 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 0.40 0.00 0.00 1.51 -1.08 0.00 0.00 179.45 180.28 1r3n n ILE 93 N -2.95 0.79 -0.16 1.86 0.00 -1.26 -4.33 119.36 113.31 1r3n n ILE 93 Ca -0.01 -0.89 0.00 0.00 0.00 0.00 0.00 62.75 61.85 1r3n n ILE 93 Cb 0.17 0.69 0.00 0.00 0.00 0.00 0.00 39.64 40.50 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 1.06 0.74 3.75 4.50 0.00 -0.59 -4.74 105.19 109.90 1r3n n GLY 94 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.52 6.75 -0.10 1.61 0.01 -1.26 -4.42 114.94 115.01 1r3n s ASN 95 Ca 0.00 2.59 -0.01 0.00 -0.71 0.00 0.00 52.86 54.74 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 -0.62 -0.06 -0.04 -1.51 0.00 0.00 177.10 174.87 1r3n s MET 96 N -0.54 3.07 -0.27 -0.60 -1.94 -0.29 -1.20 119.30 117.54 1r3n s MET 96 Ca 0.57 -0.55 -0.00 0.00 -1.71 0.00 0.00 55.69 54.00 1r3n s MET 96 Cb -0.40 -2.69 0.08 0.00 2.01 0.00 0.00 34.83 33.83 1r3n s MET 96 CO 0.43 0.51 0.03 -0.06 -0.01 0.00 0.00 175.02 175.92 1r3n s PHE 97 N -0.38 2.05 -0.72 -0.03 0.40 0.11 -1.06 117.98 118.34 1r3n s PHE 97 Ca 0.06 -1.73 -0.19 0.00 -0.60 0.00 0.00 56.93 54.47 1r3n s PHE 97 Cb -0.12 -1.69 0.12 0.00 0.51 0.00 0.00 43.02 41.84 1r3n s PHE 97 CO 0.02 -0.80 0.86 0.00 0.70 0.00 0.00 175.22 176.00 1r3n s ALA 98 N 1.51 3.46 -0.33 5.36 0.00 0.06 -0.19 121.76 131.62 1r3n s ALA 98 Ca 0.03 -2.48 -0.24 0.00 0.00 0.00 0.00 51.96 49.27 1r3n s ALA 98 Cb -0.18 -3.71 0.00 0.00 0.00 0.00 0.00 23.12 19.24 1r3n s ALA 98 CO -0.14 -2.56 0.80 0.08 0.00 0.00 0.00 175.76 173.94 1r3n s VAL 99 N 2.49 4.75 -0.20 0.00 1.01 0.19 -1.80 120.40 126.85 1r3n s VAL 99 Ca 0.19 1.08 -0.15 0.00 0.00 0.00 0.00 61.98 63.10 1r3n s VAL 99 Cb -0.16 -4.19 -0.04 0.00 0.00 0.00 0.00 36.38 31.99 1r3n s VAL 99 CO 0.00 -0.34 0.36 -0.47 0.00 0.00 0.00 175.10 174.65 1r3n s TYR 100 N 3.06 3.38 0.02 5.22 5.04 0.19 -2.00 117.35 132.26 1r3n s TYR 100 Ca 0.33 0.57 -0.30 0.00 -2.44 0.00 0.00 57.07 55.23 1r3n s TYR 100 Cb -0.14 -2.47 -0.05 0.00 0.35 0.00 0.00 41.96 39.65 1r3n s TYR 100 CO 0.15 0.04 1.22 -1.25 -1.34 0.00 0.00 175.55 174.37 1r3n s PRO 101 N 1.14 4.39 0.00 4.97 0.04 -1.26 -1.47 135.00 142.81 1r3n s PRO 101 Ca 0.17 1.77 0.00 0.00 0.04 0.00 0.00 61.00 62.98 1r3n s PRO 101 Cb -0.14 -3.43 0.00 0.00 0.04 0.00 0.00 34.50 30.97 1r3n s PRO 101 CO 0.07 -0.35 0.00 0.41 0.04 0.00 0.00 177.00 177.17 1r3n n GLY 102 N 3.31 0.88 0.14 0.56 0.00 -1.26 -4.68 105.19 104.14 1r3n n GLY 102 Ca 0.10 -1.94 -0.22 0.00 0.00 0.00 0.00 46.02 43.95 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 0.44 0.00 1.61 3.64 -0.70 -3.43 116.57 118.13 1r3n h LYS 103 Ca 0.00 -0.75 -0.30 0.00 -1.27 0.00 0.00 60.65 58.32 1r3n h LYS 103 Cb 0.00 0.28 -0.05 0.00 -0.41 0.00 0.00 32.23 32.06 1r3n h LYS 103 CO 0.00 1.35 -1.98 0.09 -2.27 0.00 0.00 179.45 176.64 1r3n n ASN 104 N -3.63 1.85 0.00 4.20 3.02 0.06 -5.01 115.26 115.75 1r3n n ASN 104 Ca -0.18 0.32 0.00 0.00 -0.03 0.00 0.00 54.58 54.69 1r3n n ASN 104 Cb 1.08 -0.75 0.00 0.00 -0.61 0.00 0.00 39.78 39.50 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 1.44 0.90 6.55 7.41 0.00 -1.26 -5.02 105.19 115.21 1r3n n GLY 105 Ca -0.39 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.03 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 0.02 3.75 -0.02 0.00 -1.26 -3.34 105.19 104.35 1r3n n GLY 106 Ca 0.00 -0.04 -0.41 0.00 0.00 0.00 0.00 46.02 45.57 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 0.00 4.33 0.52 1.61 1.02 -1.26 -4.71 119.74 121.25 1r3n s LYS 107 Ca 0.00 2.20 -0.21 0.00 0.02 0.00 0.00 55.97 57.98 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 -0.29 1.18 -1.25 -0.92 0.00 0.00 175.35 174.06 1r3n s PRO 108 N -0.77 3.45 -0.22 -1.68 0.04 -1.26 -4.29 135.00 130.27 1r3n s PRO 108 Ca 0.55 1.76 -0.29 0.00 0.04 0.00 0.00 61.00 63.06 1r3n s PRO 108 Cb -0.40 -2.18 0.01 0.00 0.04 0.00 0.00 34.50 31.97 1r3n s PRO 108 CO 0.45 -0.81 1.09 0.99 0.04 0.00 0.00 177.00 178.77 1r3n s THR 109 N -1.61 4.58 -0.06 1.26 2.01 -0.33 0.01 115.64 121.49 1r3n s THR 109 Ca 0.70 1.90 -0.05 0.00 0.31 0.00 0.00 61.69 64.54 1r3n s THR 109 Cb -0.28 -4.25 -0.04 0.00 0.01 0.00 0.00 72.50 67.94 1r3n s THR 109 CO 0.33 -0.19 0.17 0.00 -0.69 0.00 0.00 174.62 174.23 1r3n s ALA 110 N 3.31 3.92 0.01 7.40 0.00 -0.50 -1.03 121.76 134.86 1r3n s ALA 110 Ca 0.47 -0.70 0.06 0.00 0.00 0.00 0.00 51.96 51.79 1r3n s ALA 110 Cb -0.16 -1.93 -0.02 0.00 0.00 0.00 0.00 23.12 21.01 1r3n s ALA 110 CO 0.09 0.69 -0.17 -0.08 0.00 0.00 0.00 175.76 176.28 1r3n s THR 111 N -1.19 1.38 0.09 0.00 -1.32 0.24 -1.16 115.64 113.68 1r3n s THR 111 Ca 0.22 -0.86 -0.27 0.00 -1.21 0.00 0.00 61.69 59.57 1r3n s THR 111 Cb -0.12 -1.17 0.09 0.00 -1.51 0.00 0.00 72.50 69.78 1r3n s THR 111 CO 0.12 0.29 1.09 -0.83 -2.21 0.00 0.00 174.62 173.09 1r3n s GLY 112 N -0.66 -0.25 0.00 6.08 0.00 -1.00 0.26 107.32 111.75 1r3n s GLY 112 Ca 0.06 0.26 0.00 0.00 0.00 0.00 0.00 44.72 45.05 1r3n s GLY 112 CO 0.00 0.49 0.00 -1.26 0.00 0.00 0.00 173.10 172.33 1r3n n SER 113 N -0.58 0.33 -4.21 1.64 2.88 -0.87 -4.48 113.62 108.34 1r3n n SER 113 Ca -0.06 0.00 -0.21 0.00 -1.33 0.00 0.00 58.87 57.26 1r3n n SER 113 Cb 0.61 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.95 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 -0.84 1.48 -0.25 0.66 -3.43 -1.25 -1.20 115.29 110.47 1r3n s HIS 114 Ca 0.00 -0.41 0.21 0.00 -0.80 0.00 0.00 55.06 54.06 1r3n s HIS 114 Cb 0.00 -0.84 -0.30 0.00 -1.43 0.00 0.00 32.58 30.01 1r3n s HIS 114 CO 0.00 0.10 0.56 1.28 -2.00 0.00 0.00 174.74 174.68 1r3n n LEU 115 N 1.44 0.23 -4.82 5.38 4.77 -1.26 -2.39 117.00 120.35 1r3n n LEU 115 Ca -0.19 -0.12 -0.33 0.00 -0.03 0.00 0.00 56.01 55.34 1r3n n LEU 115 Cb 0.54 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.61 1r3n n LEU 115 CO 0.22 0.06 0.70 1.51 -1.33 0.00 0.00 177.39 178.55 1r3n s ASP 116 N -4.06 6.30 0.46 -1.43 -4.77 -1.26 -4.84 116.67 107.07 1r3n s ASP 116 Ca -0.04 1.74 0.03 0.00 -3.30 0.00 0.00 52.55 50.98 1r3n s ASP 116 Cb 0.14 -2.53 -0.04 0.00 -1.09 0.00 0.00 42.92 39.40 1r3n s ASP 116 CO 0.86 -0.81 0.02 0.42 0.70 0.00 0.00 175.17 176.37 1r3n s THR 117 N -2.39 1.36 0.88 2.11 -4.23 0.11 -4.78 115.64 108.69 1r3n s THR 117 Ca 0.63 -2.00 -0.12 0.00 -1.18 0.00 0.00 61.69 59.02 1r3n s THR 117 Cb -0.13 -2.47 0.12 0.00 1.34 0.00 0.00 72.50 71.35 1r3n s THR 117 CO 0.29 0.00 1.11 -1.58 -0.54 0.00 0.00 174.62 173.90 1r3n s GLN 118 N -3.81 1.42 0.24 3.99 2.00 -1.26 -4.53 119.66 117.71 1r3n s GLN 118 Ca 0.18 0.52 -0.06 0.00 -2.00 0.00 0.00 55.36 54.01 1r3n s GLN 118 Cb 0.05 -1.85 0.25 0.00 0.80 0.00 0.00 33.01 32.26 1r3n s GLN 118 CO 0.09 -2.06 1.86 -1.35 -0.50 0.00 0.00 175.29 173.34 1r3n h PRO 119 N -1.40 1.19 -4.64 1.67 0.11 -1.96 -3.33 132.00 123.65 1r3n h PRO 119 Ca -0.50 -0.15 -0.67 0.00 0.11 0.00 0.00 66.00 64.79 1r3n h PRO 119 Cb 1.30 -0.23 -0.38 0.00 0.11 0.00 0.00 31.00 31.80 1r3n h PRO 119 CO 0.59 0.89 -0.67 -1.21 -0.21 0.00 0.00 178.00 177.39 1r3n s GLU 120 N -5.75 1.68 0.32 1.05 2.02 -1.26 -4.62 118.70 112.13 1r3n s GLU 120 Ca -0.12 -1.83 0.04 0.00 0.02 0.00 0.00 54.97 53.08 1r3n s GLU 120 Cb 0.17 -3.31 -0.06 0.00 0.10 0.00 0.00 34.13 31.02 1r3n s GLU 120 CO 0.82 -0.96 0.04 0.00 0.02 0.00 0.00 175.26 175.18 1r3n s ALA 121 N 0.99 2.34 0.57 5.21 0.00 -0.62 -3.01 121.76 127.24 1r3n s ALA 121 Ca 0.09 -2.03 0.04 0.00 0.00 0.00 0.00 51.96 50.06 1r3n s ALA 121 Cb -0.20 0.59 0.06 0.00 0.00 0.00 0.00 23.12 23.57 1r3n s ALA 121 CO -0.07 -0.28 0.79 0.20 0.00 0.00 0.00 175.76 176.40 1r3n s GLY 122 N -3.48 1.82 0.07 0.00 0.00 -1.01 -0.89 107.32 103.83 1r3n s GLY 122 Ca 0.35 -1.63 0.26 0.00 0.00 0.00 0.00 44.72 43.70 1r3n s GLY 122 CO 0.15 -1.27 1.59 0.28 0.00 0.00 0.00 173.10 173.84 1r3n n LYS 123 N -2.34 0.12 -0.06 2.90 5.02 -1.26 -4.36 118.16 118.18 1r3n n LYS 123 Ca 0.11 0.06 -0.06 0.00 -2.02 0.00 0.00 58.31 56.40 1r3n n LYS 123 Cb 0.60 -1.60 -0.08 0.00 -0.02 0.00 0.00 35.03 33.93 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 -1.79 0.00 -1.90 2.13 4.02 -1.26 -4.68 117.16 113.67 1r3n n TYR 124 Ca 0.05 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.52 1r3n n TYR 124 Cb 0.38 -0.53 -0.03 0.00 -0.02 0.00 0.00 39.34 39.14 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 -4.53 6.55 0.00 7.72 2.15 -1.26 -1.33 116.67 125.97 1r3n s ASP 125 Ca -0.08 2.69 0.00 0.00 0.43 0.00 0.00 52.55 55.59 1r3n s ASP 125 Cb 0.04 -2.60 0.00 0.00 -0.30 0.00 0.00 42.92 40.05 1r3n s ASP 125 CO 0.42 -0.83 0.00 0.61 -0.17 0.00 0.00 175.17 175.19 1r3n n GLY 126 N 3.37 0.51 0.33 2.66 0.00 -1.26 -4.53 105.19 106.28 1r3n n GLY 126 Ca 0.12 -0.00 0.12 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 0.67 -0.08 -0.61 2.04 -1.43 -2.37 117.51 115.73 1r3n h ILE 127 Ca 0.00 -0.23 0.04 0.00 1.00 0.00 0.00 64.86 65.67 1r3n h ILE 127 Cb 0.00 -0.05 -0.06 0.00 -0.74 0.00 0.00 36.82 35.97 1r3n h ILE 127 CO 0.00 0.12 -0.40 0.25 0.00 0.00 0.00 178.15 178.12 1r3n h LEU 128 N 0.66 -1.25 -0.81 1.44 6.46 -1.44 -0.63 115.31 119.75 1r3n h LEU 128 Ca 0.55 0.16 -0.02 0.00 -0.12 0.00 0.00 57.88 58.46 1r3n h LEU 128 Cb 0.88 0.50 -0.04 0.00 -0.73 0.00 0.00 40.66 41.27 1r3n h LEU 128 CO -0.40 -0.43 0.45 1.23 -0.62 0.00 0.00 178.44 178.67 1r3n h GLY 129 N -0.51 1.21 0.71 3.75 0.00 -1.22 0.18 103.07 107.20 1r3n h GLY 129 Ca 0.07 -0.55 -0.01 0.00 0.00 0.00 0.00 47.33 46.84 1r3n h GLY 129 CO -0.36 0.53 -0.11 -2.08 0.00 0.00 0.00 176.54 174.52 1r3n h VAL 130 N 1.13 0.85 0.00 4.60 2.07 -1.27 -0.90 116.25 122.72 1r3n h VAL 130 Ca 0.29 -0.56 -0.05 0.00 0.82 0.00 0.00 66.70 67.19 1r3n h VAL 130 Cb 0.03 1.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.96 1r3n h VAL 130 CO -0.05 0.12 -0.26 -0.07 0.02 0.00 0.00 177.57 177.34 1r3n h LEU 131 N -0.60 0.00 -0.52 2.57 3.38 -1.05 -1.52 115.31 117.57 1r3n h LEU 131 Ca -0.03 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.79 1r3n h LEU 131 Cb 0.43 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 1r3n h LEU 131 CO 0.05 0.26 -0.39 0.00 0.09 0.00 0.00 178.44 178.45 1r3n h ALA 132 N 1.74 0.70 -0.63 1.53 0.00 -0.58 -0.80 119.26 121.22 1r3n h ALA 132 Ca -0.00 -0.45 -0.02 0.00 0.00 0.00 0.00 54.91 54.45 1r3n h ALA 132 Cb 0.73 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 1r3n h ALA 132 CO 0.03 0.67 0.34 0.78 0.00 0.00 0.00 179.25 181.06 1r3n h GLY 133 N 0.90 0.95 0.94 0.00 0.00 -0.39 -1.49 103.07 103.98 1r3n h GLY 133 Ca 0.05 -0.44 0.01 0.00 0.00 0.00 0.00 47.33 46.96 1r3n h GLY 133 CO 0.09 0.42 0.31 -2.00 0.00 0.00 0.00 176.54 175.36 1r3n h LEU 134 N 0.86 0.52 -1.60 3.11 6.46 -1.13 -2.35 115.31 121.18 1r3n h LEU 134 Ca 0.22 -0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.96 1r3n h LEU 134 Cb 0.06 -0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 39.86 1r3n h LEU 134 CO -0.03 0.37 0.11 -0.33 -0.62 0.00 0.00 178.44 177.94 1r3n h GLU 135 N 0.62 0.38 -0.87 1.25 4.39 -0.79 0.50 114.58 120.06 1r3n h GLU 135 Ca 0.19 -0.04 -0.03 0.00 0.34 0.00 0.00 59.36 59.82 1r3n h GLU 135 Cb -0.03 -0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 28.51 1r3n h GLU 135 CO -0.06 0.31 0.43 0.28 -1.16 0.00 0.00 179.01 178.81 1r3n h VAL 136 N 0.38 1.26 -0.22 3.13 2.07 -0.75 0.64 116.25 122.76 1r3n h VAL 136 Ca 0.10 -0.71 -0.18 0.00 0.82 0.00 0.00 66.70 66.72 1r3n h VAL 136 Cb 0.07 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 29.98 1r3n h VAL 136 CO -0.01 0.31 -0.57 -0.07 0.02 0.00 0.00 177.57 177.25 1r3n h LEU 137 N 1.23 0.89 -0.97 2.57 3.38 -1.05 -1.44 115.31 119.91 1r3n h LEU 137 Ca 0.30 -0.57 0.02 0.00 0.09 0.00 0.00 57.88 57.72 1r3n h LEU 137 Cb 0.10 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.54 1r3n h LEU 137 CO -0.04 1.30 0.64 0.03 0.09 0.00 0.00 178.44 180.46 1r3n h ARG 138 N 0.52 1.26 0.01 1.13 3.08 -0.62 -1.82 114.38 117.94 1r3n h ARG 138 Ca -0.01 -0.08 -0.20 0.00 0.07 0.00 0.00 59.98 59.77 1r3n h ARG 138 Cb 1.19 -0.28 -0.02 0.00 0.08 0.00 0.00 29.97 30.94 1r3n h ARG 138 CO 0.12 0.83 -0.93 1.79 -1.07 0.00 0.00 179.97 180.72 1r3n h THR 139 N 1.30 1.58 -0.55 2.04 1.35 -0.81 -1.40 112.91 116.42 1r3n h THR 139 Ca 0.37 -2.92 0.07 0.00 -0.55 0.00 0.00 66.41 63.38 1r3n h THR 139 Cb -0.11 2.62 -0.06 0.00 -1.73 0.00 0.00 68.15 68.88 1r3n h THR 139 CO -0.09 0.84 0.23 -0.26 -0.25 0.00 0.00 175.52 175.98 1r3n h PHE 140 N 0.04 0.40 -0.15 4.73 0.05 -0.88 -0.11 116.94 121.03 1r3n h PHE 140 Ca -0.03 0.03 -0.04 0.00 3.82 0.00 0.00 57.97 61.74 1r3n h PHE 140 Cb 1.60 -0.10 -0.00 0.00 2.00 0.00 0.00 35.95 39.45 1r3n h PHE 140 CO 0.02 0.15 -0.07 0.87 -0.18 0.00 0.00 178.31 179.10 1r3n h LYS 141 N 0.43 0.31 -0.55 1.51 1.79 -1.28 0.17 116.57 118.95 1r3n h LYS 141 Ca 0.26 -0.13 0.09 0.00 -2.18 0.00 0.00 60.65 58.68 1r3n h LYS 141 Cb 0.26 -0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 30.87 1r3n h LYS 141 CO -0.24 0.63 0.37 -0.44 -1.08 0.00 0.00 179.45 178.69 1r3n h ASP 142 N -0.02 0.34 -0.38 0.86 3.45 -0.88 -1.75 116.42 118.04 1r3n h ASP 142 Ca 0.03 0.01 0.00 0.00 0.43 0.00 0.00 57.03 57.50 1r3n h ASP 142 Cb 0.53 -0.07 0.00 0.00 -0.56 0.00 0.00 39.33 39.23 1r3n h ASP 142 CO 0.02 0.21 0.00 0.59 -1.57 0.00 0.00 179.24 178.49 1r3n n ASN 143 N -4.47 3.37 -4.18 6.45 3.02 -0.09 -4.96 115.26 114.41 1r3n n ASN 143 Ca 0.08 -1.96 -0.36 0.00 -0.03 0.00 0.00 54.58 52.31 1r3n n ASN 143 Cb 0.34 -0.24 -0.02 0.00 -0.61 0.00 0.00 39.78 39.25 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 1.39 -3.44 -4.63 6.41 3.02 -0.66 -4.92 115.26 112.43 1r3n n ASN 144 Ca 0.18 -0.98 -0.41 0.00 -0.03 0.00 0.00 54.58 53.35 1r3n n ASN 144 Cb 0.58 -2.81 -0.05 0.00 -0.61 0.00 0.00 39.78 36.88 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 -3.26 3.29 -0.32 3.10 5.04 0.50 -5.02 117.35 120.68 1r3n s TYR 145 Ca 0.74 0.96 -0.10 0.00 -2.44 0.00 0.00 57.07 56.23 1r3n s TYR 145 Cb -0.40 -2.93 -0.00 0.00 0.35 0.00 0.00 41.96 38.97 1r3n s TYR 145 CO 0.91 -0.36 0.16 0.08 -1.34 0.00 0.00 175.55 175.00 1r3n s VAL 146 N 2.66 4.61 0.73 3.14 1.01 -1.26 -4.64 120.40 126.64 1r3n s VAL 146 Ca 0.30 -0.48 -0.14 0.00 0.00 0.00 0.00 61.98 61.66 1r3n s VAL 146 Cb -0.15 -3.38 0.04 0.00 0.00 0.00 0.00 36.38 32.88 1r3n s VAL 146 CO 0.08 0.02 1.15 -2.84 0.00 0.00 0.00 175.10 173.51 1r3n s PRO 147 N 1.61 2.24 0.24 2.72 0.02 -1.26 -4.79 135.00 135.77 1r3n s PRO 147 Ca 0.04 1.54 -0.07 0.00 0.02 0.00 0.00 61.00 62.54 1r3n s PRO 147 Cb -0.17 -1.87 0.29 0.00 0.02 0.00 0.00 34.50 32.76 1r3n s PRO 147 CO 0.06 -1.71 1.87 -0.91 -0.33 0.00 0.00 177.00 175.98 1r3n h ASN 148 N -0.47 0.89 -3.51 2.53 2.35 -1.95 0.22 115.58 115.64 1r3n h ASN 148 Ca -0.46 0.00 -0.44 0.00 -0.55 0.00 0.00 56.30 54.85 1r3n h ASN 148 Cb 1.27 -0.19 -0.14 0.00 0.05 0.00 0.00 38.32 39.31 1r3n h ASN 148 CO 0.50 0.60 -0.62 -0.31 -1.65 0.00 0.00 177.43 175.95 1r3n s TYR 149 N -6.09 1.84 0.67 1.19 1.51 -1.26 -0.76 117.35 114.45 1r3n s TYR 149 Ca -0.13 -0.97 -0.17 0.00 -1.01 0.00 0.00 57.07 54.80 1r3n s TYR 149 Cb 0.18 -1.16 -0.01 0.00 -0.11 0.00 0.00 41.96 40.86 1r3n s TYR 149 CO 0.79 -0.03 1.07 -0.25 -1.11 0.00 0.00 175.55 176.02 1r3n n ASP 150 N -0.60 1.03 -4.09 2.29 8.00 -1.21 -4.12 116.55 117.85 1r3n n ASP 150 Ca -0.03 0.75 -0.22 0.00 0.71 0.00 0.00 54.79 56.01 1r3n n ASP 150 Cb 0.66 -1.45 -0.15 0.00 -0.02 0.00 0.00 41.12 40.16 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 -1.62 1.03 0.02 2.53 1.01 -0.54 -1.19 120.40 121.65 1r3n s VAL 151 Ca 0.77 -0.55 -0.00 0.00 0.00 0.00 0.00 61.98 62.20 1r3n s VAL 151 Cb -0.37 -0.86 -0.02 0.00 0.00 0.00 0.00 36.38 35.12 1r3n s VAL 151 CO 0.46 0.29 -0.03 0.00 0.00 0.00 0.00 175.10 175.83 1r3n s VAL 153 N -1.75 5.20 -0.14 0.00 1.01 -0.75 -0.59 120.40 123.39 1r3n s VAL 153 Ca -0.13 0.11 -0.05 0.00 0.00 0.00 0.00 61.98 61.91 1r3n s VAL 153 Cb -0.08 -3.36 -0.04 0.00 0.00 0.00 0.00 36.38 32.91 1r3n s VAL 153 CO -0.02 0.46 0.03 -0.69 0.00 0.00 0.00 175.10 174.89 1r3n s VAL 154 N 0.25 4.57 -0.35 2.92 1.01 0.14 -0.76 120.40 128.17 1r3n s VAL 154 Ca 0.07 -0.13 -0.07 0.00 0.00 0.00 0.00 61.98 61.85 1r3n s VAL 154 Cb -0.11 -3.00 0.04 0.00 0.00 0.00 0.00 36.38 33.31 1r3n s VAL 154 CO -0.01 0.53 0.13 -0.69 0.00 0.00 0.00 175.10 175.06 1r3n s VAL 155 N -0.19 3.88 0.10 2.92 1.01 -0.22 -2.04 120.40 125.85 1r3n s VAL 155 Ca 0.06 -1.16 -0.28 0.00 0.00 0.00 0.00 61.98 60.61 1r3n s VAL 155 Cb -0.12 -3.22 -0.06 0.00 0.00 0.00 0.00 36.38 32.98 1r3n s VAL 155 CO 0.02 -0.23 0.88 0.26 0.00 0.00 0.00 175.10 176.03 1r3n s TRP 156 N 1.41 3.80 0.22 5.22 0.52 -0.34 -1.14 118.94 128.64 1r3n s TRP 156 Ca -0.01 1.69 -0.30 0.00 0.02 0.00 0.00 56.10 57.50 1r3n s TRP 156 Cb -0.20 -2.96 -0.09 0.00 -1.15 0.00 0.00 33.47 29.08 1r3n s TRP 156 CO 0.03 0.26 1.11 0.12 0.02 0.00 0.00 176.95 178.49 1r3n s PHE 157 N -0.14 3.56 -1.16 -1.98 5.36 -1.26 -4.37 117.98 117.99 1r3n s PHE 157 Ca 0.43 1.62 -0.25 0.00 -0.96 0.00 0.00 56.93 57.76 1r3n s PHE 157 Cb -0.22 -3.30 0.01 0.00 -0.34 0.00 0.00 43.02 39.16 1r3n s PHE 157 CO 0.27 -0.67 0.76 -1.71 -1.46 0.00 0.00 175.22 172.42 1r3n n ASN 158 N 1.88 -5.00 -0.05 6.13 5.15 -1.26 -0.42 115.26 121.69 1r3n n ASN 158 Ca 0.01 -1.10 -0.06 0.00 -0.60 0.00 0.00 54.58 52.83 1r3n n ASN 158 Cb 0.45 -2.87 0.13 0.00 -0.53 0.00 0.00 39.78 36.97 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 -2.12 0.67 -0.02 1.20 4.22 -1.90 -2.09 114.58 114.54 1r3n h GLU 159 Ca -0.68 -0.26 -0.17 0.00 0.08 0.00 0.00 59.36 58.33 1r3n h GLU 159 Cb 1.37 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.57 1r3n h GLU 159 CO 0.49 0.84 -0.76 0.93 -2.18 0.00 0.00 179.01 178.32 1r3n h GLU 160 N 0.59 0.15 -4.36 1.92 4.39 -1.89 0.01 114.58 115.39 1r3n h GLU 160 Ca 0.09 -0.14 -0.36 0.00 0.34 0.00 0.00 59.36 59.28 1r3n h GLU 160 Cb 0.69 0.03 0.07 0.00 -0.10 0.00 0.00 28.75 29.45 1r3n h GLU 160 CO 0.05 0.84 -0.56 0.41 -1.16 0.00 0.00 179.01 178.60 1r3n n GLY 161 N 0.63 -0.39 0.08 -3.84 0.00 -1.25 -4.67 105.19 95.76 1r3n n GLY 161 Ca -0.02 0.06 -0.10 0.00 0.00 0.00 0.00 46.02 45.96 1r3n n GLY 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r3n n ALA 162 N -3.73 0.57 -0.16 4.61 0.00 -1.26 -4.25 120.51 116.28 1r3n n ALA 162 Ca -0.07 -0.45 -0.10 0.00 0.00 0.00 0.00 53.44 52.82 1r3n n ALA 162 Cb 0.59 -0.16 0.03 0.00 0.00 0.00 0.00 19.45 19.92 1r3n n ALA 162 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1r3n h ARG 163 N -1.00 0.97 -5.14 0.00 1.12 -1.90 -3.42 114.38 105.02 1r3n h ARG 163 Ca -0.12 -0.37 -0.67 0.00 -1.11 0.00 0.00 59.98 57.71 1r3n h ARG 163 Cb 0.77 -0.06 -0.34 0.00 -0.01 0.00 0.00 29.97 30.34 1r3n h ARG 163 CO -0.07 1.04 -0.85 -0.06 -3.11 0.00 0.00 179.97 176.92 1r3n s PHE 164 N -4.78 2.74 0.00 2.20 0.40 -1.26 -0.85 117.98 116.43 1r3n s PHE 164 Ca -0.11 -1.40 -0.03 0.00 -0.60 0.00 0.00 56.93 54.79 1r3n s PHE 164 Cb 0.13 -1.88 -0.14 0.00 0.51 0.00 0.00 43.02 41.65 1r3n s PHE 164 CO 0.86 -0.66 2.16 0.00 0.70 0.00 0.00 175.22 178.27 1r3n n ALA 165 N 4.30 3.95 -3.55 5.36 0.00 -1.26 -4.27 120.51 125.05 1r3n n ALA 165 Ca -0.20 -0.92 -0.15 0.00 0.00 0.00 0.00 53.44 52.17 1r3n n ALA 165 Cb 0.51 -2.18 -0.13 0.00 0.00 0.00 0.00 19.45 17.66 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 1.72 0.18 0.55 0.00 6.06 -1.26 -5.07 118.95 121.12 1r3n s ARG 166 Ca 0.34 0.47 -0.17 0.00 -2.50 0.00 0.00 55.73 53.86 1r3n s ARG 166 Cb 0.16 -0.63 -0.06 0.00 0.06 0.00 0.00 34.95 34.48 1r3n s ARG 166 CO 0.00 -0.50 1.04 -1.54 -2.50 0.00 0.00 175.30 171.80 1r3n s SER 167 N 2.38 6.10 -1.43 -2.12 1.04 -1.26 -3.78 113.70 114.62 1r3n s SER 167 Ca 0.05 1.81 -0.08 0.00 0.48 0.00 0.00 55.95 58.21 1r3n s SER 167 Cb -0.14 -2.54 0.05 0.00 0.10 0.00 0.00 66.02 63.49 1r3n s SER 167 CO -0.11 -0.95 0.87 0.00 0.98 0.00 0.00 173.24 174.04 1r3n h THR 169 N -2.03 1.13 0.03 0.00 2.02 -1.48 -0.45 112.91 112.12 1r3n h THR 169 Ca -0.59 -0.29 -0.00 0.00 0.77 0.00 0.00 66.41 66.30 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 0.62 0.13 -0.01 1.23 0.37 0.00 0.00 175.52 177.86 1r3n h GLY 170 N 0.49 -0.04 2.00 2.16 0.00 -0.96 -1.94 103.07 104.78 1r3n h GLY 170 Ca 0.14 0.01 -0.07 0.00 0.00 0.00 0.00 47.33 47.41 1r3n h GLY 170 CO -0.03 -0.01 -0.31 1.48 0.00 0.00 0.00 176.54 177.67 1r3n h SER 171 N -0.23 0.00 0.17 0.19 4.64 -1.76 -2.66 113.55 113.89 1r3n h SER 171 Ca -0.00 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.17 1r3n h SER 171 Cb 0.21 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 1r3n h SER 171 CO 0.01 0.31 -0.53 0.28 -0.87 0.00 0.00 176.83 176.03 1r3n h SER 172 N 0.00 0.44 0.19 4.97 0.02 -0.98 -0.42 113.55 117.77 1r3n h SER 172 Ca -0.00 -0.23 -0.01 0.00 -0.84 0.00 0.00 61.79 60.71 1r3n h SER 172 Cb 0.99 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.40 1r3n h SER 172 CO 0.04 0.88 -0.09 0.58 -1.14 0.00 0.00 176.83 177.10 1r3n h VAL 173 N 0.31 0.90 -1.03 2.27 2.07 -1.25 -0.19 116.25 119.33 1r3n h VAL 173 Ca 0.01 -0.78 0.26 0.00 0.82 0.00 0.00 66.70 67.00 1r3n h VAL 173 Cb 1.03 1.34 -0.11 0.00 -1.52 0.00 0.00 31.29 32.04 1r3n h VAL 173 CO 0.09 0.17 0.64 -0.25 0.02 0.00 0.00 177.57 178.24 1r3n h TRP 174 N -0.67 0.80 -0.08 1.57 7.01 -1.46 -1.47 115.95 121.66 1r3n h TRP 174 Ca -0.03 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.00 1r3n h TRP 174 Cb 0.48 -0.23 0.00 0.00 -2.10 0.00 0.00 29.16 27.31 1r3n h TRP 174 CO 0.05 0.06 0.00 -1.13 -2.79 0.00 0.00 178.44 174.63 1r3n n SER 175 N -4.73 1.60 -1.55 2.65 3.41 -0.17 -0.71 113.62 114.11 1r3n n SER 175 Ca 0.26 -1.59 -0.15 0.00 -0.26 0.00 0.00 58.87 57.14 1r3n n SER 175 Cb 0.83 -0.04 -0.02 0.00 -0.26 0.00 0.00 64.21 64.72 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 -0.54 0.15 7.33 8.25 -0.55 -4.90 115.22 125.21 1r3n n HIS 176 Ca 0.18 0.00 0.10 0.00 -0.26 0.00 0.00 57.72 57.74 1r3n n HIS 176 Cb 0.35 -2.98 0.07 0.00 1.12 0.00 0.00 29.99 28.55 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 -3.45 0.41 3.32 -1.27 -3.46 116.42 111.97 1r3n h ASP 177 Ca -0.34 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 56.41 1r3n h ASP 177 Cb 1.19 0.00 -0.35 0.00 0.22 0.00 0.00 39.33 40.40 1r3n h ASP 177 CO 0.42 0.11 -0.71 -0.22 -1.72 0.00 0.00 179.24 177.12 1r3n s LEU 178 N -5.91 0.80 0.57 1.55 2.96 -1.00 -4.99 118.68 112.66 1r3n s LEU 178 Ca 0.03 0.10 -0.19 0.00 -0.22 0.00 0.00 54.13 53.86 1r3n s LEU 178 Cb 0.07 0.00 -0.05 0.00 0.50 0.00 0.00 46.19 46.72 1r3n s LEU 178 CO 0.73 -0.16 1.14 -0.94 -1.32 0.00 0.00 176.35 175.81 1r3n s SER 179 N 1.34 5.53 0.35 3.68 1.04 -1.26 -4.08 113.70 120.31 1r3n s SER 179 Ca -0.06 2.20 0.04 0.00 0.48 0.00 0.00 55.95 58.62 1r3n s SER 179 Cb -0.13 -2.58 0.69 0.00 0.10 0.00 0.00 66.02 64.10 1r3n s SER 179 CO -0.04 -1.35 1.97 0.25 0.98 0.00 0.00 173.24 175.05 1r3n h LEU 180 N 1.00 0.71 -0.54 2.42 5.85 -1.94 -2.37 115.31 120.43 1r3n h LEU 180 Ca -0.50 -0.00 -0.16 0.00 0.84 0.00 0.00 57.88 58.06 1r3n h LEU 180 Cb 1.27 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.13 1r3n h LEU 180 CO 0.56 0.47 -0.55 -0.33 -0.34 0.00 0.00 178.44 178.26 1r3n h GLU 181 N 0.81 0.52 -0.34 1.25 3.07 -1.99 -0.99 114.58 116.91 1r3n h GLU 181 Ca 0.30 -0.33 -0.10 0.00 -0.50 0.00 0.00 59.36 58.73 1r3n h GLU 181 Cb 0.15 0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.09 1r3n h GLU 181 CO -0.09 0.93 -0.17 1.49 -1.40 0.00 0.00 179.01 179.77 1r3n h GLU 182 N 0.40 0.72 -0.29 2.33 4.81 -1.88 -2.93 114.58 117.74 1r3n h GLU 182 Ca 0.01 -0.31 0.02 0.00 -0.13 0.00 0.00 59.36 58.94 1r3n h GLU 182 Cb 1.09 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.42 1r3n h GLU 182 CO 0.10 0.92 0.14 0.00 -0.73 0.00 0.00 179.01 179.44 1r3n h ALA 183 N 0.78 0.34 -0.49 2.92 0.00 -1.25 -2.60 119.26 118.97 1r3n h ALA 183 Ca 0.08 0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.07 1r3n h ALA 183 Cb 0.70 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 1r3n h ALA 183 CO 0.05 -0.25 0.33 1.88 0.00 0.00 0.00 179.25 181.26 1r3n h TYR 184 N 0.29 0.39 -0.23 0.00 0.99 -1.16 -2.38 116.97 114.87 1r3n h TYR 184 Ca 0.12 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.86 1r3n h TYR 184 Cb 0.04 -0.13 0.00 0.00 1.00 0.00 0.00 36.73 37.64 1r3n h TYR 184 CO -0.10 0.20 0.00 0.41 -0.00 0.00 0.00 178.16 178.68 1r3n n GLY 185 N -1.52 0.70 3.72 3.88 0.00 -0.99 -2.80 105.19 108.19 1r3n n GLY 185 Ca 0.07 -0.51 -0.42 0.00 0.00 0.00 0.00 46.02 45.17 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 -1.53 4.39 0.22 0.99 1.43 -0.90 -4.88 118.68 118.41 1r3n s LEU 186 Ca 0.34 2.35 0.02 0.00 -1.03 0.00 0.00 54.13 55.80 1r3n s LEU 186 Cb 0.19 -3.60 -0.04 0.00 0.03 0.00 0.00 46.19 42.77 1r3n s LEU 186 CO 0.27 -0.59 0.38 -0.04 0.23 0.00 0.00 176.35 176.61 1r3n s MET 187 N 0.56 3.48 0.32 1.70 -1.94 -1.26 -1.82 119.30 120.34 1r3n s MET 187 Ca 0.61 -0.50 -0.20 0.00 -1.71 0.00 0.00 55.69 53.89 1r3n s MET 187 Cb -0.36 -2.85 -0.09 0.00 2.01 0.00 0.00 34.83 33.53 1r3n s MET 187 CO 0.34 0.40 0.83 -1.54 -0.01 0.00 0.00 175.02 175.03 1r3n s SER 188 N -3.52 7.01 0.03 3.03 1.04 -1.00 -4.36 113.70 115.93 1r3n s SER 188 Ca 0.37 1.53 0.00 0.00 0.48 0.00 0.00 55.95 58.33 1r3n s SER 188 Cb -0.10 -2.47 -0.04 0.00 0.10 0.00 0.00 66.02 63.51 1r3n s SER 188 CO 0.30 -0.15 0.12 0.68 0.98 0.00 0.00 173.24 175.17 1r3n s VAL 189 N -1.83 4.91 -1.01 5.02 -7.23 -0.03 -4.62 120.40 115.59 1r3n s VAL 189 Ca 0.52 -0.46 -0.05 0.00 -1.81 0.00 0.00 61.98 60.18 1r3n s VAL 189 Cb -0.13 -3.31 -0.06 0.00 0.56 0.00 0.00 36.38 33.43 1r3n s VAL 189 CO 0.19 0.25 0.89 0.61 -0.31 0.00 0.00 175.10 176.73 1r3n n GLY 190 N 0.80 -1.15 3.07 2.32 0.00 -1.26 -4.81 105.19 104.15 1r3n n GLY 190 Ca -0.10 0.57 -0.12 0.00 0.00 0.00 0.00 46.02 46.37 1r3n n GLY 190 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1r3n s GLU 191 N -4.27 0.32 0.00 1.61 2.12 -1.26 -5.10 118.70 112.12 1r3n s GLU 191 Ca 0.42 -0.05 0.00 0.00 0.36 0.00 0.00 54.97 55.71 1r3n s GLU 191 Cb -0.05 0.14 0.00 0.00 0.26 0.00 0.00 34.13 34.48 1r3n s GLU 191 CO 0.73 -0.06 0.54 -0.25 -0.54 0.00 0.00 175.26 175.68 1r3n n ASP 192 N 2.32 0.00 -4.27 -1.70 9.92 -1.26 -4.15 116.55 117.42 1r3n n ASP 192 Ca -0.17 0.54 -0.44 0.00 -0.53 0.00 0.00 54.79 54.20 1r3n n ASP 192 Cb 0.57 -0.04 -0.06 0.00 -0.64 0.00 0.00 41.12 40.95 1r3n n ASP 192 CO 0.00 0.00 0.00 -1.59 0.13 0.00 0.00 177.20 175.74 1r3n s LYS 193 N -1.17 2.77 0.84 -1.24 0.00 -1.26 -5.08 119.74 114.59 1r3n s LYS 193 Ca 0.00 -1.75 -0.13 0.00 0.00 0.00 0.00 55.97 54.09 1r3n s LYS 193 Cb 0.00 -4.13 0.08 0.00 0.00 0.00 0.00 37.83 33.77 1r3n s LYS 193 CO 0.00 -1.27 1.04 -2.30 0.00 0.00 0.00 175.35 172.82 1r3n n PRO 194 N 5.07 0.03 -4.19 1.78 -0.02 -1.26 -5.06 135.00 131.35 1r3n n PRO 194 Ca -0.11 0.08 -0.11 0.00 -2.02 0.00 0.00 63.50 61.34 1r3n n PRO 194 Cb 0.40 -2.31 -0.10 0.00 -0.02 0.00 0.00 33.50 31.48 1r3n n PRO 194 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 1r3n s GLU 195 N -4.02 1.06 0.71 -0.52 -1.05 -1.26 -4.94 118.70 108.68 1r3n s GLU 195 Ca 0.70 -1.53 -0.09 0.00 -0.15 0.00 0.00 54.97 53.90 1r3n s GLU 195 Cb -0.28 0.15 0.05 0.00 -0.44 0.00 0.00 34.13 33.61 1r3n s GLU 195 CO 0.55 -0.28 1.05 -1.54 0.95 0.00 0.00 175.26 175.98 1r3n s SER 196 N -3.12 4.97 0.19 0.83 1.04 -1.26 -2.39 113.70 113.96 1r3n s SER 196 Ca 0.29 0.69 -0.11 0.00 0.48 0.00 0.00 55.95 57.30 1r3n s SER 196 Cb 0.07 -1.38 0.12 0.00 0.10 0.00 0.00 66.02 64.93 1r3n s SER 196 CO 0.06 -1.54 1.80 0.58 0.98 0.00 0.00 173.24 175.11 1r3n h VAL 197 N -0.65 1.22 -0.12 5.02 2.07 -1.30 -1.26 116.25 121.23 1r3n h VAL 197 Ca -0.45 -0.58 0.00 0.00 0.82 0.00 0.00 66.70 66.49 1r3n h VAL 197 Cb 1.30 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 31.42 1r3n h VAL 197 CO 0.62 0.25 0.08 0.22 0.02 0.00 0.00 177.57 178.76 1r3n h TYR 198 N 0.94 0.15 -0.61 1.57 3.20 -1.81 -0.79 116.97 119.63 1r3n h TYR 198 Ca 0.24 0.00 0.12 0.00 3.14 0.00 0.00 58.73 62.23 1r3n h TYR 198 Cb 0.07 -0.05 -0.09 0.00 1.54 0.00 0.00 36.73 38.20 1r3n h TYR 198 CO -0.00 0.10 0.09 -0.44 -1.64 0.00 0.00 178.16 176.27 1r3n h ASP 199 N 0.15 -0.08 0.19 -2.11 3.32 -1.81 -1.86 116.42 114.23 1r3n h ASP 199 Ca 0.04 0.13 -0.01 0.00 0.02 0.00 0.00 57.03 57.21 1r3n h ASP 199 Cb -0.01 0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.73 1r3n h ASP 199 CO -0.01 -0.03 -0.09 0.28 -1.72 0.00 0.00 179.24 177.67 1r3n h SER 200 N 0.21 -0.22 0.43 6.45 0.02 -0.84 -2.78 113.55 116.82 1r3n h SER 200 Ca 0.32 -0.11 -0.05 0.00 -0.84 0.00 0.00 61.79 61.11 1r3n h SER 200 Cb 0.50 0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.09 1r3n h SER 200 CO -0.44 -0.03 -0.26 -0.07 -1.14 0.00 0.00 176.83 174.89 1r3n h LEU 201 N -0.40 0.00 -0.13 5.07 3.38 -0.93 -2.79 115.31 119.50 1r3n h LEU 201 Ca -0.03 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 1r3n h LEU 201 Cb 0.31 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 1r3n h LEU 201 CO 0.04 0.26 -0.15 0.50 0.09 0.00 0.00 178.44 179.18 1r3n h LYS 202 N 0.00 0.34 -0.99 1.13 3.64 -1.33 0.89 116.57 120.25 1r3n h LYS 202 Ca -0.00 -0.19 0.21 0.00 -1.27 0.00 0.00 60.65 59.40 1r3n h LYS 202 Cb 0.55 0.01 -0.12 0.00 -0.41 0.00 0.00 32.23 32.26 1r3n h LYS 202 CO 0.03 0.75 0.58 -0.97 -2.27 0.00 0.00 179.45 177.57 1r3n h ASN 203 N -0.04 0.70 -0.03 4.20 -0.73 -1.23 -1.25 115.58 117.21 1r3n h ASN 203 Ca 0.02 0.12 0.00 0.00 1.87 0.00 0.00 56.30 58.31 1r3n h ASN 203 Cb 0.69 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.29 1r3n h ASN 203 CO 0.04 0.18 -0.11 2.30 -0.37 0.00 0.00 177.43 179.47 1r3n n ILE 204 N -4.84 0.00 -2.54 2.57 -5.35 -1.12 -4.99 119.36 103.09 1r3n n ILE 204 Ca 0.25 -0.44 -0.08 0.00 -0.27 0.00 0.00 62.75 62.20 1r3n n ILE 204 Cb 0.65 1.43 0.01 0.00 -1.74 0.00 0.00 39.64 40.00 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 1.34 0.24 0.77 3.28 0.00 -0.47 -4.93 105.19 105.42 1r3n n GLY 205 Ca 0.13 -0.44 0.03 0.00 0.00 0.00 0.00 46.02 45.73 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 -3.70 0.58 -2.69 1.61 4.02 0.30 -4.84 117.16 112.43 1r3n n TYR 206 Ca -0.04 -1.35 -0.42 0.00 -0.01 0.00 0.00 57.90 56.08 1r3n n TYR 206 Cb 0.54 -0.34 -0.03 0.00 -0.02 0.00 0.00 39.34 39.49 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 -3.11 4.13 0.74 -0.72 1.01 -1.18 -3.44 121.20 118.62 1r3n s ILE 207 Ca 0.40 0.49 -0.04 0.00 0.00 0.00 0.00 60.65 61.50 1r3n s ILE 207 Cb 0.36 -4.69 0.12 0.00 0.01 0.00 0.00 42.46 38.26 1r3n s ILE 207 CO -0.00 -1.36 1.02 -0.83 0.00 0.00 0.00 174.94 173.77 1r3n s GLY 208 N 3.11 1.76 -0.09 6.18 0.00 -0.78 -4.95 107.32 112.56 1r3n s GLY 208 Ca 0.35 -1.48 0.18 0.00 0.00 0.00 0.00 44.72 43.78 1r3n s GLY 208 CO 0.20 -0.94 0.38 1.22 0.00 0.00 0.00 173.10 173.96 1r3n n ASP 209 N -2.93 0.25 -4.76 1.64 8.00 -0.86 -3.83 116.55 114.05 1r3n n ASP 209 Ca 0.13 0.11 -0.41 0.00 0.71 0.00 0.00 54.79 55.33 1r3n n ASP 209 Cb 0.60 0.99 -0.02 0.00 -0.02 0.00 0.00 41.12 42.67 1r3n n ASP 209 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1r3n s THR 210 N -2.84 2.71 0.26 -3.53 2.01 -0.97 -4.84 115.64 108.44 1r3n s THR 210 Ca -0.08 0.67 -0.30 0.00 0.31 0.00 0.00 61.69 62.30 1r3n s THR 210 Cb 0.09 -3.43 -0.11 0.00 0.01 0.00 0.00 72.50 69.06 1r3n s THR 210 CO 0.84 0.14 1.51 -2.84 -0.69 0.00 0.00 174.62 173.59 1r3n s PRO 211 N -1.36 4.21 -1.21 4.92 0.02 -1.26 -1.85 135.00 138.47 1r3n s PRO 211 Ca 0.52 2.41 -0.12 0.00 0.02 0.00 0.00 61.00 63.83 1r3n s PRO 211 Cb -0.40 -3.08 0.19 0.00 0.02 0.00 0.00 34.50 31.22 1r3n s PRO 211 CO 0.50 -0.51 1.49 0.00 -0.33 0.00 0.00 177.00 178.14 1r3n n ALA 212 N 2.43 4.25 -3.58 -1.55 0.00 -1.26 -4.29 120.51 116.51 1r3n n ALA 212 Ca 0.08 -4.33 -0.11 0.00 0.00 0.00 0.00 53.44 49.07 1r3n n ALA 212 Cb 0.39 -2.94 -0.08 0.00 0.00 0.00 0.00 19.45 16.82 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 2.09 -0.72 0.58 0.00 0.15 -1.26 -3.98 113.70 110.56 1r3n s SER 213 Ca 0.40 1.29 0.35 0.00 0.70 0.00 0.00 55.95 58.70 1r3n s SER 213 Cb -0.01 1.25 1.73 0.00 -1.71 0.00 0.00 66.02 67.28 1r3n s SER 213 CO -0.00 -0.22 2.14 0.10 1.20 0.00 0.00 173.24 176.45 1r3n h TYR 214 N 5.89 0.00 0.02 3.44 -0.00 -1.15 0.15 116.97 125.31 1r3n h TYR 214 Ca -0.30 0.00 -0.20 0.00 0.00 0.00 0.00 58.73 58.23 1r3n h TYR 214 Cb 1.19 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 37.90 1r3n h TYR 214 CO 0.28 0.04 -0.94 0.87 -0.00 0.00 0.00 178.16 178.42 1r3n h LYS 215 N 0.00 0.10 0.00 0.10 1.57 -1.96 -3.36 116.57 113.02 1r3n h LYS 215 Ca -0.00 -0.13 -0.43 0.00 -1.87 0.00 0.00 60.65 58.22 1r3n h LYS 215 Cb 0.30 0.04 -0.07 0.00 0.08 0.00 0.00 32.23 32.58 1r3n h LYS 215 CO 0.01 0.96 -2.49 0.39 -0.57 0.00 0.00 179.45 177.75 1r3n n GLU 216 N -3.53 0.59 -3.42 3.15 1.02 -0.90 -4.72 120.64 112.83 1r3n n GLU 216 Ca -0.02 0.22 -0.44 0.00 -0.02 0.00 0.00 57.16 56.90 1r3n n GLU 216 Cb 0.86 -1.47 -0.03 0.00 -0.02 0.00 0.00 31.44 30.78 1r3n n GLU 216 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1r3n s ASN 217 N -7.16 6.67 0.32 1.62 2.47 0.46 -5.01 114.94 114.31 1r3n s ASN 217 Ca -0.37 -3.17 -0.20 0.00 0.42 0.00 0.00 52.86 49.54 1r3n s ASN 217 Cb 0.13 -2.13 -0.09 0.00 -1.45 0.00 0.00 41.25 37.71 1r3n s ASN 217 CO 0.50 -0.40 0.83 -1.61 -3.72 0.00 0.00 177.10 172.71 1r3n s GLU 218 N -0.56 4.27 0.16 0.43 2.02 -1.26 -4.52 118.70 119.23 1r3n s GLU 218 Ca 0.23 0.99 0.08 0.00 0.02 0.00 0.00 54.97 56.29 1r3n s GLU 218 Cb -0.11 -2.60 -0.04 0.00 0.10 0.00 0.00 34.13 31.48 1r3n s GLU 218 CO -0.08 0.22 -0.17 0.96 0.02 0.00 0.00 175.26 176.20 1r3n s ILE 219 N -1.80 1.68 -0.05 -1.63 -4.36 -1.26 -4.34 121.20 109.43 1r3n s ILE 219 Ca 0.52 -1.89 -0.10 0.00 -0.26 0.00 0.00 60.65 58.91 1r3n s ILE 219 Cb -0.14 -1.78 -0.30 0.00 1.25 0.00 0.00 42.46 41.49 1r3n s ILE 219 CO 0.19 -0.37 0.66 -0.78 0.24 0.00 0.00 174.94 174.89 1r3n h ASP 220 N 3.27 0.60 -5.18 4.36 3.58 -0.60 -3.47 116.42 118.98 1r3n h ASP 220 Ca -0.41 -0.92 -0.05 0.00 0.42 0.00 0.00 57.03 56.06 1r3n h ASP 220 Cb 1.20 -0.20 -0.06 0.00 1.72 0.00 0.00 39.33 42.00 1r3n h ASP 220 CO 0.52 1.78 0.04 0.00 -2.88 0.00 0.00 179.24 178.70 1r3n s ALA 221 N -2.58 -0.41 -0.16 -0.78 0.00 -1.26 -4.10 121.76 112.47 1r3n s ALA 221 Ca -0.16 -0.82 -0.04 0.00 0.00 0.00 0.00 51.96 50.94 1r3n s ALA 221 Cb 0.05 0.95 0.07 0.00 0.00 0.00 0.00 23.12 24.20 1r3n s ALA 221 CO 0.85 -0.92 0.20 -1.58 0.00 0.00 0.00 175.76 174.32 1r3n s HIS 222 N -3.46 -0.24 -0.13 0.00 2.46 -0.55 -1.41 115.29 111.96 1r3n s HIS 222 Ca 0.20 0.40 -0.02 0.00 0.47 0.00 0.00 55.06 56.10 1r3n s HIS 222 Cb -0.03 -0.31 -0.03 0.00 -0.13 0.00 0.00 32.58 32.08 1r3n s HIS 222 CO 0.11 -0.47 -0.05 -0.06 -2.47 0.00 0.00 174.74 171.80 1r3n s PHE 223 N 2.32 2.99 -0.14 3.88 0.40 -0.31 -2.04 117.98 125.09 1r3n s PHE 223 Ca 0.05 -0.21 0.01 0.00 -0.60 0.00 0.00 56.93 56.18 1r3n s PHE 223 Cb -0.14 -1.87 0.02 0.00 0.51 0.00 0.00 43.02 41.53 1r3n s PHE 223 CO -0.10 0.08 -0.17 -2.00 0.70 0.00 0.00 175.22 173.73 1r3n s GLU 224 N -0.02 2.50 -0.13 0.44 2.12 -0.83 -2.37 118.70 120.42 1r3n s GLU 224 Ca 0.00 -0.65 -0.18 0.00 0.36 0.00 0.00 54.97 54.50 1r3n s GLU 224 Cb -0.13 -2.16 -0.04 0.00 0.26 0.00 0.00 34.13 32.05 1r3n s GLU 224 CO 0.03 -0.14 0.46 -1.17 -0.54 0.00 0.00 175.26 173.90 1r3n s LEU 225 N 1.17 4.27 0.05 2.70 2.96 -1.26 -0.76 118.68 127.81 1r3n s LEU 225 Ca -0.01 0.78 -0.12 0.00 -0.22 0.00 0.00 54.13 54.56 1r3n s LEU 225 Cb -0.14 -2.66 0.01 0.00 0.50 0.00 0.00 46.19 43.90 1r3n s LEU 225 CO -0.06 0.00 0.26 -2.28 -1.32 0.00 0.00 176.35 172.95 1r3n s HIS 226 N 0.65 -0.04 0.60 5.38 2.46 -0.53 -2.71 115.29 121.09 1r3n s HIS 226 Ca 0.25 -0.14 -0.17 0.00 0.47 0.00 0.00 55.06 55.47 1r3n s HIS 226 Cb -0.15 0.05 -0.03 0.00 -0.13 0.00 0.00 32.58 32.32 1r3n s HIS 226 CO 0.10 -0.48 1.11 0.96 -2.47 0.00 0.00 174.74 173.95 1r3n s ILE 227 N -2.64 3.31 0.41 0.89 -4.36 -1.26 -2.66 121.20 114.89 1r3n s ILE 227 Ca -0.04 0.70 0.10 0.00 -0.26 0.00 0.00 60.65 61.14 1r3n s ILE 227 Cb -0.01 -3.23 0.20 0.00 1.25 0.00 0.00 42.46 40.67 1r3n s ILE 227 CO -0.04 -0.29 1.98 -0.08 0.24 0.00 0.00 174.94 176.75 1r3n h GLU 228 N 0.63 0.29 -1.93 0.37 4.81 -1.54 -3.45 114.58 113.76 1r3n h GLU 228 Ca -0.48 -0.05 -0.40 0.00 -0.13 0.00 0.00 59.36 58.30 1r3n h GLU 228 Cb 1.25 -0.05 -0.10 0.00 0.63 0.00 0.00 28.75 30.48 1r3n h GLU 228 CO 0.56 0.33 -0.43 1.04 -0.73 0.00 0.00 179.01 179.78 1r3n n GLN 229 N -4.36 -1.57 -3.83 1.92 6.02 -1.26 -4.89 117.38 109.41 1r3n n GLN 229 Ca -0.00 1.08 -0.09 0.00 -0.01 0.00 0.00 57.00 57.97 1r3n n GLN 229 Cb 0.20 -5.57 -0.05 0.00 1.02 0.00 0.00 30.24 25.84 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 -2.41 0.13 0.00 1.08 0.00 -1.25 -4.72 107.32 100.16 1r3n s GLY 230 Ca 0.00 -0.47 0.25 0.00 0.00 0.00 0.00 44.72 44.50 1r3n s GLY 230 CO 0.00 -0.43 1.52 -1.55 0.00 0.00 0.00 173.10 172.64 1r3n n PRO 231 N -0.33 1.98 0.06 2.90 -0.04 -1.26 -4.04 135.00 134.27 1r3n n PRO 231 Ca -0.08 -1.44 -0.13 0.00 -0.04 0.00 0.00 63.50 61.81 1r3n n PRO 231 Cb 0.62 -1.46 -0.08 0.00 -0.04 0.00 0.00 33.50 32.53 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 3.32 1.04 -0.77 0.52 2.04 -1.98 -1.38 117.51 120.30 1r3n h ILE 232 Ca 0.00 -0.59 -0.05 0.00 1.00 0.00 0.00 64.86 65.22 1r3n h ILE 232 Cb 0.71 1.41 -0.03 0.00 -0.74 0.00 0.00 36.82 38.17 1r3n h ILE 232 CO 0.00 0.14 0.28 -0.07 0.00 0.00 0.00 178.15 178.51 1r3n h LEU 233 N -0.42 1.08 -0.26 1.44 3.38 -1.91 -1.79 115.31 116.82 1r3n h LEU 233 Ca -0.02 -0.18 -0.00 0.00 0.09 0.00 0.00 57.88 57.77 1r3n h LEU 233 Cb 0.35 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1r3n h LEU 233 CO 0.02 0.97 0.15 -0.08 0.09 0.00 0.00 178.44 179.59 1r3n h GLU 234 N 1.12 0.36 -0.89 1.13 4.81 -1.80 -1.60 114.58 117.71 1r3n h GLU 234 Ca 0.25 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.43 1r3n h GLU 234 Cb 0.25 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.51 1r3n h GLU 234 CO -0.02 0.30 0.48 0.22 -0.73 0.00 0.00 179.01 179.26 1r3n h ASP 235 N 0.32 1.12 -0.23 1.04 1.82 -0.93 -2.53 116.42 117.02 1r3n h ASP 235 Ca 0.09 -0.10 0.00 0.00 -0.39 0.00 0.00 57.03 56.63 1r3n h ASP 235 Cb 0.04 -0.29 0.00 0.00 0.68 0.00 0.00 39.33 39.76 1r3n h ASP 235 CO -0.02 0.90 0.00 -0.62 -1.61 0.00 0.00 179.24 177.90 1r3n n GLU 236 N -4.33 1.73 -2.75 0.28 1.02 -0.70 -4.93 120.64 110.96 1r3n n GLU 236 Ca 0.09 -1.11 -0.18 0.00 -0.02 0.00 0.00 57.16 55.95 1r3n n GLU 236 Cb 0.10 -1.34 0.00 0.00 -0.02 0.00 0.00 31.44 30.19 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 0.36 -4.49 -4.90 1.62 4.13 -0.93 -4.99 115.26 106.06 1r3n n ASN 237 Ca 0.14 -0.05 -0.28 0.00 1.68 0.00 0.00 54.58 56.07 1r3n n ASN 237 Cb 0.30 -3.74 -0.02 0.00 -1.54 0.00 0.00 39.78 34.79 1r3n n ASN 237 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1r3n s LYS 238 N -5.37 3.63 -0.20 3.52 -0.14 -0.65 -4.83 119.74 115.70 1r3n s LYS 238 Ca 0.14 0.19 0.14 0.00 -1.36 0.00 0.00 55.97 55.07 1r3n s LYS 238 Cb -0.07 -2.47 -0.22 0.00 -1.68 0.00 0.00 37.83 33.39 1r3n s LYS 238 CO 0.18 -0.02 0.00 0.00 -0.76 0.00 0.00 175.35 174.75 1r3n n ALA 239 N -1.61 1.52 -3.03 5.17 0.00 0.12 -4.63 120.51 118.05 1r3n n ALA 239 Ca 0.00 -1.21 -0.14 0.00 0.00 0.00 0.00 53.44 52.09 1r3n n ALA 239 Cb 0.55 -0.13 -0.15 0.00 0.00 0.00 0.00 19.45 19.72 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 -2.47 0.09 -0.25 0.00 1.09 -0.99 -4.38 121.20 114.30 1r3n s ILE 240 Ca -0.15 -0.01 -0.06 0.00 -1.10 0.00 0.00 60.65 59.33 1r3n s ILE 240 Cb 0.06 -0.11 -0.01 0.00 -1.06 0.00 0.00 42.46 41.34 1r3n s ILE 240 CO 0.73 0.05 0.02 -0.83 -0.10 0.00 0.00 174.94 174.81 1r3n s GLY 241 N 0.19 1.70 -0.47 6.18 0.00 -0.31 -1.99 107.32 112.62 1r3n s GLY 241 Ca -0.02 -1.22 -0.27 0.00 0.00 0.00 0.00 44.72 43.22 1r3n s GLY 241 CO -0.01 0.52 1.03 -0.42 0.00 0.00 0.00 173.10 174.22 1r3n s ILE 242 N 1.53 4.34 -0.31 0.90 -1.09 0.08 -0.98 121.20 125.68 1r3n s ILE 242 Ca 0.05 0.96 -0.25 0.00 -2.23 0.00 0.00 60.65 59.17 1r3n s ILE 242 Cb -0.15 -4.52 0.01 0.00 -1.58 0.00 0.00 42.46 36.21 1r3n s ILE 242 CO 0.00 -0.93 0.89 -0.69 -1.23 0.00 0.00 174.94 172.99 1r3n s VAL 243 N 4.10 4.69 -0.44 2.92 1.01 -1.06 -1.12 120.40 130.50 1r3n s VAL 243 Ca 0.42 1.38 0.23 0.00 0.00 0.00 0.00 61.98 64.01 1r3n s VAL 243 Cb -0.09 -4.25 -0.08 0.00 0.00 0.00 0.00 36.38 31.96 1r3n s VAL 243 CO 0.29 -0.34 1.01 0.35 0.00 0.00 0.00 175.10 176.41 1r3n n THR 244 N 5.66 0.32 -1.67 3.92 -2.24 -0.57 -4.11 114.28 115.58 1r3n n THR 244 Ca 0.07 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 1r3n n THR 244 Cb 0.48 -0.03 0.00 0.00 -2.10 0.00 0.00 70.33 68.68 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 1.29 -1.52 3.31 3.38 0.00 -1.26 -1.73 105.19 108.67 1r3n n GLY 245 Ca 0.01 -1.04 -0.32 0.00 0.00 0.00 0.00 46.02 44.67 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 -2.50 2.48 0.59 1.61 1.01 0.34 -0.07 120.40 123.86 1r3n s VAL 246 Ca 0.00 -0.89 -0.20 0.00 0.00 0.00 0.00 61.98 60.89 1r3n s VAL 246 Cb 0.00 -1.97 -0.03 0.00 0.00 0.00 0.00 36.38 34.38 1r3n s VAL 246 CO 0.00 0.56 1.32 -1.10 0.00 0.00 0.00 175.10 175.87 1r3n s GLN 247 N 0.03 2.87 0.67 2.72 -0.21 -0.53 -1.16 119.66 124.05 1r3n s GLN 247 Ca -0.08 2.13 -0.13 0.00 0.02 0.00 0.00 55.36 57.30 1r3n s GLN 247 Cb -0.15 -2.05 0.00 0.00 1.00 0.00 0.00 33.01 31.81 1r3n s GLN 247 CO 0.05 -1.37 1.07 0.00 -2.12 0.00 0.00 175.29 172.92 1r3n s ALA 248 N -1.36 2.58 0.03 6.09 0.00 0.25 -4.59 121.76 124.75 1r3n s ALA 248 Ca 0.77 0.30 -0.09 0.00 0.00 0.00 0.00 51.96 52.95 1r3n s ALA 248 Cb -0.38 -3.24 0.00 0.00 0.00 0.00 0.00 23.12 19.50 1r3n s ALA 248 CO 0.43 -1.21 0.17 1.52 0.00 0.00 0.00 175.76 176.67 1r3n s TYR 249 N -2.70 0.06 -0.06 0.00 -0.85 0.25 -2.31 117.35 111.74 1r3n s TYR 249 Ca 0.62 -0.25 -0.00 0.00 -0.52 0.00 0.00 57.07 56.92 1r3n s TYR 249 Cb -0.16 -0.05 0.03 0.00 0.38 0.00 0.00 41.96 42.15 1r3n s TYR 249 CO 0.47 -0.38 -0.02 1.21 -1.52 0.00 0.00 175.55 175.31 1r3n s ASN 250 N -1.88 1.31 -0.12 -0.18 2.47 -0.58 -0.90 114.94 115.05 1r3n s ASN 250 Ca -0.08 -0.11 -0.05 0.00 0.42 0.00 0.00 52.86 53.05 1r3n s ASN 250 Cb -0.03 -0.45 -0.04 0.00 -1.45 0.00 0.00 41.25 39.29 1r3n s ASN 250 CO -0.02 -0.13 0.06 0.26 -3.72 0.00 0.00 177.10 173.54 1r3n s TRP 251 N 1.52 3.31 0.06 0.43 0.51 0.33 -1.46 118.94 123.63 1r3n s TRP 251 Ca -0.02 0.25 0.04 0.00 -2.12 0.00 0.00 56.10 54.24 1r3n s TRP 251 Cb -0.13 -1.91 -0.03 0.00 -0.81 0.00 0.00 33.47 30.59 1r3n s TRP 251 CO -0.03 0.45 -0.11 -0.65 -0.51 0.00 0.00 176.95 176.10 1r3n s GLN 252 N -0.57 0.68 -0.11 4.98 -1.52 0.62 -1.10 119.66 122.64 1r3n s GLN 252 Ca 0.11 -0.88 0.04 0.00 -1.95 0.00 0.00 55.36 52.67 1r3n s GLN 252 Cb -0.12 -0.53 0.00 0.00 -0.22 0.00 0.00 33.01 32.14 1r3n s GLN 252 CO 0.02 0.11 -0.23 0.21 -0.25 0.00 0.00 175.29 175.15 1r3n s LYS 253 N -1.79 2.94 -0.11 2.91 2.20 0.11 -0.03 119.74 125.97 1r3n s LYS 253 Ca -0.05 -0.84 0.00 0.00 -0.36 0.00 0.00 55.97 54.73 1r3n s LYS 253 Cb -0.09 -2.27 -0.02 0.00 -1.51 0.00 0.00 37.83 33.94 1r3n s LYS 253 CO 0.01 0.12 -0.13 0.08 -0.36 0.00 0.00 175.35 175.08 1r3n s VAL 254 N 0.48 3.12 -0.18 4.02 1.01 -0.02 -0.54 120.40 128.29 1r3n s VAL 254 Ca -0.16 -0.65 -0.02 0.00 0.00 0.00 0.00 61.98 61.15 1r3n s VAL 254 Cb -0.17 -2.29 -0.00 0.00 0.00 0.00 0.00 36.38 33.91 1r3n s VAL 254 CO 0.06 0.54 -0.11 -0.89 0.00 0.00 0.00 175.10 174.70 1r3n s THR 255 N 0.08 2.97 -0.18 3.92 2.01 -0.38 -1.22 115.64 122.85 1r3n s THR 255 Ca -0.05 -0.65 -0.08 0.00 0.31 0.00 0.00 61.69 61.22 1r3n s THR 255 Cb -0.15 -2.30 -0.04 0.00 0.01 0.00 0.00 72.50 70.02 1r3n s THR 255 CO 0.04 0.48 0.10 -0.69 -0.69 0.00 0.00 174.62 173.87 1r3n s VAL 256 N 1.07 5.15 -0.20 3.82 1.01 0.81 -1.11 120.40 130.94 1r3n s VAL 256 Ca -0.00 0.09 -0.05 0.00 0.00 0.00 0.00 61.98 62.02 1r3n s VAL 256 Cb -0.15 -3.32 -0.02 0.00 0.00 0.00 0.00 36.38 32.90 1r3n s VAL 256 CO -0.02 0.48 -0.01 -1.00 0.00 0.00 0.00 175.10 174.55 1r3n s HIS 257 N 0.11 3.01 0.00 5.22 3.76 0.80 -1.61 115.29 126.57 1r3n s HIS 257 Ca 0.07 -0.57 0.00 0.00 -0.15 0.00 0.00 55.06 54.41 1r3n s HIS 257 Cb -0.12 -2.09 0.00 0.00 1.11 0.00 0.00 32.58 31.49 1r3n s HIS 257 CO -0.00 -0.32 0.00 0.41 -0.85 0.00 0.00 174.74 173.98 1r3n n GLY 258 N 4.38 5.29 2.75 -2.22 0.00 0.20 -2.52 105.19 113.07 1r3n n GLY 258 Ca -0.17 -1.23 -0.23 0.00 0.00 0.00 0.00 46.02 44.38 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 0.32 -0.07 1.61 1.01 -0.78 -4.81 120.40 120.88 1r3n s VAL 259 Ca 0.00 0.09 -0.30 0.00 0.00 0.00 0.00 61.98 61.77 1r3n s VAL 259 Cb 0.00 -0.54 -0.05 0.00 0.00 0.00 0.00 36.38 35.79 1r3n s VAL 259 CO 0.00 0.20 1.63 -0.83 0.00 0.00 0.00 175.10 176.10 1r3n s GLY 260 N 1.99 1.52 0.05 4.51 0.00 -1.26 -4.35 107.32 109.78 1r3n s GLY 260 Ca 0.04 0.88 -0.09 0.00 0.00 0.00 0.00 44.72 45.55 1r3n s GLY 260 CO -0.05 3.01 0.20 0.00 0.00 0.00 0.00 173.10 176.25 1r3n s ALA 261 N 4.10 -0.34 0.27 3.20 0.00 -1.18 -4.96 121.76 122.85 1r3n s ALA 261 Ca 0.72 -0.36 -0.30 0.00 0.00 0.00 0.00 51.96 52.03 1r3n s ALA 261 Cb -0.32 0.34 -0.10 0.00 0.00 0.00 0.00 23.12 23.04 1r3n s ALA 261 CO 0.29 -0.40 1.42 -1.58 0.00 0.00 0.00 175.76 175.48 1r3n s HIS 262 N -2.92 2.99 0.51 0.00 2.46 -1.26 0.42 115.29 117.49 1r3n s HIS 262 Ca -0.02 1.11 0.41 0.00 0.47 0.00 0.00 55.06 57.03 1r3n s HIS 262 Cb 0.01 -3.81 2.12 0.00 -0.13 0.00 0.00 32.58 30.77 1r3n s HIS 262 CO -0.06 -2.53 2.27 0.00 -2.47 0.00 0.00 174.74 171.95 1r3n h ALA 263 N 4.57 1.02 0.00 1.58 0.00 -0.50 -3.04 119.26 122.89 1r3n h ALA 263 Ca -0.47 -0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.13 1r3n h ALA 263 Cb 1.22 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.95 1r3n h ALA 263 CO 0.74 0.00 -2.16 0.41 0.00 0.00 0.00 179.25 178.25 1r3n n GLY 264 N -0.78 -0.49 0.20 0.00 0.00 -1.26 -4.54 105.19 98.31 1r3n n GLY 264 Ca -0.02 -0.19 0.11 0.00 0.00 0.00 0.00 46.02 45.92 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 0.12 -3.56 2.61 1.35 -1.96 -3.44 112.91 108.03 1r3n h THR 265 Ca -0.46 -1.17 -0.69 0.00 -0.55 0.00 0.00 66.41 63.55 1r3n h THR 265 Cb 1.83 2.02 -0.19 0.00 -1.73 0.00 0.00 68.15 70.09 1r3n h THR 265 CO -0.03 0.07 -0.24 -0.89 -0.25 0.00 0.00 175.52 174.17 1r3n s THR 266 N -3.19 5.12 0.66 6.82 2.01 -1.15 -5.06 115.64 120.85 1r3n s THR 266 Ca 0.06 -0.29 -0.12 0.00 0.31 0.00 0.00 61.69 61.64 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 0.69 -0.35 1.05 -2.16 -0.69 0.00 0.00 174.62 173.16 1r3n s PRO 267 N 2.08 3.14 0.22 4.92 0.04 -1.26 -4.86 135.00 139.27 1r3n s PRO 267 Ca 0.11 1.00 -0.15 0.00 0.04 0.00 0.00 61.00 62.00 1r3n s PRO 267 Cb -0.17 -2.02 0.24 0.00 0.04 0.00 0.00 34.50 32.59 1r3n s PRO 267 CO 0.13 -0.94 1.60 -1.49 0.04 0.00 0.00 177.00 176.33 1r3n h TRP 268 N -0.32 -0.61 0.00 0.56 4.06 -1.97 -1.19 115.95 116.47 1r3n h TRP 268 Ca -0.45 0.07 0.00 0.00 2.06 0.00 0.00 58.89 60.57 1r3n h TRP 268 Cb 1.21 0.38 0.00 0.00 -1.00 0.00 0.00 29.16 29.75 1r3n h TRP 268 CO 0.62 -0.35 0.00 2.89 -3.56 0.00 0.00 178.44 178.04 1r3n n ARG 269 N -5.47 0.20 -0.46 0.49 1.85 -1.26 -2.28 116.66 109.73 1r3n n ARG 269 Ca 0.08 0.10 0.02 0.00 -1.00 0.00 0.00 57.85 57.06 1r3n n ARG 269 Cb 0.37 -1.50 0.03 0.00 -1.05 0.00 0.00 32.46 30.32 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 -1.14 0.57 -4.95 2.89 4.77 -0.46 -3.03 117.00 115.64 1r3n n LEU 270 Ca 0.05 -1.52 -0.20 0.00 -0.03 0.00 0.00 56.01 54.31 1r3n n LEU 270 Cb 0.05 -0.10 -0.02 0.00 -2.33 0.00 0.00 43.42 41.02 1r3n n LEU 270 CO 0.06 0.37 -0.02 0.00 -1.33 0.00 0.00 177.39 176.47 1r3n s ARG 271 N -0.65 3.21 -0.47 3.23 1.70 -0.96 -4.86 118.95 120.15 1r3n s ARG 271 Ca 0.09 -0.93 0.06 0.00 -0.47 0.00 0.00 55.73 54.48 1r3n s ARG 271 Cb 0.08 -2.80 0.22 0.00 -0.57 0.00 0.00 34.95 31.89 1r3n s ARG 271 CO -0.00 0.26 0.52 1.63 -1.08 0.00 0.00 175.30 176.62 1r3n n LYS 272 N -1.47 1.02 -2.55 3.89 5.02 -1.26 -4.12 118.16 118.68 1r3n n LYS 272 Ca -0.05 -3.58 -0.43 0.00 -2.02 0.00 0.00 58.31 52.23 1r3n n LYS 272 Cb 0.58 -1.60 -0.02 0.00 -0.02 0.00 0.00 35.03 33.97 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 -1.16 6.60 0.21 4.39 -1.08 -1.26 -1.86 116.67 122.51 1r3n s ASP 273 Ca 0.35 0.60 0.05 0.00 -0.52 0.00 0.00 52.55 53.03 1r3n s ASP 273 Cb 0.12 -2.55 0.15 0.00 -1.46 0.00 0.00 42.92 39.18 1r3n s ASP 273 CO -0.12 -1.25 1.49 0.00 0.52 0.00 0.00 175.17 175.80 1r3n h ALA 274 N 9.41 0.73 0.02 3.66 0.00 -1.63 -2.73 119.26 128.72 1r3n h ALA 274 Ca -0.24 -0.64 -0.25 0.00 0.00 0.00 0.00 54.91 53.79 1r3n h ALA 274 Cb 1.07 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.78 1r3n h ALA 274 CO 1.11 0.85 -1.02 1.25 0.00 0.00 0.00 179.25 181.44 1r3n h LEU 275 N 0.10 0.63 -0.80 0.00 5.85 -1.92 -0.21 115.31 118.97 1r3n h LEU 275 Ca -0.02 -0.53 -0.06 0.00 0.84 0.00 0.00 57.88 58.11 1r3n h LEU 275 Cb 1.30 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 42.10 1r3n h LEU 275 CO 0.11 1.34 0.24 0.25 -0.34 0.00 0.00 178.44 180.04 1r3n h LEU 276 N 0.25 1.06 -0.33 2.25 5.85 -1.94 -0.16 115.31 122.29 1r3n h LEU 276 Ca -0.11 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.41 1r3n h LEU 276 Cb 1.67 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 42.41 1r3n h LEU 276 CO 0.18 0.98 0.17 -0.03 -0.34 0.00 0.00 178.44 179.41 1r3n h MET 277 N 1.10 0.47 -0.74 1.25 4.05 -1.38 -1.94 114.93 117.74 1r3n h MET 277 Ca 0.24 -0.06 -0.02 0.00 -0.28 0.00 0.00 59.70 59.57 1r3n h MET 277 Cb 0.29 -0.09 -0.03 0.00 -0.80 0.00 0.00 31.60 30.97 1r3n h MET 277 CO -0.01 0.41 0.36 0.77 0.23 0.00 0.00 176.91 178.67 1r3n h SER 278 N 0.41 0.95 -0.43 1.39 0.02 -0.82 -0.90 113.55 114.16 1r3n h SER 278 Ca 0.12 -0.10 -0.01 0.00 -0.84 0.00 0.00 61.79 60.96 1r3n h SER 278 Cb 0.08 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.36 1r3n h SER 278 CO -0.02 0.79 0.25 0.28 -1.14 0.00 0.00 176.83 176.99 1r3n h SER 279 N 1.04 0.53 -0.62 3.07 0.02 -0.74 0.78 113.55 117.64 1r3n h SER 279 Ca 0.26 -0.08 -0.02 0.00 -0.84 0.00 0.00 61.79 61.11 1r3n h SER 279 Cb 0.09 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 62.47 1r3n h SER 279 CO -0.03 0.46 0.31 0.11 -1.14 0.00 0.00 176.83 176.54 1r3n h LYS 280 N 0.57 0.88 -0.65 3.45 1.57 -1.04 -2.19 116.57 119.16 1r3n h LYS 280 Ca 0.15 -0.12 -0.01 0.00 -1.87 0.00 0.00 60.65 58.81 1r3n h LYS 280 Cb 0.04 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.15 1r3n h LYS 280 CO -0.03 0.69 0.39 0.52 -0.57 0.00 0.00 179.45 180.45 1r3n h MET 281 N 0.84 0.89 -0.28 3.15 2.86 -0.67 -0.54 114.93 121.18 1r3n h MET 281 Ca 0.21 -0.09 -0.01 0.00 -2.06 0.00 0.00 59.70 57.76 1r3n h MET 281 Cb 0.09 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.55 1r3n h MET 281 CO -0.03 0.64 0.13 0.82 1.06 0.00 0.00 176.91 179.53 1r3n h ILE 282 N 0.88 1.16 -0.96 -1.22 2.04 -0.73 0.36 117.51 119.05 1r3n h ILE 282 Ca 0.23 -0.45 -0.00 0.00 1.00 0.00 0.00 64.86 65.64 1r3n h ILE 282 Cb -0.01 0.93 -0.05 0.00 -0.74 0.00 0.00 36.82 36.96 1r3n h ILE 282 CO -0.04 0.16 0.59 0.58 0.00 0.00 0.00 178.15 179.44 1r3n h VAL 283 N 0.32 1.26 -0.22 1.67 2.07 -1.25 -1.44 116.25 118.66 1r3n h VAL 283 Ca 0.10 -0.54 -0.04 0.00 0.82 0.00 0.00 66.70 67.03 1r3n h VAL 283 Cb 0.13 -0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 29.79 1r3n h VAL 283 CO -0.01 0.27 -0.02 0.00 0.02 0.00 0.00 177.57 177.82 1r3n h ALA 284 N 1.33 0.31 -0.65 1.67 0.00 -0.66 -2.01 119.26 119.25 1r3n h ALA 284 Ca 0.35 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 1r3n h ALA 284 Cb -0.08 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1r3n h ALA 284 CO -0.07 0.06 0.22 0.00 0.00 0.00 0.00 179.25 179.46 1r3n h ALA 285 N 0.78 1.15 -0.00 0.00 0.00 -0.79 -1.40 119.26 119.00 1r3n h ALA 285 Ca 0.06 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 54.81 1r3n h ALA 285 Cb 0.45 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 1r3n h ALA 285 CO 0.02 0.59 -0.23 0.77 0.00 0.00 0.00 179.25 180.40 1r3n h SER 286 N 0.96 -0.69 -0.48 0.00 0.02 -1.04 -1.51 113.55 110.82 1r3n h SER 286 Ca 0.22 0.10 -0.02 0.00 -0.84 0.00 0.00 61.79 61.24 1r3n h SER 286 Cb 0.25 0.28 -0.03 0.00 0.14 0.00 0.00 62.40 63.05 1r3n h SER 286 CO -0.01 -0.30 0.24 -0.33 -1.14 0.00 0.00 176.83 175.29 1r3n h GLU 287 N -0.36 0.73 -0.21 3.45 5.08 -0.96 -2.12 114.58 120.20 1r3n h GLU 287 Ca 0.06 -0.09 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 1r3n h GLU 287 Cb 0.45 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 1r3n h GLU 287 CO -0.21 0.58 0.07 0.82 -1.00 0.00 0.00 179.01 179.26 1r3n h ILE 288 N 0.73 1.19 -0.78 3.13 5.03 -0.93 -1.98 117.51 123.91 1r3n h ILE 288 Ca 0.18 -0.59 -0.00 0.00 -0.12 0.00 0.00 64.86 64.33 1r3n h ILE 288 Cb 0.09 1.19 -0.04 0.00 -3.03 0.00 0.00 36.82 35.03 1r3n h ILE 288 CO -0.02 0.19 0.47 0.00 -0.68 0.00 0.00 178.15 178.11 1r3n h ALA 289 N 0.89 0.99 -0.64 1.87 0.00 -0.93 -2.64 119.26 118.80 1r3n h ALA 289 Ca 0.07 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1r3n h ALA 289 Cb 0.23 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 1r3n h ALA 289 CO -0.00 0.45 0.32 1.96 0.00 0.00 0.00 179.25 181.98 1r3n h GLN 290 N 1.06 0.92 -0.98 0.00 4.20 -1.30 0.73 115.11 119.74 1r3n h GLN 290 Ca 0.28 -0.13 0.13 0.00 0.06 0.00 0.00 58.65 59.00 1r3n h GLN 290 Cb -0.05 -0.17 -0.08 0.00 0.30 0.00 0.00 27.48 27.48 1r3n h GLN 290 CO -0.05 0.72 0.62 0.00 -0.67 0.00 0.00 178.83 179.45 1r3n h ARG 291 N 0.88 0.88 -0.62 1.46 3.08 -1.01 -1.77 114.38 117.28 1r3n h ARG 291 Ca 0.22 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.22 1r3n h ARG 291 Cb 0.10 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 29.95 1r3n h ARG 291 CO -0.03 0.58 0.00 0.72 -1.07 0.00 0.00 179.97 180.17 1r3n n HIS 292 N -4.62 0.83 -3.50 3.04 8.25 -1.00 -4.95 115.22 113.27 1r3n n HIS 292 Ca 0.19 -0.41 -0.25 0.00 -0.26 0.00 0.00 57.72 56.99 1r3n n HIS 292 Cb 0.41 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.56 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 1.43 -5.51 -1.28 0.41 4.05 -0.67 -5.01 115.26 108.68 1r3n n ASN 293 Ca 0.22 -0.52 0.00 0.00 0.45 0.00 0.00 54.58 54.73 1r3n n ASN 293 Cb 0.56 -4.41 0.00 0.00 1.23 0.00 0.00 39.78 37.16 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 -1.67 4.04 3.14 8.20 0.00 0.17 -4.89 105.19 114.18 1r3n n GLY 294 Ca -0.02 -2.13 -0.21 0.00 0.00 0.00 0.00 46.02 43.67 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 2.15 -0.01 0.99 1.43 0.03 -4.27 118.68 119.00 1r3n s LEU 295 Ca 0.00 -0.44 0.02 0.00 -1.03 0.00 0.00 54.13 52.69 1r3n s LEU 295 Cb 0.00 -0.63 -0.00 0.00 0.03 0.00 0.00 46.19 45.58 1r3n s LEU 295 CO 0.00 0.06 -0.08 0.12 0.23 0.00 0.00 176.35 176.68 1r3n s PHE 296 N -0.79 0.73 -0.03 0.29 5.36 -1.26 -0.74 117.98 121.54 1r3n s PHE 296 Ca 0.02 -0.15 -0.02 0.00 -0.96 0.00 0.00 56.93 55.82 1r3n s PHE 296 Cb -0.08 -0.49 0.01 0.00 -0.34 0.00 0.00 43.02 42.12 1r3n s PHE 296 CO 0.01 -0.04 0.06 0.99 -1.46 0.00 0.00 175.22 174.78 1r3n s THR 297 N -0.03 -0.01 -0.29 0.12 2.01 -0.50 -4.92 115.64 112.02 1r3n s THR 297 Ca 0.01 0.03 -0.05 0.00 0.31 0.00 0.00 61.69 61.99 1r3n s THR 297 Cb -0.05 -0.10 0.02 0.00 0.01 0.00 0.00 72.50 72.38 1r3n s THR 297 CO -0.00 0.01 0.04 0.00 -0.69 0.00 0.00 174.62 173.98 1r3n n GLY 299 N 4.80 -0.68 2.99 0.00 0.00 -1.26 -4.96 105.19 106.08 1r3n n GLY 299 Ca -0.15 -0.40 -0.23 0.00 0.00 0.00 0.00 46.02 45.25 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 -2.97 0.92 -0.08 -0.61 1.01 -1.26 -5.04 121.20 113.18 1r3n s ILE 300 Ca -0.03 -0.37 -0.06 0.00 0.00 0.00 0.00 60.65 60.18 1r3n s ILE 300 Cb 0.11 -0.86 0.02 0.00 0.01 0.00 0.00 42.46 41.74 1r3n s ILE 300 CO 0.67 0.30 0.20 -0.51 0.00 0.00 0.00 174.94 175.59 1r3n s ILE 301 N 0.63 -0.01 -0.10 2.92 2.07 -1.26 -1.82 121.20 123.62 1r3n s ILE 301 Ca -0.12 0.03 -0.05 0.00 -1.41 0.00 0.00 60.65 59.10 1r3n s ILE 301 Cb -0.14 -0.28 0.05 0.00 0.13 0.00 0.00 42.46 42.21 1r3n s ILE 301 CO 0.02 0.01 0.24 -1.81 -1.91 0.00 0.00 174.94 171.49 1r3n s ASP 302 N 0.28 -0.17 -0.10 4.50 1.01 -0.07 -5.00 116.67 117.13 1r3n s ASP 302 Ca -0.02 0.50 -0.01 0.00 0.71 0.00 0.00 52.55 53.74 1r3n s ASP 302 Cb -0.03 0.41 -0.03 0.00 1.01 0.00 0.00 42.92 44.28 1r3n s ASP 302 CO -0.01 -0.17 -0.06 0.00 0.21 0.00 0.00 175.17 175.14 1r3n s ALA 303 N 1.39 2.97 0.06 5.23 0.00 -1.26 -1.27 121.76 128.88 1r3n s ALA 303 Ca -0.08 -0.86 0.06 0.00 0.00 0.00 0.00 51.96 51.08 1r3n s ALA 303 Cb -0.11 -1.34 -0.04 0.00 0.00 0.00 0.00 23.12 21.64 1r3n s ALA 303 CO -0.08 0.44 -0.12 0.15 0.00 0.00 0.00 175.76 176.15 1r3n s LYS 304 N -0.37 2.21 0.00 0.00 1.02 0.49 -3.41 119.74 119.68 1r3n s LYS 304 Ca 0.05 -0.94 0.15 0.00 0.02 0.00 0.00 55.97 55.26 1r3n s LYS 304 Cb -0.12 -2.32 0.43 0.00 -0.52 0.00 0.00 37.83 35.30 1r3n s LYS 304 CO 0.02 0.54 1.36 -0.35 -0.92 0.00 0.00 175.35 176.00 1r3n n PRO 305 N 1.16 2.08 -1.93 -1.68 -0.04 -1.26 -1.22 135.00 132.10 1r3n n PRO 305 Ca -0.15 -1.68 -0.01 0.00 -0.04 0.00 0.00 63.50 61.63 1r3n n PRO 305 Cb 0.52 -1.37 0.00 0.00 -0.04 0.00 0.00 33.50 32.61 1r3n n PRO 305 CO 0.00 0.00 0.00 0.98 -0.04 0.00 0.00 175.50 176.44 1r3n n TYR 306 N 0.86 -0.91 -3.71 0.54 9.36 -1.22 -5.10 117.16 116.98 1r3n n TYR 306 Ca 0.16 0.36 -0.14 0.00 3.32 0.00 0.00 57.90 61.59 1r3n n TYR 306 Cb 0.40 -2.26 -0.09 0.00 -0.63 0.00 0.00 39.34 36.76 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 -2.02 -0.37 0.41 2.98 0.01 -1.26 -5.03 113.70 108.41 1r3n s SER 307 Ca 0.02 0.53 0.12 0.00 1.31 0.00 0.00 55.95 57.93 1r3n s SER 307 Cb -0.01 0.60 0.95 0.00 0.21 0.00 0.00 66.02 67.78 1r3n s SER 307 CO 0.22 -0.34 1.97 0.58 0.41 0.00 0.00 173.24 176.08 1r3n h VAL 308 N 4.01 0.93 -0.43 3.43 2.07 -2.04 -3.02 116.25 121.19 1r3n h VAL 308 Ca -0.28 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.07 1r3n h VAL 308 Cb 1.17 0.38 0.00 0.00 -1.52 0.00 0.00 31.29 31.32 1r3n h VAL 308 CO 0.32 0.09 0.00 -0.46 0.02 0.00 0.00 177.57 177.54 1r3n n ASN 309 N -4.48 3.99 -4.18 0.57 6.94 -1.26 -4.92 115.26 111.92 1r3n n ASN 309 Ca 0.10 -2.54 -0.31 0.00 -0.02 0.00 0.00 54.58 51.82 1r3n n ASN 309 Cb 0.33 -0.47 -0.17 0.00 -2.36 0.00 0.00 39.78 37.11 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 -1.98 1.90 0.07 1.53 1.01 -1.14 0.27 121.20 122.85 1r3n s ILE 310 Ca 0.40 -0.92 -0.31 0.00 0.00 0.00 0.00 60.65 59.82 1r3n s ILE 310 Cb 0.28 -1.65 -0.10 0.00 0.01 0.00 0.00 42.46 41.00 1r3n s ILE 310 CO 0.16 0.52 1.92 -0.38 0.00 0.00 0.00 174.94 177.17 1r3n n ILE 311 N 3.60 0.61 -1.76 2.92 5.41 0.17 -4.70 119.36 125.61 1r3n n ILE 311 Ca -0.20 -0.11 -0.42 0.00 1.00 0.00 0.00 62.75 63.02 1r3n n ILE 311 Cb 0.53 -2.23 -0.03 0.00 -0.71 0.00 0.00 39.64 37.20 1r3n n ILE 311 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 1r3n s PRO 312 N 3.77 4.14 0.04 0.38 0.02 -1.26 -3.09 135.00 139.00 1r3n s PRO 312 Ca 0.86 2.57 0.22 0.00 0.02 0.00 0.00 61.00 64.68 1r3n s PRO 312 Cb -0.46 -3.23 -0.09 0.00 0.02 0.00 0.00 34.50 30.74 1r3n s PRO 312 CO 0.41 -0.76 0.87 0.41 -0.33 0.00 0.00 177.00 177.60 1r3n n GLY 313 N 4.02 -1.16 2.95 0.52 0.00 -0.36 -1.66 105.19 109.50 1r3n n GLY 313 Ca 0.16 -0.44 -0.13 0.00 0.00 0.00 0.00 46.02 45.61 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 -3.28 0.12 -0.04 1.61 2.12 -1.15 0.63 118.70 118.72 1r3n s GLU 314 Ca 0.01 0.42 0.01 0.00 0.36 0.00 0.00 54.97 55.77 1r3n s GLU 314 Cb 0.14 -0.17 0.02 0.00 0.26 0.00 0.00 34.13 34.38 1r3n s GLU 314 CO 0.84 -0.17 -0.05 0.08 -0.54 0.00 0.00 175.26 175.41 1r3n s VAL 315 N 1.23 0.56 -0.08 3.70 1.01 -0.64 -0.38 120.40 125.80 1r3n s VAL 315 Ca -0.09 -0.17 0.03 0.00 0.00 0.00 0.00 61.98 61.75 1r3n s VAL 315 Cb -0.11 -0.55 -0.02 0.00 0.00 0.00 0.00 36.38 35.70 1r3n s VAL 315 CO -0.07 0.21 -0.18 -0.44 0.00 0.00 0.00 175.10 174.63 1r3n s SER 316 N 0.66 3.66 0.14 3.32 0.01 -0.40 -0.13 113.70 120.97 1r3n s SER 316 Ca -0.09 -0.36 -0.07 0.00 1.31 0.00 0.00 55.95 56.75 1r3n s SER 316 Cb -0.12 -1.11 -0.02 0.00 0.21 0.00 0.00 66.02 64.99 1r3n s SER 316 CO 0.00 0.25 0.21 0.72 0.41 0.00 0.00 173.24 174.83 1r3n s PHE 317 N -0.16 0.49 0.14 2.43 -0.12 -0.35 -0.89 117.98 119.52 1r3n s PHE 317 Ca -0.02 -0.87 0.06 0.00 -0.05 0.00 0.00 56.93 56.05 1r3n s PHE 317 Cb -0.14 -0.17 -0.04 0.00 -0.63 0.00 0.00 43.02 42.04 1r3n s PHE 317 CO 0.04 -0.64 0.04 0.95 -0.05 0.00 0.00 175.22 175.56 1r3n s THR 318 N -3.97 4.08 -0.13 -4.49 -4.23 -0.76 -0.84 115.64 105.30 1r3n s THR 318 Ca 0.17 -1.16 0.01 0.00 -1.18 0.00 0.00 61.69 59.54 1r3n s THR 318 Cb 0.05 -3.02 0.02 0.00 1.34 0.00 0.00 72.50 70.88 1r3n s THR 318 CO -0.01 -0.03 -0.16 -0.76 -0.54 0.00 0.00 174.62 173.13 1r3n s LEU 319 N -2.77 1.76 -0.45 4.79 1.43 0.95 -4.18 118.68 120.22 1r3n s LEU 319 Ca 0.28 -0.47 -0.03 0.00 -1.03 0.00 0.00 54.13 52.88 1r3n s LEU 319 Cb -0.10 -1.17 0.12 0.00 0.03 0.00 0.00 46.19 45.06 1r3n s LEU 319 CO 0.20 -0.01 0.24 -0.62 0.23 0.00 0.00 176.35 176.40 1r3n s ASP 320 N 1.17 5.22 -0.04 2.29 -1.08 0.04 -0.28 116.67 124.00 1r3n s ASP 320 Ca -0.02 -2.21 -0.06 0.00 -0.52 0.00 0.00 52.55 49.74 1r3n s ASP 320 Cb -0.14 -1.82 -0.04 0.00 -1.46 0.00 0.00 42.92 39.45 1r3n s ASP 320 CO -0.05 -0.50 0.22 -0.36 0.52 0.00 0.00 175.17 175.00 1r3n s PHE 321 N 0.88 3.59 -0.07 -5.34 0.40 -0.54 -1.42 117.98 115.49 1r3n s PHE 321 Ca 0.10 0.54 -0.06 0.00 -0.60 0.00 0.00 56.93 56.91 1r3n s PHE 321 Cb -0.22 -1.96 0.02 0.00 0.51 0.00 0.00 43.02 41.37 1r3n s PHE 321 CO -0.04 0.66 0.19 1.03 0.70 0.00 0.00 175.22 177.76 1r3n s ARG 322 N -1.53 0.22 -0.20 0.44 1.81 0.08 -1.53 118.95 118.23 1r3n s ARG 322 Ca 0.23 0.26 -0.27 0.00 -1.72 0.00 0.00 55.73 54.24 1r3n s ARG 322 Cb -0.13 0.10 0.07 0.00 -0.45 0.00 0.00 34.95 34.54 1r3n s ARG 322 CO 0.13 -0.03 0.71 -1.58 -0.68 0.00 0.00 175.30 173.85 1r3n s HIS 323 N 0.12 -0.75 0.41 -0.53 2.46 -0.98 -0.79 115.29 115.23 1r3n s HIS 323 Ca -0.00 1.68 0.15 0.00 0.47 0.00 0.00 55.06 57.37 1r3n s HIS 323 Cb -0.01 0.31 1.03 0.00 -0.13 0.00 0.00 32.58 33.77 1r3n s HIS 323 CO 0.00 -0.45 1.87 -1.35 -2.47 0.00 0.00 174.74 172.34 1r3n h PRO 324 N 4.39 0.45 -5.43 2.88 0.11 -1.90 0.74 132.00 133.24 1r3n h PRO 324 Ca -0.28 -0.03 -0.63 0.00 0.11 0.00 0.00 66.00 65.17 1r3n h PRO 324 Cb 1.15 -0.10 -0.11 0.00 0.11 0.00 0.00 31.00 32.05 1r3n h PRO 324 CO 0.15 0.30 -0.50 0.45 -0.21 0.00 0.00 178.00 178.19 1r3n s SER 325 N -5.72 6.15 0.29 -2.05 0.15 -1.26 -4.41 113.70 106.85 1r3n s SER 325 Ca -0.08 0.29 -0.01 0.00 0.70 0.00 0.00 55.95 56.85 1r3n s SER 325 Cb 0.22 -2.04 0.45 0.00 -1.71 0.00 0.00 66.02 62.94 1r3n s SER 325 CO 0.78 0.27 1.88 0.44 1.20 0.00 0.00 173.24 177.81 1r3n h ASP 326 N 6.01 0.79 -0.33 5.45 3.45 -1.97 -2.39 116.42 127.43 1r3n h ASP 326 Ca -0.46 -0.10 -0.15 0.00 0.43 0.00 0.00 57.03 56.75 1r3n h ASP 326 Cb 1.18 -0.20 -0.00 0.00 -0.56 0.00 0.00 39.33 39.74 1r3n h ASP 326 CO 0.68 0.71 -0.39 0.44 -1.57 0.00 0.00 179.24 179.11 1r3n h ASP 327 N 0.86 0.91 0.53 6.45 3.32 -1.96 -2.04 116.42 124.48 1r3n h ASP 327 Ca 0.20 -0.49 -0.11 0.00 0.02 0.00 0.00 57.03 56.66 1r3n h ASP 327 Cb 0.16 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 1r3n h ASP 327 CO -0.02 1.21 -0.53 0.58 -1.72 0.00 0.00 179.24 178.77 1r3n h VAL 328 N 0.62 1.38 -0.45 -1.35 2.07 -1.96 -1.88 116.25 114.68 1r3n h VAL 328 Ca 0.04 -1.81 -0.08 0.00 0.82 0.00 0.00 66.70 65.68 1r3n h VAL 328 Cb 0.98 1.98 -0.02 0.00 -1.52 0.00 0.00 31.29 32.71 1r3n h VAL 328 CO 0.09 0.52 -0.02 0.25 0.02 0.00 0.00 177.57 178.43 1r3n h LEU 329 N 0.00 0.80 -0.92 2.57 5.85 -1.28 0.49 115.31 122.81 1r3n h LEU 329 Ca -0.01 -0.32 0.02 0.00 0.84 0.00 0.00 57.88 58.42 1r3n h LEU 329 Cb 0.93 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.70 1r3n h LEU 329 CO 0.07 0.92 0.60 0.00 -0.34 0.00 0.00 178.44 179.69 1r3n h ALA 330 N 0.90 1.19 -0.51 1.25 0.00 -1.12 -1.52 119.26 119.45 1r3n h ALA 330 Ca 0.13 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1r3n h ALA 330 Cb 0.52 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1r3n h ALA 330 CO 0.03 0.51 0.05 1.15 0.00 0.00 0.00 179.25 180.99 1r3n h THR 331 N 1.20 1.26 -0.60 0.00 2.02 -0.99 -1.99 112.91 113.81 1r3n h THR 331 Ca 0.35 -1.00 0.03 0.00 0.77 0.00 0.00 66.41 66.56 1r3n h THR 331 Cb -0.07 0.90 -0.04 0.00 -1.74 0.00 0.00 68.15 67.20 1r3n h THR 331 CO -0.10 0.35 0.37 0.24 0.37 0.00 0.00 175.52 176.76 1r3n h MET 332 N 0.74 0.71 -0.36 6.66 2.07 -0.47 -1.50 114.93 122.78 1r3n h MET 332 Ca 0.15 -0.04 -0.16 0.00 -2.07 0.00 0.00 59.70 57.57 1r3n h MET 332 Cb 0.45 -0.16 -0.00 0.00 -1.87 0.00 0.00 31.60 30.01 1r3n h MET 332 CO 0.02 0.47 -0.42 -0.07 1.07 0.00 0.00 176.91 177.97 1r3n h LEU 333 N 0.73 0.98 -0.66 1.22 3.38 -1.15 -0.98 115.31 118.83 1r3n h LEU 333 Ca 0.24 -0.46 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 1r3n h LEU 333 Cb 0.01 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.46 1r3n h LEU 333 CO -0.10 1.26 0.30 0.50 0.09 0.00 0.00 178.44 180.49 1r3n h LYS 334 N 0.73 0.96 -0.04 1.13 3.64 -1.21 -1.12 116.57 120.67 1r3n h LYS 334 Ca 0.05 -0.15 -0.17 0.00 -1.27 0.00 0.00 60.65 59.11 1r3n h LYS 334 Cb 1.01 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.66 1r3n h LYS 334 CO 0.10 0.78 -0.74 0.93 -2.27 0.00 0.00 179.45 178.25 1r3n h GLU 335 N 0.92 0.24 -0.09 1.90 5.08 -1.20 -2.13 114.58 119.30 1r3n h GLU 335 Ca 0.22 -0.20 -0.02 0.00 -1.00 0.00 0.00 59.36 58.36 1r3n h GLU 335 Cb 0.15 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.44 1r3n h GLU 335 CO -0.03 0.87 -0.04 0.00 -1.00 0.00 0.00 179.01 178.82 1r3n h ALA 336 N 1.07 0.12 -0.97 3.43 0.00 -1.03 -1.89 119.26 119.99 1r3n h ALA 336 Ca -0.03 -0.24 0.08 0.00 0.00 0.00 0.00 54.91 54.72 1r3n h ALA 336 Cb 1.30 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.99 1r3n h ALA 336 CO 0.11 -0.12 0.61 0.00 0.00 0.00 0.00 179.25 179.86 1r3n h ALA 337 N 0.64 1.37 -0.53 0.00 0.00 -1.18 0.23 119.26 119.79 1r3n h ALA 337 Ca 0.02 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1r3n h ALA 337 Cb 0.48 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1r3n h ALA 337 CO 0.01 0.35 0.26 0.00 0.00 0.00 0.00 179.25 179.87 1r3n h ALA 338 N 1.46 0.68 -0.21 0.00 0.00 -1.33 -0.94 119.26 118.92 1r3n h ALA 338 Ca 0.43 -0.12 -0.13 0.00 0.00 0.00 0.00 54.91 55.10 1r3n h ALA 338 Cb 0.25 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1r3n h ALA 338 CO -0.20 0.23 -0.41 1.49 0.00 0.00 0.00 179.25 180.37 1r3n h GLU 339 N 0.70 0.49 -0.40 0.00 4.57 -0.44 -2.10 114.58 117.40 1r3n h GLU 339 Ca 0.18 -0.25 -0.09 0.00 -1.18 0.00 0.00 59.36 58.03 1r3n h GLU 339 Cb 0.11 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.69 1r3n h GLU 339 CO -0.02 0.82 -0.08 0.74 -1.18 0.00 0.00 179.01 179.28 1r3n h PHE 340 N 0.41 0.86 0.00 0.92 0.05 -0.83 -0.23 116.94 118.11 1r3n h PHE 340 Ca 0.04 -0.18 -0.00 0.00 3.82 0.00 0.00 57.97 61.64 1r3n h PHE 340 Cb 0.89 -0.21 -0.00 0.00 2.00 0.00 0.00 35.95 38.63 1r3n h PHE 340 CO 0.03 0.89 -0.02 -0.44 -0.18 0.00 0.00 178.31 178.59 1r3n h ASP 341 N 0.58 0.00 0.00 2.17 3.32 -1.00 -1.19 116.42 120.30 1r3n h ASP 341 Ca 0.10 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.08 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 0.02 -0.45 -0.09 -1.72 0.00 0.00 179.24 177.04 1r3n h ARG 342 N 0.00 0.00 -0.77 3.56 2.43 -1.00 -3.39 114.38 115.21 1r3n h ARG 342 Ca -0.00 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.13 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 0.78 0.34 -0.07 -1.51 0.00 0.00 179.97 179.51 1r3n h LEU 343 N -1.00 1.03 -2.71 3.80 3.38 -0.81 -2.55 115.31 116.46 1r3n h LEU 343 Ca -0.11 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1r3n h LEU 343 Cb 0.92 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.41 1r3n h LEU 343 CO -0.07 0.90 0.00 -0.29 0.09 0.00 0.00 178.44 179.07 1r3n h ILE 344 N 1.11 0.00 0.00 1.22 6.09 -1.42 -1.22 117.51 123.30 1r3n h ILE 344 Ca 0.26 -0.01 0.00 0.00 -1.37 0.00 0.00 64.86 63.74 1r3n h ILE 344 Cb 0.16 0.92 0.00 0.00 0.47 0.00 0.00 36.82 38.38 1r3n h ILE 344 CO -0.03 0.00 -1.09 0.29 -3.07 0.00 0.00 178.15 174.25 1r3n n LYS 345 N -2.94 0.27 -2.78 2.19 4.01 -0.96 -1.91 118.16 116.04 1r3n n LYS 345 Ca -0.03 -0.02 -0.43 0.00 -0.51 0.00 0.00 58.31 57.32 1r3n n LYS 345 Cb 0.07 -1.57 -0.02 0.00 -0.51 0.00 0.00 35.03 33.00 1r3n n LYS 345 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 1r3n s ILE 346 N -3.19 4.47 -0.30 -0.18 -1.09 -0.46 -4.57 121.20 115.88 1r3n s ILE 346 Ca 0.04 -1.56 -0.12 0.00 -2.23 0.00 0.00 60.65 56.78 1r3n s ILE 346 Cb 0.15 -4.94 0.15 0.00 -1.58 0.00 0.00 42.46 36.24 1r3n s ILE 346 CO 0.82 -1.72 0.82 0.21 -1.23 0.00 0.00 174.94 173.83 1r3n s ASN 347 N 3.97 -0.87 0.41 3.58 2.47 -1.26 -5.03 114.94 118.20 1r3n s ASN 347 Ca 0.41 1.16 0.08 0.00 0.42 0.00 0.00 52.86 54.93 1r3n s ASN 347 Cb -0.02 1.98 0.88 0.00 -1.45 0.00 0.00 41.25 42.64 1r3n s ASN 347 CO -0.06 -0.17 2.05 0.44 -3.72 0.00 0.00 177.10 175.65 1r3n h ASP 348 N 7.76 0.46 0.00 -4.21 5.19 -1.88 -0.50 116.42 123.25 1r3n h ASP 348 Ca -0.17 -0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.23 1r3n h ASP 348 Cb 1.11 -0.11 0.00 0.00 0.18 0.00 0.00 39.33 40.51 1r3n h ASP 348 CO 0.09 0.33 0.00 0.61 -3.12 0.00 0.00 179.24 177.15 1r3n n GLY 349 N -1.48 -0.70 0.00 2.75 0.00 -1.17 -4.86 105.19 99.73 1r3n n GLY 349 Ca 0.04 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.94 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 0.38 2.85 3.74 -0.02 0.00 -0.19 -4.83 105.19 107.12 1r3n n GLY 350 Ca 0.15 -1.93 -0.41 0.00 0.00 0.00 0.00 46.02 43.83 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 -2.89 3.43 0.98 4.61 0.00 -1.26 -4.61 121.76 122.01 1r3n s ALA 351 Ca 0.00 0.94 -0.14 0.00 0.00 0.00 0.00 51.96 52.76 1r3n s ALA 351 Cb 0.00 -3.40 0.20 0.00 0.00 0.00 0.00 23.12 19.92 1r3n s ALA 351 CO 0.00 -0.34 1.20 1.28 0.00 0.00 0.00 175.76 177.91 1r3n n LEU 352 N 2.25 0.00 -4.14 0.00 4.32 -0.80 -5.02 117.00 113.61 1r3n n LEU 352 Ca 0.03 -1.39 -0.09 0.00 -0.02 0.00 0.00 56.01 54.54 1r3n n LEU 352 Cb 0.45 -0.91 -0.10 0.00 -1.62 0.00 0.00 43.42 41.24 1r3n n LEU 352 CO 0.55 -1.34 -0.32 -0.94 -1.22 0.00 0.00 177.39 174.12 1r3n s SER 353 N -5.42 0.49 0.01 -1.43 1.04 -1.05 -4.72 113.70 102.62 1r3n s SER 353 Ca 0.69 -1.13 -0.08 0.00 0.48 0.00 0.00 55.95 55.91 1r3n s SER 353 Cb -0.02 0.24 0.00 0.00 0.10 0.00 0.00 66.02 66.34 1r3n s SER 353 CO 0.48 -0.66 0.15 -0.72 0.98 0.00 0.00 173.24 173.47 1r3n s TYR 354 N -3.95 0.04 0.16 5.02 -0.85 -1.26 -0.14 117.35 116.36 1r3n s TYR 354 Ca 0.18 -0.14 0.10 0.00 -0.52 0.00 0.00 57.07 56.69 1r3n s TYR 354 Cb 0.07 -0.04 -0.04 0.00 0.38 0.00 0.00 41.96 42.33 1r3n s TYR 354 CO -0.02 -0.30 -0.23 -1.21 -1.52 0.00 0.00 175.55 172.27 1r3n s GLU 355 N -1.49 1.36 0.02 -3.49 0.41 -0.27 -4.98 118.70 110.27 1r3n s GLU 355 Ca -0.14 -1.39 0.04 0.00 -0.41 0.00 0.00 54.97 53.07 1r3n s GLU 355 Cb -0.07 -1.66 -0.02 0.00 -1.78 0.00 0.00 34.13 30.61 1r3n s GLU 355 CO 0.01 0.37 -0.13 0.45 -0.49 0.00 0.00 175.26 175.47 1r3n s SER 356 N -2.39 1.52 -0.10 -0.19 0.15 -1.26 -1.25 113.70 110.18 1r3n s SER 356 Ca 0.15 -0.38 -0.04 0.00 0.70 0.00 0.00 55.95 56.38 1r3n s SER 356 Cb -0.08 -0.11 0.05 0.00 -1.71 0.00 0.00 66.02 64.16 1r3n s SER 356 CO 0.07 0.06 0.21 -0.70 1.20 0.00 0.00 173.24 174.08 1r3n s GLU 357 N -0.89 0.13 0.02 5.44 2.12 0.30 -4.97 118.70 120.84 1r3n s GLU 357 Ca 0.02 0.57 -0.30 0.00 0.36 0.00 0.00 54.97 55.62 1r3n s GLU 357 Cb -0.07 -0.14 -0.06 0.00 0.26 0.00 0.00 34.13 34.12 1r3n s GLU 357 CO 0.01 -0.23 1.34 0.95 -0.54 0.00 0.00 175.26 176.79 1r3n s THR 358 N 1.82 3.76 -0.18 -1.70 -4.23 -1.26 0.07 115.64 113.92 1r3n s THR 358 Ca -0.03 1.18 -0.11 0.00 -1.18 0.00 0.00 61.69 61.55 1r3n s THR 358 Cb -0.11 -3.76 -0.22 0.00 1.34 0.00 0.00 72.50 69.75 1r3n s THR 358 CO -0.07 0.03 0.18 0.18 -0.54 0.00 0.00 174.62 174.39 1r3n n LEU 359 N 4.91 2.40 -3.49 4.79 4.77 -0.26 -4.93 117.00 125.19 1r3n n LEU 359 Ca 0.12 0.24 -0.13 0.00 -0.03 0.00 0.00 56.01 56.21 1r3n n LEU 359 Cb 0.44 -1.02 -0.04 0.00 -2.33 0.00 0.00 43.42 40.47 1r3n n LEU 359 CO 0.58 0.67 0.52 -1.58 -1.33 0.00 0.00 177.39 176.25 1r3n s GLN 360 N -2.49 1.02 -0.03 3.23 0.74 -1.23 -5.02 119.66 115.88 1r3n s GLN 360 Ca -0.27 -0.10 -0.12 0.00 0.05 0.00 0.00 55.36 54.91 1r3n s GLN 360 Cb 0.07 0.48 0.02 0.00 1.10 0.00 0.00 33.01 34.68 1r3n s GLN 360 CO 0.67 -0.39 0.26 0.08 -0.55 0.00 0.00 175.29 175.36 1r3n s VAL 361 N -2.39 0.05 -0.25 1.34 1.01 -1.26 -0.51 120.40 118.40 1r3n s VAL 361 Ca -0.03 -0.43 -0.09 0.00 0.00 0.00 0.00 61.98 61.44 1r3n s VAL 361 Cb -0.01 -0.52 0.11 0.00 0.00 0.00 0.00 36.38 35.96 1r3n s VAL 361 CO -0.02 -0.24 0.53 -0.55 0.00 0.00 0.00 175.10 174.82 1r3n s SER 362 N -1.03 -0.69 0.72 3.32 0.15 -0.08 -4.99 113.70 111.09 1r3n s SER 362 Ca -0.11 1.27 -0.12 0.00 0.70 0.00 0.00 55.95 57.70 1r3n s SER 362 Cb -0.05 1.79 0.02 0.00 -1.71 0.00 0.00 66.02 66.07 1r3n s SER 362 CO 0.03 -0.23 1.08 -2.16 1.20 0.00 0.00 173.24 173.16 1r3n s PRO 363 N 2.71 2.65 0.76 5.44 0.04 -1.26 -0.58 135.00 144.76 1r3n s PRO 363 Ca -0.04 1.13 -0.14 0.00 0.04 0.00 0.00 61.00 61.99 1r3n s PRO 363 Cb -0.12 -1.95 0.06 0.00 0.04 0.00 0.00 34.50 32.53 1r3n s PRO 363 CO -0.16 -1.33 1.21 0.00 0.04 0.00 0.00 177.00 176.76 1r3n s ALA 364 N -2.84 2.00 -0.15 8.56 0.00 -1.26 -4.51 121.76 123.57 1r3n s ALA 364 Ca 0.61 0.86 0.01 0.00 0.00 0.00 0.00 51.96 53.45 1r3n s ALA 364 Cb -0.16 -3.48 0.02 0.00 0.00 0.00 0.00 23.12 19.49 1r3n s ALA 364 CO 0.52 -2.05 -0.18 0.08 0.00 0.00 0.00 175.76 174.13 1r3n s VAL 365 N -2.06 1.85 -0.28 0.00 1.01 -0.31 -4.91 120.40 115.70 1r3n s VAL 365 Ca 0.74 -0.82 -0.11 0.00 0.00 0.00 0.00 61.98 61.79 1r3n s VAL 365 Cb -0.29 -1.67 -0.04 0.00 0.00 0.00 0.00 36.38 34.38 1r3n s VAL 365 CO 0.48 0.51 0.18 0.20 0.00 0.00 0.00 175.10 176.46 1r3n s ASN 366 N 1.17 5.87 0.69 3.32 -0.87 -1.26 -0.51 114.94 123.35 1r3n s ASN 366 Ca 0.00 -0.11 -0.11 0.00 -1.57 0.00 0.00 52.86 51.07 1r3n s ASN 366 Cb -0.14 -2.09 0.01 0.00 -0.02 0.00 0.00 41.25 39.01 1r3n s ASN 366 CO -0.08 -0.07 1.06 -0.36 -2.57 0.00 0.00 177.10 175.08 1r3n s PHE 367 N 1.73 3.07 0.24 2.20 0.08 -0.71 -4.97 117.98 119.62 1r3n s PHE 367 Ca 0.07 1.44 -0.30 0.00 0.12 0.00 0.00 56.93 58.26 1r3n s PHE 367 Cb -0.16 -2.90 -0.09 0.00 -0.57 0.00 0.00 43.02 39.30 1r3n s PHE 367 CO 0.10 -1.25 1.26 -1.58 -0.10 0.00 0.00 175.22 173.64 1r3n s HIS 368 N -2.98 3.28 0.45 0.36 2.46 -0.64 -4.93 115.29 113.29 1r3n s HIS 368 Ca 0.59 1.37 0.12 0.00 0.47 0.00 0.00 55.06 57.61 1r3n s HIS 368 Cb -0.14 -3.55 1.03 0.00 -0.13 0.00 0.00 32.58 29.78 1r3n s HIS 368 CO 0.53 -1.58 2.05 1.05 -2.47 0.00 0.00 174.74 174.32 1r3n h GLU 369 N 4.62 0.16 -0.12 2.88 4.11 -1.93 -1.03 114.58 123.27 1r3n h GLU 369 Ca -0.46 -0.02 -0.17 0.00 0.07 0.00 0.00 59.36 58.78 1r3n h GLU 369 Cb 1.22 -0.03 0.01 0.00 0.50 0.00 0.00 28.75 30.44 1r3n h GLU 369 CO 0.72 0.19 -0.59 0.28 0.07 0.00 0.00 179.01 179.69 1r3n h VAL 370 N 0.17 1.34 -0.60 -1.06 2.07 -1.97 -2.52 116.25 113.67 1r3n h VAL 370 Ca 0.04 -1.87 -0.09 0.00 0.82 0.00 0.00 66.70 65.60 1r3n h VAL 370 Cb 0.13 2.13 -0.02 0.00 -1.52 0.00 0.00 31.29 32.01 1r3n h VAL 370 CO 0.00 0.57 0.03 0.00 0.02 0.00 0.00 177.57 178.20 1r3n h ILE 372 N 0.95 1.21 -0.23 0.00 2.04 -1.21 -1.78 117.51 118.49 1r3n h ILE 372 Ca 0.18 -0.56 -0.08 0.00 1.00 0.00 0.00 64.86 65.39 1r3n h ILE 372 Cb 0.50 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 1r3n h ILE 372 CO 0.02 0.24 -0.22 -0.08 0.00 0.00 0.00 178.15 178.11 1r3n h GLU 373 N 0.87 0.43 -0.47 2.37 4.57 -1.26 0.16 114.58 121.25 1r3n h GLU 373 Ca 0.22 -0.15 -0.02 0.00 -1.18 0.00 0.00 59.36 58.23 1r3n h GLU 373 Cb 0.08 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.61 1r3n h GLU 373 CO -0.03 0.63 0.20 0.00 -1.18 0.00 0.00 179.01 178.63 1r3n h VAL 375 N 0.61 1.28 0.04 0.00 2.07 -1.01 -2.32 116.25 116.93 1r3n h VAL 375 Ca 0.16 -1.06 0.00 0.00 0.82 0.00 0.00 66.70 66.62 1r3n h VAL 375 Cb 0.16 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.40 1r3n h VAL 375 CO -0.02 0.33 -0.05 0.28 0.02 0.00 0.00 177.57 178.14 1r3n h SER 376 N 0.21 -0.13 -0.09 0.57 0.02 -0.60 0.23 113.55 113.77 1r3n h SER 376 Ca 0.06 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.02 1r3n h SER 376 Cb 0.52 0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.10 1r3n h SER 376 CO 0.02 -0.07 0.04 -0.09 -1.14 0.00 0.00 176.83 175.59 1r3n h ARG 377 N -0.10 0.17 -0.15 3.45 9.65 -1.16 0.15 114.38 126.40 1r3n h ARG 377 Ca 0.01 -0.02 -0.08 0.00 -1.10 0.00 0.00 59.98 58.80 1r3n h ARG 377 Cb 0.10 -0.04 -0.00 0.00 -1.39 0.00 0.00 29.97 28.65 1r3n h ARG 377 CO -0.02 0.16 -0.21 1.03 2.80 0.00 0.00 179.97 183.73 1r3n h SER 378 N 0.17 0.43 -0.08 -3.80 0.87 -0.86 -2.93 113.55 107.36 1r3n h SER 378 Ca 0.04 -0.52 -0.02 0.00 -1.23 0.00 0.00 61.79 60.07 1r3n h SER 378 Cb 0.06 -0.12 -0.00 0.00 -0.44 0.00 0.00 62.40 61.89 1r3n h SER 378 CO -0.00 0.87 -0.02 0.00 -0.53 0.00 0.00 176.83 177.15 1r3n h ALA 379 N 0.58 0.11 0.00 6.23 0.00 -0.06 -3.10 119.26 123.01 1r3n h ALA 379 Ca 0.02 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1r3n h ALA 379 Cb 0.77 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1r3n h ALA 379 CO 0.05 -0.17 0.00 0.74 0.00 0.00 0.00 179.25 179.87 1r3n h PHE 380 N -0.18 0.00 0.00 0.00 0.05 -0.85 0.11 116.94 116.07 1r3n h PHE 380 Ca 0.02 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.81 1r3n h PHE 380 Cb 0.42 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.37 1r3n h PHE 380 CO 0.05 0.00 0.00 0.00 -0.18 0.00 0.00 178.31 178.18 1r3n h ALA 381 N 2.08 1.00 0.00 2.45 0.00 -1.44 -3.36 119.26 119.99 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 0.46 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.25 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 -2.36 3.13 -4.03 0.00 6.02 -0.64 -5.06 117.38 114.43 1r3n n GLN 382 Ca 0.05 -0.09 -0.09 0.00 -0.01 0.00 0.00 57.00 56.86 1r3n n GLN 382 Cb 0.44 -0.47 -0.11 0.00 1.02 0.00 0.00 30.24 31.12 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 -0.47 0.43 0.49 1.08 0.40 0.31 -5.09 117.98 115.12 1r3n s PHE 383 Ca 0.00 -0.70 -0.22 0.00 -0.60 0.00 0.00 56.93 55.41 1r3n s PHE 383 Cb 0.00 -0.30 -0.07 0.00 0.51 0.00 0.00 43.02 43.16 1r3n s PHE 383 CO 0.00 -0.23 1.15 0.15 0.70 0.00 0.00 175.22 176.99 1r3n s LYS 384 N -2.32 3.62 0.32 0.44 1.02 -1.26 -4.50 119.74 117.05 1r3n s LYS 384 Ca -0.07 1.70 0.09 0.00 0.02 0.00 0.00 55.97 57.70 1r3n s LYS 384 Cb -0.04 -2.25 0.93 0.00 -0.52 0.00 0.00 37.83 35.95 1r3n s LYS 384 CO -0.04 -0.65 1.63 -0.22 -0.92 0.00 0.00 175.35 175.15 1r3n h LYS 385 N 1.73 0.16 0.00 1.68 3.64 -1.94 -0.40 116.57 121.44 1r3n h LYS 385 Ca -0.50 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 1r3n h LYS 385 Cb 1.25 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 1r3n h LYS 385 CO 0.59 0.11 0.00 -0.40 -2.27 0.00 0.00 179.45 177.48 1r3n n ASP 386 N -5.23 0.00 -0.41 4.20 5.68 -1.26 -2.36 116.55 117.17 1r3n n ASP 386 Ca 0.27 -0.82 0.10 0.00 -0.50 0.00 0.00 54.79 53.85 1r3n n ASP 386 Cb 0.89 -0.01 -0.02 0.00 -1.14 0.00 0.00 41.12 40.83 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 1.11 -4.79 0.11 6.02 -0.16 -4.70 117.38 113.96 1r3n n GLN 387 Ca 0.20 -0.83 -0.30 0.00 -0.01 0.00 0.00 57.00 56.06 1r3n n GLN 387 Cb 0.10 -1.46 -0.14 0.00 1.02 0.00 0.00 30.24 29.76 1r3n n GLN 387 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1r3n s VAL 388 N -2.49 2.37 -0.12 5.09 1.01 -1.00 0.12 120.40 125.40 1r3n s VAL 388 Ca 0.16 -1.34 -0.06 0.00 0.00 0.00 0.00 61.98 60.74 1r3n s VAL 388 Cb 0.17 -1.96 0.05 0.00 0.00 0.00 0.00 36.38 34.64 1r3n s VAL 388 CO 0.60 0.34 0.27 -0.60 0.00 0.00 0.00 175.10 175.71 1r3n s ARG 389 N -1.36 0.23 0.31 2.72 6.06 -0.84 -4.99 118.95 121.08 1r3n s ARG 389 Ca 0.13 0.57 -0.28 0.00 -2.50 0.00 0.00 55.73 53.65 1r3n s ARG 389 Cb -0.10 -0.10 -0.09 0.00 0.06 0.00 0.00 34.95 34.71 1r3n s ARG 389 CO 0.03 -0.17 1.06 -0.65 -2.50 0.00 0.00 175.30 173.08 1r3n s GLN 390 N 1.33 4.54 -0.01 5.12 -0.21 -1.26 -0.74 119.66 128.43 1r3n s GLN 390 Ca -0.09 1.67 -0.09 0.00 0.02 0.00 0.00 55.36 56.87 1r3n s GLN 390 Cb -0.10 -3.02 0.01 0.00 1.00 0.00 0.00 33.01 30.90 1r3n s GLN 390 CO -0.09 0.16 0.19 -1.50 -2.12 0.00 0.00 175.29 171.93 1r3n s ILE 391 N -1.31 0.07 -0.14 1.08 2.07 -0.27 -4.86 121.20 117.84 1r3n s ILE 391 Ca 0.48 -0.59 -0.09 0.00 -1.41 0.00 0.00 60.65 59.03 1r3n s ILE 391 Cb -0.28 -0.48 -0.05 0.00 0.13 0.00 0.00 42.46 41.79 1r3n s ILE 391 CO 0.36 -0.33 0.18 0.26 -1.91 0.00 0.00 174.94 173.50 1r3n s TRP 392 N -1.29 3.54 0.11 3.50 0.52 -1.26 -1.51 118.94 122.56 1r3n s TRP 392 Ca -0.14 0.52 -0.30 0.00 0.02 0.00 0.00 56.10 56.20 1r3n s TRP 392 Cb -0.07 -2.08 -0.06 0.00 -1.15 0.00 0.00 33.47 30.12 1r3n s TRP 392 CO 0.02 0.54 1.04 0.45 0.02 0.00 0.00 176.95 179.03 1r3n s SER 393 N -0.46 7.35 0.20 2.95 0.15 0.90 -4.93 113.70 119.86 1r3n s SER 393 Ca 0.14 1.91 0.23 0.00 0.70 0.00 0.00 55.95 58.93 1r3n s SER 393 Cb -0.12 -2.59 0.21 0.00 -1.71 0.00 0.00 66.02 61.81 1r3n s SER 393 CO 0.03 -0.20 1.25 1.23 1.20 0.00 0.00 173.24 176.75 1r3n h GLY 394 N 5.74 0.00 -3.16 9.45 0.00 -1.90 -1.42 103.07 111.79 1r3n h GLY 394 Ca -0.43 0.00 -0.64 0.00 0.00 0.00 0.00 47.33 46.26 1r3n h GLY 394 CO 0.74 0.00 -0.78 0.00 0.00 0.00 0.00 176.54 176.50 1r3n s ALA 395 N -3.26 2.72 0.40 3.60 0.00 -1.26 -4.79 121.76 119.16 1r3n s ALA 395 Ca 0.04 -1.61 -0.17 0.00 0.00 0.00 0.00 51.96 50.21 1r3n s ALA 395 Cb 0.11 -0.47 -0.09 0.00 0.00 0.00 0.00 23.12 22.66 1r3n s ALA 395 CO 0.74 0.42 0.86 0.20 0.00 0.00 0.00 175.76 177.98 1r3n s GLY 396 N -2.84 2.29 0.25 0.00 0.00 -1.26 -4.91 107.32 100.85 1r3n s GLY 396 Ca 0.23 0.18 -0.01 0.00 0.00 0.00 0.00 44.72 45.12 1r3n s GLY 396 CO 0.12 0.43 0.25 0.30 0.00 0.00 0.00 173.10 174.20 1r3n s HIS 397 N -2.18 1.14 0.55 1.90 3.76 -1.26 -5.03 115.29 114.17 1r3n s HIS 397 Ca 0.58 -1.32 0.24 0.00 -0.15 0.00 0.00 55.06 54.41 1r3n s HIS 397 Cb -0.10 -0.42 1.48 0.00 1.11 0.00 0.00 32.58 34.65 1r3n s HIS 397 CO 0.19 -0.79 2.09 -0.44 -0.85 0.00 0.00 174.74 174.93 1r3n h ASP 398 N 2.42 0.00 -0.28 1.40 3.32 -1.97 -0.90 116.42 120.42 1r3n h ASP 398 Ca -0.32 0.00 0.08 0.00 0.02 0.00 0.00 57.03 56.81 1r3n h ASP 398 Cb 1.25 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.78 1r3n h ASP 398 CO 0.46 0.00 0.24 0.28 -1.72 0.00 0.00 179.24 178.49 1r3n h SER 399 N 0.00 0.00 0.10 6.45 0.02 -1.95 -0.45 113.55 117.72 1r3n h SER 399 Ca 0.11 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.02 1r3n h SER 399 Cb 0.50 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.04 1r3n h SER 399 CO -0.00 0.00 -0.14 0.00 -1.14 0.00 0.00 176.83 175.55 1r3n h GLN 401 N 0.09 0.19 0.00 0.00 7.50 -1.23 -3.35 115.11 118.31 1r3n h GLN 401 Ca 0.02 -0.33 -0.24 0.00 0.50 0.00 0.00 58.65 58.60 1r3n h GLN 401 Cb 0.31 0.12 -0.04 0.00 0.05 0.00 0.00 27.48 27.92 1r3n h GLN 401 CO 0.02 1.16 -1.30 1.79 -1.50 0.00 0.00 178.83 178.99 1r3n h THR 402 N 0.05 1.29 -0.94 -0.54 1.35 -1.36 -3.39 112.91 109.37 1r3n h THR 402 Ca -0.10 -3.05 0.12 0.00 -0.55 0.00 0.00 66.41 62.83 1r3n h THR 402 Cb 1.91 2.63 -0.08 0.00 -1.73 0.00 0.00 68.15 70.88 1r3n h THR 402 CO 0.18 0.74 0.57 0.00 -0.25 0.00 0.00 175.52 176.76 1r3n h ALA 403 N 1.02 1.42 0.00 6.62 0.00 -1.44 0.80 119.26 127.68 1r3n h ALA 403 Ca -0.13 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1r3n h ALA 403 Cb 1.86 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.49 1r3n h ALA 403 CO 0.10 0.15 0.00 -1.35 0.00 0.00 0.00 179.25 178.15 1r3n h PRO 404 N 0.89 0.00 0.00 0.00 0.11 -1.78 -3.36 132.00 127.86 1r3n h PRO 404 Ca 0.48 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 66.42 1r3n h PRO 404 Cb 0.50 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.58 1r3n h PRO 404 CO -0.28 0.00 -1.63 0.72 -0.21 0.00 0.00 178.00 176.60 1r3n n HIS 405 N -2.62 0.00 -4.23 0.65 8.25 0.12 -5.05 115.22 112.34 1r3n n HIS 405 Ca 0.00 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 57.28 1r3n n HIS 405 Cb 0.18 -0.42 -0.11 0.00 1.12 0.00 0.00 29.99 30.75 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 -2.22 1.29 -0.03 1.59 -7.23 -0.28 -5.10 120.40 108.42 1r3n s VAL 406 Ca -0.15 -1.66 -0.34 0.00 -1.81 0.00 0.00 61.98 58.02 1r3n s VAL 406 Cb 0.04 -1.46 -0.12 0.00 0.56 0.00 0.00 36.38 35.39 1r3n s VAL 406 CO 0.25 -0.39 1.80 -2.65 -0.31 0.00 0.00 175.10 173.80 1r3n n PRO 407 N 0.65 2.14 -3.98 4.82 -0.02 -1.26 -4.23 135.00 133.11 1r3n n PRO 407 Ca -0.16 0.78 -0.09 0.00 -2.02 0.00 0.00 63.50 62.01 1r3n n PRO 407 Cb 0.57 -2.60 -0.10 0.00 -0.02 0.00 0.00 33.50 31.34 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 3.27 0.16 0.23 3.45 -4.23 -1.26 -1.49 115.64 115.77 1r3n s THR 408 Ca 0.89 -1.29 -0.18 0.00 -1.18 0.00 0.00 61.69 59.93 1r3n s THR 408 Cb -0.70 -1.01 0.02 0.00 1.34 0.00 0.00 72.50 72.16 1r3n s THR 408 CO 0.49 -0.71 0.59 -0.55 -0.54 0.00 0.00 174.62 173.89 1r3n s SER 409 N -2.30 -0.27 0.15 3.99 0.15 -0.86 -1.63 113.70 112.92 1r3n s SER 409 Ca -0.02 -0.54 0.05 0.00 0.70 0.00 0.00 55.95 56.14 1r3n s SER 409 Cb 0.01 0.63 -0.04 0.00 -1.71 0.00 0.00 66.02 64.90 1r3n s SER 409 CO -0.06 -1.15 -0.11 -0.04 1.20 0.00 0.00 173.24 173.08 1r3n s MET 410 N -3.90 1.07 -0.07 5.44 -1.94 -1.26 -1.96 119.30 116.69 1r3n s MET 410 Ca 0.11 -1.44 0.03 0.00 -1.71 0.00 0.00 55.69 52.68 1r3n s MET 410 Cb -0.03 -0.67 0.01 0.00 2.01 0.00 0.00 34.83 36.15 1r3n s MET 410 CO 0.01 0.09 -0.14 0.42 -0.01 0.00 0.00 175.02 175.38 1r3n s ILE 411 N -3.21 1.29 -0.01 2.53 1.01 0.06 -2.57 121.20 120.30 1r3n s ILE 411 Ca 0.16 -0.58 0.02 0.00 0.00 0.00 0.00 60.65 60.24 1r3n s ILE 411 Cb 0.02 -1.16 -0.03 0.00 0.01 0.00 0.00 42.46 41.30 1r3n s ILE 411 CO 0.01 0.39 -0.02 -0.36 0.00 0.00 0.00 174.94 174.96 1r3n s PHE 412 N 0.51 3.04 0.22 3.97 0.40 -0.15 -1.45 117.98 124.51 1r3n s PHE 412 Ca -0.13 0.06 0.11 0.00 -0.60 0.00 0.00 56.93 56.37 1r3n s PHE 412 Cb -0.15 -1.67 -0.05 0.00 0.51 0.00 0.00 43.02 41.67 1r3n s PHE 412 CO 0.04 0.44 -0.21 0.96 0.70 0.00 0.00 175.22 177.15 1r3n s ILE 413 N -1.04 2.24 0.35 0.64 -4.36 -1.09 -1.16 121.20 116.78 1r3n s ILE 413 Ca 0.18 -2.14 -0.27 0.00 -0.26 0.00 0.00 60.65 58.16 1r3n s ILE 413 Cb -0.11 -2.12 -0.12 0.00 1.25 0.00 0.00 42.46 41.36 1r3n s ILE 413 CO 0.09 -0.29 1.08 -2.65 0.24 0.00 0.00 174.94 173.42 1r3n n PRO 414 N -0.06 1.56 -4.29 0.37 -0.02 -1.26 -1.50 135.00 129.81 1r3n n PRO 414 Ca -0.10 0.55 -0.34 0.00 -2.02 0.00 0.00 63.50 61.60 1r3n n PRO 414 Cb 0.58 -2.04 -0.15 0.00 -0.02 0.00 0.00 33.50 31.86 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 -0.55 3.81 0.11 2.55 0.01 -1.26 -4.60 113.70 113.76 1r3n s SER 415 Ca 0.59 -0.46 -0.33 0.00 1.31 0.00 0.00 55.95 57.06 1r3n s SER 415 Cb -0.61 -1.61 -0.12 0.00 0.21 0.00 0.00 66.02 63.88 1r3n s SER 415 CO 0.60 0.05 1.73 1.17 0.41 0.00 0.00 173.24 177.19 1r3n n LYS 416 N 4.32 2.42 -0.99 12.44 4.81 -0.43 -1.28 118.16 139.45 1r3n n LYS 416 Ca -0.19 0.88 -0.03 0.00 -0.87 0.00 0.00 58.31 58.10 1r3n n LYS 416 Cb 0.51 -2.71 -0.01 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 4.78 -5.20 -1.33 3.14 8.00 -1.26 -1.49 116.55 123.19 1r3n n ASP 417 Ca 0.18 0.08 -0.16 0.00 0.71 0.00 0.00 54.79 55.60 1r3n n ASP 417 Cb 0.32 -3.34 -0.05 0.00 -0.02 0.00 0.00 41.12 38.03 1r3n n ASP 417 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1r3n n GLY 418 N 0.67 1.14 3.71 0.44 0.00 -0.40 -4.71 105.19 106.03 1r3n n GLY 418 Ca -0.03 -0.27 -0.42 0.00 0.00 0.00 0.00 46.02 45.30 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 -3.76 4.37 0.22 0.99 2.96 -0.56 -3.87 118.68 119.03 1r3n s LEU 419 Ca 0.00 1.75 -0.04 0.00 -0.22 0.00 0.00 54.13 55.62 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 -0.31 0.24 -0.55 -1.32 0.00 0.00 176.35 174.41 1r3n s SER 420 N 1.01 0.16 -1.40 3.68 0.15 -1.26 -4.52 113.70 111.52 1r3n s SER 420 Ca 0.54 -1.28 -0.05 0.00 0.70 0.00 0.00 55.95 55.86 1r3n s SER 420 Cb -0.23 0.45 0.03 0.00 -1.71 0.00 0.00 66.02 64.56 1r3n s SER 420 CO 0.28 -0.94 0.75 1.41 1.20 0.00 0.00 173.24 175.94 1r3n n HIS 421 N -0.32 -1.99 -3.61 3.44 8.25 -1.26 -4.95 115.22 114.78 1r3n n HIS 421 Ca 0.01 0.85 -0.16 0.00 -0.26 0.00 0.00 57.72 58.16 1r3n n HIS 421 Cb 0.65 -4.13 -0.07 0.00 1.12 0.00 0.00 29.99 27.55 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 -4.02 -0.58 0.37 0.41 3.84 -1.16 -4.70 114.94 109.10 1r3n s ASN 422 Ca 0.22 0.83 0.16 0.00 0.21 0.00 0.00 52.86 54.28 1r3n s ASN 422 Cb -0.11 0.79 1.05 0.00 -0.55 0.00 0.00 41.25 42.42 1r3n s ASN 422 CO 0.83 -0.43 1.75 1.88 -2.79 0.00 0.00 177.10 178.34 1r3n h TYR 423 N 3.97 0.77 -0.01 0.43 0.99 -1.75 -2.60 116.97 118.77 1r3n h TYR 423 Ca -0.28 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.48 1r3n h TYR 423 Cb 1.16 -0.22 0.00 0.00 1.00 0.00 0.00 36.73 38.67 1r3n h TYR 423 CO 0.41 0.05 -0.12 0.66 -0.00 0.00 0.00 178.16 179.15 1r3n n TYR 424 N -4.71 0.00 -1.43 4.88 4.02 -1.26 -4.38 117.16 114.28 1r3n n TYR 424 Ca 0.26 0.00 -0.55 0.00 -0.01 0.00 0.00 57.90 57.60 1r3n n TYR 424 Cb 0.86 -0.08 -0.07 0.00 -0.02 0.00 0.00 39.34 40.03 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 -0.37 0.00 -3.69 -0.72 2.13 -1.03 -4.96 120.64 111.99 1r3n n GLU 425 Ca 0.16 0.00 -0.10 0.00 0.66 0.00 0.00 57.16 57.87 1r3n n GLU 425 Cb 0.33 -1.37 -0.11 0.00 0.27 0.00 0.00 31.44 30.56 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 -0.14 -0.61 0.02 4.31 5.04 -1.26 -4.60 117.35 120.12 1r3n s TYR 426 Ca 0.84 1.29 0.06 0.00 -2.44 0.00 0.00 57.07 56.81 1r3n s TYR 426 Cb -1.17 0.26 -0.02 0.00 0.35 0.00 0.00 41.96 41.38 1r3n s TYR 426 CO 0.55 -0.35 -0.17 -1.12 -1.34 0.00 0.00 175.55 173.12 1r3n s SER 427 N 1.48 2.01 0.52 4.32 0.01 -1.26 -1.32 113.70 119.47 1r3n s SER 427 Ca -0.09 -0.43 -0.18 0.00 1.31 0.00 0.00 55.95 56.57 1r3n s SER 427 Cb -0.09 -0.17 -0.07 0.00 0.21 0.00 0.00 66.02 65.90 1r3n s SER 427 CO -0.13 0.13 1.01 -0.94 0.41 0.00 0.00 173.24 173.73 1r3n s SER 428 N -0.90 6.34 0.30 2.44 1.04 -1.26 -4.86 113.70 116.79 1r3n s SER 428 Ca 0.05 1.74 0.04 0.00 0.48 0.00 0.00 55.95 58.26 1r3n s SER 428 Cb -0.08 -2.53 0.69 0.00 0.10 0.00 0.00 66.02 64.20 1r3n s SER 428 CO 0.01 -0.78 1.78 -0.65 0.98 0.00 0.00 173.24 174.58 1r3n h PRO 429 N 1.03 0.77 -0.41 4.02 0.11 -2.00 0.49 132.00 136.01 1r3n h PRO 429 Ca -0.48 -0.05 -0.09 0.00 0.11 0.00 0.00 66.00 65.50 1r3n h PRO 429 Cb 1.20 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 1r3n h PRO 429 CO 0.60 0.51 -0.10 1.49 -0.21 0.00 0.00 178.00 180.28 1r3n h GLU 430 N 0.79 0.79 -0.72 1.05 4.81 -1.99 -1.47 114.58 117.84 1r3n h GLU 430 Ca 0.56 -0.30 -0.01 0.00 -0.13 0.00 0.00 59.36 59.47 1r3n h GLU 430 Cb 0.81 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 30.11 1r3n h GLU 430 CO -0.36 0.92 0.40 0.93 -0.73 0.00 0.00 179.01 180.16 1r3n h GLU 431 N 0.61 1.00 -0.50 1.92 5.08 -1.58 -0.49 114.58 120.62 1r3n h GLU 431 Ca 0.10 -0.12 -0.05 0.00 -1.00 0.00 0.00 59.36 58.29 1r3n h GLU 431 Cb 0.63 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.66 1r3n h GLU 431 CO 0.04 0.75 0.10 0.82 -1.00 0.00 0.00 179.01 179.72 1r3n h ILE 432 N 0.99 1.24 -0.78 3.13 2.04 -0.86 -1.66 117.51 121.61 1r3n h ILE 432 Ca 0.25 -0.88 -0.03 0.00 1.00 0.00 0.00 64.86 65.20 1r3n h ILE 432 Cb 0.03 0.86 -0.04 0.00 -0.74 0.00 0.00 36.82 36.94 1r3n h ILE 432 CO -0.04 0.32 0.37 -0.08 0.00 0.00 0.00 178.15 178.71 1r3n h GLU 433 N 0.69 1.13 -0.56 2.37 4.81 -0.93 -1.49 114.58 120.59 1r3n h GLU 433 Ca 0.15 -0.17 0.01 0.00 -0.13 0.00 0.00 59.36 59.23 1r3n h GLU 433 Cb 0.36 -0.20 -0.03 0.00 0.63 0.00 0.00 28.75 29.51 1r3n h GLU 433 CO 0.01 0.88 0.36 -0.91 -0.73 0.00 0.00 179.01 178.62 1r3n h ASN 434 N 1.10 0.61 -0.48 1.04 -0.26 -0.88 -0.14 115.58 116.57 1r3n h ASN 434 Ca 0.27 -0.01 0.02 0.00 -0.56 0.00 0.00 56.30 56.01 1r3n h ASN 434 Cb 0.13 -0.14 -0.03 0.00 -1.06 0.00 0.00 38.32 37.22 1r3n h ASN 434 CO -0.03 0.44 0.30 1.23 -1.06 0.00 0.00 177.43 178.30 1r3n h GLY 435 N 0.73 0.68 1.07 2.83 0.00 -0.98 -2.29 103.07 105.10 1r3n h GLY 435 Ca 0.21 -0.23 -0.08 0.00 0.00 0.00 0.00 47.33 47.23 1r3n h GLY 435 CO -0.06 0.20 0.06 -2.75 0.00 0.00 0.00 176.54 173.99 1r3n h PHE 436 N 0.60 1.15 -0.79 5.60 3.57 -0.97 -1.32 116.94 124.78 1r3n h PHE 436 Ca 0.19 -0.18 0.07 0.00 3.53 0.00 0.00 57.97 61.58 1r3n h PHE 436 Cb -0.01 -0.31 -0.06 0.00 2.79 0.00 0.00 35.95 38.36 1r3n h PHE 436 CO -0.06 0.99 0.46 0.87 -2.23 0.00 0.00 178.31 178.34 1r3n h LYS 437 N 0.98 0.80 -0.04 1.11 1.57 -0.76 0.03 116.57 120.26 1r3n h LYS 437 Ca 0.19 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.90 1r3n h LYS 437 Cb 0.49 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.62 1r3n h LYS 437 CO 0.02 0.53 -0.05 0.28 -0.57 0.00 0.00 179.45 179.66 1r3n h VAL 438 N 0.82 1.40 -0.52 0.50 2.07 -1.12 -2.85 116.25 116.55 1r3n h VAL 438 Ca 0.36 -1.27 0.08 0.00 0.82 0.00 0.00 66.70 66.69 1r3n h VAL 438 Cb 0.24 2.15 -0.07 0.00 -1.52 0.00 0.00 31.29 32.10 1r3n h VAL 438 CO -0.20 0.34 0.16 0.25 0.02 0.00 0.00 177.57 178.14 1r3n h LEU 439 N -0.37 0.12 -0.35 2.57 5.85 -0.99 0.89 115.31 123.03 1r3n h LEU 439 Ca 0.01 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.80 1r3n h LEU 439 Cb 0.58 0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.67 1r3n h LEU 439 CO 0.01 0.09 0.23 0.25 -0.34 0.00 0.00 178.44 178.68 1r3n h LEU 440 N 0.32 0.41 -0.59 2.25 5.85 -0.99 -1.38 115.31 121.17 1r3n h LEU 440 Ca 0.26 -0.02 -0.13 0.00 0.84 0.00 0.00 57.88 58.83 1r3n h LEU 440 Cb 0.31 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.22 1r3n h LEU 440 CO -0.29 0.31 -0.62 -0.61 -0.34 0.00 0.00 178.44 176.88 1r3n h GLN 441 N 0.47 0.00 -0.44 1.25 5.75 -1.24 -2.13 115.11 118.77 1r3n h GLN 441 Ca 0.13 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.62 1r3n h GLN 441 Cb -0.04 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.49 1r3n h GLN 441 CO -0.03 0.62 0.24 0.00 -2.65 0.00 0.00 178.83 177.02 1r3n h ALA 442 N 1.38 0.56 -0.36 3.38 0.00 -0.38 0.30 119.26 124.14 1r3n h ALA 442 Ca -0.01 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1r3n h ALA 442 Cb 1.20 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 1r3n h ALA 442 CO 0.08 0.08 0.14 0.82 0.00 0.00 0.00 179.25 180.37 1r3n h ILE 443 N 0.57 1.19 -0.80 0.00 2.04 -1.17 -0.27 117.51 119.07 1r3n h ILE 443 Ca 0.15 -0.60 0.06 0.00 1.00 0.00 0.00 64.86 65.47 1r3n h ILE 443 Cb 0.04 0.92 -0.06 0.00 -0.74 0.00 0.00 36.82 36.98 1r3n h ILE 443 CO -0.03 0.21 0.49 0.40 0.00 0.00 0.00 178.15 179.23 1r3n h ILE 444 N 0.43 1.03 -0.07 -0.67 2.04 -1.17 -0.20 117.51 118.90 1r3n h ILE 444 Ca 0.12 -0.31 0.01 0.00 1.00 0.00 0.00 64.86 65.68 1r3n h ILE 444 Cb 0.20 0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.32 1r3n h ILE 444 CO -0.01 0.16 -0.00 0.78 0.00 0.00 0.00 178.15 179.08 1r3n h ASN 445 N 0.90 -0.04 -0.58 1.72 2.35 0.04 -0.90 115.58 119.07 1r3n h ASN 445 Ca 0.35 0.02 -0.04 0.00 -0.55 0.00 0.00 56.30 56.08 1r3n h ASN 445 Cb 0.16 0.03 -0.03 0.00 0.05 0.00 0.00 38.32 38.54 1r3n h ASN 445 CO -0.17 -0.01 0.23 0.22 -1.65 0.00 0.00 177.43 176.05 1r3n h TYR 446 N 0.02 0.90 -0.50 1.19 3.20 -0.67 -0.31 116.97 120.81 1r3n h TYR 446 Ca 0.03 -0.07 0.00 0.00 3.14 0.00 0.00 58.73 61.84 1r3n h TYR 446 Cb 0.04 -0.27 -0.02 0.00 1.54 0.00 0.00 36.73 38.02 1r3n h TYR 446 CO -0.12 0.73 0.32 0.22 -1.64 0.00 0.00 178.16 177.67 1r3n h ASP 447 N 0.81 0.57 0.86 -2.11 3.58 -0.90 -1.41 116.42 117.82 1r3n h ASP 447 Ca 0.19 -0.02 -0.15 0.00 0.42 0.00 0.00 57.03 57.48 1r3n h ASP 447 Cb 0.22 -0.14 -0.02 0.00 1.72 0.00 0.00 39.33 41.10 1r3n h ASP 447 CO -0.01 0.42 -0.72 0.78 -2.88 0.00 0.00 179.24 176.83 1r3n h ASN 448 N 0.67 0.00 -0.15 2.28 2.35 -0.66 -3.22 115.58 116.85 1r3n h ASN 448 Ca 0.18 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.82 1r3n h ASN 448 Cb -0.07 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.29 1r3n h ASN 448 CO -0.04 0.72 -0.29 0.22 -1.65 0.00 0.00 177.43 176.39 1r3n h TYR 449 N 0.00 0.72 -0.01 1.19 5.03 -0.11 -3.00 116.97 120.79 1r3n h TYR 449 Ca -0.01 -0.17 0.00 0.00 2.58 0.00 0.00 58.73 61.13 1r3n h TYR 449 Cb 1.34 -0.17 -0.00 0.00 1.55 0.00 0.00 36.73 39.45 1r3n h TYR 449 CO 0.00 0.85 0.01 0.00 -1.32 0.00 0.00 178.16 177.69 1r3n h ARG 450 N 0.54 0.00 -0.17 1.82 3.08 -1.31 0.49 114.38 118.83 1r3n h ARG 450 Ca 0.07 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 59.94 1r3n h ARG 450 Cb 0.77 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.83 1r3n h ARG 450 CO 0.06 0.00 -0.58 0.28 -1.07 0.00 0.00 179.97 178.66 1r3n h VAL 451 N 0.00 1.31 -0.04 2.04 2.07 -1.62 -2.91 116.25 117.10 1r3n h VAL 451 Ca 0.00 -1.82 -0.00 0.00 0.82 0.00 0.00 66.70 65.70 1r3n h VAL 451 Cb 0.02 1.97 -0.00 0.00 -1.52 0.00 0.00 31.29 31.75 1r3n h VAL 451 CO -0.00 0.57 0.01 0.40 0.02 0.00 0.00 177.57 178.57 1r3n h ILE 452 N 0.38 1.20 -0.27 4.57 2.04 -1.24 -3.07 117.51 121.12 1r3n h ILE 452 Ca -0.03 -0.59 0.05 0.00 1.00 0.00 0.00 64.86 65.30 1r3n h ILE 452 Cb 1.21 1.52 -0.04 0.00 -0.74 0.00 0.00 36.82 38.77 1r3n h ILE 452 CO 0.12 0.16 -0.00 -0.09 0.00 0.00 0.00 178.15 178.34 1r3n h ARG 453 N -0.17 0.08 -0.20 2.37 2.43 -1.03 -2.83 114.38 115.02 1r3n h ARG 453 Ca 0.01 -0.00 0.04 0.00 -0.81 0.00 0.00 59.98 59.22 1r3n h ARG 453 Cb 0.25 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.74 1r3n h ARG 453 CO 0.00 0.05 -0.05 0.78 -1.51 0.00 0.00 179.97 179.24 1r3n h GLY 454 N 0.08 0.14 -1.00 2.80 0.00 -1.54 -3.51 103.07 100.03 1r3n h GLY 454 Ca 0.13 0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.53 1r3n h GLY 454 CO -0.22 -0.08 0.00 1.42 0.00 0.00 0.00 176.54 177.66