#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r3n s ALA 24 N 0.00 3.45 0.17 3.55 0.00 -1.26 -5.08 121.76 122.59 1r3n s ALA 24 Ca 0.00 -2.98 -0.32 0.00 0.00 0.00 0.00 51.96 48.67 1r3n s ALA 24 Cb 0.00 -2.63 -0.11 0.00 0.00 0.00 0.00 23.12 20.38 1r3n s ALA 24 CO 0.00 -2.00 1.68 0.00 0.00 0.00 0.00 175.76 175.44 1r3n s ALA 25 N 0.44 3.84 0.30 0.00 0.00 -1.26 -4.95 121.76 120.14 1r3n s ALA 25 Ca 0.13 1.47 -0.29 0.00 0.00 0.00 0.00 51.96 53.27 1r3n s ALA 25 Cb -0.21 -3.68 -0.10 0.00 0.00 0.00 0.00 23.12 19.13 1r3n s ALA 25 CO -0.04 -0.92 1.34 0.00 0.00 0.00 0.00 175.76 176.14 1r3n s ALA 26 N 1.48 3.53 -0.77 0.00 0.00 -1.26 -4.94 121.76 119.80 1r3n s ALA 26 Ca 0.74 1.27 -0.26 0.00 0.00 0.00 0.00 51.96 53.71 1r3n s ALA 26 Cb -0.46 -3.50 0.02 0.00 0.00 0.00 0.00 23.12 19.17 1r3n s ALA 26 CO 0.32 -0.66 1.49 -1.25 0.00 0.00 0.00 175.76 175.66 1r3n s PRO 27 N -1.33 3.08 0.23 0.00 0.04 -1.26 -4.98 135.00 130.79 1r3n s PRO 27 Ca 0.52 -0.20 -0.30 0.00 0.04 0.00 0.00 61.00 61.06 1r3n s PRO 27 Cb -0.40 -4.49 -0.09 0.00 0.04 0.00 0.00 34.50 29.57 1r3n s PRO 27 CO 0.50 -2.38 1.04 -0.51 0.04 0.00 0.00 177.00 175.68 1r3n s LEU 28 N 6.67 4.57 -0.20 -3.56 1.43 -1.26 -4.97 118.68 121.37 1r3n s LEU 28 Ca 0.47 2.09 -0.29 0.00 -1.03 0.00 0.00 54.13 55.37 1r3n s LEU 28 Cb -0.08 -3.61 -0.01 0.00 0.03 0.00 0.00 46.19 42.52 1r3n s LEU 28 CO 0.11 -0.05 1.30 -0.55 0.23 0.00 0.00 176.35 177.40 1r3n s SER 29 N -0.77 6.84 -0.01 2.29 0.15 -1.26 -5.01 113.70 115.93 1r3n s SER 29 Ca 0.44 1.59 -0.20 0.00 0.70 0.00 0.00 55.95 58.49 1r3n s SER 29 Cb -0.29 -2.54 -0.05 0.00 -1.71 0.00 0.00 66.02 61.43 1r3n s SER 29 CO 0.36 -0.87 0.57 -0.63 1.20 0.00 0.00 173.24 173.87 1r3n s ILE 30 N 3.82 4.92 -0.57 6.45 -1.09 -1.26 -4.90 121.20 128.57 1r3n s ILE 30 Ca 0.57 1.20 -0.27 0.00 -2.23 0.00 0.00 60.65 59.91 1r3n s ILE 30 Cb -0.21 -3.91 0.00 0.00 -1.58 0.00 0.00 42.46 36.76 1r3n s ILE 30 CO 0.18 0.43 1.56 0.00 -1.23 0.00 0.00 174.94 175.88 1r3n s ALA 31 N -0.27 2.63 0.14 9.38 0.00 -1.26 -4.97 121.76 127.41 1r3n s ALA 31 Ca 0.30 -0.66 -0.31 0.00 0.00 0.00 0.00 51.96 51.29 1r3n s ALA 31 Cb -0.18 -4.17 -0.10 0.00 0.00 0.00 0.00 23.12 18.68 1r3n s ALA 31 CO 0.17 -3.21 1.61 0.45 0.00 0.00 0.00 175.76 174.78 1r3n s SER 32 N 5.52 6.58 0.00 0.00 0.15 -1.26 -2.56 113.70 122.13 1r3n s SER 32 Ca 0.57 2.59 0.00 0.00 0.70 0.00 0.00 55.95 59.82 1r3n s SER 32 Cb -0.12 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.61 1r3n s SER 32 CO 0.23 -0.86 0.00 0.61 1.20 0.00 0.00 173.24 174.43 1r3n n GLY 33 N 3.86 1.95 0.15 9.45 0.00 -1.26 -4.93 105.19 114.41 1r3n n GLY 33 Ca 0.15 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.05 1r3n n GLY 33 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1r3n h ARG 34 N 2.72 0.43 0.03 1.61 2.43 -1.92 -1.23 114.38 118.45 1r3n h ARG 34 Ca 0.00 -0.15 0.02 0.00 -0.81 0.00 0.00 59.98 59.04 1r3n h ARG 34 Cb 0.00 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.49 1r3n h ARG 34 CO 0.00 0.63 -0.17 1.25 -1.51 0.00 0.00 179.97 180.18 1r3n h LEU 35 N 0.18 -0.49 -0.73 3.80 5.85 -1.92 0.32 115.31 122.33 1r3n h LEU 35 Ca 0.06 0.07 0.06 0.00 0.84 0.00 0.00 57.88 58.91 1r3n h LEU 35 Cb 0.46 0.20 -0.06 0.00 0.37 0.00 0.00 40.66 41.63 1r3n h LEU 35 CO 0.02 -0.24 0.43 -1.13 -0.34 0.00 0.00 178.44 177.18 1r3n h ASN 36 N -0.29 0.66 -0.78 1.25 -0.73 -1.92 -1.49 115.58 112.28 1r3n h ASN 36 Ca 0.05 0.02 -0.04 0.00 1.87 0.00 0.00 56.30 58.20 1r3n h ASN 36 Cb 0.35 -0.11 -0.04 0.00 0.27 0.00 0.00 38.32 38.79 1r3n h ASN 36 CO -0.14 0.43 0.34 -0.61 -0.37 0.00 0.00 177.43 177.07 1r3n h GLN 37 N 0.80 1.15 -0.48 6.67 5.75 -0.77 -2.24 115.11 125.99 1r3n h GLN 37 Ca 0.32 -0.19 -0.05 0.00 -0.15 0.00 0.00 58.65 58.58 1r3n h GLN 37 Cb 0.16 -0.20 -0.02 0.00 1.07 0.00 0.00 27.48 28.49 1r3n h GLN 37 CO -0.17 0.92 0.11 1.15 -2.65 0.00 0.00 178.83 178.18 1r3n h THR 38 N 1.13 1.24 -0.78 2.39 2.02 -0.08 0.52 112.91 119.35 1r3n h THR 38 Ca 0.27 -0.86 -0.00 0.00 0.77 0.00 0.00 66.41 66.58 1r3n h THR 38 Cb 0.18 0.87 -0.04 0.00 -1.74 0.00 0.00 68.15 67.42 1r3n h THR 38 CO -0.03 0.31 0.48 0.40 0.37 0.00 0.00 175.52 177.06 1r3n h ILE 39 N 0.66 1.22 -0.12 3.11 2.04 -1.11 -0.77 117.51 122.54 1r3n h ILE 39 Ca 0.15 -0.45 -0.16 0.00 1.00 0.00 0.00 64.86 65.39 1r3n h ILE 39 Cb 0.35 0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 36.53 1r3n h ILE 39 CO 0.00 0.22 -0.62 -0.07 0.00 0.00 0.00 178.15 177.68 1r3n h LEU 40 N 1.07 0.48 -0.04 1.44 3.38 -1.15 -2.06 115.31 118.44 1r3n h LEU 40 Ca 0.28 -0.28 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 1r3n h LEU 40 Cb -0.06 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.55 1r3n h LEU 40 CO -0.06 0.99 -0.22 -0.33 0.09 0.00 0.00 178.44 178.91 1r3n h GLU 41 N 0.31 0.22 -0.19 1.13 5.08 -0.63 -2.60 114.58 117.90 1r3n h GLU 41 Ca -0.01 -0.18 -0.09 0.00 -1.00 0.00 0.00 59.36 58.08 1r3n h GLU 41 Cb 1.16 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.44 1r3n h GLU 41 CO 0.11 0.84 -0.27 1.79 -1.00 0.00 0.00 179.01 180.47 1r3n h THR 42 N -0.34 1.26 0.33 1.13 1.35 -1.23 -2.16 112.91 113.25 1r3n h THR 42 Ca -0.02 -1.25 -0.02 0.00 -0.55 0.00 0.00 66.41 64.58 1r3n h THR 42 Cb 0.88 1.42 0.00 0.00 -1.73 0.00 0.00 68.15 68.72 1r3n h THR 42 CO 0.04 0.39 -0.16 1.23 -0.25 0.00 0.00 175.52 176.77 1r3n h GLY 43 N 1.03 -0.46 1.88 5.82 0.00 -1.43 -0.10 103.07 109.80 1r3n h GLY 43 Ca 0.05 0.17 -0.03 0.00 0.00 0.00 0.00 47.33 47.52 1r3n h GLY 43 CO 0.05 -0.17 -0.06 0.23 0.00 0.00 0.00 176.54 176.60 1r3n h SER 44 N -0.66 0.14 0.10 0.19 0.87 -1.40 -0.07 113.55 112.72 1r3n h SER 44 Ca -0.04 -0.02 -0.19 0.00 -1.23 0.00 0.00 61.79 60.31 1r3n h SER 44 Cb 0.47 -0.04 0.02 0.00 -0.44 0.00 0.00 62.40 62.41 1r3n h SER 44 CO 0.07 0.22 -0.81 -0.61 -0.53 0.00 0.00 176.83 175.18 1r3n h GLN 45 N 0.15 0.36 -2.41 2.24 4.15 -1.35 -3.37 115.11 114.89 1r3n h GLN 45 Ca 0.04 -0.53 -0.60 0.00 0.77 0.00 0.00 58.65 58.32 1r3n h GLN 45 Cb 0.20 0.18 -0.42 0.00 0.21 0.00 0.00 27.48 27.66 1r3n h GLN 45 CO 0.01 1.22 -0.59 1.19 -1.93 0.00 0.00 178.83 178.73 1r3n n PHE 46 N -4.12 3.52 0.00 3.99 3.01 -0.06 -4.79 117.46 119.01 1r3n n PHE 46 Ca -0.13 -4.19 0.00 0.00 1.01 0.00 0.00 57.45 54.14 1r3n n PHE 46 Cb 0.80 -0.57 0.00 0.00 -0.01 0.00 0.00 39.48 39.70 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 1.13 1.28 3.69 1.37 0.00 -1.21 -4.77 105.19 106.67 1r3n n GLY 47 Ca 0.27 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.87 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 -1.70 1.70 0.30 -0.02 0.00 -0.05 0.00 107.32 107.55 1r3n s GLY 48 Ca 0.00 1.02 0.03 0.00 0.00 0.00 0.00 44.72 45.77 1r3n s GLY 48 CO 0.00 2.71 0.17 -1.34 0.00 0.00 0.00 173.10 174.64 1r3n s VAL 49 N 2.64 0.28 -1.48 1.40 -7.23 0.56 -4.92 120.40 111.64 1r3n s VAL 49 Ca 0.69 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.82 1r3n s VAL 49 Cb -0.35 -2.51 0.00 0.00 0.56 0.00 0.00 36.38 34.09 1r3n s VAL 49 CO 0.29 0.00 0.16 0.00 -0.31 0.00 0.00 175.10 175.24 1r3n n ALA 50 N -0.56 -2.08 -1.69 1.32 0.00 -1.26 -1.33 120.51 114.90 1r3n n ALA 50 Ca 0.02 -0.41 -0.44 0.00 0.00 0.00 0.00 53.44 52.61 1r3n n ALA 50 Cb 0.65 -1.15 -0.03 0.00 0.00 0.00 0.00 19.45 18.91 1r3n n ALA 50 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1r3n n ARG 51 N -4.60 2.60 0.00 0.00 0.63 -1.26 -4.08 116.66 109.95 1r3n n ARG 51 Ca -0.30 0.94 0.04 0.00 -0.92 0.00 0.00 57.85 57.61 1r3n n ARG 51 Cb 0.68 -2.79 0.02 0.00 0.45 0.00 0.00 32.46 30.82 1r3n n ARG 51 CO 0.00 0.00 0.00 -2.67 -2.51 0.00 0.00 177.63 172.45 1r3n n TRP 52 N 4.71 0.00 -3.83 -0.14 2.14 0.05 -4.98 117.44 115.39 1r3n n TRP 52 Ca 0.18 0.00 -0.06 0.00 2.07 0.00 0.00 57.50 59.68 1r3n n TRP 52 Cb 0.34 0.00 0.00 0.00 -0.81 0.00 0.00 31.31 30.84 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 -0.81 0.08 0.13 -1.67 0.00 -1.21 -5.05 107.32 98.80 1r3n s GLY 53 Ca 0.08 -0.38 0.26 0.00 0.00 0.00 0.00 44.72 44.68 1r3n s GLY 53 CO 0.13 0.31 1.81 -1.06 0.00 0.00 0.00 173.10 174.29 1r3n n GLN 54 N -0.53 0.16 -2.35 2.90 6.02 -1.26 -4.75 117.38 117.57 1r3n n GLN 54 Ca -0.06 0.16 -0.33 0.00 -0.01 0.00 0.00 57.00 56.76 1r3n n GLN 54 Cb 0.60 -1.70 -0.02 0.00 1.02 0.00 0.00 30.24 30.14 1r3n n GLN 54 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1r3n s GLU 55 N -3.08 3.72 0.56 -1.09 0.41 -1.26 -4.95 118.70 113.01 1r3n s GLU 55 Ca 0.11 1.15 0.36 0.00 -0.41 0.00 0.00 54.97 56.18 1r3n s GLU 55 Cb 0.14 -2.09 1.70 0.00 -1.78 0.00 0.00 34.13 32.09 1r3n s GLU 55 CO 0.55 -0.47 2.08 0.66 -0.49 0.00 0.00 175.26 177.59 1r3n h SER 56 N 0.99 0.00 -0.28 -0.19 4.64 -2.03 -2.09 113.55 114.59 1r3n h SER 56 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1r3n h SER 56 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1r3n h SER 56 CO 0.59 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.55 1r3n n HIS 57 N -2.98 0.35 -2.10 4.77 1.44 -1.26 -4.79 115.22 110.65 1r3n n HIS 57 Ca -0.01 -0.21 -0.38 0.00 -2.01 0.00 0.00 57.72 55.11 1r3n n HIS 57 Cb 0.21 -0.00 -0.00 0.00 0.12 0.00 0.00 29.99 30.31 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 1.21 4.34 -4.09 -1.40 1.02 -0.79 -4.88 120.64 116.06 1r3n n GLU 58 Ca 0.16 -3.65 -0.10 0.00 -0.02 0.00 0.00 57.16 53.54 1r3n n GLU 58 Cb 0.53 -2.47 -0.07 0.00 -0.02 0.00 0.00 31.44 29.40 1r3n n GLU 58 CO 0.00 0.00 0.00 -0.59 1.18 0.00 0.00 177.13 177.72 1r3n s PHE 59 N -2.44 0.72 0.39 -0.32 -0.12 -1.26 -0.77 117.98 114.18 1r3n s PHE 59 Ca 0.50 -1.02 0.01 0.00 -0.05 0.00 0.00 56.93 56.37 1r3n s PHE 59 Cb 0.24 -0.15 0.01 0.00 -0.63 0.00 0.00 43.02 42.49 1r3n s PHE 59 CO -0.16 -0.83 0.06 0.41 -0.05 0.00 0.00 175.22 174.65 1r3n n GLY 60 N -0.33 3.56 3.27 1.99 0.00 -0.44 -4.77 105.19 108.47 1r3n n GLY 60 Ca -0.00 -2.32 -0.26 0.00 0.00 0.00 0.00 46.02 43.44 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 -3.46 1.37 -0.31 1.61 -1.94 -0.24 -0.32 119.30 116.01 1r3n s MET 61 Ca 0.04 -1.01 -0.01 0.00 -1.71 0.00 0.00 55.69 53.00 1r3n s MET 61 Cb -0.00 -1.53 0.13 0.00 2.01 0.00 0.00 34.83 35.44 1r3n s MET 61 CO 0.03 0.38 0.25 0.50 -0.01 0.00 0.00 175.02 176.17 1r3n s ARG 62 N -1.36 0.38 -0.45 2.03 3.52 0.10 -1.50 118.95 121.67 1r3n s ARG 62 Ca 0.08 -0.55 0.03 0.00 -0.13 0.00 0.00 55.73 55.16 1r3n s ARG 62 Cb -0.09 -0.89 0.16 0.00 -1.56 0.00 0.00 34.95 32.57 1r3n s ARG 62 CO 0.02 -1.08 0.33 0.50 -0.81 0.00 0.00 175.30 174.26 1r3n s ARG 63 N 1.94 1.14 0.45 5.12 3.52 -1.26 -4.59 118.95 125.27 1r3n s ARG 63 Ca 0.12 -2.15 -0.22 0.00 -0.13 0.00 0.00 55.73 53.35 1r3n s ARG 63 Cb -0.16 -1.84 -0.09 0.00 -1.56 0.00 0.00 34.95 31.30 1r3n s ARG 63 CO -0.24 -1.31 1.04 -0.51 -0.81 0.00 0.00 175.30 173.48 1r3n s LEU 64 N 0.05 3.96 0.24 -0.88 1.43 -1.26 -0.09 118.68 122.12 1r3n s LEU 64 Ca 0.27 1.96 -0.31 0.00 -1.03 0.00 0.00 54.13 55.02 1r3n s LEU 64 Cb -0.06 -4.42 -0.13 0.00 0.03 0.00 0.00 46.19 41.61 1r3n s LEU 64 CO -0.13 -0.67 1.54 0.00 0.23 0.00 0.00 176.35 177.32 1r3n n ALA 65 N -0.63 1.82 -1.00 4.21 0.00 -1.26 -2.62 120.51 121.03 1r3n n ALA 65 Ca 0.08 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.92 1r3n n ALA 65 Cb 0.51 -2.38 0.00 0.00 0.00 0.00 0.00 19.45 17.59 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 2.61 0.24 3.93 0.00 0.00 -1.26 -4.95 105.19 105.76 1r3n n GLY 66 Ca 0.12 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.87 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 -1.49 2.11 0.28 2.61 -4.23 -1.08 -4.61 115.64 109.22 1r3n s THR 67 Ca 0.00 -0.14 0.01 0.00 -1.18 0.00 0.00 61.69 60.38 1r3n s THR 67 Cb 0.00 -2.97 0.26 0.00 1.34 0.00 0.00 72.50 71.14 1r3n s THR 67 CO 0.00 0.00 1.78 0.00 -0.54 0.00 0.00 174.62 175.86 1r3n h ALA 68 N -0.98 1.43 0.00 3.99 0.00 -1.95 -1.99 119.26 119.76 1r3n h ALA 68 Ca -0.44 0.07 -0.17 0.00 0.00 0.00 0.00 54.91 54.36 1r3n h ALA 68 Cb 1.30 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 1r3n h ALA 68 CO 0.56 0.00 -0.82 -0.07 0.00 0.00 0.00 179.25 178.92 1r3n h LEU 69 N 0.75 0.04 -0.21 0.00 4.07 -1.93 -2.28 115.31 115.75 1r3n h LEU 69 Ca 0.50 -0.03 0.01 0.00 0.08 0.00 0.00 57.88 58.43 1r3n h LEU 69 Cb 0.66 -0.01 -0.01 0.00 1.08 0.00 0.00 40.66 42.38 1r3n h LEU 69 CO -0.34 0.84 0.12 -0.78 -1.08 0.00 0.00 178.44 177.20 1r3n h ASP 70 N 0.02 0.20 -0.81 -0.43 3.58 -1.58 -1.87 116.42 115.53 1r3n h ASP 70 Ca -0.01 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.41 1r3n h ASP 70 Cb 1.44 -0.04 -0.04 0.00 1.72 0.00 0.00 39.33 42.41 1r3n h ASP 70 CO 0.11 0.15 0.41 1.23 -2.88 0.00 0.00 179.24 178.26 1r3n h GLY 71 N 0.25 1.24 1.03 -0.78 0.00 -1.38 -1.80 103.07 101.64 1r3n h GLY 71 Ca 0.08 -0.59 -0.09 0.00 0.00 0.00 0.00 47.33 46.73 1r3n h GLY 71 CO -0.04 0.56 -0.05 0.00 0.00 0.00 0.00 176.54 177.01 1r3n h ALA 72 N 1.30 0.68 -0.58 3.60 0.00 -1.19 0.56 119.26 123.63 1r3n h ALA 72 Ca 0.28 -0.31 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 1r3n h ALA 72 Cb 0.08 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1r3n h ALA 72 CO -0.04 0.54 0.03 1.98 0.00 0.00 0.00 179.25 181.76 1r3n h MET 73 N 0.78 1.01 -0.86 0.00 -1.53 -1.28 -1.68 114.93 111.37 1r3n h MET 73 Ca 0.14 -0.31 -0.03 0.00 -3.44 0.00 0.00 59.70 56.06 1r3n h MET 73 Cb 0.59 -0.10 -0.04 0.00 -0.55 0.00 0.00 31.60 31.50 1r3n h MET 73 CO 0.04 0.99 0.42 0.00 0.14 0.00 0.00 176.91 178.49 1r3n h ARG 74 N 0.90 1.23 -0.36 0.39 3.08 -1.09 0.21 114.38 118.74 1r3n h ARG 74 Ca 0.17 -0.18 -0.02 0.00 0.07 0.00 0.00 59.98 60.02 1r3n h ARG 74 Cb 0.51 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.32 1r3n h ARG 74 CO 0.02 0.94 0.15 -0.44 -1.07 0.00 0.00 179.97 179.58 1r3n h ASP 75 N 1.22 0.49 -0.68 7.04 3.32 -0.70 -0.43 116.42 126.69 1r3n h ASP 75 Ca 0.30 -0.15 0.04 0.00 0.02 0.00 0.00 57.03 57.23 1r3n h ASP 75 Cb 0.11 -0.13 -0.05 0.00 0.22 0.00 0.00 39.33 39.49 1r3n h ASP 75 CO -0.04 0.51 0.41 -0.25 -1.72 0.00 0.00 179.24 178.16 1r3n h TRP 76 N 0.44 0.77 -0.36 4.55 7.01 -0.94 -2.05 115.95 125.38 1r3n h TRP 76 Ca 0.12 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.12 1r3n h TRP 76 Cb 0.17 -0.25 -0.02 0.00 -2.10 0.00 0.00 29.16 26.96 1r3n h TRP 76 CO -0.01 0.43 0.13 0.35 -2.79 0.00 0.00 178.44 176.55 1r3n h PHE 77 N 0.80 0.56 -0.62 2.65 3.57 -0.59 -2.02 116.94 121.29 1r3n h PHE 77 Ca 0.28 -0.05 0.02 0.00 3.53 0.00 0.00 57.97 61.74 1r3n h PHE 77 Cb 0.05 -0.16 -0.03 0.00 2.79 0.00 0.00 35.95 38.60 1r3n h PHE 77 CO -0.05 0.53 0.40 1.15 -2.23 0.00 0.00 178.31 178.10 1r3n h THR 78 N 0.43 1.12 0.00 4.41 2.02 -0.92 -2.23 112.91 117.74 1r3n h THR 78 Ca 0.12 -0.27 -0.06 0.00 0.77 0.00 0.00 66.41 66.96 1r3n h THR 78 Cb 0.22 0.26 -0.01 0.00 -1.74 0.00 0.00 68.15 66.88 1r3n h THR 78 CO -0.01 0.15 -0.30 -1.13 0.37 0.00 0.00 175.52 174.60 1r3n h ASN 79 N 0.80 0.00 0.04 4.18 -0.73 -1.17 -1.07 115.58 117.63 1r3n h ASN 79 Ca 0.23 0.00 -0.00 0.00 1.87 0.00 0.00 56.30 58.40 1r3n h ASN 79 Cb -0.05 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.54 1r3n h ASN 79 CO -0.07 0.30 -0.02 -0.33 -0.37 0.00 0.00 177.43 176.94 1r3n h GLU 80 N 0.00 -0.05 -0.65 6.67 4.39 -1.03 -2.83 114.58 121.07 1r3n h GLU 80 Ca -0.00 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 59.62 1r3n h GLU 80 Cb 0.54 0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 29.17 1r3n h GLU 80 CO 0.04 0.33 0.07 0.00 -1.16 0.00 0.00 179.01 178.30 1r3n h GLU 82 N 1.02 0.90 0.00 0.00 5.08 -1.28 -1.60 114.58 118.70 1r3n h GLU 82 Ca 0.19 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1r3n h GLU 82 Cb 0.48 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.60 1r3n h GLU 82 CO 0.02 0.80 0.00 0.66 -1.00 0.00 0.00 179.01 179.49 1r3n h SER 83 N 0.87 0.00 0.42 1.42 4.64 -1.22 -1.67 113.55 118.01 1r3n h SER 83 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 1r3n h SER 83 Cb 0.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 1r3n h SER 83 CO -0.00 0.00 -1.07 0.18 -0.87 0.00 0.00 176.83 175.07 1r3n n LEU 84 N -2.60 0.60 0.00 5.97 4.77 -0.68 -4.97 117.00 120.09 1r3n n LEU 84 Ca -0.00 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 1r3n n LEU 84 Cb 0.15 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 1r3n n LEU 84 CO 0.18 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 176.89 1r3n n GLY 85 N 1.36 1.25 3.81 -0.72 0.00 -0.63 -5.02 105.19 105.24 1r3n n GLY 85 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 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 -3.54 4.13 -0.55 0.00 2.20 -0.88 -4.42 119.74 116.69 1r3n s LYS 87 Ca 0.65 0.11 -0.14 0.00 -0.36 0.00 0.00 55.97 56.23 1r3n s LYS 87 Cb -0.14 -3.56 0.14 0.00 -1.51 0.00 0.00 37.83 32.75 1r3n s LYS 87 CO 0.25 -0.07 0.48 0.08 -0.36 0.00 0.00 175.35 175.73 1r3n s VAL 88 N 1.40 4.93 0.15 4.02 1.01 -1.26 -0.38 120.40 130.28 1r3n s VAL 88 Ca 0.17 -1.69 -0.27 0.00 0.00 0.00 0.00 61.98 60.19 1r3n s VAL 88 Cb -0.15 -4.17 -0.07 0.00 0.00 0.00 0.00 36.38 31.98 1r3n s VAL 88 CO 0.08 -0.86 0.83 -0.54 0.00 0.00 0.00 175.10 174.61 1r3n s LYS 89 N 1.38 4.63 -0.12 2.72 1.02 0.08 -4.89 119.74 124.55 1r3n s LYS 89 Ca 0.05 1.24 0.02 0.00 0.02 0.00 0.00 55.97 57.31 1r3n s LYS 89 Cb -0.27 -3.30 -0.00 0.00 -0.52 0.00 0.00 37.83 33.74 1r3n s LYS 89 CO 0.01 0.45 -0.20 0.08 -0.92 0.00 0.00 175.35 174.77 1r3n s VAL 90 N -0.77 2.39 0.68 3.17 1.01 -1.26 -0.25 120.40 125.37 1r3n s VAL 90 Ca 0.39 -0.89 0.00 0.00 0.00 0.00 0.00 61.98 61.48 1r3n s VAL 90 Cb -0.23 -1.96 0.11 0.00 0.00 0.00 0.00 36.38 34.30 1r3n s VAL 90 CO 0.27 0.54 0.94 1.51 0.00 0.00 0.00 175.10 178.37 1r3n s ASP 91 N 0.46 4.55 0.57 3.32 1.47 -0.36 -1.66 116.67 125.03 1r3n s ASP 91 Ca -0.14 -0.35 0.27 0.00 1.18 0.00 0.00 52.55 53.51 1r3n s ASP 91 Cb -0.17 -0.12 1.57 0.00 -0.34 0.00 0.00 42.92 43.86 1r3n s ASP 91 CO 0.06 -1.71 2.07 0.11 0.68 0.00 0.00 175.17 176.38 1r3n h LYS 92 N -0.38 0.00 -0.29 2.11 1.57 -1.41 -1.53 116.57 116.65 1r3n h LYS 92 Ca -0.37 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.41 1r3n h LYS 92 Cb 1.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.58 1r3n h LYS 92 CO 0.42 0.00 0.00 1.51 -0.57 0.00 0.00 179.45 180.81 1r3n n ILE 93 N -3.95 0.53 -0.20 1.86 0.00 -1.26 -4.33 119.36 112.00 1r3n n ILE 93 Ca 0.03 -0.76 0.00 0.00 0.00 0.00 0.00 62.75 62.02 1r3n n ILE 93 Cb 0.38 0.90 0.00 0.00 0.00 0.00 0.00 39.64 40.92 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 1.01 0.82 3.75 4.50 0.00 -0.64 -4.76 105.19 109.87 1r3n n GLY 94 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.27 6.87 -0.08 1.61 0.01 -1.26 -4.39 114.94 115.44 1r3n s ASN 95 Ca 0.00 2.49 0.00 0.00 -0.71 0.00 0.00 52.86 54.64 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 -0.52 -0.07 -0.04 -1.51 0.00 0.00 177.10 174.96 1r3n s MET 96 N -0.65 2.85 -0.26 -0.60 -1.94 -0.33 -1.22 119.30 117.15 1r3n s MET 96 Ca 0.54 -0.56 -0.01 0.00 -1.71 0.00 0.00 55.69 53.96 1r3n s MET 96 Cb -0.37 -2.61 0.08 0.00 2.01 0.00 0.00 34.83 33.93 1r3n s MET 96 CO 0.42 0.61 0.03 -0.06 -0.01 0.00 0.00 175.02 176.02 1r3n s PHE 97 N -0.65 1.83 -0.69 -0.03 0.40 0.66 -1.16 117.98 118.33 1r3n s PHE 97 Ca 0.10 -1.56 -0.19 0.00 -0.60 0.00 0.00 56.93 54.67 1r3n s PHE 97 Cb -0.11 -1.55 0.12 0.00 0.51 0.00 0.00 43.02 41.98 1r3n s PHE 97 CO 0.02 -0.78 0.83 0.00 0.70 0.00 0.00 175.22 176.00 1r3n s ALA 98 N 1.58 3.43 -0.32 5.36 0.00 0.21 -0.74 121.76 131.28 1r3n s ALA 98 Ca 0.02 -2.39 -0.20 0.00 0.00 0.00 0.00 51.96 49.39 1r3n s ALA 98 Cb -0.18 -3.68 -0.01 0.00 0.00 0.00 0.00 23.12 19.26 1r3n s ALA 98 CO -0.14 -2.53 0.63 0.08 0.00 0.00 0.00 175.76 173.80 1r3n s VAL 99 N 2.64 4.92 -0.21 0.00 1.01 0.49 -1.92 120.40 127.32 1r3n s VAL 99 Ca 0.18 0.79 -0.14 0.00 0.00 0.00 0.00 61.98 62.81 1r3n s VAL 99 Cb -0.18 -4.02 -0.04 0.00 0.00 0.00 0.00 36.38 32.13 1r3n s VAL 99 CO 0.02 -0.19 0.30 -0.47 0.00 0.00 0.00 175.10 174.76 1r3n s TYR 100 N 2.64 3.36 0.05 5.22 5.04 0.22 -2.06 117.35 131.82 1r3n s TYR 100 Ca 0.25 0.47 -0.30 0.00 -2.44 0.00 0.00 57.07 55.05 1r3n s TYR 100 Cb -0.15 -2.42 -0.08 0.00 0.35 0.00 0.00 41.96 39.66 1r3n s TYR 100 CO 0.13 0.04 1.67 -1.25 -1.34 0.00 0.00 175.55 174.79 1r3n s PRO 101 N 1.16 4.19 0.00 4.97 0.04 -1.26 -1.66 135.00 142.44 1r3n s PRO 101 Ca 0.15 2.32 0.00 0.00 0.04 0.00 0.00 61.00 63.51 1r3n s PRO 101 Cb -0.14 -3.68 0.00 0.00 0.04 0.00 0.00 34.50 30.72 1r3n s PRO 101 CO 0.06 -0.76 0.00 0.41 0.04 0.00 0.00 177.00 176.75 1r3n n GLY 102 N 4.04 0.74 0.14 0.56 0.00 -1.26 -4.65 105.19 104.76 1r3n n GLY 102 Ca 0.16 -1.93 -0.23 0.00 0.00 0.00 0.00 46.02 44.02 1r3n n GLY 102 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1r3n h LYS 103 N 0.00 0.47 0.00 1.61 1.57 -0.73 -3.43 116.57 116.06 1r3n h LYS 103 Ca 0.00 -0.80 -0.38 0.00 -1.87 0.00 0.00 60.65 57.59 1r3n h LYS 103 Cb 0.00 0.30 -0.06 0.00 0.08 0.00 0.00 32.23 32.55 1r3n h LYS 103 CO 0.00 1.38 -2.31 0.09 -0.57 0.00 0.00 179.45 178.04 1r3n n ASN 104 N -3.66 1.80 0.00 0.86 3.02 -0.10 -5.01 115.26 112.18 1r3n n ASN 104 Ca -0.18 0.20 0.00 0.00 -0.03 0.00 0.00 54.58 54.57 1r3n n ASN 104 Cb 1.09 -0.62 0.00 0.00 -0.61 0.00 0.00 39.78 39.64 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 1.72 0.79 7.00 7.41 0.00 -1.26 -5.03 105.19 115.82 1r3n n GLY 105 Ca -0.45 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 44.89 1r3n n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r3n n GLY 106 N 0.00 0.07 3.75 -0.02 0.00 -1.26 -3.32 105.19 104.41 1r3n n GLY 106 Ca 0.00 -0.28 -0.41 0.00 0.00 0.00 0.00 46.02 45.33 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 4.28 0.52 1.61 1.02 -1.26 -4.74 119.74 121.17 1r3n s LYS 107 Ca 0.00 2.30 -0.21 0.00 0.02 0.00 0.00 55.97 58.08 1r3n s LYS 107 Cb 0.00 -3.09 -0.06 0.00 -0.52 0.00 0.00 37.83 34.16 1r3n s LYS 107 CO 0.00 -0.38 1.17 -1.25 -0.92 0.00 0.00 175.35 173.97 1r3n s PRO 108 N -0.81 3.41 -0.23 -1.68 0.04 -1.26 -4.34 135.00 130.13 1r3n s PRO 108 Ca 0.56 1.74 -0.29 0.00 0.04 0.00 0.00 61.00 63.06 1r3n s PRO 108 Cb -0.42 -2.14 0.00 0.00 0.04 0.00 0.00 34.50 31.98 1r3n s PRO 108 CO 0.47 -0.83 1.14 0.99 0.04 0.00 0.00 177.00 178.81 1r3n s THR 109 N -1.63 4.47 -0.00 1.26 2.01 0.25 -0.37 115.64 121.62 1r3n s THR 109 Ca 0.70 1.75 -0.06 0.00 0.31 0.00 0.00 61.69 64.39 1r3n s THR 109 Cb -0.28 -4.21 -0.05 0.00 0.01 0.00 0.00 72.50 67.97 1r3n s THR 109 CO 0.32 -0.25 0.25 0.00 -0.69 0.00 0.00 174.62 174.24 1r3n s ALA 110 N 3.51 3.87 -0.01 7.40 0.00 -0.32 -0.90 121.76 135.30 1r3n s ALA 110 Ca 0.49 -0.61 0.03 0.00 0.00 0.00 0.00 51.96 51.88 1r3n s ALA 110 Cb -0.17 -2.03 -0.01 0.00 0.00 0.00 0.00 23.12 20.91 1r3n s ALA 110 CO 0.12 0.66 -0.11 -0.08 0.00 0.00 0.00 175.76 176.35 1r3n s THR 111 N -1.28 0.90 0.05 0.00 -1.32 0.43 -1.23 115.64 113.18 1r3n s THR 111 Ca 0.27 -0.48 -0.28 0.00 -1.21 0.00 0.00 61.69 59.99 1r3n s THR 111 Cb -0.13 -0.76 0.10 0.00 -1.51 0.00 0.00 72.50 70.20 1r3n s THR 111 CO 0.16 0.26 1.18 -0.83 -2.21 0.00 0.00 174.62 173.18 1r3n s GLY 112 N -0.19 -0.28 0.00 6.08 0.00 -0.84 -0.25 107.32 111.83 1r3n s GLY 112 Ca 0.03 0.37 0.00 0.00 0.00 0.00 0.00 44.72 45.12 1r3n s GLY 112 CO -0.00 0.96 0.00 -1.26 0.00 0.00 0.00 173.10 172.80 1r3n n SER 113 N -0.63 2.05 -4.21 1.64 2.88 -0.90 -4.44 113.62 110.01 1r3n n SER 113 Ca -0.06 0.00 -0.21 0.00 -1.33 0.00 0.00 58.87 57.27 1r3n n SER 113 Cb 0.61 0.00 -0.12 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 -0.37 1.45 -0.20 0.66 -3.43 -1.25 -1.09 115.29 111.06 1r3n s HIS 114 Ca 0.00 -0.43 0.22 0.00 -0.80 0.00 0.00 55.06 54.05 1r3n s HIS 114 Cb 0.00 -0.82 -0.27 0.00 -1.43 0.00 0.00 32.58 30.07 1r3n s HIS 114 CO 0.00 0.11 0.62 1.28 -2.00 0.00 0.00 174.74 174.75 1r3n n LEU 115 N 1.33 0.24 -4.85 5.38 4.77 -1.26 -2.52 117.00 120.09 1r3n n LEU 115 Ca -0.20 -0.03 -0.32 0.00 -0.03 0.00 0.00 56.01 55.44 1r3n n LEU 115 Cb 0.54 -0.01 -0.04 0.00 -2.33 0.00 0.00 43.42 41.58 1r3n n LEU 115 CO 0.22 0.01 0.60 1.51 -1.33 0.00 0.00 177.39 178.40 1r3n s ASP 116 N -4.39 6.64 0.44 -1.43 -4.77 -1.26 -4.85 116.67 107.04 1r3n s ASP 116 Ca -0.05 1.45 0.04 0.00 -3.30 0.00 0.00 52.55 50.70 1r3n s ASP 116 Cb 0.14 -2.46 -0.04 0.00 -1.09 0.00 0.00 42.92 39.47 1r3n s ASP 116 CO 0.89 -0.49 0.03 0.42 0.70 0.00 0.00 175.17 176.71 1r3n s THR 117 N -2.48 1.35 0.85 2.11 -4.23 0.87 -4.76 115.64 109.35 1r3n s THR 117 Ca 0.57 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 58.96 1r3n s THR 117 Cb -0.10 -2.55 0.10 0.00 1.34 0.00 0.00 72.50 71.30 1r3n s THR 117 CO 0.29 0.00 1.10 -1.10 -0.54 0.00 0.00 174.62 174.36 1r3n s GLN 118 N -3.80 1.64 0.26 3.99 -1.52 -1.26 -4.52 119.66 114.45 1r3n s GLN 118 Ca 0.22 0.73 -0.04 0.00 -1.95 0.00 0.00 55.36 54.32 1r3n s GLN 118 Cb 0.05 -1.86 0.32 0.00 -0.22 0.00 0.00 33.01 31.30 1r3n s GLN 118 CO 0.11 -1.96 1.89 -1.00 -0.25 0.00 0.00 175.29 174.08 1r3n h PRO 119 N -1.34 1.14 -4.66 2.91 0.13 -1.96 -3.33 132.00 124.90 1r3n h PRO 119 Ca -0.48 -0.13 -0.68 0.00 -0.87 0.00 0.00 66.00 63.84 1r3n h PRO 119 Cb 1.28 -0.23 -0.36 0.00 0.13 0.00 0.00 31.00 31.82 1r3n h PRO 119 CO 0.57 0.83 -0.66 -1.21 -0.23 0.00 0.00 178.00 177.29 1r3n s GLU 120 N -5.77 1.98 0.34 0.86 2.02 -1.26 -4.62 118.70 112.25 1r3n s GLU 120 Ca -0.12 -1.65 0.04 0.00 0.02 0.00 0.00 54.97 53.26 1r3n s GLU 120 Cb 0.17 -3.30 -0.07 0.00 0.10 0.00 0.00 34.13 31.03 1r3n s GLU 120 CO 0.81 -0.87 0.05 0.00 0.02 0.00 0.00 175.26 175.28 1r3n s ALA 121 N 1.09 2.51 0.44 5.21 0.00 -0.56 -3.13 121.76 127.32 1r3n s ALA 121 Ca 0.04 -2.08 0.08 0.00 0.00 0.00 0.00 51.96 50.00 1r3n s ALA 121 Cb -0.21 0.58 0.02 0.00 0.00 0.00 0.00 23.12 23.51 1r3n s ALA 121 CO -0.05 -0.28 0.58 0.20 0.00 0.00 0.00 175.76 176.22 1r3n s GLY 122 N -3.53 1.94 0.05 0.00 0.00 -1.00 -1.08 107.32 103.71 1r3n s GLY 122 Ca 0.36 -1.74 0.28 0.00 0.00 0.00 0.00 44.72 43.62 1r3n s GLY 122 CO 0.16 -1.53 1.82 0.28 0.00 0.00 0.00 173.10 173.82 1r3n n LYS 123 N -1.87 0.07 -0.05 2.90 5.02 -1.26 -4.31 118.16 118.65 1r3n n LYS 123 Ca 0.08 0.05 -0.06 0.00 -2.02 0.00 0.00 58.31 56.37 1r3n n LYS 123 Cb 0.60 -1.57 -0.07 0.00 -0.02 0.00 0.00 35.03 33.96 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 -1.68 0.00 -1.89 2.13 4.02 -1.26 -4.65 117.16 113.82 1r3n n TYR 124 Ca 0.06 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.53 1r3n n TYR 124 Cb 0.36 -0.48 -0.03 0.00 -0.02 0.00 0.00 39.34 39.17 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 -4.40 6.55 0.00 7.72 3.68 -1.26 -1.56 116.67 127.39 1r3n s ASP 125 Ca -0.07 2.66 0.00 0.00 2.13 0.00 0.00 52.55 57.26 1r3n s ASP 125 Cb 0.03 -2.59 0.00 0.00 -1.45 0.00 0.00 42.92 38.91 1r3n s ASP 125 CO 0.37 -0.86 0.00 0.61 0.13 0.00 0.00 175.17 175.43 1r3n n GLY 126 N 3.81 0.79 0.28 2.66 0.00 -1.26 -4.54 105.19 106.94 1r3n n GLY 126 Ca 0.14 -0.01 0.07 0.00 0.00 0.00 0.00 46.02 46.23 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 0.60 -0.26 -0.61 2.04 -1.48 -2.23 117.51 115.57 1r3n h ILE 127 Ca 0.00 -0.14 0.06 0.00 1.00 0.00 0.00 64.86 65.78 1r3n h ILE 127 Cb 0.00 0.15 -0.08 0.00 -0.74 0.00 0.00 36.82 36.15 1r3n h ILE 127 CO 0.00 0.07 -0.36 0.25 0.00 0.00 0.00 178.15 178.12 1r3n h LEU 128 N 0.41 -1.15 -0.96 1.44 6.46 -1.52 -0.01 115.31 119.97 1r3n h LEU 128 Ca 0.44 0.18 -0.03 0.00 -0.12 0.00 0.00 57.88 58.35 1r3n h LEU 128 Cb 0.73 0.50 -0.04 0.00 -0.73 0.00 0.00 40.66 41.12 1r3n h LEU 128 CO -0.45 -0.36 0.38 1.23 -0.62 0.00 0.00 178.44 178.62 1r3n h GLY 129 N -0.36 1.20 0.44 3.75 0.00 -1.16 0.50 103.07 107.45 1r3n h GLY 129 Ca 0.12 -0.58 -0.00 0.00 0.00 0.00 0.00 47.33 46.86 1r3n h GLY 129 CO -0.45 0.56 -0.04 -2.08 0.00 0.00 0.00 176.54 174.52 1r3n h VAL 130 N 1.12 1.16 0.00 4.60 2.07 -1.21 -1.72 116.25 122.26 1r3n h VAL 130 Ca 0.27 -1.17 -0.06 0.00 0.82 0.00 0.00 66.70 66.56 1r3n h VAL 130 Cb 0.10 1.88 -0.01 0.00 -1.52 0.00 0.00 31.29 31.75 1r3n h VAL 130 CO -0.04 0.27 -0.29 -0.07 0.02 0.00 0.00 177.57 177.47 1r3n h LEU 131 N -0.68 0.00 -0.64 2.57 3.38 -0.99 -1.45 115.31 117.51 1r3n h LEU 131 Ca -0.01 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.84 1r3n h LEU 131 Cb 0.54 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 1r3n h LEU 131 CO 0.02 0.29 -0.18 0.00 0.09 0.00 0.00 178.44 178.66 1r3n h ALA 132 N 1.71 0.83 -0.58 1.53 0.00 -0.92 -0.23 119.26 121.59 1r3n h ALA 132 Ca -0.00 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1r3n h ALA 132 Cb 0.62 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 1r3n h ALA 132 CO 0.04 0.65 0.37 0.78 0.00 0.00 0.00 179.25 181.09 1r3n h GLY 133 N 0.94 0.84 0.97 0.00 0.00 -0.45 -1.29 103.07 104.08 1r3n h GLY 133 Ca 0.11 -0.33 0.01 0.00 0.00 0.00 0.00 47.33 47.12 1r3n h GLY 133 CO 0.05 0.32 0.39 -2.00 0.00 0.00 0.00 176.54 175.30 1r3n h LEU 134 N 0.79 0.66 -1.43 3.11 6.46 -1.09 -2.53 115.31 121.29 1r3n h LEU 134 Ca 0.21 -0.01 -0.06 0.00 -0.12 0.00 0.00 57.88 57.90 1r3n h LEU 134 Cb -0.06 -0.16 -0.01 0.00 -0.73 0.00 0.00 40.66 39.70 1r3n h LEU 134 CO -0.04 0.48 -0.29 -0.33 -0.62 0.00 0.00 178.44 177.64 1r3n h GLU 135 N 0.79 0.00 -0.82 1.25 4.39 -0.64 0.83 114.58 120.38 1r3n h GLU 135 Ca 0.22 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.90 1r3n h GLU 135 Cb -0.07 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.55 1r3n h GLU 135 CO -0.06 0.29 0.43 0.28 -1.16 0.00 0.00 179.01 178.79 1r3n h VAL 136 N 0.00 1.25 -0.24 3.13 2.07 -0.84 0.19 116.25 121.81 1r3n h VAL 136 Ca -0.00 -0.64 -0.18 0.00 0.82 0.00 0.00 66.70 66.70 1r3n h VAL 136 Cb 0.54 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.48 1r3n h VAL 136 CO 0.04 0.28 -0.54 -0.07 0.02 0.00 0.00 177.57 177.31 1r3n h LEU 137 N 1.15 0.89 -0.99 2.57 3.38 -1.01 -1.86 115.31 119.44 1r3n h LEU 137 Ca 0.29 -0.55 0.01 0.00 0.09 0.00 0.00 57.88 57.72 1r3n h LEU 137 Cb 0.06 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.51 1r3n h LEU 137 CO -0.04 1.28 0.66 0.03 0.09 0.00 0.00 178.44 180.46 1r3n h ARG 138 N 0.54 1.29 -0.05 1.13 3.08 -0.61 -2.03 114.38 117.73 1r3n h ARG 138 Ca 0.00 -0.08 -0.21 0.00 0.07 0.00 0.00 59.98 59.77 1r3n h ARG 138 Cb 1.15 -0.29 0.00 0.00 0.08 0.00 0.00 29.97 30.91 1r3n h ARG 138 CO 0.12 0.86 -0.83 1.79 -1.07 0.00 0.00 179.97 180.84 1r3n h THR 139 N 1.33 1.37 -0.63 2.04 1.35 -0.93 -1.49 112.91 115.95 1r3n h THR 139 Ca 0.37 -2.24 0.07 0.00 -0.55 0.00 0.00 66.41 64.06 1r3n h THR 139 Cb -0.13 2.22 -0.06 0.00 -1.73 0.00 0.00 68.15 68.45 1r3n h THR 139 CO -0.09 0.68 0.31 -0.26 -0.25 0.00 0.00 175.52 175.91 1r3n h PHE 140 N 0.29 0.56 -0.03 4.73 0.05 -1.06 -0.00 116.94 121.48 1r3n h PHE 140 Ca -0.05 0.03 -0.00 0.00 3.82 0.00 0.00 57.97 61.76 1r3n h PHE 140 Cb 1.43 -0.16 -0.00 0.00 2.00 0.00 0.00 35.95 39.23 1r3n h PHE 140 CO 0.06 0.23 0.01 0.87 -0.18 0.00 0.00 178.31 179.30 1r3n h LYS 141 N 0.56 0.05 0.00 1.51 1.79 -1.32 0.30 116.57 119.46 1r3n h LYS 141 Ca 0.30 -0.01 -0.03 0.00 -2.18 0.00 0.00 60.65 58.73 1r3n h LYS 141 Cb 0.27 -0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 30.90 1r3n h LYS 141 CO -0.23 0.22 -0.14 -0.44 -1.08 0.00 0.00 179.45 177.78 1r3n h ASP 142 N -0.13 0.00 -0.28 0.86 3.32 -0.77 -1.76 116.42 117.66 1r3n h ASP 142 Ca 0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1r3n h ASP 142 Cb 0.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.74 1r3n h ASP 142 CO -0.00 0.14 0.00 0.59 -1.72 0.00 0.00 179.24 178.25 1r3n n ASN 143 N -3.79 3.07 -3.23 6.45 3.02 -0.06 -4.97 115.26 115.75 1r3n n ASN 143 Ca -0.02 -1.90 -0.23 0.00 -0.03 0.00 0.00 54.58 52.41 1r3n n ASN 143 Cb 0.24 -0.18 0.01 0.00 -0.61 0.00 0.00 39.78 39.24 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 1.18 -4.41 -4.64 6.41 3.02 -0.63 -4.94 115.26 111.25 1r3n n ASN 144 Ca 0.15 -0.34 -0.41 0.00 -0.03 0.00 0.00 54.58 53.96 1r3n n ASN 144 Cb 0.52 -3.62 -0.05 0.00 -0.61 0.00 0.00 39.78 36.02 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 -2.99 3.33 -0.28 3.10 5.04 0.97 -5.02 117.35 121.50 1r3n s TYR 145 Ca 0.36 1.02 -0.08 0.00 -2.44 0.00 0.00 57.07 55.93 1r3n s TYR 145 Cb -0.18 -2.94 -0.01 0.00 0.35 0.00 0.00 41.96 39.17 1r3n s TYR 145 CO 0.44 -0.32 0.11 0.08 -1.34 0.00 0.00 175.55 174.51 1r3n s VAL 146 N 2.50 4.39 0.68 3.14 1.01 -1.26 -4.63 120.40 126.23 1r3n s VAL 146 Ca 0.32 -0.35 -0.15 0.00 0.00 0.00 0.00 61.98 61.80 1r3n s VAL 146 Cb -0.16 -3.16 0.01 0.00 0.00 0.00 0.00 36.38 33.08 1r3n s VAL 146 CO 0.09 0.19 1.13 -2.84 0.00 0.00 0.00 175.10 173.66 1r3n s PRO 147 N 1.60 2.60 0.34 2.72 0.02 -1.26 -4.79 135.00 136.24 1r3n s PRO 147 Ca 0.05 1.46 0.07 0.00 0.02 0.00 0.00 61.00 62.61 1r3n s PRO 147 Cb -0.16 -1.92 0.63 0.00 0.02 0.00 0.00 34.50 33.06 1r3n s PRO 147 CO 0.05 -1.42 1.82 -0.91 -0.33 0.00 0.00 177.00 176.21 1r3n h ASN 148 N -0.12 0.28 -4.17 2.53 2.35 -1.95 0.59 115.58 115.10 1r3n h ASN 148 Ca -0.47 -0.08 -0.43 0.00 -0.55 0.00 0.00 56.30 54.77 1r3n h ASN 148 Cb 1.26 -0.07 -0.14 0.00 0.05 0.00 0.00 38.32 39.41 1r3n h ASN 148 CO 0.53 0.51 -0.57 -0.31 -1.65 0.00 0.00 177.43 175.94 1r3n s TYR 149 N -4.53 1.67 0.62 1.19 1.51 -1.26 -0.92 117.35 115.63 1r3n s TYR 149 Ca -0.05 -1.25 -0.19 0.00 -1.01 0.00 0.00 57.07 54.57 1r3n s TYR 149 Cb 0.15 -0.99 -0.02 0.00 -0.11 0.00 0.00 41.96 40.99 1r3n s TYR 149 CO 0.75 -0.36 1.28 -0.25 -1.11 0.00 0.00 175.55 175.87 1r3n n ASP 150 N -0.85 2.13 -4.11 2.29 8.00 -1.21 -4.15 116.55 118.65 1r3n n ASP 150 Ca -0.01 0.87 -0.25 0.00 0.71 0.00 0.00 54.79 56.11 1r3n n ASP 150 Cb 0.65 -1.55 -0.16 0.00 -0.02 0.00 0.00 41.12 40.05 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 -1.37 1.28 0.03 2.53 1.01 -0.67 -0.59 120.40 122.62 1r3n s VAL 151 Ca 0.79 -0.64 0.01 0.00 0.00 0.00 0.00 61.98 62.14 1r3n s VAL 151 Cb -0.39 -1.10 -0.02 0.00 0.00 0.00 0.00 36.38 34.87 1r3n s VAL 151 CO 0.43 0.37 -0.05 0.00 0.00 0.00 0.00 175.10 175.85 1r3n s VAL 153 N -1.22 5.33 -0.11 0.00 1.01 -0.81 -0.43 120.40 124.17 1r3n s VAL 153 Ca -0.11 0.16 -0.02 0.00 0.00 0.00 0.00 61.98 62.01 1r3n s VAL 153 Cb -0.09 -3.43 -0.03 0.00 0.00 0.00 0.00 36.38 32.84 1r3n s VAL 153 CO -0.00 0.45 -0.02 0.68 0.00 0.00 0.00 175.10 176.20 1r3n s VAL 154 N 0.32 4.06 -0.35 2.92 -7.23 0.65 -0.62 120.40 120.15 1r3n s VAL 154 Ca 0.08 -0.32 -0.04 0.00 -1.81 0.00 0.00 61.98 59.88 1r3n s VAL 154 Cb -0.11 -2.73 0.06 0.00 0.56 0.00 0.00 36.38 34.16 1r3n s VAL 154 CO -0.02 0.56 0.11 -0.69 -0.31 0.00 0.00 175.10 174.75 1r3n s VAL 155 N -0.35 3.45 0.12 1.32 1.01 -0.31 -2.12 120.40 123.52 1r3n s VAL 155 Ca 0.06 -1.47 -0.30 0.00 0.00 0.00 0.00 61.98 60.27 1r3n s VAL 155 Cb -0.12 -3.08 -0.06 0.00 0.00 0.00 0.00 36.38 33.12 1r3n s VAL 155 CO 0.02 -0.32 0.99 0.26 0.00 0.00 0.00 175.10 176.06 1r3n s TRP 156 N 1.29 3.76 0.18 5.22 0.52 -0.25 -1.19 118.94 128.48 1r3n s TRP 156 Ca 0.00 1.75 -0.30 0.00 0.02 0.00 0.00 56.10 57.57 1r3n s TRP 156 Cb -0.21 -3.11 -0.08 0.00 -1.15 0.00 0.00 33.47 28.93 1r3n s TRP 156 CO -0.00 0.02 1.10 0.12 0.02 0.00 0.00 176.95 178.21 1r3n s PHE 157 N -0.00 3.59 -1.15 -1.98 5.36 -1.26 -4.36 117.98 118.17 1r3n s PHE 157 Ca 0.48 1.60 -0.22 0.00 -0.96 0.00 0.00 56.93 57.83 1r3n s PHE 157 Cb -0.25 -3.28 -0.00 0.00 -0.34 0.00 0.00 43.02 39.15 1r3n s PHE 157 CO 0.31 -0.61 0.78 -1.71 -1.46 0.00 0.00 175.22 172.53 1r3n n ASN 158 N 2.32 -5.16 -0.06 6.13 5.15 -1.26 -0.44 115.26 121.94 1r3n n ASN 158 Ca 0.03 -1.04 -0.09 0.00 -0.60 0.00 0.00 54.58 52.88 1r3n n ASN 158 Cb 0.46 -3.24 0.07 0.00 -0.53 0.00 0.00 39.78 36.54 1r3n n ASN 158 CO 0.00 0.00 0.00 -0.08 1.40 0.00 0.00 177.26 178.58 1r3n h GLU 159 N -1.96 0.71 -0.00 1.20 4.22 -1.90 -2.07 114.58 114.78 1r3n h GLU 159 Ca -0.67 -0.34 -0.16 0.00 0.08 0.00 0.00 59.36 58.28 1r3n h GLU 159 Cb 1.36 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.59 1r3n h GLU 159 CO 0.49 0.95 -0.75 0.93 -2.18 0.00 0.00 179.01 178.44 1r3n h GLU 160 N 0.59 0.00 -5.17 1.92 4.39 -1.89 -0.23 114.58 114.20 1r3n h GLU 160 Ca 0.06 -0.00 -0.38 0.00 0.34 0.00 0.00 59.36 59.37 1r3n h GLU 160 Cb 0.87 0.00 0.11 0.00 -0.10 0.00 0.00 28.75 29.63 1r3n h GLU 160 CO 0.08 0.76 -0.63 0.41 -1.16 0.00 0.00 179.01 178.47 1r3n n GLY 161 N 0.64 -0.47 0.08 -3.84 0.00 -1.25 -4.68 105.19 95.67 1r3n n GLY 161 Ca -0.01 0.17 -0.08 0.00 0.00 0.00 0.00 46.02 46.11 1r3n n GLY 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r3n h ALA 162 N 0.97 0.05 -0.34 4.61 0.00 -1.89 -3.38 119.26 119.29 1r3n h ALA 162 Ca -0.53 -0.64 -0.13 0.00 0.00 0.00 0.00 54.91 53.62 1r3n h ALA 162 Cb 1.35 0.54 -0.01 0.00 0.00 0.00 0.00 17.79 19.67 1r3n h ALA 162 CO 0.54 0.54 -0.30 -0.09 0.00 0.00 0.00 179.25 179.93 1r3n h ARG 163 N -1.00 0.73 -5.17 0.00 2.43 -1.90 -3.42 114.38 106.04 1r3n h ARG 163 Ca -0.07 -0.33 -0.67 0.00 -0.81 0.00 0.00 59.98 58.10 1r3n h ARG 163 Cb 0.65 -0.02 -0.34 0.00 -0.42 0.00 0.00 29.97 29.85 1r3n h ARG 163 CO -0.04 0.94 -0.87 -0.06 -1.51 0.00 0.00 179.97 178.43 1r3n s PHE 164 N -4.46 2.68 0.00 2.20 0.40 -1.26 -0.42 117.98 117.12 1r3n s PHE 164 Ca -0.09 -1.39 -0.03 0.00 -0.60 0.00 0.00 56.93 54.82 1r3n s PHE 164 Cb 0.13 -1.83 -0.16 0.00 0.51 0.00 0.00 43.02 41.67 1r3n s PHE 164 CO 0.84 -0.64 2.36 0.00 0.70 0.00 0.00 175.22 178.48 1r3n n ALA 165 N 4.15 4.25 -3.46 5.36 0.00 -1.26 -4.28 120.51 125.27 1r3n n ALA 165 Ca -0.20 -1.07 -0.11 0.00 0.00 0.00 0.00 53.44 52.06 1r3n n ALA 165 Cb 0.51 -2.24 -0.10 0.00 0.00 0.00 0.00 19.45 17.62 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 1.71 0.30 0.48 0.00 6.06 -1.26 -5.08 118.95 121.16 1r3n s ARG 166 Ca 0.39 0.60 -0.21 0.00 -2.50 0.00 0.00 55.73 54.01 1r3n s ARG 166 Cb 0.19 -0.40 -0.08 0.00 0.06 0.00 0.00 34.95 34.71 1r3n s ARG 166 CO 0.00 -0.54 1.04 -1.54 -2.50 0.00 0.00 175.30 171.77 1r3n s SER 167 N 2.51 6.37 -1.35 -2.12 1.04 -1.26 -3.85 113.70 115.04 1r3n s SER 167 Ca 0.08 1.94 -0.08 0.00 0.48 0.00 0.00 55.95 58.38 1r3n s SER 167 Cb -0.14 -2.56 0.02 0.00 0.10 0.00 0.00 66.02 63.43 1r3n s SER 167 CO -0.14 -0.76 1.12 0.00 0.98 0.00 0.00 173.24 174.44 1r3n h THR 169 N -2.49 1.10 0.02 0.00 2.02 -1.48 -0.01 112.91 112.07 1r3n h THR 169 Ca -0.58 -0.25 -0.00 0.00 0.77 0.00 0.00 66.41 66.35 1r3n h THR 169 Cb 1.36 0.83 0.00 0.00 -1.74 0.00 0.00 68.15 68.61 1r3n h THR 169 CO 0.56 0.10 -0.01 1.23 0.37 0.00 0.00 175.52 177.77 1r3n h GLY 170 N 0.29 -0.02 2.00 2.16 0.00 -0.97 -1.59 103.07 104.94 1r3n h GLY 170 Ca 0.09 0.01 -0.10 0.00 0.00 0.00 0.00 47.33 47.32 1r3n h GLY 170 CO -0.02 -0.01 -0.48 1.48 0.00 0.00 0.00 176.54 177.52 1r3n h SER 171 N -0.19 0.00 0.17 0.19 4.64 -1.76 -2.61 113.55 113.98 1r3n h SER 171 Ca -0.00 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.17 1r3n h SER 171 Cb 0.19 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.27 1r3n h SER 171 CO 0.00 0.48 -0.54 0.28 -0.87 0.00 0.00 176.83 176.18 1r3n h SER 172 N 0.00 0.44 -0.10 4.97 0.02 -0.85 -0.65 113.55 117.38 1r3n h SER 172 Ca -0.00 -0.23 -0.13 0.00 -0.84 0.00 0.00 61.79 60.58 1r3n h SER 172 Cb 1.01 -0.13 0.01 0.00 0.14 0.00 0.00 62.40 63.43 1r3n h SER 172 CO 0.06 0.90 -0.45 -0.37 -1.14 0.00 0.00 176.83 175.83 1r3n h VAL 173 N 0.31 1.38 -0.86 2.27 -1.51 -1.18 -0.21 116.25 116.45 1r3n h VAL 173 Ca 0.01 -1.79 0.15 0.00 -1.23 0.00 0.00 66.70 63.84 1r3n h VAL 173 Cb 1.05 2.20 -0.07 0.00 -2.13 0.00 0.00 31.29 32.35 1r3n h VAL 173 CO 0.09 0.53 0.56 -0.25 -1.23 0.00 0.00 177.57 177.27 1r3n h TRP 174 N 0.07 0.70 0.00 5.19 7.01 -1.45 -1.74 115.95 125.73 1r3n h TRP 174 Ca -0.03 0.02 0.00 0.00 2.11 0.00 0.00 58.89 60.99 1r3n h TRP 174 Cb 1.09 -0.22 0.00 0.00 -2.10 0.00 0.00 29.16 27.93 1r3n h TRP 174 CO 0.12 0.25 -0.12 0.45 -2.79 0.00 0.00 178.44 176.34 1r3n n SER 175 N -4.54 0.22 -0.38 2.65 2.88 -0.26 -0.62 113.62 113.57 1r3n n SER 175 Ca 0.17 0.35 -0.05 0.00 -1.33 0.00 0.00 58.87 58.01 1r3n n SER 175 Cb 0.52 -0.36 -0.02 0.00 -0.75 0.00 0.00 64.21 63.60 1r3n n SER 175 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 1r3n n HIS 176 N -1.61 0.00 0.10 0.66 8.25 -0.65 -4.91 115.22 117.06 1r3n n HIS 176 Ca 0.06 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.56 1r3n n HIS 176 Cb 0.35 -1.21 -0.01 0.00 1.12 0.00 0.00 29.99 30.25 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 -3.51 0.41 3.32 -1.29 -3.45 116.42 111.90 1r3n h ASP 177 Ca -0.10 0.00 -0.33 0.00 0.02 0.00 0.00 57.03 56.62 1r3n h ASP 177 Cb 0.34 0.00 -0.34 0.00 0.22 0.00 0.00 39.33 39.55 1r3n h ASP 177 CO 0.15 0.43 -0.74 -0.22 -1.72 0.00 0.00 179.24 177.13 1r3n s LEU 178 N -6.05 1.16 0.53 1.55 2.96 -0.90 -4.99 118.68 112.94 1r3n s LEU 178 Ca 0.01 -0.00 -0.21 0.00 -0.22 0.00 0.00 54.13 53.71 1r3n s LEU 178 Cb 0.08 -0.16 -0.05 0.00 0.50 0.00 0.00 46.19 46.55 1r3n s LEU 178 CO 0.77 -0.11 1.25 -0.94 -1.32 0.00 0.00 176.35 176.00 1r3n s SER 179 N 1.01 5.54 0.26 3.68 1.04 -1.26 -4.02 113.70 119.96 1r3n s SER 179 Ca -0.10 2.50 -0.02 0.00 0.48 0.00 0.00 55.95 58.82 1r3n s SER 179 Cb -0.13 -2.61 0.49 0.00 0.10 0.00 0.00 66.02 63.86 1r3n s SER 179 CO -0.02 -1.36 1.79 0.25 0.98 0.00 0.00 173.24 174.88 1r3n h LEU 180 N 1.48 0.64 -0.80 2.42 5.85 -1.94 -2.30 115.31 120.65 1r3n h LEU 180 Ca -0.50 0.07 -0.08 0.00 0.84 0.00 0.00 57.88 58.21 1r3n h LEU 180 Cb 1.28 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.25 1r3n h LEU 180 CO 0.58 0.31 0.00 -0.08 -0.34 0.00 0.00 178.44 178.91 1r3n h GLU 181 N 0.73 0.90 -0.28 1.25 4.57 -1.99 -1.07 114.58 118.70 1r3n h GLU 181 Ca 0.44 -0.26 -0.11 0.00 -1.18 0.00 0.00 59.36 58.26 1r3n h GLU 181 Cb 0.53 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 29.02 1r3n h GLU 181 CO -0.31 0.89 -0.24 0.93 -1.18 0.00 0.00 179.01 179.11 1r3n h GLU 182 N 0.83 0.65 -0.17 1.92 5.08 -1.86 -2.79 114.58 118.24 1r3n h GLU 182 Ca 0.16 -0.33 0.04 0.00 -1.00 0.00 0.00 59.36 58.22 1r3n h GLU 182 Cb 0.49 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.71 1r3n h GLU 182 CO 0.02 0.93 -0.06 0.00 -1.00 0.00 0.00 179.01 178.91 1r3n h ALA 183 N 0.71 0.10 -0.79 3.43 0.00 -1.26 -2.65 119.26 118.79 1r3n h ALA 183 Ca 0.05 0.07 0.12 0.00 0.00 0.00 0.00 54.91 55.15 1r3n h ALA 183 Cb 0.79 0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.68 1r3n h ALA 183 CO 0.06 -0.49 0.52 1.88 0.00 0.00 0.00 179.25 181.22 1r3n h TYR 184 N -0.02 0.69 -0.09 0.00 0.99 -1.16 -2.34 116.97 115.03 1r3n h TYR 184 Ca 0.09 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.84 1r3n h TYR 184 Cb 0.15 -0.22 0.00 0.00 1.00 0.00 0.00 36.73 37.66 1r3n h TYR 184 CO -0.21 0.29 0.00 0.41 -0.00 0.00 0.00 178.16 178.65 1r3n n GLY 185 N -1.47 0.04 3.71 3.88 0.00 -1.01 -2.78 105.19 107.56 1r3n n GLY 185 Ca 0.14 -0.40 -0.42 0.00 0.00 0.00 0.00 46.02 45.34 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 -1.77 4.36 0.35 0.99 1.43 -0.88 -4.87 118.68 118.29 1r3n s LEU 186 Ca 0.35 2.32 0.00 0.00 -1.03 0.00 0.00 54.13 55.77 1r3n s LEU 186 Cb 0.19 -3.58 -0.03 0.00 0.03 0.00 0.00 46.19 42.79 1r3n s LEU 186 CO 0.30 -0.68 0.55 -0.04 0.23 0.00 0.00 176.35 176.71 1r3n s MET 187 N 1.38 3.49 0.36 1.70 -1.94 -1.26 -1.43 119.30 121.60 1r3n s MET 187 Ca 0.65 -0.31 -0.26 0.00 -1.71 0.00 0.00 55.69 54.06 1r3n s MET 187 Cb -0.37 -2.66 -0.09 0.00 2.01 0.00 0.00 34.83 33.73 1r3n s MET 187 CO 0.30 0.14 1.09 -1.54 -0.01 0.00 0.00 175.02 175.00 1r3n s SER 188 N -4.01 6.89 -0.20 3.03 1.04 0.21 -4.55 113.70 116.10 1r3n s SER 188 Ca 0.40 2.19 -0.09 0.00 0.48 0.00 0.00 55.95 58.93 1r3n s SER 188 Cb -0.10 -2.61 -0.05 0.00 0.10 0.00 0.00 66.02 63.37 1r3n s SER 188 CO 0.36 -0.41 0.11 -0.69 0.98 0.00 0.00 173.24 173.60 1r3n s VAL 189 N -1.43 5.21 -1.12 5.02 1.01 0.44 -4.54 120.40 124.98 1r3n s VAL 189 Ca 0.53 0.12 -0.03 0.00 0.00 0.00 0.00 61.98 62.60 1r3n s VAL 189 Cb -0.27 -3.37 0.00 0.00 0.00 0.00 0.00 36.38 32.73 1r3n s VAL 189 CO 0.35 0.43 0.95 0.61 0.00 0.00 0.00 175.10 177.44 1r3n n GLY 190 N 3.62 -0.31 3.38 4.51 0.00 -1.26 -4.88 105.19 110.26 1r3n n GLY 190 Ca -0.16 0.08 -0.24 0.00 0.00 0.00 0.00 46.02 45.69 1r3n n GLY 190 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1r3n s GLU 191 N -5.53 1.41 0.30 1.61 2.02 -1.26 -5.04 118.70 112.21 1r3n s GLU 191 Ca 0.17 -1.48 0.01 0.00 0.02 0.00 0.00 54.97 53.69 1r3n s GLU 191 Cb -0.08 -1.60 0.54 0.00 0.10 0.00 0.00 34.13 33.10 1r3n s GLU 191 CO 0.65 0.34 1.90 0.38 0.02 0.00 0.00 175.26 178.55 1r3n h ASP 192 N 3.18 0.90 -3.25 -0.19 2.03 -1.98 -3.39 116.42 113.72 1r3n h ASP 192 Ca -0.44 0.01 -0.67 0.00 -0.73 0.00 0.00 57.03 55.20 1r3n h ASP 192 Cb 1.21 -0.18 -0.33 0.00 -0.83 0.00 0.00 39.33 39.20 1r3n h ASP 192 CO 0.50 0.56 -0.86 -1.59 -1.03 0.00 0.00 179.24 176.82 1r3n s LYS 193 N -5.90 3.06 -0.02 4.15 0.00 -1.26 -5.11 119.74 114.65 1r3n s LYS 193 Ca -0.11 -0.85 -0.30 0.00 0.00 0.00 0.00 55.97 54.71 1r3n s LYS 193 Cb 0.20 -2.42 -0.04 0.00 0.00 0.00 0.00 37.83 35.57 1r3n s LYS 193 CO 0.80 0.05 1.17 -1.25 0.00 0.00 0.00 175.35 176.12 1r3n s PRO 194 N 0.66 4.39 -0.01 1.78 0.04 -1.26 -4.88 135.00 135.73 1r3n s PRO 194 Ca -0.11 1.66 0.00 0.00 0.04 0.00 0.00 61.00 62.60 1r3n s PRO 194 Cb -0.16 -3.50 0.01 0.00 0.04 0.00 0.00 34.50 30.89 1r3n s PRO 194 CO 0.02 -0.36 -0.01 -2.00 0.04 0.00 0.00 177.00 174.70 1r3n s GLU 195 N 1.81 0.12 0.68 4.56 2.12 -1.26 -4.83 118.70 121.90 1r3n s GLU 195 Ca 0.56 -0.00 -0.11 0.00 0.36 0.00 0.00 54.97 55.78 1r3n s GLU 195 Cb -0.25 -0.18 0.01 0.00 0.26 0.00 0.00 34.13 33.96 1r3n s GLU 195 CO 0.24 -0.02 1.07 -1.54 -0.54 0.00 0.00 175.26 174.47 1r3n s SER 196 N 0.26 5.57 0.19 -1.70 1.04 -1.26 0.64 113.70 118.45 1r3n s SER 196 Ca -0.02 1.13 -0.12 0.00 0.48 0.00 0.00 55.95 57.42 1r3n s SER 196 Cb -0.04 -1.98 0.11 0.00 0.10 0.00 0.00 66.02 64.21 1r3n s SER 196 CO -0.01 -1.24 1.81 0.58 0.98 0.00 0.00 173.24 175.36 1r3n h VAL 197 N -0.56 1.20 -0.19 5.02 2.07 -1.14 -1.07 116.25 121.59 1r3n h VAL 197 Ca -0.45 -0.49 0.01 0.00 0.82 0.00 0.00 66.70 66.59 1r3n h VAL 197 Cb 1.24 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 1r3n h VAL 197 CO 0.63 0.22 0.11 0.22 0.02 0.00 0.00 177.57 178.77 1r3n h TYR 198 N 0.90 0.21 -0.95 1.57 3.20 -1.80 -0.99 116.97 119.10 1r3n h TYR 198 Ca 0.23 0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.14 1r3n h TYR 198 Cb 0.02 -0.07 -0.05 0.00 1.54 0.00 0.00 36.73 38.17 1r3n h TYR 198 CO -0.01 0.13 0.62 -0.44 -1.64 0.00 0.00 178.16 176.82 1r3n h ASP 199 N 0.23 1.05 -0.23 -2.11 3.32 -1.78 -1.92 116.42 114.98 1r3n h ASP 199 Ca 0.07 -0.01 -0.08 0.00 0.02 0.00 0.00 57.03 57.03 1r3n h ASP 199 Cb -0.01 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 39.29 1r3n h ASP 199 CO -0.03 0.73 -0.16 0.28 -1.72 0.00 0.00 179.24 178.34 1r3n h SER 200 N 1.22 0.53 0.43 6.45 0.02 -0.88 -2.80 113.55 118.53 1r3n h SER 200 Ca 0.37 -0.44 -0.09 0.00 -0.84 0.00 0.00 61.79 60.79 1r3n h SER 200 Cb -0.04 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.34 1r3n h SER 200 CO -0.11 0.86 -0.42 -0.07 -1.14 0.00 0.00 176.83 175.95 1r3n h LEU 201 N 0.21 0.00 -0.30 5.07 4.07 -1.05 -2.87 115.31 120.42 1r3n h LEU 201 Ca 0.04 0.00 -0.14 0.00 0.08 0.00 0.00 57.88 57.86 1r3n h LEU 201 Cb 0.68 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.42 1r3n h LEU 201 CO 0.04 0.42 -0.38 0.50 -1.08 0.00 0.00 178.44 177.95 1r3n h LYS 202 N 0.00 0.79 0.00 1.13 3.64 -1.36 0.78 116.57 121.55 1r3n h LYS 202 Ca -0.00 -0.44 -0.02 0.00 -1.27 0.00 0.00 60.65 58.91 1r3n h LYS 202 Cb 0.75 0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.59 1r3n h LYS 202 CO 0.05 1.08 -0.08 -0.97 -2.27 0.00 0.00 179.45 177.26 1r3n h ASN 203 N 0.56 0.00 -0.02 4.20 -0.00 -1.28 -1.82 115.58 117.22 1r3n h ASN 203 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.34 1r3n h ASN 203 Cb 0.97 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.29 1r3n h ASN 203 CO 0.09 0.08 -0.39 2.30 -0.00 0.00 0.00 177.43 179.52 1r3n n ILE 204 N -4.42 0.00 -2.42 2.57 -5.35 -1.12 -4.99 119.36 103.63 1r3n n ILE 204 Ca -0.03 -0.31 -0.06 0.00 -0.27 0.00 0.00 62.75 62.09 1r3n n ILE 204 Cb 0.16 1.28 0.01 0.00 -1.74 0.00 0.00 39.64 39.35 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 1.36 0.33 0.68 3.28 0.00 -0.67 -4.93 105.19 105.24 1r3n n GLY 205 Ca 0.09 -0.55 0.05 0.00 0.00 0.00 0.00 46.02 45.61 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 -3.63 0.54 -2.67 1.61 4.02 0.26 -4.84 117.16 112.45 1r3n n TYR 206 Ca -0.04 -1.23 -0.42 0.00 -0.01 0.00 0.00 57.90 56.20 1r3n n TYR 206 Cb 0.53 -0.31 -0.03 0.00 -0.02 0.00 0.00 39.34 39.52 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 -3.04 4.03 0.74 -0.72 -1.09 -1.18 -3.44 121.20 116.49 1r3n s ILE 207 Ca 0.39 0.34 -0.04 0.00 -2.23 0.00 0.00 60.65 59.11 1r3n s ILE 207 Cb 0.35 -4.76 0.12 0.00 -1.58 0.00 0.00 42.46 36.59 1r3n s ILE 207 CO 0.02 -1.53 1.03 -0.83 -1.23 0.00 0.00 174.94 172.40 1r3n s GLY 208 N 3.39 1.76 -0.12 6.18 0.00 -0.81 -4.95 107.32 112.77 1r3n s GLY 208 Ca 0.33 -1.45 0.19 0.00 0.00 0.00 0.00 44.72 43.79 1r3n s GLY 208 CO 0.17 -0.91 0.27 1.22 0.00 0.00 0.00 173.10 173.86 1r3n n ASP 209 N -2.96 0.08 -4.77 1.64 8.00 -0.66 -3.69 116.55 114.19 1r3n n ASP 209 Ca 0.13 0.04 -0.41 0.00 0.71 0.00 0.00 54.79 55.26 1r3n n ASP 209 Cb 0.60 1.25 -0.01 0.00 -0.02 0.00 0.00 41.12 42.94 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 -2.87 2.37 0.27 -3.53 2.01 -0.98 -4.84 115.64 108.06 1r3n s THR 210 Ca -0.09 0.37 -0.30 0.00 0.31 0.00 0.00 61.69 61.98 1r3n s THR 210 Cb 0.09 -3.23 -0.10 0.00 0.01 0.00 0.00 72.50 69.27 1r3n s THR 210 CO 0.86 0.08 1.35 -2.84 -0.69 0.00 0.00 174.62 173.38 1r3n s PRO 211 N -1.71 4.34 -1.22 4.92 0.02 -1.26 -1.71 135.00 138.38 1r3n s PRO 211 Ca 0.53 2.19 -0.12 0.00 0.02 0.00 0.00 61.00 63.62 1r3n s PRO 211 Cb -0.43 -3.12 0.18 0.00 0.02 0.00 0.00 34.50 31.15 1r3n s PRO 211 CO 0.56 -0.27 1.57 0.00 -0.33 0.00 0.00 177.00 178.53 1r3n n ALA 212 N 1.80 4.45 -3.61 -1.55 0.00 -1.26 -4.27 120.51 116.07 1r3n n ALA 212 Ca 0.04 -4.32 -0.10 0.00 0.00 0.00 0.00 53.44 49.06 1r3n n ALA 212 Cb 0.42 -2.97 -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 1.89 -0.76 0.57 0.00 0.15 -1.26 -4.01 113.70 110.27 1r3n s SER 213 Ca 0.41 1.31 0.31 0.00 0.70 0.00 0.00 55.95 58.68 1r3n s SER 213 Cb 0.01 1.24 1.70 0.00 -1.71 0.00 0.00 66.02 67.27 1r3n s SER 213 CO 0.00 -0.22 2.16 0.10 1.20 0.00 0.00 173.24 176.48 1r3n h TYR 214 N 6.30 0.00 0.00 3.44 -0.00 -1.10 0.98 116.97 126.59 1r3n h TYR 214 Ca -0.31 0.00 -0.20 0.00 0.00 0.00 0.00 58.73 58.23 1r3n h TYR 214 Cb 1.20 0.00 -0.03 0.00 0.00 0.00 0.00 36.73 37.90 1r3n h TYR 214 CO 0.22 0.06 -0.95 0.87 -0.00 0.00 0.00 178.16 178.36 1r3n h LYS 215 N 0.00 0.00 0.00 0.10 1.57 -1.96 -3.37 116.57 112.91 1r3n h LYS 215 Ca -0.00 0.00 -0.46 0.00 -1.87 0.00 0.00 60.65 58.32 1r3n h LYS 215 Cb 0.20 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.45 1r3n h LYS 215 CO 0.01 0.95 -2.52 0.39 -0.57 0.00 0.00 179.45 177.70 1r3n n GLU 216 N -3.39 0.59 -3.42 3.15 1.02 -0.94 -4.74 120.64 112.92 1r3n n GLU 216 Ca -0.00 0.26 -0.44 0.00 -0.02 0.00 0.00 57.16 56.96 1r3n n GLU 216 Cb 0.90 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.79 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 -7.43 6.55 0.30 1.62 2.47 0.29 -5.01 114.94 113.72 1r3n s ASN 217 Ca -0.38 -2.97 -0.13 0.00 0.42 0.00 0.00 52.86 49.79 1r3n s ASN 217 Cb 0.14 -2.13 -0.08 0.00 -1.45 0.00 0.00 41.25 37.73 1r3n s ASN 217 CO 0.50 -0.45 0.68 -1.61 -3.72 0.00 0.00 177.10 172.50 1r3n s GLU 218 N -0.26 3.94 0.11 0.43 2.02 -1.26 -4.53 118.70 119.16 1r3n s GLU 218 Ca 0.21 0.55 0.06 0.00 0.02 0.00 0.00 54.97 55.80 1r3n s GLU 218 Cb -0.12 -2.49 -0.04 0.00 0.10 0.00 0.00 34.13 31.59 1r3n s GLU 218 CO -0.08 0.20 -0.14 0.42 0.02 0.00 0.00 175.26 175.68 1r3n s ILE 219 N -1.95 1.26 -0.07 -1.63 1.09 -1.26 -4.34 121.20 114.30 1r3n s ILE 219 Ca 0.52 -1.67 -0.15 0.00 -1.10 0.00 0.00 60.65 58.26 1r3n s ILE 219 Cb -0.10 -1.46 -0.29 0.00 -1.06 0.00 0.00 42.46 39.54 1r3n s ILE 219 CO 0.19 -0.41 0.65 -0.78 -0.10 0.00 0.00 174.94 174.48 1r3n h ASP 220 N 3.60 0.50 -5.22 3.58 3.58 -0.90 -3.47 116.42 118.10 1r3n h ASP 220 Ca -0.40 -0.90 -0.05 0.00 0.42 0.00 0.00 57.03 56.11 1r3n h ASP 220 Cb 1.19 -0.16 -0.09 0.00 1.72 0.00 0.00 39.33 41.99 1r3n h ASP 220 CO 0.50 1.67 -0.08 0.00 -2.88 0.00 0.00 179.24 178.45 1r3n s ALA 221 N -2.52 -0.33 -0.12 -0.78 0.00 -1.26 -4.08 121.76 112.68 1r3n s ALA 221 Ca -0.17 -0.83 -0.04 0.00 0.00 0.00 0.00 51.96 50.92 1r3n s ALA 221 Cb 0.04 1.05 0.05 0.00 0.00 0.00 0.00 23.12 24.26 1r3n s ALA 221 CO 0.81 -0.87 0.12 -1.58 0.00 0.00 0.00 175.76 174.24 1r3n s HIS 222 N -3.97 -0.00 -0.13 0.00 2.46 -0.46 -1.17 115.29 112.01 1r3n s HIS 222 Ca 0.21 0.14 -0.03 0.00 0.47 0.00 0.00 55.06 55.85 1r3n s HIS 222 Cb -0.01 -0.48 -0.03 0.00 -0.13 0.00 0.00 32.58 31.92 1r3n s HIS 222 CO 0.09 -0.39 -0.03 -0.06 -2.47 0.00 0.00 174.74 171.89 1r3n s PHE 223 N 2.21 3.05 -0.12 3.88 0.40 -0.37 -2.15 117.98 124.89 1r3n s PHE 223 Ca 0.04 -0.13 0.01 0.00 -0.60 0.00 0.00 56.93 56.25 1r3n s PHE 223 Cb -0.14 -1.89 0.02 0.00 0.51 0.00 0.00 43.02 41.52 1r3n s PHE 223 CO -0.07 0.14 -0.14 -2.00 0.70 0.00 0.00 175.22 173.84 1r3n s GLU 224 N -0.07 2.14 -0.12 0.44 2.12 -0.93 -1.99 118.70 120.29 1r3n s GLU 224 Ca 0.02 -0.52 -0.17 0.00 0.36 0.00 0.00 54.97 54.67 1r3n s GLU 224 Cb -0.13 -1.89 -0.04 0.00 0.26 0.00 0.00 34.13 32.32 1r3n s GLU 224 CO 0.02 -0.13 0.42 -1.17 -0.54 0.00 0.00 175.26 173.87 1r3n s LEU 225 N 1.19 4.29 -0.00 2.70 2.96 -1.26 -0.83 118.68 127.73 1r3n s LEU 225 Ca -0.02 0.75 -0.18 0.00 -0.22 0.00 0.00 54.13 54.45 1r3n s LEU 225 Cb -0.14 -2.60 0.03 0.00 0.50 0.00 0.00 46.19 43.98 1r3n s LEU 225 CO -0.05 0.06 0.40 -2.28 -1.32 0.00 0.00 176.35 173.16 1r3n s HIS 226 N 0.41 -0.28 0.71 5.38 2.46 -0.58 -2.62 115.29 120.78 1r3n s HIS 226 Ca 0.23 0.39 -0.14 0.00 0.47 0.00 0.00 55.06 56.01 1r3n s HIS 226 Cb -0.15 0.18 0.03 0.00 -0.13 0.00 0.00 32.58 32.51 1r3n s HIS 226 CO 0.09 -0.48 1.14 0.96 -2.47 0.00 0.00 174.74 173.98 1r3n s ILE 227 N -1.65 2.91 0.34 0.89 -4.36 -1.26 -2.63 121.20 115.44 1r3n s ILE 227 Ca -0.11 0.40 0.07 0.00 -0.26 0.00 0.00 60.65 60.76 1r3n s ILE 227 Cb -0.03 -2.89 0.12 0.00 1.25 0.00 0.00 42.46 40.91 1r3n s ILE 227 CO 0.03 -0.29 1.83 -0.08 0.24 0.00 0.00 174.94 176.68 1r3n h GLU 228 N -0.37 0.31 -1.95 0.37 4.81 -1.46 -3.44 114.58 112.85 1r3n h GLU 228 Ca -0.46 -0.09 -0.36 0.00 -0.13 0.00 0.00 59.36 58.31 1r3n h GLU 228 Cb 1.26 -0.03 -0.10 0.00 0.63 0.00 0.00 28.75 30.51 1r3n h GLU 228 CO 0.52 0.50 -0.38 1.04 -0.73 0.00 0.00 179.01 179.96 1r3n n GLN 229 N -4.19 -1.57 -3.92 1.92 6.02 -1.26 -4.88 117.38 109.49 1r3n n GLN 229 Ca -0.01 0.98 -0.09 0.00 -0.01 0.00 0.00 57.00 57.88 1r3n n GLN 229 Cb 0.33 -5.43 -0.05 0.00 1.02 0.00 0.00 30.24 26.11 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 -2.34 0.32 0.00 1.08 0.00 -1.25 -4.74 107.32 100.39 1r3n s GLY 230 Ca 0.00 -0.67 0.25 0.00 0.00 0.00 0.00 44.72 44.30 1r3n s GLY 230 CO 0.00 -0.51 1.56 -1.55 0.00 0.00 0.00 173.10 172.59 1r3n n PRO 231 N -0.36 1.91 0.18 2.90 -0.04 -1.26 -3.98 135.00 134.34 1r3n n PRO 231 Ca -0.04 -1.34 -0.14 0.00 -0.04 0.00 0.00 63.50 61.94 1r3n n PRO 231 Cb 0.62 -1.46 -0.08 0.00 -0.04 0.00 0.00 33.50 32.54 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 3.03 0.68 -0.68 0.52 2.04 -1.97 -1.87 117.51 119.26 1r3n h ILE 232 Ca 0.00 -0.39 -0.07 0.00 1.00 0.00 0.00 64.86 65.40 1r3n h ILE 232 Cb 0.65 0.89 -0.03 0.00 -0.74 0.00 0.00 36.82 37.59 1r3n h ILE 232 CO 0.00 0.08 0.16 -0.07 0.00 0.00 0.00 178.15 178.32 1r3n h LEU 233 N -0.67 1.03 -0.32 1.44 3.38 -1.91 -1.89 115.31 116.38 1r3n h LEU 233 Ca -0.05 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.70 1r3n h LEU 233 Cb 0.47 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1r3n h LEU 233 CO 0.08 0.99 0.17 -0.08 0.09 0.00 0.00 178.44 179.68 1r3n h GLU 234 N 1.03 0.44 -0.82 1.13 4.81 -1.81 -1.29 114.58 118.08 1r3n h GLU 234 Ca 0.22 -0.05 0.02 0.00 -0.13 0.00 0.00 59.36 59.41 1r3n h GLU 234 Cb 0.36 -0.09 -0.04 0.00 0.63 0.00 0.00 28.75 29.61 1r3n h GLU 234 CO 0.00 0.38 0.53 0.22 -0.73 0.00 0.00 179.01 179.41 1r3n h ASP 235 N 0.39 0.91 -0.42 1.04 -0.00 -1.03 -2.62 116.42 114.69 1r3n h ASP 235 Ca 0.11 -0.02 0.00 0.00 -0.00 0.00 0.00 57.03 57.12 1r3n h ASP 235 Cb 0.07 -0.22 0.00 0.00 -0.00 0.00 0.00 39.33 39.18 1r3n h ASP 235 CO -0.02 0.65 0.00 -0.62 -0.00 0.00 0.00 179.24 179.25 1r3n n GLU 236 N -4.54 2.06 -2.11 0.28 1.02 -0.74 -4.93 120.64 111.69 1r3n n GLU 236 Ca 0.09 -1.64 -0.21 0.00 -0.02 0.00 0.00 57.16 55.38 1r3n n GLU 236 Cb 0.04 -1.38 -0.04 0.00 -0.02 0.00 0.00 31.44 30.04 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 0.84 -5.76 -4.87 1.62 4.13 -0.91 -4.99 115.26 105.33 1r3n n ASN 237 Ca 0.16 0.17 -0.31 0.00 1.68 0.00 0.00 54.58 56.29 1r3n n ASN 237 Cb 0.40 -4.88 -0.04 0.00 -1.54 0.00 0.00 39.78 33.73 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 -4.57 3.82 -0.13 3.52 -0.14 -0.54 -4.84 119.74 116.87 1r3n s LYS 238 Ca 0.00 0.53 0.16 0.00 -1.36 0.00 0.00 55.97 55.30 1r3n s LYS 238 Cb 0.00 -2.38 -0.23 0.00 -1.68 0.00 0.00 37.83 33.53 1r3n s LYS 238 CO 0.00 -0.02 0.15 0.00 -0.76 0.00 0.00 175.35 174.72 1r3n n ALA 239 N -1.16 1.86 -3.27 5.17 0.00 0.78 -4.63 120.51 119.26 1r3n n ALA 239 Ca 0.03 -0.96 -0.13 0.00 0.00 0.00 0.00 53.44 52.38 1r3n n ALA 239 Cb 0.54 -0.25 -0.15 0.00 0.00 0.00 0.00 19.45 19.59 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 -2.64 -0.03 -0.21 0.00 -1.09 -1.03 -4.37 121.20 111.83 1r3n s ILE 240 Ca -0.08 0.10 -0.04 0.00 -2.23 0.00 0.00 60.65 58.39 1r3n s ILE 240 Cb 0.07 -0.05 -0.01 0.00 -1.58 0.00 0.00 42.46 40.89 1r3n s ILE 240 CO 0.72 0.04 -0.03 -0.83 -1.23 0.00 0.00 174.94 173.61 1r3n s GLY 241 N 0.48 1.65 -0.49 6.18 0.00 -0.43 -1.79 107.32 112.92 1r3n s GLY 241 Ca -0.04 -1.10 -0.25 0.00 0.00 0.00 0.00 44.72 43.33 1r3n s GLY 241 CO -0.01 0.35 0.94 -0.42 0.00 0.00 0.00 173.10 173.95 1r3n s ILE 242 N 1.30 4.43 -0.32 0.90 -1.09 0.41 -1.17 121.20 125.66 1r3n s ILE 242 Ca 0.04 0.63 -0.28 0.00 -2.23 0.00 0.00 60.65 58.80 1r3n s ILE 242 Cb -0.14 -4.47 0.02 0.00 -1.58 0.00 0.00 42.46 36.28 1r3n s ILE 242 CO -0.01 -0.93 1.05 -0.69 -1.23 0.00 0.00 174.94 173.13 1r3n s VAL 243 N 3.85 4.52 -0.31 2.92 1.01 -1.04 -0.96 120.40 130.40 1r3n s VAL 243 Ca 0.35 1.66 0.23 0.00 0.00 0.00 0.00 61.98 64.22 1r3n s VAL 243 Cb -0.11 -4.40 -0.04 0.00 0.00 0.00 0.00 36.38 31.84 1r3n s VAL 243 CO 0.24 -0.48 1.03 0.35 0.00 0.00 0.00 175.10 176.24 1r3n n THR 244 N 5.88 0.49 -1.12 3.92 -2.24 -0.56 -4.08 114.28 116.56 1r3n n THR 244 Ca 0.11 -0.48 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 1r3n n THR 244 Cb 0.47 -0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.48 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 1.23 -1.40 3.32 3.38 0.00 -1.26 -1.35 105.19 109.10 1r3n n GLY 245 Ca 0.00 -1.01 -0.32 0.00 0.00 0.00 0.00 46.02 44.69 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 -2.35 2.49 0.28 1.61 1.01 0.62 -0.11 120.40 123.96 1r3n s VAL 246 Ca 0.00 -0.89 -0.30 0.00 0.00 0.00 0.00 61.98 60.78 1r3n s VAL 246 Cb 0.00 -1.97 -0.12 0.00 0.00 0.00 0.00 36.38 34.30 1r3n s VAL 246 CO 0.00 0.56 1.62 -1.10 0.00 0.00 0.00 175.10 176.18 1r3n s GLN 247 N -0.03 4.11 0.64 2.72 -0.21 -0.49 -1.19 119.66 125.22 1r3n s GLN 247 Ca -0.06 2.60 -0.17 0.00 0.02 0.00 0.00 55.36 57.75 1r3n s GLN 247 Cb -0.15 -3.02 -0.01 0.00 1.00 0.00 0.00 33.01 30.83 1r3n s GLN 247 CO 0.05 -0.67 1.17 0.00 -2.12 0.00 0.00 175.29 173.72 1r3n s ALA 248 N 0.18 2.44 0.04 6.09 0.00 0.11 -4.68 121.76 125.94 1r3n s ALA 248 Ca 0.65 0.84 -0.02 0.00 0.00 0.00 0.00 51.96 53.43 1r3n s ALA 248 Cb -0.49 -3.41 -0.03 0.00 0.00 0.00 0.00 23.12 19.20 1r3n s ALA 248 CO 0.46 -1.31 0.00 1.52 0.00 0.00 0.00 175.76 176.43 1r3n s TYR 249 N -1.89 0.36 -0.06 0.00 -0.85 0.13 -2.08 117.35 112.96 1r3n s TYR 249 Ca 0.73 -0.76 -0.01 0.00 -0.52 0.00 0.00 57.07 56.52 1r3n s TYR 249 Cb -0.27 -0.26 0.03 0.00 0.38 0.00 0.00 41.96 41.84 1r3n s TYR 249 CO 0.37 -0.32 0.00 1.21 -1.52 0.00 0.00 175.55 175.29 1r3n s ASN 250 N -2.28 1.20 -0.12 -0.18 2.47 -0.40 -1.07 114.94 114.55 1r3n s ASN 250 Ca -0.03 -0.06 -0.05 0.00 0.42 0.00 0.00 52.86 53.14 1r3n s ASN 250 Cb 0.00 -0.36 -0.04 0.00 -1.45 0.00 0.00 41.25 39.40 1r3n s ASN 250 CO -0.06 -0.16 0.07 0.26 -3.72 0.00 0.00 177.10 173.49 1r3n s TRP 251 N 1.64 3.35 0.05 0.43 0.51 0.16 -1.37 118.94 123.71 1r3n s TRP 251 Ca -0.00 0.29 0.01 0.00 -2.12 0.00 0.00 56.10 54.27 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 0.49 -0.05 -0.65 -0.51 0.00 0.00 176.95 176.20 1r3n s GLN 252 N -0.63 0.53 -0.13 4.98 -0.21 0.52 -1.21 119.66 123.51 1r3n s GLN 252 Ca 0.11 -0.93 0.03 0.00 0.02 0.00 0.00 55.36 54.59 1r3n s GLN 252 Cb -0.12 -0.02 0.01 0.00 1.00 0.00 0.00 33.01 33.88 1r3n s GLN 252 CO 0.02 -0.03 -0.21 0.21 -2.12 0.00 0.00 175.29 173.16 1r3n s LYS 253 N -2.52 2.87 -0.10 2.91 2.20 0.92 0.05 119.74 126.07 1r3n s LYS 253 Ca -0.04 -0.81 0.00 0.00 -0.36 0.00 0.00 55.97 54.77 1r3n s LYS 253 Cb -0.03 -2.30 -0.02 0.00 -1.51 0.00 0.00 37.83 33.97 1r3n s LYS 253 CO -0.04 0.02 -0.11 0.08 -0.36 0.00 0.00 175.35 174.95 1r3n s VAL 254 N 0.74 3.33 -0.19 4.02 1.01 0.18 -0.61 120.40 128.88 1r3n s VAL 254 Ca -0.10 -0.59 -0.01 0.00 0.00 0.00 0.00 61.98 61.29 1r3n s VAL 254 Cb -0.16 -2.38 0.01 0.00 0.00 0.00 0.00 36.38 33.85 1r3n s VAL 254 CO 0.00 0.55 -0.14 -0.89 0.00 0.00 0.00 175.10 174.63 1r3n s THR 255 N -0.17 2.57 -0.19 3.92 2.01 -0.20 -0.98 115.64 122.59 1r3n s THR 255 Ca 0.01 -0.77 -0.09 0.00 0.31 0.00 0.00 61.69 61.14 1r3n s THR 255 Cb -0.13 -2.12 -0.05 0.00 0.01 0.00 0.00 72.50 70.21 1r3n s THR 255 CO 0.03 0.50 0.12 -0.69 -0.69 0.00 0.00 174.62 173.88 1r3n s VAL 256 N 1.33 5.30 -0.21 3.82 1.01 0.71 -1.23 120.40 131.13 1r3n s VAL 256 Ca 0.05 0.15 -0.05 0.00 0.00 0.00 0.00 61.98 62.13 1r3n s VAL 256 Cb -0.14 -3.41 -0.02 0.00 0.00 0.00 0.00 36.38 32.81 1r3n s VAL 256 CO -0.09 0.45 -0.01 -1.00 0.00 0.00 0.00 175.10 174.45 1r3n s HIS 257 N 0.33 3.02 0.00 5.22 3.76 0.50 -1.56 115.29 126.56 1r3n s HIS 257 Ca 0.07 -0.58 0.00 0.00 -0.15 0.00 0.00 55.06 54.41 1r3n s HIS 257 Cb -0.11 -2.10 0.00 0.00 1.11 0.00 0.00 32.58 31.48 1r3n s HIS 257 CO -0.02 -0.33 0.00 0.41 -0.85 0.00 0.00 174.74 173.96 1r3n n GLY 258 N 4.44 5.17 2.77 -2.22 0.00 0.18 -2.65 105.19 112.87 1r3n n GLY 258 Ca -0.17 -1.28 -0.20 0.00 0.00 0.00 0.00 46.02 44.37 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 3.42 0.21 -0.07 1.61 1.01 -0.80 -4.82 120.40 120.96 1r3n s VAL 259 Ca 0.00 0.17 -0.30 0.00 0.00 0.00 0.00 61.98 61.86 1r3n s VAL 259 Cb 0.00 -0.37 -0.05 0.00 0.00 0.00 0.00 36.38 35.97 1r3n s VAL 259 CO 0.00 0.21 1.54 -0.83 0.00 0.00 0.00 175.10 176.02 1r3n s GLY 260 N 1.68 1.60 0.07 4.51 0.00 -1.26 -4.36 107.32 109.56 1r3n s GLY 260 Ca -0.00 0.84 -0.09 0.00 0.00 0.00 0.00 44.72 45.47 1r3n s GLY 260 CO -0.03 2.85 0.19 0.00 0.00 0.00 0.00 173.10 176.11 1r3n s ALA 261 N 3.66 -0.28 0.23 3.20 0.00 -1.18 -4.96 121.76 122.43 1r3n s ALA 261 Ca 0.68 -0.48 -0.31 0.00 0.00 0.00 0.00 51.96 51.86 1r3n s ALA 261 Cb -0.31 0.40 -0.11 0.00 0.00 0.00 0.00 23.12 23.10 1r3n s ALA 261 CO 0.26 -0.45 1.53 -1.58 0.00 0.00 0.00 175.76 175.53 1r3n s HIS 262 N -3.32 2.96 0.51 0.00 2.46 -1.26 0.04 115.29 116.68 1r3n s HIS 262 Ca 0.01 0.81 0.41 0.00 0.47 0.00 0.00 55.06 56.76 1r3n s HIS 262 Cb 0.02 -3.93 2.20 0.00 -0.13 0.00 0.00 32.58 30.74 1r3n s HIS 262 CO -0.08 -3.22 2.26 0.00 -2.47 0.00 0.00 174.74 171.23 1r3n h ALA 263 N 5.59 1.00 0.00 1.58 0.00 -0.63 -3.02 119.26 123.78 1r3n h ALA 263 Ca -0.45 0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.23 1r3n h ALA 263 Cb 1.21 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.96 1r3n h ALA 263 CO 0.83 0.00 -1.86 0.41 0.00 0.00 0.00 179.25 178.63 1r3n n GLY 264 N -1.02 -0.45 0.16 0.00 0.00 -1.26 -4.59 105.19 98.02 1r3n n GLY 264 Ca -0.03 -0.17 0.09 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 0.16 -3.59 2.61 1.35 -1.96 -3.44 112.91 108.04 1r3n h THR 265 Ca -0.34 -1.26 -0.68 0.00 -0.55 0.00 0.00 66.41 63.59 1r3n h THR 265 Cb 1.67 1.87 -0.18 0.00 -1.73 0.00 0.00 68.15 69.78 1r3n h THR 265 CO -0.01 0.09 -0.21 -0.89 -0.25 0.00 0.00 175.52 174.25 1r3n s THR 266 N -3.21 5.10 0.66 6.82 2.01 -1.14 -5.05 115.64 120.83 1r3n s THR 266 Ca 0.03 -0.12 -0.12 0.00 0.31 0.00 0.00 61.69 61.79 1r3n s THR 266 Cb 0.07 -3.95 -0.01 0.00 0.01 0.00 0.00 72.50 68.62 1r3n s THR 266 CO 0.74 -0.28 1.05 -2.16 -0.69 0.00 0.00 174.62 173.28 1r3n s PRO 267 N 2.13 3.11 0.21 4.92 0.04 -1.26 -4.87 135.00 139.28 1r3n s PRO 267 Ca 0.13 1.00 -0.15 0.00 0.04 0.00 0.00 61.00 62.02 1r3n s PRO 267 Cb -0.17 -2.01 0.22 0.00 0.04 0.00 0.00 34.50 32.58 1r3n s PRO 267 CO 0.13 -0.97 1.61 -1.49 0.04 0.00 0.00 177.00 176.32 1r3n h TRP 268 N -0.36 -0.53 0.00 0.56 4.06 -1.97 -0.93 115.95 116.78 1r3n h TRP 268 Ca -0.45 0.06 0.00 0.00 2.06 0.00 0.00 58.89 60.57 1r3n h TRP 268 Cb 1.21 0.33 0.00 0.00 -1.00 0.00 0.00 29.16 29.70 1r3n h TRP 268 CO 0.61 -0.32 0.00 2.89 -3.56 0.00 0.00 178.44 178.06 1r3n n ARG 269 N -5.45 0.24 -0.24 0.49 1.85 -1.26 -2.16 116.66 110.14 1r3n n ARG 269 Ca 0.07 0.08 0.02 0.00 -1.00 0.00 0.00 57.85 57.03 1r3n n ARG 269 Cb 0.35 -1.50 0.03 0.00 -1.05 0.00 0.00 32.46 30.29 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 -1.12 0.76 -4.96 2.89 4.77 -0.36 -2.79 117.00 116.18 1r3n n LEU 270 Ca 0.06 -1.37 -0.21 0.00 -0.03 0.00 0.00 56.01 54.47 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 0.33 -0.04 0.00 -1.33 0.00 0.00 177.39 176.42 1r3n s ARG 271 N -0.77 3.37 -0.46 3.23 1.70 -0.92 -4.86 118.95 120.24 1r3n s ARG 271 Ca 0.07 -0.81 0.08 0.00 -0.47 0.00 0.00 55.73 54.60 1r3n s ARG 271 Cb 0.06 -2.86 0.27 0.00 -0.57 0.00 0.00 34.95 31.85 1r3n s ARG 271 CO 0.01 0.38 0.64 1.63 -1.08 0.00 0.00 175.30 176.88 1r3n n LYS 272 N -1.42 1.38 -2.33 3.89 5.02 -1.26 -4.14 118.16 119.30 1r3n n LYS 272 Ca -0.08 -3.73 -0.43 0.00 -2.02 0.00 0.00 58.31 52.06 1r3n n LYS 272 Cb 0.57 -1.62 -0.02 0.00 -0.02 0.00 0.00 35.03 33.94 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 -1.84 6.48 0.21 4.39 -1.08 -1.26 -1.91 116.67 121.67 1r3n s ASP 273 Ca 0.38 1.15 0.03 0.00 -0.52 0.00 0.00 52.55 53.58 1r3n s ASP 273 Cb 0.20 -2.54 0.17 0.00 -1.46 0.00 0.00 42.92 39.29 1r3n s ASP 273 CO -0.08 -1.26 1.51 0.00 0.52 0.00 0.00 175.17 175.86 1r3n h ALA 274 N 10.15 0.75 0.13 3.66 0.00 -1.70 -2.93 119.26 129.32 1r3n h ALA 274 Ca -0.28 -0.58 -0.28 0.00 0.00 0.00 0.00 54.91 53.78 1r3n h ALA 274 Cb 1.11 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.83 1r3n h ALA 274 CO 1.05 0.76 -1.23 1.25 0.00 0.00 0.00 179.25 181.08 1r3n h LEU 275 N 0.20 0.50 -0.74 0.00 5.85 -1.92 0.03 115.31 119.24 1r3n h LEU 275 Ca -0.01 -0.51 -0.01 0.00 0.84 0.00 0.00 57.88 58.18 1r3n h LEU 275 Cb 1.19 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 42.03 1r3n h LEU 275 CO 0.10 1.38 0.42 0.25 -0.34 0.00 0.00 178.44 180.25 1r3n h LEU 276 N 0.11 0.91 -0.26 2.25 5.85 -1.95 -0.60 115.31 121.62 1r3n h LEU 276 Ca -0.14 -0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.46 1r3n h LEU 276 Cb 1.94 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 42.72 1r3n h LEU 276 CO 0.21 0.74 0.06 -0.03 -0.34 0.00 0.00 178.44 179.07 1r3n h MET 277 N 1.02 0.43 -0.97 1.25 4.05 -1.36 -1.94 114.93 117.41 1r3n h MET 277 Ca 0.26 -0.11 0.02 0.00 -0.28 0.00 0.00 59.70 59.60 1r3n h MET 277 Cb 0.02 -0.05 -0.05 0.00 -0.80 0.00 0.00 31.60 30.71 1r3n h MET 277 CO -0.04 0.53 0.63 0.77 0.23 0.00 0.00 176.91 179.03 1r3n h SER 278 N 0.25 1.08 -0.65 1.39 0.02 -0.88 -0.14 113.55 114.62 1r3n h SER 278 Ca 0.08 -0.02 0.02 0.00 -0.84 0.00 0.00 61.79 61.03 1r3n h SER 278 Cb 0.30 -0.26 -0.04 0.00 0.14 0.00 0.00 62.40 62.55 1r3n h SER 278 CO 0.00 0.76 0.42 0.28 -1.14 0.00 0.00 176.83 177.15 1r3n h SER 279 N 1.26 0.71 -0.77 3.07 0.02 -0.84 0.65 113.55 117.65 1r3n h SER 279 Ca 0.37 -0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 61.27 1r3n h SER 279 Cb -0.07 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.27 1r3n h SER 279 CO -0.10 0.51 0.33 0.11 -1.14 0.00 0.00 176.83 176.53 1r3n h LYS 280 N 0.84 1.13 -0.49 3.45 1.57 -0.64 -2.26 116.57 120.17 1r3n h LYS 280 Ca 0.25 -0.19 -0.02 0.00 -1.87 0.00 0.00 60.65 58.81 1r3n h LYS 280 Cb -0.05 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.04 1r3n h LYS 280 CO -0.07 0.91 0.22 0.52 -0.57 0.00 0.00 179.45 180.45 1r3n h MET 281 N 1.10 0.72 -0.05 3.15 2.86 -0.15 -1.05 114.93 121.52 1r3n h MET 281 Ca 0.26 -0.12 -0.00 0.00 -2.06 0.00 0.00 59.70 57.78 1r3n h MET 281 Cb 0.18 -0.12 -0.00 0.00 0.06 0.00 0.00 31.60 31.72 1r3n h MET 281 CO -0.03 0.62 0.02 0.82 1.06 0.00 0.00 176.91 179.41 1r3n h ILE 282 N 0.65 1.11 -0.76 -1.22 2.04 -0.79 0.83 117.51 119.37 1r3n h ILE 282 Ca 0.17 -0.33 0.09 0.00 1.00 0.00 0.00 64.86 65.78 1r3n h ILE 282 Cb 0.16 1.24 -0.07 0.00 -0.74 0.00 0.00 36.82 37.41 1r3n h ILE 282 CO -0.02 0.09 0.42 0.58 0.00 0.00 0.00 178.15 179.22 1r3n h VAL 283 N -0.05 0.91 -0.32 1.67 2.07 -1.34 -1.21 116.25 117.97 1r3n h VAL 283 Ca 0.02 -0.25 -0.17 0.00 0.82 0.00 0.00 66.70 67.12 1r3n h VAL 283 Cb 0.13 0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 30.02 1r3n h VAL 283 CO -0.00 0.13 -0.46 0.00 0.02 0.00 0.00 177.57 177.26 1r3n h ALA 284 N 1.42 0.49 -0.67 1.67 0.00 -0.77 -2.04 119.26 119.36 1r3n h ALA 284 Ca 0.36 -0.48 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 1r3n h ALA 284 Cb 0.32 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1r3n h ALA 284 CO -0.24 0.65 0.24 0.00 0.00 0.00 0.00 179.25 179.90 1r3n h ALA 285 N 0.71 0.88 -0.23 0.00 0.00 -0.59 -1.55 119.26 118.49 1r3n h ALA 285 Ca 0.03 -0.19 0.06 0.00 0.00 0.00 0.00 54.91 54.81 1r3n h ALA 285 Cb 1.06 -0.26 -0.06 0.00 0.00 0.00 0.00 17.79 18.52 1r3n h ALA 285 CO 0.11 0.52 -0.21 1.03 0.00 0.00 0.00 179.25 180.70 1r3n h SER 286 N 0.97 -0.66 -0.55 0.00 0.87 -1.08 -1.15 113.55 111.95 1r3n h SER 286 Ca 0.22 0.13 -0.02 0.00 -1.23 0.00 0.00 61.79 60.89 1r3n h SER 286 Cb 0.25 0.32 -0.03 0.00 -0.44 0.00 0.00 62.40 62.50 1r3n h SER 286 CO -0.01 -0.25 0.29 -0.33 -0.53 0.00 0.00 176.83 176.00 1r3n h GLU 287 N -0.22 0.81 -0.21 2.24 5.08 -1.01 -2.05 114.58 119.22 1r3n h GLU 287 Ca 0.13 -0.10 -0.07 0.00 -1.00 0.00 0.00 59.36 58.33 1r3n h GLU 287 Cb 0.42 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1r3n h GLU 287 CO -0.35 0.62 -0.13 0.82 -1.00 0.00 0.00 179.01 178.97 1r3n h ILE 288 N 0.81 1.31 -0.60 3.13 2.04 -0.94 -2.21 117.51 121.05 1r3n h ILE 288 Ca 0.20 -1.22 0.05 0.00 1.00 0.00 0.00 64.86 64.89 1r3n h ILE 288 Cb 0.07 1.65 -0.05 0.00 -0.74 0.00 0.00 36.82 37.75 1r3n h ILE 288 CO -0.03 0.37 0.33 0.00 0.00 0.00 0.00 178.15 178.82 1r3n h ALA 289 N 0.69 0.79 -0.76 1.87 0.00 -0.94 -2.60 119.26 118.31 1r3n h ALA 289 Ca 0.04 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1r3n h ALA 289 Cb 0.63 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 1r3n h ALA 289 CO 0.04 0.01 0.42 1.96 0.00 0.00 0.00 179.25 181.67 1r3n h GLN 290 N 0.63 1.05 -0.75 0.00 4.20 -1.33 0.43 115.11 119.35 1r3n h GLN 290 Ca 0.26 -0.12 0.04 0.00 0.06 0.00 0.00 58.65 58.89 1r3n h GLN 290 Cb 0.13 -0.21 -0.04 0.00 0.30 0.00 0.00 27.48 27.66 1r3n h GLN 290 CO -0.16 0.78 0.49 -0.09 -0.67 0.00 0.00 178.83 179.19 1r3n h ARG 291 N 1.05 0.85 -0.67 1.46 2.43 -1.03 -1.57 114.38 116.90 1r3n h ARG 291 Ca 0.27 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.39 1r3n h ARG 291 Cb 0.03 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.39 1r3n h ARG 291 CO -0.04 0.56 0.00 0.72 -1.51 0.00 0.00 179.97 179.70 1r3n n HIS 292 N -4.46 1.15 -4.19 2.20 8.25 -1.03 -4.95 115.22 112.19 1r3n n HIS 292 Ca 0.10 -0.51 -0.33 0.00 -0.26 0.00 0.00 57.72 56.72 1r3n n HIS 292 Cb 0.15 -0.11 -0.04 0.00 1.12 0.00 0.00 29.99 31.11 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 1.28 -1.82 -0.86 0.41 2.85 -0.59 -4.99 115.26 111.54 1r3n n ASN 293 Ca 0.23 -1.06 0.00 0.00 -0.11 0.00 0.00 54.58 53.64 1r3n n ASN 293 Cb 0.70 -2.61 0.00 0.00 1.24 0.00 0.00 39.78 39.11 1r3n n ASN 293 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1r3n n GLY 294 N -1.68 4.50 3.17 8.20 0.00 0.07 -4.89 105.19 114.55 1r3n n GLY 294 Ca -0.08 -2.10 -0.21 0.00 0.00 0.00 0.00 46.02 43.63 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 2.18 -0.01 0.99 1.43 0.06 -4.32 118.68 119.00 1r3n s LEU 295 Ca 0.00 -0.48 0.01 0.00 -1.03 0.00 0.00 54.13 52.63 1r3n s LEU 295 Cb 0.00 -0.67 0.01 0.00 0.03 0.00 0.00 46.19 45.56 1r3n s LEU 295 CO 0.00 0.05 -0.03 0.12 0.23 0.00 0.00 176.35 176.72 1r3n s PHE 296 N -0.86 0.42 -0.00 0.29 5.36 -1.26 -0.86 117.98 121.07 1r3n s PHE 296 Ca 0.03 -0.07 0.00 0.00 -0.96 0.00 0.00 56.93 55.92 1r3n s PHE 296 Cb -0.08 -0.34 0.00 0.00 -0.34 0.00 0.00 43.02 42.26 1r3n s PHE 296 CO 0.01 -0.06 0.00 0.99 -1.46 0.00 0.00 175.22 174.71 1r3n s THR 297 N 0.27 0.01 -0.30 0.12 2.01 -0.55 -4.90 115.64 112.31 1r3n s THR 297 Ca -0.03 0.02 -0.06 0.00 0.31 0.00 0.00 61.69 61.94 1r3n s THR 297 Cb -0.06 -0.04 0.02 0.00 0.01 0.00 0.00 72.50 72.43 1r3n s THR 297 CO -0.00 0.02 0.06 0.00 -0.69 0.00 0.00 174.62 174.00 1r3n n GLY 299 N 4.81 -0.65 3.03 0.00 0.00 -1.26 -4.95 105.19 106.17 1r3n n GLY 299 Ca -0.14 -0.41 -0.22 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 -2.88 0.93 -0.07 -0.61 1.01 -1.26 -5.03 121.20 113.29 1r3n s ILE 300 Ca -0.01 -0.43 -0.07 0.00 0.00 0.00 0.00 60.65 60.13 1r3n s ILE 300 Cb 0.11 -0.82 0.02 0.00 0.01 0.00 0.00 42.46 41.77 1r3n s ILE 300 CO 0.67 0.29 0.20 -0.51 0.00 0.00 0.00 174.94 175.59 1r3n s ILE 301 N 0.21 0.01 -0.11 2.92 2.07 -1.26 -1.98 121.20 123.06 1r3n s ILE 301 Ca -0.04 -0.06 -0.05 0.00 -1.41 0.00 0.00 60.65 59.09 1r3n s ILE 301 Cb -0.10 -0.31 0.05 0.00 0.13 0.00 0.00 42.46 42.23 1r3n s ILE 301 CO 0.01 -0.03 0.25 -1.81 -1.91 0.00 0.00 174.94 171.45 1r3n s ASP 302 N -0.02 -0.24 -0.10 4.50 1.01 -0.00 -5.00 116.67 116.82 1r3n s ASP 302 Ca -0.01 0.54 0.00 0.00 0.71 0.00 0.00 52.55 53.79 1r3n s ASP 302 Cb -0.02 0.43 -0.02 0.00 1.01 0.00 0.00 42.92 44.32 1r3n s ASP 302 CO 0.00 -0.17 -0.10 0.00 0.21 0.00 0.00 175.17 175.11 1r3n s ALA 303 N 1.33 2.78 0.04 5.23 0.00 -1.26 -0.96 121.76 128.91 1r3n s ALA 303 Ca -0.09 -0.90 0.04 0.00 0.00 0.00 0.00 51.96 51.02 1r3n s ALA 303 Cb -0.10 -1.21 -0.04 0.00 0.00 0.00 0.00 23.12 21.77 1r3n s ALA 303 CO -0.09 0.40 -0.06 0.15 0.00 0.00 0.00 175.76 176.16 1r3n s LYS 304 N -0.21 2.45 0.00 0.00 1.02 0.83 -3.45 119.74 120.39 1r3n s LYS 304 Ca 0.02 -0.81 0.17 0.00 0.02 0.00 0.00 55.97 55.36 1r3n s LYS 304 Cb -0.13 -2.46 0.54 0.00 -0.52 0.00 0.00 37.83 35.25 1r3n s LYS 304 CO 0.03 0.57 1.42 -0.35 -0.92 0.00 0.00 175.35 176.10 1r3n n PRO 305 N 1.19 1.92 -1.95 -1.68 -0.05 -1.26 -1.03 135.00 132.14 1r3n n PRO 305 Ca -0.14 -1.40 -0.01 0.00 -0.05 0.00 0.00 63.50 61.90 1r3n n PRO 305 Cb 0.52 -1.37 0.00 0.00 -0.05 0.00 0.00 33.50 32.60 1r3n n PRO 305 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 175.50 176.43 1r3n n TYR 306 N 0.62 -0.96 -3.74 0.54 9.36 -1.22 -5.10 117.16 116.66 1r3n n TYR 306 Ca 0.15 0.38 -0.13 0.00 3.32 0.00 0.00 57.90 61.61 1r3n n TYR 306 Cb 0.37 -2.29 -0.09 0.00 -0.63 0.00 0.00 39.34 36.70 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 -1.99 -0.30 0.63 2.98 0.01 -1.26 -5.01 113.70 108.75 1r3n s SER 307 Ca 0.03 0.40 0.35 0.00 1.31 0.00 0.00 55.95 58.04 1r3n s SER 307 Cb -0.01 0.51 2.02 0.00 0.21 0.00 0.00 66.02 68.75 1r3n s SER 307 CO 0.23 -0.33 2.25 0.58 0.41 0.00 0.00 173.24 176.38 1r3n h VAL 308 N 4.08 0.28 0.00 3.43 2.07 -2.04 -3.01 116.25 121.06 1r3n h VAL 308 Ca -0.28 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.24 1r3n h VAL 308 Cb 1.18 0.95 0.00 0.00 -1.52 0.00 0.00 31.29 31.89 1r3n h VAL 308 CO 0.35 0.00 -0.97 -3.20 0.02 0.00 0.00 177.57 173.76 1r3n n ASN 309 N -3.48 0.84 -4.14 0.57 4.05 -1.26 -4.92 115.26 106.92 1r3n n ASN 309 Ca -0.02 -0.72 -0.29 0.00 0.45 0.00 0.00 54.58 54.00 1r3n n ASN 309 Cb 0.14 1.15 -0.17 0.00 1.23 0.00 0.00 39.78 42.13 1r3n n ASN 309 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 1r3n s ILE 310 N -2.68 1.66 0.07 -1.44 1.01 -1.14 0.14 121.20 118.83 1r3n s ILE 310 Ca 0.04 -0.79 -0.31 0.00 0.00 0.00 0.00 60.65 59.59 1r3n s ILE 310 Cb 0.12 -1.45 -0.09 0.00 0.01 0.00 0.00 42.46 41.05 1r3n s ILE 310 CO 0.69 0.47 1.85 -0.63 0.00 0.00 0.00 174.94 177.32 1r3n s ILE 311 N 0.42 2.84 0.24 2.92 1.01 0.11 -4.66 121.20 124.07 1r3n s ILE 311 Ca -0.16 0.13 -0.31 0.00 0.00 0.00 0.00 60.65 60.31 1r3n s ILE 311 Cb -0.16 -3.09 -0.12 0.00 0.01 0.00 0.00 42.46 39.10 1r3n s ILE 311 CO 0.06 -0.01 1.68 -2.65 0.00 0.00 0.00 174.94 174.03 1r3n n PRO 312 N 6.45 2.77 -0.00 2.79 -0.02 -1.26 -3.11 135.00 142.62 1r3n n PRO 312 Ca 0.18 1.00 0.10 0.00 -2.02 0.00 0.00 63.50 62.76 1r3n n PRO 312 Cb 0.40 -2.82 -0.11 0.00 -0.02 0.00 0.00 33.50 30.95 1r3n n PRO 312 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1r3n n GLY 313 N 3.26 -1.03 3.07 -1.23 0.00 -0.20 -1.90 105.19 107.17 1r3n n GLY 313 Ca 0.13 -0.56 -0.12 0.00 0.00 0.00 0.00 46.02 45.47 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 -3.14 0.21 -0.05 1.61 2.12 -1.11 0.47 118.70 118.81 1r3n s GLU 314 Ca 0.04 0.59 0.02 0.00 0.36 0.00 0.00 54.97 55.97 1r3n s GLU 314 Cb 0.15 -0.10 0.02 0.00 0.26 0.00 0.00 34.13 34.46 1r3n s GLU 314 CO 0.87 -0.18 -0.07 0.08 -0.54 0.00 0.00 175.26 175.41 1r3n s VAL 315 N 1.47 0.71 -0.09 3.70 1.01 -0.60 -0.12 120.40 126.49 1r3n s VAL 315 Ca -0.08 -0.25 0.01 0.00 0.00 0.00 0.00 61.98 61.67 1r3n s VAL 315 Cb -0.10 -0.69 -0.02 0.00 0.00 0.00 0.00 36.38 35.56 1r3n s VAL 315 CO -0.09 0.26 -0.11 -0.44 0.00 0.00 0.00 175.10 174.72 1r3n s SER 316 N 0.72 4.26 0.07 3.32 0.01 -0.14 -0.21 113.70 121.74 1r3n s SER 316 Ca -0.11 -0.18 -0.07 0.00 1.31 0.00 0.00 55.95 56.90 1r3n s SER 316 Cb -0.14 -1.22 -0.01 0.00 0.21 0.00 0.00 66.02 64.86 1r3n s SER 316 CO 0.01 0.29 0.14 0.72 0.41 0.00 0.00 173.24 174.80 1r3n s PHE 317 N -0.36 0.22 0.13 2.43 -0.12 -0.15 -0.82 117.98 119.30 1r3n s PHE 317 Ca 0.04 -0.65 0.04 0.00 -0.05 0.00 0.00 56.93 56.31 1r3n s PHE 317 Cb -0.12 -0.13 -0.04 0.00 -0.63 0.00 0.00 43.02 42.09 1r3n s PHE 317 CO 0.02 -0.48 0.15 0.95 -0.05 0.00 0.00 175.22 175.81 1r3n s THR 318 N -3.63 4.70 -0.10 -4.49 -4.23 -0.84 -0.64 115.64 106.41 1r3n s THR 318 Ca 0.03 -0.87 0.00 0.00 -1.18 0.00 0.00 61.69 59.68 1r3n s THR 318 Cb 0.04 -3.36 0.02 0.00 1.34 0.00 0.00 72.50 70.55 1r3n s THR 318 CO -0.10 -0.02 -0.09 -0.76 -0.54 0.00 0.00 174.62 173.11 1r3n s LEU 319 N -2.87 1.35 -0.41 4.79 1.43 0.11 -4.20 118.68 118.88 1r3n s LEU 319 Ca 0.31 -0.32 -0.04 0.00 -1.03 0.00 0.00 54.13 53.05 1r3n s LEU 319 Cb -0.11 -0.86 0.10 0.00 0.03 0.00 0.00 46.19 45.35 1r3n s LEU 319 CO 0.24 -0.07 0.21 -0.62 0.23 0.00 0.00 176.35 176.33 1r3n s ASP 320 N 1.41 5.32 -0.06 2.29 2.15 0.25 -0.35 116.67 127.69 1r3n s ASP 320 Ca -0.00 -1.87 -0.08 0.00 0.43 0.00 0.00 52.55 51.03 1r3n s ASP 320 Cb -0.13 -1.86 -0.04 0.00 -0.30 0.00 0.00 42.92 40.58 1r3n s ASP 320 CO -0.05 -0.53 0.22 -0.36 -0.17 0.00 0.00 175.17 174.27 1r3n s PHE 321 N 1.22 3.61 -0.02 -5.34 0.40 -0.47 -1.48 117.98 115.90 1r3n s PHE 321 Ca 0.06 0.60 -0.03 0.00 -0.60 0.00 0.00 56.93 56.96 1r3n s PHE 321 Cb -0.23 -2.00 0.00 0.00 0.51 0.00 0.00 43.02 41.31 1r3n s PHE 321 CO -0.03 0.68 0.07 1.03 0.70 0.00 0.00 175.22 177.68 1r3n s ARG 322 N -1.31 0.18 -0.19 0.44 0.52 -0.04 -1.28 118.95 117.27 1r3n s ARG 322 Ca 0.21 -0.08 -0.25 0.00 -0.52 0.00 0.00 55.73 55.08 1r3n s ARG 322 Cb -0.13 0.08 0.07 0.00 0.52 0.00 0.00 34.95 35.48 1r3n s ARG 322 CO 0.10 -0.03 0.67 -1.58 0.02 0.00 0.00 175.30 174.48 1r3n s HIS 323 N -0.40 -0.71 0.38 -0.53 2.46 -0.88 -0.76 115.29 114.84 1r3n s HIS 323 Ca -0.05 1.60 0.15 0.00 0.47 0.00 0.00 55.06 57.23 1r3n s HIS 323 Cb -0.03 0.29 1.01 0.00 -0.13 0.00 0.00 32.58 33.73 1r3n s HIS 323 CO 0.00 -0.43 1.79 -1.35 -2.47 0.00 0.00 174.74 172.28 1r3n h PRO 324 N 4.47 0.47 -5.50 2.88 0.11 -1.90 0.34 132.00 132.87 1r3n h PRO 324 Ca -0.28 -0.03 -0.64 0.00 0.11 0.00 0.00 66.00 65.16 1r3n h PRO 324 Cb 1.16 -0.11 -0.14 0.00 0.11 0.00 0.00 31.00 32.02 1r3n h PRO 324 CO 0.17 0.31 -0.56 0.45 -0.21 0.00 0.00 178.00 178.16 1r3n s SER 325 N -5.36 5.72 0.24 -2.05 0.15 -1.26 -4.41 113.70 106.73 1r3n s SER 325 Ca -0.09 0.18 -0.07 0.00 0.70 0.00 0.00 55.95 56.67 1r3n s SER 325 Cb 0.25 -1.89 0.23 0.00 -1.71 0.00 0.00 66.02 62.91 1r3n s SER 325 CO 0.80 0.27 1.91 0.44 1.20 0.00 0.00 173.24 177.85 1r3n h ASP 326 N 6.02 1.11 -0.36 5.45 3.45 -1.95 -2.18 116.42 127.95 1r3n h ASP 326 Ca -0.44 -0.04 -0.14 0.00 0.43 0.00 0.00 57.03 56.84 1r3n h ASP 326 Cb 1.18 -0.28 -0.01 0.00 -0.56 0.00 0.00 39.33 39.67 1r3n h ASP 326 CO 0.65 0.82 -0.31 0.44 -1.57 0.00 0.00 179.24 179.27 1r3n h ASP 327 N 1.29 0.90 0.55 6.45 3.32 -1.97 -1.96 116.42 125.01 1r3n h ASP 327 Ca 0.34 -0.45 -0.11 0.00 0.02 0.00 0.00 57.03 56.83 1r3n h ASP 327 Cb -0.11 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.17 1r3n h ASP 327 CO -0.07 1.16 -0.53 0.58 -1.72 0.00 0.00 179.24 178.67 1r3n h VAL 328 N 0.64 1.36 -0.41 -1.35 2.07 -1.96 -1.75 116.25 114.85 1r3n h VAL 328 Ca 0.06 -1.81 -0.06 0.00 0.82 0.00 0.00 66.70 65.71 1r3n h VAL 328 Cb 0.89 1.98 -0.02 0.00 -1.52 0.00 0.00 31.29 32.63 1r3n h VAL 328 CO 0.08 0.51 0.02 0.25 0.02 0.00 0.00 177.57 178.45 1r3n h LEU 329 N 0.00 0.70 -1.06 2.57 5.85 -1.24 0.05 115.31 122.17 1r3n h LEU 329 Ca -0.01 -0.30 -0.00 0.00 0.84 0.00 0.00 57.88 58.42 1r3n h LEU 329 Cb 0.94 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.74 1r3n h LEU 329 CO 0.07 0.82 0.55 0.00 -0.34 0.00 0.00 178.44 179.54 1r3n h ALA 330 N 0.90 1.30 -0.56 1.25 0.00 -1.15 -1.79 119.26 119.22 1r3n h ALA 330 Ca 0.12 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 1r3n h ALA 330 Cb 0.45 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1r3n h ALA 330 CO 0.02 0.61 -0.02 1.15 0.00 0.00 0.00 179.25 181.01 1r3n h THR 331 N 1.21 1.27 -0.66 0.00 2.02 -1.05 -1.95 112.91 113.75 1r3n h THR 331 Ca 0.32 -1.15 -0.01 0.00 0.77 0.00 0.00 66.41 66.34 1r3n h THR 331 Cb -0.08 0.89 -0.03 0.00 -1.74 0.00 0.00 68.15 67.19 1r3n h THR 331 CO -0.06 0.41 0.39 0.24 0.37 0.00 0.00 175.52 176.87 1r3n h MET 332 N 0.88 0.90 -0.37 6.66 2.07 -0.54 -1.42 114.93 123.11 1r3n h MET 332 Ca 0.16 -0.09 -0.16 0.00 -2.07 0.00 0.00 59.70 57.54 1r3n h MET 332 Cb 0.57 -0.19 -0.01 0.00 -1.87 0.00 0.00 31.60 30.11 1r3n h MET 332 CO 0.03 0.65 -0.40 -0.07 1.07 0.00 0.00 176.91 178.19 1r3n h LEU 333 N 0.90 0.99 -0.66 1.22 3.38 -1.20 -1.34 115.31 118.59 1r3n h LEU 333 Ca 0.24 -0.46 -0.04 0.00 0.09 0.00 0.00 57.88 57.71 1r3n h LEU 333 Cb -0.01 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.43 1r3n h LEU 333 CO -0.04 1.26 0.27 0.50 0.09 0.00 0.00 178.44 180.52 1r3n h LYS 334 N 0.74 0.97 -0.12 1.13 3.64 -1.20 -0.87 116.57 120.87 1r3n h LYS 334 Ca 0.06 -0.17 -0.18 0.00 -1.27 0.00 0.00 60.65 59.08 1r3n h LYS 334 Cb 1.00 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 32.65 1r3n h LYS 334 CO 0.10 0.81 -0.69 0.93 -2.27 0.00 0.00 179.45 178.33 1r3n h GLU 335 N 0.92 0.52 -0.01 1.90 5.08 -1.18 -2.23 114.58 119.59 1r3n h GLU 335 Ca 0.22 -0.39 -0.00 0.00 -1.00 0.00 0.00 59.36 58.18 1r3n h GLU 335 Cb 0.19 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.51 1r3n h GLU 335 CO -0.02 1.02 0.00 0.00 -1.00 0.00 0.00 179.01 179.01 1r3n h ALA 336 N 0.88 0.01 -0.90 3.43 0.00 -1.15 -1.60 119.26 119.93 1r3n h ALA 336 Ca -0.02 -0.14 0.14 0.00 0.00 0.00 0.00 54.91 54.89 1r3n h ALA 336 Cb 1.27 -0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.96 1r3n h ALA 336 CO 0.13 -0.35 0.51 0.00 0.00 0.00 0.00 179.25 179.53 1r3n h ALA 337 N 0.74 1.37 -0.54 0.00 0.00 -1.11 0.74 119.26 120.46 1r3n h ALA 337 Ca 0.00 0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 1r3n h ALA 337 Cb 0.27 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1r3n h ALA 337 CO 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 179.25 179.15 1r3n h ALA 338 N 1.55 0.74 -0.05 0.00 0.00 -1.29 -0.89 119.26 119.33 1r3n h ALA 338 Ca 0.48 -0.35 -0.15 0.00 0.00 0.00 0.00 54.91 54.89 1r3n h ALA 338 Cb 0.62 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1r3n h ALA 338 CO -0.33 0.66 -0.65 1.49 0.00 0.00 0.00 179.25 180.42 1r3n h GLU 339 N 0.91 0.19 -0.34 0.00 4.57 -0.20 -2.01 114.58 117.70 1r3n h GLU 339 Ca 0.14 -0.14 -0.06 0.00 -1.18 0.00 0.00 59.36 58.12 1r3n h GLU 339 Cb 0.67 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.28 1r3n h GLU 339 CO 0.05 0.77 -0.03 0.74 -1.18 0.00 0.00 179.01 179.36 1r3n h PHE 340 N 0.14 0.68 0.00 0.92 0.05 -0.79 -0.26 116.94 117.67 1r3n h PHE 340 Ca -0.01 -0.13 0.00 0.00 3.82 0.00 0.00 57.97 61.65 1r3n h PHE 340 Cb 1.17 -0.17 0.00 0.00 2.00 0.00 0.00 35.95 38.95 1r3n h PHE 340 CO 0.02 0.75 0.00 -0.44 -0.18 0.00 0.00 178.31 178.46 1r3n h ASP 341 N 0.41 0.00 0.00 2.17 3.32 -1.04 -1.06 116.42 120.22 1r3n h ASP 341 Ca 0.09 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.06 1r3n h ASP 341 Cb 0.50 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.04 1r3n h ASP 341 CO 0.02 0.00 -0.49 -0.09 -1.72 0.00 0.00 179.24 176.96 1r3n h ARG 342 N 0.00 0.00 -0.70 3.56 2.43 -1.02 -3.40 114.38 115.25 1r3n h ARG 342 Ca 0.00 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 1r3n h ARG 342 Cb 0.28 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.80 1r3n h ARG 342 CO 0.00 0.70 0.34 -0.07 -1.51 0.00 0.00 179.97 179.43 1r3n h LEU 343 N -1.00 0.89 -2.31 3.80 3.38 -0.85 -2.71 115.31 116.52 1r3n h LEU 343 Ca -0.12 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.76 1r3n h LEU 343 Cb 0.87 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.39 1r3n h LEU 343 CO -0.07 0.75 0.05 -0.29 0.09 0.00 0.00 178.44 178.96 1r3n h ILE 344 N 0.99 0.00 0.00 1.22 6.09 -1.39 -1.43 117.51 122.98 1r3n h ILE 344 Ca 0.24 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.73 1r3n h ILE 344 Cb 0.09 0.77 0.00 0.00 0.47 0.00 0.00 36.82 38.15 1r3n h ILE 344 CO -0.03 0.00 -1.43 0.29 -3.07 0.00 0.00 178.15 173.91 1r3n n LYS 345 N -2.75 0.31 -2.80 2.19 5.02 -1.02 -1.69 118.16 117.42 1r3n n LYS 345 Ca -0.02 -0.09 -0.43 0.00 -2.02 0.00 0.00 58.31 55.75 1r3n n LYS 345 Cb 0.10 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.58 1r3n n LYS 345 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1r3n s ILE 346 N -3.22 4.45 -0.30 -0.18 -1.09 -0.54 -4.59 121.20 115.74 1r3n s ILE 346 Ca 0.01 -1.30 -0.09 0.00 -2.23 0.00 0.00 60.65 57.04 1r3n s ILE 346 Cb 0.15 -4.88 0.16 0.00 -1.58 0.00 0.00 42.46 36.31 1r3n s ILE 346 CO 0.88 -1.66 0.75 0.21 -1.23 0.00 0.00 174.94 173.89 1r3n s ASN 347 N 4.09 -1.03 0.29 3.58 2.47 -1.26 -5.04 114.94 118.05 1r3n s ASN 347 Ca 0.37 1.11 0.03 0.00 0.42 0.00 0.00 52.86 54.79 1r3n s ASN 347 Cb -0.03 2.05 0.61 0.00 -1.45 0.00 0.00 41.25 42.43 1r3n s ASN 347 CO -0.10 -0.19 1.81 0.44 -3.72 0.00 0.00 177.10 175.34 1r3n h ASP 348 N 7.89 0.84 0.00 -4.21 3.32 -1.88 -0.54 116.42 121.84 1r3n h ASP 348 Ca -0.18 0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.94 1r3n h ASP 348 Cb 1.13 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.58 1r3n h ASP 348 CO 0.12 0.39 0.00 0.61 -1.72 0.00 0.00 179.24 178.64 1r3n n GLY 349 N -1.34 -0.70 0.00 2.75 0.00 -1.12 -4.87 105.19 99.92 1r3n n GLY 349 Ca 0.20 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.12 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 0.33 3.00 3.75 -0.02 0.00 -0.21 -4.83 105.19 107.22 1r3n n GLY 350 Ca 0.12 -1.95 -0.41 0.00 0.00 0.00 0.00 46.02 43.78 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 -2.96 3.47 0.86 4.61 0.00 -1.26 -4.56 121.76 121.93 1r3n s ALA 351 Ca 0.00 1.05 -0.08 0.00 0.00 0.00 0.00 51.96 52.93 1r3n s ALA 351 Cb 0.00 -3.43 0.16 0.00 0.00 0.00 0.00 23.12 19.85 1r3n s ALA 351 CO 0.00 -0.42 0.98 1.28 0.00 0.00 0.00 175.76 177.60 1r3n n LEU 352 N 1.87 0.00 -4.16 0.00 4.32 -0.68 -5.02 117.00 113.33 1r3n n LEU 352 Ca 0.03 -1.44 -0.10 0.00 -0.02 0.00 0.00 56.01 54.48 1r3n n LEU 352 Cb 0.44 -0.71 -0.10 0.00 -1.62 0.00 0.00 43.42 41.43 1r3n n LEU 352 CO 0.57 -1.12 -0.29 -0.94 -1.22 0.00 0.00 177.39 174.39 1r3n s SER 353 N -4.73 0.31 0.02 -1.43 1.04 -1.08 -4.71 113.70 103.12 1r3n s SER 353 Ca 0.59 -1.23 -0.11 0.00 0.48 0.00 0.00 55.95 55.68 1r3n s SER 353 Cb -0.02 0.30 0.01 0.00 0.10 0.00 0.00 66.02 66.41 1r3n s SER 353 CO 0.40 -0.74 0.23 -0.72 0.98 0.00 0.00 173.24 173.40 1r3n s TYR 354 N -4.05 -0.03 0.16 5.02 -0.85 -1.26 -0.37 117.35 115.97 1r3n s TYR 354 Ca 0.26 -0.09 0.09 0.00 -0.52 0.00 0.00 57.07 56.81 1r3n s TYR 354 Cb 0.07 0.02 -0.04 0.00 0.38 0.00 0.00 41.96 42.39 1r3n s TYR 354 CO 0.03 -0.41 -0.20 -1.83 -1.52 0.00 0.00 175.55 171.62 1r3n s GLU 355 N -2.09 1.28 0.05 -3.49 -1.05 -0.36 -4.97 118.70 108.06 1r3n s GLU 355 Ca -0.09 -1.37 0.07 0.00 -0.15 0.00 0.00 54.97 53.43 1r3n s GLU 355 Cb -0.03 -1.41 -0.03 0.00 -0.44 0.00 0.00 34.13 32.22 1r3n s GLU 355 CO -0.01 0.30 -0.19 0.45 0.95 0.00 0.00 175.26 176.76 1r3n s SER 356 N -2.51 2.24 -0.03 0.83 0.15 -1.26 -1.03 113.70 112.08 1r3n s SER 356 Ca 0.15 -0.53 -0.01 0.00 0.70 0.00 0.00 55.95 56.25 1r3n s SER 356 Cb -0.07 -0.16 0.03 0.00 -1.71 0.00 0.00 66.02 64.11 1r3n s SER 356 CO 0.07 0.10 0.05 -0.70 1.20 0.00 0.00 173.24 173.96 1r3n s GLU 357 N -1.30 -0.04 -0.05 5.44 2.12 0.22 -4.98 118.70 120.12 1r3n s GLU 357 Ca 0.05 0.27 -0.30 0.00 0.36 0.00 0.00 54.97 55.36 1r3n s GLU 357 Cb -0.09 -0.31 -0.04 0.00 0.26 0.00 0.00 34.13 33.95 1r3n s GLU 357 CO 0.02 -0.22 1.25 0.99 -0.54 0.00 0.00 175.26 176.77 1r3n s THR 358 N 1.43 4.13 -0.20 -1.70 2.01 -1.26 -0.06 115.64 119.99 1r3n s THR 358 Ca -0.05 1.46 -0.16 0.00 0.31 0.00 0.00 61.69 63.25 1r3n s THR 358 Cb -0.13 -3.94 -0.20 0.00 0.01 0.00 0.00 72.50 68.25 1r3n s THR 358 CO -0.03 -0.01 0.16 0.18 -0.69 0.00 0.00 174.62 174.22 1r3n n LEU 359 N 5.36 2.12 -3.51 4.42 4.77 -0.35 -4.94 117.00 124.87 1r3n n LEU 359 Ca 0.12 0.33 -0.16 0.00 -0.03 0.00 0.00 56.01 56.27 1r3n n LEU 359 Cb 0.45 -0.99 -0.05 0.00 -2.33 0.00 0.00 43.42 40.51 1r3n n LEU 359 CO 0.56 0.49 0.49 -1.58 -1.33 0.00 0.00 177.39 176.02 1r3n s GLN 360 N -2.44 1.02 -0.01 3.23 0.74 -1.22 -5.02 119.66 115.97 1r3n s GLN 360 Ca -0.29 0.09 -0.04 0.00 0.05 0.00 0.00 55.36 55.18 1r3n s GLN 360 Cb 0.07 0.48 -0.00 0.00 1.10 0.00 0.00 33.01 34.66 1r3n s GLN 360 CO 0.62 -0.35 0.08 0.08 -0.55 0.00 0.00 175.29 175.17 1r3n s VAL 361 N -1.71 0.06 -0.20 1.34 1.01 -1.26 -0.67 120.40 118.97 1r3n s VAL 361 Ca -0.07 -0.48 -0.07 0.00 0.00 0.00 0.00 61.98 61.36 1r3n s VAL 361 Cb -0.00 -0.28 0.09 0.00 0.00 0.00 0.00 36.38 36.19 1r3n s VAL 361 CO 0.04 -0.26 0.43 -0.55 0.00 0.00 0.00 175.10 174.75 1r3n s SER 362 N -0.85 -0.30 0.71 3.32 0.15 -0.23 -5.00 113.70 111.50 1r3n s SER 362 Ca -0.09 1.00 -0.14 0.00 0.70 0.00 0.00 55.95 57.42 1r3n s SER 362 Cb -0.06 1.33 0.03 0.00 -1.71 0.00 0.00 66.02 65.61 1r3n s SER 362 CO 0.00 -0.23 1.12 -2.84 1.20 0.00 0.00 173.24 172.49 1r3n s PRO 363 N 2.52 2.50 0.45 5.44 0.02 -1.26 -0.69 135.00 143.97 1r3n s PRO 363 Ca -0.02 1.39 -0.25 0.00 0.02 0.00 0.00 61.00 62.13 1r3n s PRO 363 Cb -0.12 -1.91 -0.08 0.00 0.02 0.00 0.00 34.50 32.41 1r3n s PRO 363 CO -0.13 -1.49 1.33 0.00 -0.33 0.00 0.00 177.00 176.38 1r3n s ALA 364 N -2.46 3.13 -0.17 -1.55 0.00 -1.26 -4.52 121.76 114.94 1r3n s ALA 364 Ca 0.66 1.27 0.00 0.00 0.00 0.00 0.00 51.96 53.90 1r3n s ALA 364 Cb -0.21 -3.52 0.01 0.00 0.00 0.00 0.00 23.12 19.40 1r3n s ALA 364 CO 0.46 -1.00 -0.17 0.08 0.00 0.00 0.00 175.76 175.13 1r3n s VAL 365 N -1.29 2.45 -0.29 0.00 1.01 -0.33 -4.91 120.40 117.03 1r3n s VAL 365 Ca 0.62 -0.83 -0.11 0.00 0.00 0.00 0.00 61.98 61.65 1r3n s VAL 365 Cb -0.39 -2.04 -0.04 0.00 0.00 0.00 0.00 36.38 33.92 1r3n s VAL 365 CO 0.49 0.52 0.20 0.20 0.00 0.00 0.00 175.10 176.50 1r3n s ASN 366 N 1.06 6.00 0.65 3.32 -0.87 -1.26 -0.27 114.94 123.56 1r3n s ASN 366 Ca -0.01 -0.13 -0.13 0.00 -1.57 0.00 0.00 52.86 51.03 1r3n s ASN 366 Cb -0.14 -2.12 -0.01 0.00 -0.02 0.00 0.00 41.25 38.96 1r3n s ASN 366 CO -0.05 -0.10 1.05 -0.36 -2.57 0.00 0.00 177.10 175.07 1r3n s PHE 367 N 1.74 3.09 0.16 2.20 0.08 -0.46 -4.98 117.98 119.82 1r3n s PHE 367 Ca 0.07 1.45 -0.30 0.00 0.12 0.00 0.00 56.93 58.27 1r3n s PHE 367 Cb -0.16 -2.92 -0.08 0.00 -0.57 0.00 0.00 43.02 39.29 1r3n s PHE 367 CO 0.11 -1.14 1.31 -1.58 -0.10 0.00 0.00 175.22 173.82 1r3n s HIS 368 N -2.81 3.28 0.41 0.36 2.46 -0.56 -4.92 115.29 113.50 1r3n s HIS 368 Ca 0.60 1.16 0.12 0.00 0.47 0.00 0.00 55.06 57.41 1r3n s HIS 368 Cb -0.14 -3.60 0.95 0.00 -0.13 0.00 0.00 32.58 29.66 1r3n s HIS 368 CO 0.47 -1.93 1.95 1.49 -2.47 0.00 0.00 174.74 174.26 1r3n h GLU 369 N 5.93 0.50 -0.17 2.88 4.57 -1.93 -0.72 114.58 125.63 1r3n h GLU 369 Ca -0.44 -0.03 -0.09 0.00 -1.18 0.00 0.00 59.36 57.63 1r3n h GLU 369 Cb 1.21 -0.11 -0.00 0.00 -0.16 0.00 0.00 28.75 29.69 1r3n h GLU 369 CO 0.80 0.33 -0.23 0.28 -1.18 0.00 0.00 179.01 179.01 1r3n h VAL 370 N 0.51 1.35 -0.66 0.32 2.07 -1.97 -2.53 116.25 115.34 1r3n h VAL 370 Ca 0.32 -1.44 -0.08 0.00 0.82 0.00 0.00 66.70 66.32 1r3n h VAL 370 Cb 0.57 1.88 -0.03 0.00 -1.52 0.00 0.00 31.29 32.19 1r3n h VAL 370 CO -0.10 0.43 0.09 0.00 0.02 0.00 0.00 177.57 178.01 1r3n h ILE 372 N 1.03 1.12 -0.04 0.00 2.04 -1.18 -1.85 117.51 118.63 1r3n h ILE 372 Ca 0.20 -0.27 -0.11 0.00 1.00 0.00 0.00 64.86 65.68 1r3n h ILE 372 Cb 0.47 0.26 -0.01 0.00 -0.74 0.00 0.00 36.82 36.79 1r3n h ILE 372 CO 0.02 0.14 -0.48 -0.33 0.00 0.00 0.00 178.15 177.50 1r3n h GLU 373 N 0.79 0.10 -0.33 2.37 5.08 -1.24 0.13 114.58 121.47 1r3n h GLU 373 Ca 0.24 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.52 1r3n h GLU 373 Cb -0.04 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 1r3n h GLU 373 CO -0.08 0.56 0.12 0.00 -1.00 0.00 0.00 179.01 178.62 1r3n h VAL 375 N 0.39 1.27 0.01 0.00 2.07 -1.05 -2.29 116.25 116.66 1r3n h VAL 375 Ca 0.11 -1.04 -0.00 0.00 0.82 0.00 0.00 66.70 66.59 1r3n h VAL 375 Cb 0.21 1.37 0.00 0.00 -1.52 0.00 0.00 31.29 31.35 1r3n h VAL 375 CO -0.01 0.33 -0.00 0.28 0.02 0.00 0.00 177.57 178.19 1r3n h SER 376 N 0.31 -0.01 -0.17 0.57 0.02 -0.71 -0.02 113.55 113.55 1r3n h SER 376 Ca 0.08 -0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.01 1r3n h SER 376 Cb 0.51 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.04 1r3n h SER 376 CO 0.02 -0.00 0.08 0.03 -1.14 0.00 0.00 176.83 175.82 1r3n h ARG 377 N -0.01 0.28 -0.15 3.45 2.47 -1.19 0.96 114.38 120.20 1r3n h ARG 377 Ca -0.00 -0.03 -0.14 0.00 -1.26 0.00 0.00 59.98 58.55 1r3n h ARG 377 Cb 0.01 -0.06 0.00 0.00 -1.65 0.00 0.00 29.97 28.27 1r3n h ARG 377 CO 0.00 0.24 -0.46 1.03 0.56 0.00 0.00 179.97 181.34 1r3n h SER 378 N 0.29 0.66 -0.08 7.04 0.87 -0.93 -3.00 113.55 118.40 1r3n h SER 378 Ca 0.07 -0.60 -0.04 0.00 -1.23 0.00 0.00 61.79 59.99 1r3n h SER 378 Cb 0.07 -0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 61.83 1r3n h SER 378 CO -0.01 1.15 -0.12 0.00 -0.53 0.00 0.00 176.83 177.32 1r3n h ALA 379 N 0.53 0.12 0.00 6.23 0.00 -0.34 -3.16 119.26 122.64 1r3n h ALA 379 Ca -0.02 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1r3n h ALA 379 Cb 1.09 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1r3n h ALA 379 CO 0.10 -0.01 0.00 0.74 0.00 0.00 0.00 179.25 180.08 1r3n h PHE 380 N -0.24 0.00 0.00 0.00 -1.00 -0.96 0.14 116.94 114.88 1r3n h PHE 380 Ca 0.01 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.79 1r3n h PHE 380 Cb 0.67 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.23 1r3n h PHE 380 CO 0.10 0.00 -0.17 0.00 -1.61 0.00 0.00 178.31 176.63 1r3n n ALA 381 N -2.02 2.50 -0.01 2.45 0.00 -1.13 -4.11 120.51 118.18 1r3n n ALA 381 Ca 0.01 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1r3n n ALA 381 Cb 0.28 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.35 1r3n n ALA 381 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1r3n n GLN 382 N -2.11 5.39 -3.97 0.00 6.02 -0.69 -5.06 117.38 116.96 1r3n n GLN 382 Ca 0.05 -0.06 -0.09 0.00 -0.01 0.00 0.00 57.00 56.89 1r3n n GLN 382 Cb 0.42 -0.51 -0.10 0.00 1.02 0.00 0.00 30.24 31.06 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 -0.79 0.27 0.51 1.08 0.40 0.40 -5.08 117.98 114.77 1r3n s PHE 383 Ca 0.00 -0.58 -0.21 0.00 -0.60 0.00 0.00 56.93 55.54 1r3n s PHE 383 Cb 0.00 -0.20 -0.06 0.00 0.51 0.00 0.00 43.02 43.27 1r3n s PHE 383 CO 0.00 -0.29 1.17 0.15 0.70 0.00 0.00 175.22 176.95 1r3n s LYS 384 N -2.26 3.47 0.32 0.44 1.02 -1.26 -4.48 119.74 117.00 1r3n s LYS 384 Ca -0.08 1.76 0.10 0.00 0.02 0.00 0.00 55.97 57.77 1r3n s LYS 384 Cb -0.04 -2.20 0.95 0.00 -0.52 0.00 0.00 37.83 36.02 1r3n s LYS 384 CO -0.03 -0.78 1.67 0.87 -0.92 0.00 0.00 175.35 176.15 1r3n h LYS 385 N 1.57 0.34 0.00 1.68 1.57 -1.94 -0.40 116.57 119.39 1r3n h LYS 385 Ca -0.50 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.26 1r3n h LYS 385 Cb 1.26 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.50 1r3n h LYS 385 CO 0.58 0.22 0.00 -0.40 -0.57 0.00 0.00 179.45 179.28 1r3n n ASP 386 N -5.06 0.00 -0.15 0.86 5.68 -1.26 -2.48 116.55 114.13 1r3n n ASP 386 Ca 0.28 -1.01 0.10 0.00 -0.50 0.00 0.00 54.79 53.67 1r3n n ASP 386 Cb 0.86 0.00 -0.09 0.00 -1.14 0.00 0.00 41.12 40.75 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 -0.95 0.39 -4.94 0.11 6.02 -0.16 -4.71 117.38 113.14 1r3n n GLN 387 Ca 0.20 -0.30 -0.31 0.00 -0.01 0.00 0.00 57.00 56.59 1r3n n GLN 387 Cb 0.09 -1.49 -0.14 0.00 1.02 0.00 0.00 30.24 29.72 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 -2.84 2.30 -0.10 5.09 1.01 -1.04 -0.16 120.40 124.67 1r3n s VAL 388 Ca 0.11 -1.26 -0.09 0.00 0.00 0.00 0.00 61.98 60.75 1r3n s VAL 388 Cb 0.17 -1.89 0.03 0.00 0.00 0.00 0.00 36.38 34.68 1r3n s VAL 388 CO 0.78 0.42 0.26 -0.60 0.00 0.00 0.00 175.10 175.96 1r3n s ARG 389 N -1.12 0.30 0.28 2.72 3.52 -0.74 -4.98 118.95 118.92 1r3n s ARG 389 Ca 0.12 0.39 -0.28 0.00 -0.13 0.00 0.00 55.73 55.82 1r3n s ARG 389 Cb -0.10 0.12 -0.09 0.00 -1.56 0.00 0.00 34.95 33.32 1r3n s ARG 389 CO 0.02 -0.05 0.97 -0.65 -0.81 0.00 0.00 175.30 174.78 1r3n s GLN 390 N 0.26 4.69 -0.03 5.12 -0.21 -1.26 -0.44 119.66 127.79 1r3n s GLN 390 Ca -0.01 1.49 -0.08 0.00 0.02 0.00 0.00 55.36 56.78 1r3n s GLN 390 Cb -0.03 -3.06 0.01 0.00 1.00 0.00 0.00 33.01 30.93 1r3n s GLN 390 CO -0.01 0.35 0.18 -1.50 -2.12 0.00 0.00 175.29 172.20 1r3n s ILE 391 N -1.35 0.05 0.03 1.08 2.07 -0.14 -4.85 121.20 118.08 1r3n s ILE 391 Ca 0.46 -0.39 -0.19 0.00 -1.41 0.00 0.00 60.65 59.11 1r3n s ILE 391 Cb -0.24 -0.39 -0.06 0.00 0.13 0.00 0.00 42.46 41.89 1r3n s ILE 391 CO 0.30 -0.21 0.57 0.26 -1.91 0.00 0.00 174.94 173.94 1r3n s TRP 392 N -0.78 3.74 0.09 3.50 0.52 -1.26 -1.50 118.94 123.24 1r3n s TRP 392 Ca -0.09 1.21 -0.30 0.00 0.02 0.00 0.00 56.10 56.94 1r3n s TRP 392 Cb -0.05 -2.54 -0.06 0.00 -1.15 0.00 0.00 33.47 29.68 1r3n s TRP 392 CO 0.01 0.47 1.09 0.45 0.02 0.00 0.00 176.95 178.99 1r3n s SER 393 N -0.63 7.25 0.27 2.95 0.15 0.85 -4.93 113.70 119.61 1r3n s SER 393 Ca 0.29 1.93 0.22 0.00 0.70 0.00 0.00 55.95 59.10 1r3n s SER 393 Cb -0.19 -2.59 0.09 0.00 -1.71 0.00 0.00 66.02 61.63 1r3n s SER 393 CO 0.17 -0.30 1.20 1.23 1.20 0.00 0.00 173.24 176.74 1r3n h GLY 394 N 6.15 0.00 -2.86 9.45 0.00 -1.90 -1.29 103.07 112.63 1r3n h GLY 394 Ca -0.42 0.00 -0.62 0.00 0.00 0.00 0.00 47.33 46.29 1r3n h GLY 394 CO 0.76 0.00 -0.75 0.00 0.00 0.00 0.00 176.54 176.55 1r3n s ALA 395 N -3.31 2.80 0.42 3.60 0.00 -1.26 -4.77 121.76 119.24 1r3n s ALA 395 Ca 0.02 -1.67 -0.18 0.00 0.00 0.00 0.00 51.96 50.12 1r3n s ALA 395 Cb 0.08 -0.48 -0.10 0.00 0.00 0.00 0.00 23.12 22.63 1r3n s ALA 395 CO 0.76 0.37 0.89 0.20 0.00 0.00 0.00 175.76 177.97 1r3n s GLY 396 N -3.12 2.28 0.29 0.00 0.00 -1.26 -4.89 107.32 100.62 1r3n s GLY 396 Ca 0.26 0.23 0.00 0.00 0.00 0.00 0.00 44.72 45.21 1r3n s GLY 396 CO 0.14 0.48 0.31 0.30 0.00 0.00 0.00 173.10 174.34 1r3n s HIS 397 N -2.23 1.25 0.54 1.90 3.76 -1.26 -5.03 115.29 114.23 1r3n s HIS 397 Ca 0.59 -1.38 0.22 0.00 -0.15 0.00 0.00 55.06 54.34 1r3n s HIS 397 Cb -0.10 -0.40 1.41 0.00 1.11 0.00 0.00 32.58 34.60 1r3n s HIS 397 CO 0.19 -0.89 2.09 -0.44 -0.85 0.00 0.00 174.74 174.83 1r3n h ASP 398 N 2.28 0.00 -0.54 1.40 5.19 -1.97 -1.27 116.42 121.51 1r3n h ASP 398 Ca -0.29 0.00 0.16 0.00 -0.62 0.00 0.00 57.03 56.28 1r3n h ASP 398 Cb 1.24 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.73 1r3n h ASP 398 CO 0.42 0.00 0.40 0.28 -3.12 0.00 0.00 179.24 177.21 1r3n h SER 399 N 0.00 0.00 0.14 6.45 0.02 -1.95 -0.44 113.55 117.77 1r3n h SER 399 Ca 0.11 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.04 1r3n h SER 399 Cb 0.48 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.02 1r3n h SER 399 CO -0.00 0.00 -0.13 0.00 -1.14 0.00 0.00 176.83 175.56 1r3n h GLN 401 N 0.00 0.12 0.00 0.00 1.08 -1.23 -3.36 115.11 111.72 1r3n h GLN 401 Ca -0.00 -0.20 -0.22 0.00 -1.45 0.00 0.00 58.65 56.78 1r3n h GLN 401 Cb 0.23 0.07 -0.03 0.00 -0.05 0.00 0.00 27.48 27.71 1r3n h GLN 401 CO 0.02 0.88 -1.08 1.79 -0.95 0.00 0.00 178.83 179.48 1r3n h THR 402 N 0.03 1.62 -1.00 -0.54 1.35 -1.45 -3.38 112.91 109.53 1r3n h THR 402 Ca -0.23 -3.34 0.15 0.00 -0.55 0.00 0.00 66.41 62.44 1r3n h THR 402 Cb 1.97 2.80 -0.10 0.00 -1.73 0.00 0.00 68.15 71.10 1r3n h THR 402 CO 0.12 0.92 0.62 0.00 -0.25 0.00 0.00 175.52 176.93 1r3n h ALA 403 N 0.99 1.58 0.00 6.62 0.00 -1.48 0.15 119.26 127.12 1r3n h ALA 403 Ca -0.04 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1r3n h ALA 403 Cb 1.80 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.45 1r3n h ALA 403 CO 0.13 0.09 0.00 -1.35 0.00 0.00 0.00 179.25 178.11 1r3n h PRO 404 N 0.88 0.00 0.00 0.00 0.11 -1.79 -3.37 132.00 127.83 1r3n h PRO 404 Ca 0.54 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.55 1r3n h PRO 404 Cb 0.69 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.78 1r3n h PRO 404 CO -0.32 0.00 -1.38 0.72 -0.21 0.00 0.00 178.00 176.80 1r3n n HIS 405 N -2.67 0.00 -4.25 0.65 8.25 0.37 -5.05 115.22 112.52 1r3n n HIS 405 Ca -0.00 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.25 1r3n n HIS 405 Cb 0.17 -0.26 -0.12 0.00 1.12 0.00 0.00 29.99 30.90 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 -2.13 1.46 -0.13 1.59 -7.23 -0.29 -5.10 120.40 108.56 1r3n s VAL 406 Ca -0.08 -1.60 -0.35 0.00 -1.81 0.00 0.00 61.98 58.14 1r3n s VAL 406 Cb 0.02 -1.48 -0.12 0.00 0.56 0.00 0.00 36.38 35.36 1r3n s VAL 406 CO 0.17 -0.25 1.87 -2.65 -0.31 0.00 0.00 175.10 173.93 1r3n n PRO 407 N 0.83 1.97 -4.09 4.82 -0.02 -1.26 -4.24 135.00 133.01 1r3n n PRO 407 Ca -0.18 0.72 -0.10 0.00 -2.02 0.00 0.00 63.50 61.92 1r3n n PRO 407 Cb 0.55 -2.55 -0.11 0.00 -0.02 0.00 0.00 33.50 31.38 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 4.12 0.44 0.21 3.45 -4.23 -1.26 -1.36 115.64 117.01 1r3n s THR 408 Ca 0.94 -1.53 -0.16 0.00 -1.18 0.00 0.00 61.69 59.76 1r3n s THR 408 Cb -0.76 -1.14 0.02 0.00 1.34 0.00 0.00 72.50 71.95 1r3n s THR 408 CO 0.54 -0.72 0.52 -0.55 -0.54 0.00 0.00 174.62 173.87 1r3n s SER 409 N -2.39 -0.21 0.16 3.99 0.15 -0.91 -1.50 113.70 112.99 1r3n s SER 409 Ca 0.01 -0.60 0.06 0.00 0.70 0.00 0.00 55.95 56.11 1r3n s SER 409 Cb -0.00 0.59 -0.04 0.00 -1.71 0.00 0.00 66.02 64.85 1r3n s SER 409 CO -0.04 -1.09 -0.12 -0.04 1.20 0.00 0.00 173.24 173.15 1r3n s MET 410 N -3.91 1.14 -0.08 5.44 -1.94 -1.26 -2.18 119.30 116.52 1r3n s MET 410 Ca 0.12 -1.47 0.04 0.00 -1.71 0.00 0.00 55.69 52.67 1r3n s MET 410 Cb -0.01 -0.82 0.00 0.00 2.01 0.00 0.00 34.83 36.01 1r3n s MET 410 CO 0.01 0.12 -0.21 0.42 -0.01 0.00 0.00 175.02 175.35 1r3n s ILE 411 N -3.07 1.76 0.04 2.53 1.01 -0.01 -2.49 121.20 120.97 1r3n s ILE 411 Ca 0.18 -0.86 0.03 0.00 0.00 0.00 0.00 60.65 59.99 1r3n s ILE 411 Cb 0.01 -1.52 -0.04 0.00 0.01 0.00 0.00 42.46 40.91 1r3n s ILE 411 CO 0.03 0.49 0.01 -0.36 0.00 0.00 0.00 174.94 175.12 1r3n s PHE 412 N 0.28 3.07 0.16 3.97 2.99 -0.32 -1.52 117.98 126.61 1r3n s PHE 412 Ca -0.13 0.04 0.11 0.00 0.00 0.00 0.00 56.93 56.95 1r3n s PHE 412 Cb -0.16 -1.62 -0.04 0.00 0.00 0.00 0.00 43.02 41.21 1r3n s PHE 412 CO 0.06 0.48 -0.24 0.96 -0.00 0.00 0.00 175.22 176.48 1r3n s ILE 413 N -1.22 2.20 0.40 0.64 -4.36 -1.08 -1.31 121.20 116.48 1r3n s ILE 413 Ca 0.23 -1.89 -0.25 0.00 -0.26 0.00 0.00 60.65 58.49 1r3n s ILE 413 Cb -0.12 -2.00 -0.11 0.00 1.25 0.00 0.00 42.46 41.48 1r3n s ILE 413 CO 0.15 -0.07 0.99 -2.65 0.24 0.00 0.00 174.94 173.60 1r3n n PRO 414 N 0.55 1.33 -4.52 0.37 -0.02 -1.26 -1.28 135.00 130.17 1r3n n PRO 414 Ca -0.15 0.47 -0.33 0.00 -2.02 0.00 0.00 63.50 61.47 1r3n n PRO 414 Cb 0.55 -1.99 -0.15 0.00 -0.02 0.00 0.00 33.50 31.88 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 -0.72 3.55 0.16 2.55 0.01 -1.26 -4.67 113.70 113.33 1r3n s SER 415 Ca 0.62 -0.50 -0.31 0.00 1.31 0.00 0.00 55.95 57.07 1r3n s SER 415 Cb -0.58 -1.54 -0.11 0.00 0.21 0.00 0.00 66.02 64.00 1r3n s SER 415 CO 0.57 0.08 1.75 -0.75 0.41 0.00 0.00 173.24 175.30 1r3n s LYS 416 N 0.86 4.14 -0.48 12.44 2.20 -0.86 -1.70 119.74 136.33 1r3n s LYS 416 Ca -0.05 2.57 0.00 0.00 -0.36 0.00 0.00 55.97 58.13 1r3n s LYS 416 Cb -0.15 -3.32 0.00 0.00 -1.51 0.00 0.00 37.83 32.85 1r3n s LYS 416 CO -0.01 -0.78 0.00 -0.25 -0.36 0.00 0.00 175.35 173.95 1r3n n ASP 417 N 4.75 -4.59 -1.37 1.43 8.00 -1.26 -1.47 116.55 122.05 1r3n n ASP 417 Ca 0.16 0.11 -0.16 0.00 0.71 0.00 0.00 54.79 55.61 1r3n n ASP 417 Cb 0.37 -3.14 -0.06 0.00 -0.02 0.00 0.00 41.12 38.27 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 0.48 1.26 3.70 0.44 0.00 -0.69 -4.70 105.19 105.68 1r3n n GLY 418 Ca -0.05 -0.24 -0.42 0.00 0.00 0.00 0.00 46.02 45.32 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 -3.90 4.34 0.17 0.99 1.98 -0.54 -3.89 118.68 117.83 1r3n s LEU 419 Ca 0.00 1.82 -0.08 0.00 -2.89 0.00 0.00 54.13 52.98 1r3n s LEU 419 Cb 0.00 -3.57 -0.01 0.00 0.66 0.00 0.00 46.19 43.27 1r3n s LEU 419 CO 0.00 -0.43 0.27 -0.55 -1.89 0.00 0.00 176.35 173.75 1r3n s SER 420 N 1.14 0.06 -1.44 3.68 0.15 -1.26 -4.59 113.70 111.44 1r3n s SER 420 Ca 0.55 -0.95 -0.07 0.00 0.70 0.00 0.00 55.95 56.18 1r3n s SER 420 Cb -0.25 0.43 0.05 0.00 -1.71 0.00 0.00 66.02 64.54 1r3n s SER 420 CO 0.26 -0.90 0.76 1.41 1.20 0.00 0.00 173.24 175.98 1r3n n HIS 421 N -0.22 -1.99 -3.63 3.44 8.25 -1.26 -4.96 115.22 114.84 1r3n n HIS 421 Ca -0.06 0.84 -0.15 0.00 -0.26 0.00 0.00 57.72 58.10 1r3n n HIS 421 Cb 0.63 -4.00 -0.07 0.00 1.12 0.00 0.00 29.99 27.68 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 -3.89 -0.40 0.26 0.41 2.47 -1.18 -4.71 114.94 107.90 1r3n s ASN 422 Ca 0.31 0.27 -0.01 0.00 0.42 0.00 0.00 52.86 53.85 1r3n s ASN 422 Cb -0.16 0.44 0.51 0.00 -1.45 0.00 0.00 41.25 40.59 1r3n s ASN 422 CO 0.84 -0.60 1.78 1.88 -3.72 0.00 0.00 177.10 177.29 1r3n h TYR 423 N 3.21 0.85 -0.11 0.43 0.99 -1.75 -2.58 116.97 118.01 1r3n h TYR 423 Ca -0.29 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.47 1r3n h TYR 423 Cb 1.18 -0.25 0.00 0.00 1.00 0.00 0.00 36.73 38.66 1r3n h TYR 423 CO 0.42 0.26 0.00 0.66 -0.00 0.00 0.00 178.16 179.50 1r3n n TYR 424 N -4.80 0.14 -1.47 4.88 4.02 -1.26 -4.40 117.16 114.27 1r3n n TYR 424 Ca 0.17 -0.07 -0.57 0.00 -0.01 0.00 0.00 57.90 57.41 1r3n n TYR 424 Cb 0.39 0.00 -0.08 0.00 -0.02 0.00 0.00 39.34 39.63 1r3n n TYR 424 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 176.86 173.94 1r3n n GLU 425 N -0.18 0.00 -4.12 -0.72 2.13 -1.05 -4.94 120.64 111.76 1r3n n GLU 425 Ca 0.12 0.00 -0.17 0.00 0.66 0.00 0.00 57.16 57.77 1r3n n GLU 425 Cb 0.17 -1.34 -0.15 0.00 0.27 0.00 0.00 31.44 30.39 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 1.46 0.48 -0.05 4.31 5.04 -1.26 -4.63 117.35 122.69 1r3n s TYR 426 Ca 0.88 -0.09 -0.01 0.00 -2.44 0.00 0.00 57.07 55.42 1r3n s TYR 426 Cb -1.25 -0.38 0.03 0.00 0.35 0.00 0.00 41.96 40.71 1r3n s TYR 426 CO 0.63 -0.06 0.00 -1.12 -1.34 0.00 0.00 175.55 173.66 1r3n s SER 427 N 0.26 1.13 0.36 4.32 0.01 -1.26 -2.03 113.70 116.49 1r3n s SER 427 Ca -0.03 -0.05 -0.27 0.00 1.31 0.00 0.00 55.95 56.91 1r3n s SER 427 Cb -0.06 -0.34 -0.12 0.00 0.21 0.00 0.00 66.02 65.71 1r3n s SER 427 CO -0.00 -0.16 1.31 -0.24 0.41 0.00 0.00 173.24 174.57 1r3n n SER 428 N 4.74 2.87 -0.04 2.44 2.88 -1.26 -4.80 113.62 120.45 1r3n n SER 428 Ca -0.14 1.19 0.20 0.00 -1.33 0.00 0.00 58.87 58.79 1r3n n SER 428 Cb 0.50 -1.51 0.67 0.00 -0.75 0.00 0.00 64.21 63.12 1r3n n SER 428 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1r3n h PRO 429 N 2.52 0.06 -0.80 -1.46 0.11 -2.00 0.12 132.00 130.54 1r3n h PRO 429 Ca -0.47 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 1r3n h PRO 429 Cb 1.28 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.34 1r3n h PRO 429 CO 0.62 0.04 0.41 1.49 -0.21 0.00 0.00 178.00 180.35 1r3n h GLU 430 N 0.06 1.13 0.08 1.05 4.81 -2.01 -2.82 114.58 116.88 1r3n h GLU 430 Ca 0.28 -0.14 -0.25 0.00 -0.13 0.00 0.00 59.36 59.12 1r3n h GLU 430 Cb 1.05 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 30.22 1r3n h GLU 430 CO -0.02 0.85 -1.12 0.93 -0.73 0.00 0.00 179.01 178.91 1r3n h GLU 431 N 1.12 0.33 -0.11 1.92 5.08 -1.14 -2.85 114.58 118.93 1r3n h GLU 431 Ca 0.28 -0.46 0.02 0.00 -1.00 0.00 0.00 59.36 58.19 1r3n h GLU 431 Cb 0.07 0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 1r3n h GLU 431 CO -0.04 1.17 0.00 0.82 -1.00 0.00 0.00 179.01 179.96 1r3n h ILE 432 N 0.14 0.93 -0.53 3.13 1.08 -1.30 -1.55 117.51 119.40 1r3n h ILE 432 Ca -0.11 -0.01 0.03 0.00 -0.39 0.00 0.00 64.86 64.38 1r3n h ILE 432 Cb 1.81 0.88 -0.04 0.00 -3.07 0.00 0.00 36.82 36.40 1r3n h ILE 432 CO 0.19 0.01 0.30 -0.08 -0.69 0.00 0.00 178.15 177.87 1r3n h GLU 433 N 0.04 0.57 -0.33 2.37 4.57 -1.53 -1.24 114.58 119.03 1r3n h GLU 433 Ca 0.05 -0.03 0.03 0.00 -1.18 0.00 0.00 59.36 58.23 1r3n h GLU 433 Cb 0.06 -0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 28.49 1r3n h GLU 433 CO -0.09 0.38 0.13 -0.91 -1.18 0.00 0.00 179.01 177.34 1r3n h ASN 434 N 0.59 0.16 -0.44 1.04 -0.26 -1.25 -0.44 115.58 114.97 1r3n h ASN 434 Ca 0.22 0.03 0.03 0.00 -0.56 0.00 0.00 56.30 56.02 1r3n h ASN 434 Cb 0.08 0.01 -0.03 0.00 -1.06 0.00 0.00 38.32 37.31 1r3n h ASN 434 CO -0.13 0.13 0.25 1.23 -1.06 0.00 0.00 177.43 177.85 1r3n h GLY 435 N 0.28 0.62 0.99 2.83 0.00 -0.89 -2.35 103.07 104.54 1r3n h GLY 435 Ca 0.14 -0.18 -0.00 0.00 0.00 0.00 0.00 47.33 47.29 1r3n h GLY 435 CO -0.13 0.15 0.23 -2.75 0.00 0.00 0.00 176.54 174.03 1r3n h PHE 436 N 0.49 0.49 -0.96 5.60 3.57 -0.86 -1.25 116.94 124.03 1r3n h PHE 436 Ca 0.18 0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.76 1r3n h PHE 436 Cb 0.05 -0.16 -0.07 0.00 2.79 0.00 0.00 35.95 38.55 1r3n h PHE 436 CO -0.08 0.35 0.60 0.87 -2.23 0.00 0.00 178.31 177.82 1r3n h LYS 437 N 0.50 1.02 -0.09 1.11 1.57 -0.83 0.10 116.57 119.95 1r3n h LYS 437 Ca 0.14 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.83 1r3n h LYS 437 Cb -0.01 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 32.07 1r3n h LYS 437 CO -0.03 0.68 -0.06 0.28 -0.57 0.00 0.00 179.45 179.75 1r3n h VAL 438 N 1.05 1.34 -0.35 0.50 2.07 -1.10 -2.76 116.25 117.00 1r3n h VAL 438 Ca 0.43 -1.13 0.05 0.00 0.82 0.00 0.00 66.70 66.87 1r3n h VAL 438 Cb 0.26 1.91 -0.05 0.00 -1.52 0.00 0.00 31.29 31.90 1r3n h VAL 438 CO -0.20 0.32 0.08 0.25 0.02 0.00 0.00 177.57 178.03 1r3n h LEU 439 N -0.20 0.04 -0.28 2.57 5.85 -0.73 0.54 115.31 123.10 1r3n h LEU 439 Ca 0.02 0.05 0.05 0.00 0.84 0.00 0.00 57.88 58.84 1r3n h LEU 439 Cb 0.53 0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.59 1r3n h LEU 439 CO 0.02 0.06 -0.01 0.25 -0.34 0.00 0.00 178.44 178.42 1r3n h LEU 440 N 0.21 -0.12 -0.47 2.25 5.85 -0.81 -1.30 115.31 120.91 1r3n h LEU 440 Ca 0.17 0.06 -0.14 0.00 0.84 0.00 0.00 57.88 58.81 1r3n h LEU 440 Cb 0.18 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.30 1r3n h LEU 440 CO -0.21 -0.03 -0.68 -0.61 -0.34 0.00 0.00 178.44 176.57 1r3n h GLN 441 N 0.08 0.00 -0.59 1.25 4.15 -1.26 -2.45 115.11 116.29 1r3n h GLN 441 Ca 0.13 0.00 -0.04 0.00 0.77 0.00 0.00 58.65 59.52 1r3n h GLN 441 Cb 0.18 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 27.84 1r3n h GLN 441 CO -0.23 0.68 0.22 0.00 -1.93 0.00 0.00 178.83 177.57 1r3n h ALA 442 N 1.32 0.76 -0.40 3.38 0.00 -0.29 0.30 119.26 124.32 1r3n h ALA 442 Ca -0.01 -0.18 -0.15 0.00 0.00 0.00 0.00 54.91 54.57 1r3n h ALA 442 Cb 1.30 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1r3n h ALA 442 CO 0.09 0.39 -0.35 -0.84 0.00 0.00 0.00 179.25 178.54 1r3n h ILE 443 N 0.81 1.27 -0.80 0.00 3.07 -1.22 -0.84 117.51 119.80 1r3n h ILE 443 Ca 0.19 -1.53 0.05 0.00 1.55 0.00 0.00 64.86 65.12 1r3n h ILE 443 Cb 0.23 1.33 -0.05 0.00 -0.27 0.00 0.00 36.82 38.06 1r3n h ILE 443 CO -0.01 0.51 0.50 0.40 -1.05 0.00 0.00 178.15 178.50 1r3n h ILE 444 N 0.78 1.07 -0.26 0.16 2.04 -1.26 -0.05 117.51 119.99 1r3n h ILE 444 Ca 0.07 -0.32 0.00 0.00 1.00 0.00 0.00 64.86 65.61 1r3n h ILE 444 Cb 0.94 0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.06 1r3n h ILE 444 CO 0.09 0.17 0.17 0.78 0.00 0.00 0.00 178.15 179.36 1r3n h ASN 445 N 0.94 0.29 -0.50 1.72 -0.26 -0.05 -1.25 115.58 116.47 1r3n h ASN 445 Ca 0.33 -0.01 -0.03 0.00 -0.56 0.00 0.00 56.30 56.03 1r3n h ASN 445 Cb 0.09 -0.07 -0.02 0.00 -1.06 0.00 0.00 38.32 37.25 1r3n h ASN 445 CO -0.14 0.21 0.18 0.22 -1.06 0.00 0.00 177.43 176.84 1r3n h TYR 446 N 0.35 0.79 -0.63 1.19 3.20 -0.85 -0.49 116.97 120.53 1r3n h TYR 446 Ca 0.10 -0.07 0.04 0.00 3.14 0.00 0.00 58.73 61.93 1r3n h TYR 446 Cb -0.04 -0.23 -0.04 0.00 1.54 0.00 0.00 36.73 37.96 1r3n h TYR 446 CO -0.06 0.67 0.42 0.22 -1.64 0.00 0.00 178.16 177.76 1r3n h ASP 447 N 0.68 0.63 0.85 -2.11 3.58 -0.89 -0.75 116.42 118.41 1r3n h ASP 447 Ca 0.17 -0.01 -0.16 0.00 0.42 0.00 0.00 57.03 57.45 1r3n h ASP 447 Cb 0.23 -0.15 -0.02 0.00 1.72 0.00 0.00 39.33 41.11 1r3n h ASP 447 CO -0.01 0.44 -0.75 0.78 -2.88 0.00 0.00 179.24 176.81 1r3n h ASN 448 N 0.74 0.00 -0.45 2.28 -0.26 -0.79 -3.24 115.58 113.85 1r3n h ASN 448 Ca 0.25 0.00 -0.10 0.00 -0.56 0.00 0.00 56.30 55.89 1r3n h ASN 448 Cb 0.10 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.34 1r3n h ASN 448 CO -0.07 0.75 -0.08 0.22 -1.06 0.00 0.00 177.43 177.19 1r3n h TYR 449 N 0.00 1.00 -0.15 1.19 5.03 0.27 -3.03 116.97 121.28 1r3n h TYR 449 Ca -0.01 -0.19 0.04 0.00 2.58 0.00 0.00 58.73 61.16 1r3n h TYR 449 Cb 1.38 -0.26 -0.01 0.00 1.55 0.00 0.00 36.73 39.40 1r3n h TYR 449 CO 0.00 0.94 0.13 0.00 -1.32 0.00 0.00 178.16 177.91 1r3n h ARG 450 N 0.82 0.00 -0.00 1.82 3.08 -1.25 0.13 114.38 118.99 1r3n h ARG 450 Ca 0.14 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.92 1r3n h ARG 450 Cb 0.61 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.67 1r3n h ARG 450 CO 0.04 0.00 -1.03 0.28 -1.07 0.00 0.00 179.97 178.19 1r3n h VAL 451 N 0.00 1.29 0.18 2.04 2.07 -1.64 -0.21 116.25 119.98 1r3n h VAL 451 Ca 0.07 -2.27 -0.01 0.00 0.82 0.00 0.00 66.70 65.32 1r3n h VAL 451 Cb 0.33 2.38 0.00 0.00 -1.52 0.00 0.00 31.29 32.48 1r3n h VAL 451 CO -0.00 0.70 -0.09 0.40 0.02 0.00 0.00 177.57 178.60 1r3n h ILE 452 N 0.38 0.93 -0.02 4.57 1.08 -1.12 -2.34 117.51 120.99 1r3n h ILE 452 Ca -0.12 -0.67 -0.00 0.00 -0.39 0.00 0.00 64.86 63.67 1r3n h ILE 452 Cb 1.69 1.33 -0.00 0.00 -3.07 0.00 0.00 36.82 36.76 1r3n h ILE 452 CO 0.20 0.15 0.01 -0.09 -0.69 0.00 0.00 178.15 177.74 1r3n h ARG 453 N -0.58 0.03 0.00 2.37 2.43 -0.92 -3.37 114.38 114.34 1r3n h ARG 453 Ca -0.02 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1r3n h ARG 453 Cb 0.43 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 1r3n h ARG 453 CO 0.04 0.06 0.00 0.41 -1.51 0.00 0.00 179.97 178.97 1r3n n GLY 454 N -0.99 -2.02 0.00 2.80 0.00 -0.09 -5.09 105.19 99.81 1r3n n GLY 454 Ca -0.07 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.07 1r3n n GLY 454 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93